USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 933 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 Set 1.1: A 446 MET CE :methyl -164:sc= -0.563 (180deg=-0.939) USER MOD Set 1.2: A 450 THR OG1 : rot 14:sc= 0.609 USER MOD Set 1.3: A 461 THR OG1 : rot 42:sc= 0.854 USER MOD Set 2.1: A 437 THR OG1 : rot 74:sc= 0.101 USER MOD Set 2.2: A 438 SER OG : rot 180:sc= 0.361 USER MOD Set 3.1: A 381 MET CE :methyl -145:sc= -0.7 (180deg=-3.7!) USER MOD Set 3.2: A 462 LYS NZ :NH3+ 161:sc= -0.104 (180deg=0) USER MOD Set 4.1: A 379 CYS SG : rot -100:sc= -0.421 USER MOD Set 4.2: A 464 CYS SG : rot 145:sc= -0.454 USER MOD Single : A 373 HIS : no HD1:sc= -1.16 X(o=-1.2,f=-1.1) USER MOD Single : A 375 THR OG1 : rot 63:sc= -2.51! USER MOD Single : A 382 ASN : amide:sc= -0.591 X(o=-0.59,f=-0.31) USER MOD Single : A 383 MET CE :methyl -123:sc= -1.51 (180deg=-3.88!) USER MOD Single : A 395 TYR OH : rot 59:sc= 0.82 USER MOD Single : A 406 CYS SG : rot 120:sc= -0.847 USER MOD Single : A 407 SER OG : rot 180:sc= -0.345 USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 130:sc= -0.398 USER MOD Single : A 413 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 414 SER OG : rot 180:sc= 0 USER MOD Single : A 429 CYS SG : rot 160:sc= -0.314 USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 442 CYS SG : rot 64:sc= -2.43! USER MOD Single : A 443 GLN : amide:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 447 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 453 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 ASN : amide:sc= -0.876 K(o=-0.88,f=-0.24) USER MOD Single : A 463 TYR OH : rot -76:sc= -0.98 USER MOD Single : A 468 SER OG : rot 180:sc= 0 USER MOD Single : A 469 TYR OH : rot 0:sc= -0.778 USER MOD Single : A 470 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 14 SER OG : rot 153:sc= 0.283 USER MOD Single : B 15 LYS NZ :NH3+ -171:sc=-0.00305 (180deg=-0.123) USER MOD Single : B 16 LYS NZ :NH3+ -156:sc= -0.0339 (180deg=-0.298) USER MOD Single : B 18 LYS NZ :NH3+ 178:sc= -0.0601 (180deg=-0.0792) USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 23 ASN : amide:sc= -0.633 X(o=-0.63,f=-0.26) USER MOD Single : B 24 GLN : amide:sc= -0.0959 K(o=-0.096,f=-0.71) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 372 1.523 8.809 -12.329 1.00 0.00 N ATOM 2 CA GLY A 372 2.126 9.990 -11.741 1.00 0.00 C ATOM 3 C GLY A 372 1.147 11.141 -11.609 1.00 0.00 C ATOM 4 O GLY A 372 1.047 11.985 -12.500 1.00 0.00 O ATOM 0 HA2 GLY A 372 2.521 9.740 -10.757 1.00 0.00 H new ATOM 0 HA3 GLY A 372 2.971 10.305 -12.353 1.00 0.00 H new ATOM 8 N HIS A 373 0.423 11.174 -10.495 1.00 0.00 N ATOM 9 CA HIS A 373 -0.551 12.231 -10.244 1.00 0.00 C ATOM 10 C HIS A 373 -0.514 12.662 -8.774 1.00 0.00 C ATOM 11 O HIS A 373 -1.433 12.372 -8.009 1.00 0.00 O ATOM 12 CB HIS A 373 -1.962 11.768 -10.638 1.00 0.00 C ATOM 13 CG HIS A 373 -2.459 10.576 -9.875 1.00 0.00 C ATOM 14 ND1 HIS A 373 -3.726 10.508 -9.333 1.00 0.00 N ATOM 15 CD2 HIS A 373 -1.854 9.405 -9.559 1.00 0.00 C ATOM 16 CE1 HIS A 373 -3.879 9.350 -8.716 1.00 0.00 C ATOM 17 NE2 HIS A 373 -2.758 8.663 -8.840 1.00 0.00 N ATOM 0 H HIS A 373 0.492 10.480 -9.751 1.00 0.00 H new ATOM 0 HA HIS A 373 -0.289 13.092 -10.858 1.00 0.00 H new ATOM 0 HB2 HIS A 373 -2.657 12.595 -10.490 1.00 0.00 H new ATOM 0 HB3 HIS A 373 -1.970 11.532 -11.702 1.00 0.00 H new ATOM 0 HD2 HIS A 373 -0.849 9.111 -9.823 1.00 0.00 H new ATOM 0 HE1 HIS A 373 -4.768 9.021 -8.199 1.00 0.00 H new ATOM 0 HE2 HIS A 373 -2.591 7.730 -8.462 1.00 0.00 H new ATOM 26 N PRO A 374 0.559 13.368 -8.363 1.00 0.00 N ATOM 27 CA PRO A 374 0.718 13.834 -6.983 1.00 0.00 C ATOM 28 C PRO A 374 -0.568 14.416 -6.408 1.00 0.00 C ATOM 29 O PRO A 374 -0.926 15.561 -6.688 1.00 0.00 O ATOM 30 CB PRO A 374 1.789 14.915 -7.106 1.00 0.00 C ATOM 31 CG PRO A 374 2.625 14.481 -8.259 1.00 0.00 C ATOM 32 CD PRO A 374 1.699 13.771 -9.213 1.00 0.00 C ATOM 0 HA PRO A 374 0.982 13.022 -6.305 1.00 0.00 H new ATOM 0 HB2 PRO A 374 1.346 15.895 -7.284 1.00 0.00 H new ATOM 0 HB3 PRO A 374 2.381 14.993 -6.194 1.00 0.00 H new ATOM 0 HG2 PRO A 374 3.097 15.337 -8.741 1.00 0.00 H new ATOM 0 HG3 PRO A 374 3.426 13.819 -7.930 1.00 0.00 H new ATOM 0 HD2 PRO A 374 1.381 14.426 -10.024 1.00 0.00 H new ATOM 0 HD3 PRO A 374 2.182 12.908 -9.671 1.00 0.00 H new ATOM 40 N THR A 375 -1.261 13.616 -5.603 1.00 0.00 N ATOM 41 CA THR A 375 -2.509 14.049 -4.986 1.00 0.00 C ATOM 42 C THR A 375 -2.292 14.434 -3.528 1.00 0.00 C ATOM 43 O THR A 375 -2.364 15.613 -3.180 1.00 0.00 O ATOM 44 CB THR A 375 -3.605 12.970 -5.072 1.00 0.00 C ATOM 45 OG1 THR A 375 -4.380 12.968 -3.870 1.00 0.00 O ATOM 46 CG2 THR A 375 -3.008 11.590 -5.296 1.00 0.00 C ATOM 0 H THR A 375 -0.979 12.665 -5.363 1.00 0.00 H new ATOM 0 HA THR A 375 -2.845 14.922 -5.546 1.00 0.00 H new ATOM 0 HB THR A 375 -4.244 13.207 -5.923 1.00 0.00 H new ATOM 0 HG1 THR A 375 -4.836 13.830 -3.773 1.00 0.00 H new ATOM 0 HG21 THR A 375 -3.808 10.852 -5.352 1.00 0.00 H new ATOM 0 HG22 THR A 375 -2.444 11.585 -6.229 1.00 0.00 H new ATOM 0 HG23 THR A 375 -2.343 11.342 -4.468 1.00 0.00 H new ATOM 54 N GLU A 376 -2.028 13.440 -2.676 1.00 0.00 N ATOM 55 CA GLU A 376 -1.794 13.701 -1.256 1.00 0.00 C ATOM 56 C GLU A 376 -1.455 12.432 -0.478 1.00 0.00 C ATOM 57 O GLU A 376 -0.549 12.444 0.354 1.00 0.00 O ATOM 58 CB GLU A 376 -3.007 14.381 -0.624 1.00 0.00 C ATOM 59 CG GLU A 376 -2.734 14.928 0.765 1.00 0.00 C ATOM 60 CD GLU A 376 -2.252 16.364 0.742 1.00 0.00 C ATOM 61 OE1 GLU A 376 -1.049 16.583 0.486 1.00 0.00 O ATOM 62 OE2 GLU A 376 -3.077 17.272 0.980 1.00 0.00 O ATOM 0 H GLU A 376 -1.972 12.457 -2.942 1.00 0.00 H new ATOM 0 HA GLU A 376 -0.932 14.366 -1.200 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -3.335 15.196 -1.270 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -3.828 13.666 -0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -3.644 14.864 1.362 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -1.986 14.305 1.256 1.00 0.00 H new ATOM 69 N VAL A 377 -2.172 11.339 -0.737 1.00 0.00 N ATOM 70 CA VAL A 377 -1.911 10.096 -0.015 1.00 0.00 C ATOM 71 C VAL A 377 -1.340 9.021 -0.935 1.00 0.00 C ATOM 72 O VAL A 377 -1.603 9.013 -2.138 1.00 0.00 O ATOM 73 CB VAL A 377 -3.179 9.564 0.697 1.00 0.00 C ATOM 74 CG1 VAL A 377 -3.985 10.714 1.281 1.00 0.00 C ATOM 75 CG2 VAL A 377 -4.040 8.733 -0.241 1.00 0.00 C ATOM 0 H VAL A 377 -2.922 11.288 -1.426 1.00 0.00 H new ATOM 0 HA VAL A 377 -1.167 10.332 0.746 1.00 0.00 H new ATOM 0 HB VAL A 377 -2.854 8.915 1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 377 -4.872 10.321 1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 377 -3.375 11.256 2.004 1.00 0.00 H new ATOM 0 HG13 VAL A 377 -4.286 11.390 0.481 1.00 0.00 H new ATOM 0 HG21 VAL A 377 -4.921 8.377 0.293 1.00 0.00 H new ATOM 0 HG22 VAL A 377 -4.352 9.345 -1.087 1.00 0.00 H new ATOM 0 HG23 VAL A 377 -3.465 7.880 -0.603 1.00 0.00 H new ATOM 85 N LEU A 378 -0.552 8.117 -0.358 1.00 0.00 N ATOM 86 CA LEU A 378 0.067 7.040 -1.118 1.00 0.00 C ATOM 87 C LEU A 378 -0.690 5.731 -0.924 1.00 0.00 C ATOM 88 O LEU A 378 -1.419 5.564 0.053 1.00 0.00 O ATOM 89 CB LEU A 378 1.527 6.865 -0.691 1.00 0.00 C ATOM 90 CG LEU A 378 2.510 6.581 -1.829 1.00 0.00 C ATOM 91 CD1 LEU A 378 3.659 7.578 -1.804 1.00 0.00 C ATOM 92 CD2 LEU A 378 3.040 5.159 -1.730 1.00 0.00 C ATOM 0 H LEU A 378 -0.328 8.111 0.637 1.00 0.00 H new ATOM 0 HA LEU A 378 0.031 7.306 -2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 378 1.848 7.768 -0.172 1.00 0.00 H new ATOM 0 HB3 LEU A 378 1.583 6.048 0.028 1.00 0.00 H new ATOM 0 HG LEU A 378 1.981 6.689 -2.776 1.00 0.00 H new ATOM 0 HD11 LEU A 378 4.348 7.360 -2.620 1.00 0.00 H new ATOM 0 HD12 LEU A 378 3.267 8.588 -1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 378 4.187 7.501 -0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 378 3.738 4.973 -2.547 1.00 0.00 H new ATOM 0 HD22 LEU A 378 3.553 5.027 -0.777 1.00 0.00 H new ATOM 0 HD23 LEU A 378 2.210 4.456 -1.795 1.00 0.00 H new ATOM 104 N CYS A 379 -0.512 4.809 -1.863 1.00 0.00 N ATOM 105 CA CYS A 379 -1.175 3.511 -1.797 1.00 0.00 C ATOM 106 C CYS A 379 -0.224 2.396 -2.214 1.00 0.00 C ATOM 107 O CYS A 379 0.059 2.216 -3.398 1.00 0.00 O ATOM 108 CB CYS A 379 -2.416 3.502 -2.690 1.00 0.00 C ATOM 109 SG CYS A 379 -3.669 2.294 -2.200 1.00 0.00 S ATOM 0 H CYS A 379 0.086 4.936 -2.680 1.00 0.00 H new ATOM 0 HA CYS A 379 -1.480 3.337 -0.765 1.00 0.00 H new ATOM 0 HB2 CYS A 379 -2.863 4.496 -2.683 1.00 0.00 H new ATOM 0 HB3 CYS A 379 -2.111 3.297 -3.716 1.00 0.00 H new ATOM 0 HG CYS A 379 -3.577 1.241 -2.957 1.00 0.00 H new ATOM 115 N LEU A 380 0.267 1.650 -1.231 1.00 0.00 N ATOM 116 CA LEU A 380 1.191 0.551 -1.489 1.00 0.00 C ATOM 117 C LEU A 380 0.472 -0.792 -1.397 1.00 0.00 C ATOM 118 O LEU A 380 0.095 -1.232 -0.311 1.00 0.00 O ATOM 119 CB LEU A 380 2.357 0.590 -0.498 1.00 0.00 C ATOM 120 CG LEU A 380 2.479 1.879 0.320 1.00 0.00 C ATOM 121 CD1 LEU A 380 1.995 1.655 1.743 1.00 0.00 C ATOM 122 CD2 LEU A 380 3.917 2.376 0.319 1.00 0.00 C ATOM 0 H LEU A 380 0.040 1.786 -0.246 1.00 0.00 H new ATOM 0 HA LEU A 380 1.583 0.667 -2.500 1.00 0.00 H new ATOM 0 HB2 LEU A 380 2.255 -0.249 0.190 1.00 0.00 H new ATOM 0 HB3 LEU A 380 3.285 0.440 -1.049 1.00 0.00 H new ATOM 0 HG LEU A 380 1.850 2.640 -0.142 1.00 0.00 H new ATOM 0 HD11 LEU A 380 2.089 2.582 2.309 1.00 0.00 H new ATOM 0 HD12 LEU A 380 0.950 1.344 1.727 1.00 0.00 H new ATOM 0 HD13 LEU A 380 2.598 0.879 2.214 1.00 0.00 H new ATOM 0 HD21 LEU A 380 3.986 3.293 0.905 1.00 0.00 H new ATOM 0 HD22 LEU A 380 4.565 1.616 0.757 1.00 0.00 H new ATOM 0 HD23 LEU A 380 4.232 2.576 -0.705 1.00 0.00 H new ATOM 134 N MET A 381 0.286 -1.441 -2.544 1.00 0.00 N ATOM 135 CA MET A 381 -0.391 -2.732 -2.591 1.00 0.00 C ATOM 136 C MET A 381 0.574 -3.845 -2.989 1.00 0.00 C ATOM 137 O MET A 381 1.765 -3.604 -3.186 1.00 0.00 O ATOM 138 CB MET A 381 -1.561 -2.684 -3.577 1.00 0.00 C ATOM 139 CG MET A 381 -2.376 -1.404 -3.494 1.00 0.00 C ATOM 140 SD MET A 381 -3.624 -1.292 -4.791 1.00 0.00 S ATOM 141 CE MET A 381 -2.590 -1.134 -6.245 1.00 0.00 C ATOM 0 H MET A 381 0.595 -1.093 -3.452 1.00 0.00 H new ATOM 0 HA MET A 381 -0.771 -2.946 -1.592 1.00 0.00 H new ATOM 0 HB2 MET A 381 -1.175 -2.794 -4.591 1.00 0.00 H new ATOM 0 HB3 MET A 381 -2.217 -3.535 -3.391 1.00 0.00 H new ATOM 0 HG2 MET A 381 -2.863 -1.350 -2.520 1.00 0.00 H new ATOM 0 HG3 MET A 381 -1.707 -0.546 -3.563 1.00 0.00 H new ATOM 0 HE1 MET A 381 -3.075 -0.477 -6.967 1.00 0.00 H new ATOM 0 HE2 MET A 381 -1.625 -0.713 -5.961 1.00 0.00 H new ATOM 0 HE3 MET A 381 -2.440 -2.116 -6.693 1.00 0.00 H new ATOM 151 N ASN A 382 0.045 -5.062 -3.106 1.00 0.00 N ATOM 152 CA ASN A 382 0.851 -6.221 -3.481 1.00 0.00 C ATOM 153 C ASN A 382 2.089 -6.332 -2.595 1.00 0.00 C ATOM 154 O ASN A 382 3.217 -6.287 -3.083 1.00 0.00 O ATOM 155 CB ASN A 382 1.266 -6.128 -4.952 1.00 0.00 C ATOM 156 CG ASN A 382 1.821 -7.437 -5.483 1.00 0.00 C ATOM 157 OD1 ASN A 382 1.213 -8.494 -5.317 1.00 0.00 O ATOM 158 ND2 ASN A 382 2.982 -7.370 -6.125 1.00 0.00 N ATOM 0 H ASN A 382 -0.941 -5.270 -2.946 1.00 0.00 H new ATOM 0 HA ASN A 382 0.244 -7.115 -3.340 1.00 0.00 H new ATOM 0 HB2 ASN A 382 0.405 -5.833 -5.551 1.00 0.00 H new ATOM 0 HB3 ASN A 382 2.017 -5.346 -5.066 1.00 0.00 H new ATOM 0 HD21 ASN A 382 3.405 -8.217 -6.504 1.00 0.00 H new ATOM 0 HD22 ASN A 382 3.451 -6.471 -6.239 1.00 0.00 H new ATOM 165 N MET A 383 1.875 -6.477 -1.292 1.00 0.00 N ATOM 166 CA MET A 383 2.981 -6.590 -0.350 1.00 0.00 C ATOM 167 C MET A 383 2.493 -7.041 1.022 1.00 0.00 C ATOM 168 O MET A 383 3.180 -6.856 2.028 1.00 0.00 O ATOM 169 CB MET A 383 3.711 -5.250 -0.230 1.00 0.00 C ATOM 170 CG MET A 383 2.907 -4.176 0.485 1.00 0.00 C ATOM 171 SD MET A 383 3.699 -3.612 2.003 1.00 0.00 S ATOM 172 CE MET A 383 3.968 -1.884 1.620 1.00 0.00 C ATOM 0 H MET A 383 0.949 -6.519 -0.866 1.00 0.00 H new ATOM 0 HA MET A 383 3.671 -7.343 -0.730 1.00 0.00 H new ATOM 0 HB2 MET A 383 4.649 -5.404 0.303 1.00 0.00 H new ATOM 0 HB3 MET A 383 3.967 -4.895 -1.228 1.00 0.00 H new ATOM 0 HG2 MET A 383 2.766 -3.327 -0.184 1.00 0.00 H new ATOM 0 HG3 MET A 383 1.916 -4.565 0.719 1.00 0.00 H new ATOM 0 HE1 MET A 383 5.029 -1.651 1.714 1.00 0.00 H new ATOM 0 HE2 MET A 383 3.641 -1.682 0.600 1.00 0.00 H new ATOM 0 HE3 MET A 383 3.398 -1.265 2.313 1.00 0.00 H new ATOM 182 N VAL A 384 1.305 -7.633 1.058 1.00 0.00 N ATOM 183 CA VAL A 384 0.729 -8.105 2.310 1.00 0.00 C ATOM 184 C VAL A 384 -0.151 -9.327 2.090 1.00 0.00 C ATOM 185 O VAL A 384 -0.828 -9.444 1.067 1.00 0.00 O ATOM 186 CB VAL A 384 -0.108 -7.010 3.000 1.00 0.00 C ATOM 187 CG1 VAL A 384 0.684 -6.360 4.122 1.00 0.00 C ATOM 188 CG2 VAL A 384 -0.571 -5.970 1.991 1.00 0.00 C ATOM 0 H VAL A 384 0.723 -7.797 0.236 1.00 0.00 H new ATOM 0 HA VAL A 384 1.568 -8.372 2.953 1.00 0.00 H new ATOM 0 HB VAL A 384 -0.992 -7.477 3.434 1.00 0.00 H new ATOM 0 HG11 VAL A 384 0.077 -5.590 4.597 1.00 0.00 H new ATOM 0 HG12 VAL A 384 0.956 -7.115 4.860 1.00 0.00 H new ATOM 0 HG13 VAL A 384 1.589 -5.909 3.715 1.00 0.00 H new ATOM 0 HG21 VAL A 384 -1.160 -5.207 2.499 1.00 0.00 H new ATOM 0 HG22 VAL A 384 0.297 -5.506 1.522 1.00 0.00 H new ATOM 0 HG23 VAL A 384 -1.182 -6.451 1.227 1.00 0.00 H new ATOM 198 N LEU A 385 -0.136 -10.236 3.057 1.00 0.00 N ATOM 199 CA LEU A 385 -0.937 -11.449 2.980 1.00 0.00 C ATOM 200 C LEU A 385 -1.985 -11.465 4.091 1.00 0.00 C ATOM 201 O LEU A 385 -1.736 -10.969 5.188 1.00 0.00 O ATOM 202 CB LEU A 385 -0.042 -12.686 3.086 1.00 0.00 C ATOM 203 CG LEU A 385 1.049 -12.788 2.019 1.00 0.00 C ATOM 204 CD1 LEU A 385 2.328 -12.116 2.495 1.00 0.00 C ATOM 205 CD2 LEU A 385 1.309 -14.244 1.662 1.00 0.00 C ATOM 0 H LEU A 385 0.424 -10.155 3.906 1.00 0.00 H new ATOM 0 HA LEU A 385 -1.446 -11.466 2.016 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.430 -12.691 4.068 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -0.669 -13.576 3.029 1.00 0.00 H new ATOM 0 HG LEU A 385 0.705 -12.270 1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 385 3.092 -12.199 1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 385 2.132 -11.063 2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 385 2.678 -12.603 3.405 1.00 0.00 H new ATOM 0 HD21 LEU A 385 2.088 -14.299 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 385 1.632 -14.785 2.552 1.00 0.00 H new ATOM 0 HD23 LEU A 385 0.394 -14.693 1.277 1.00 0.00 H new ATOM 217 N PRO A 386 -3.175 -12.031 3.822 1.00 0.00 N ATOM 218 CA PRO A 386 -4.251 -12.098 4.813 1.00 0.00 C ATOM 219 C PRO A 386 -3.847 -12.892 6.051 1.00 0.00 C ATOM 220 O PRO A 386 -4.329 -12.628 7.153 1.00 0.00 O ATOM 221 CB PRO A 386 -5.394 -12.798 4.071 1.00 0.00 C ATOM 222 CG PRO A 386 -4.744 -13.497 2.925 1.00 0.00 C ATOM 223 CD PRO A 386 -3.566 -12.649 2.543 1.00 0.00 C ATOM 0 HA PRO A 386 -4.520 -11.109 5.184 1.00 0.00 H new ATOM 0 HB2 PRO A 386 -5.912 -13.504 4.721 1.00 0.00 H new ATOM 0 HB3 PRO A 386 -6.137 -12.080 3.724 1.00 0.00 H new ATOM 0 HG2 PRO A 386 -4.428 -14.501 3.208 1.00 0.00 H new ATOM 0 HG3 PRO A 386 -5.436 -13.604 2.089 1.00 0.00 H new ATOM 0 HD2 PRO A 386 -2.759 -13.247 2.120 1.00 0.00 H new ATOM 0 HD3 PRO A 386 -3.833 -11.900 1.797 1.00 0.00 H new ATOM 231 N GLU A 387 -2.960 -13.864 5.862 1.00 0.00 N ATOM 232 CA GLU A 387 -2.486 -14.687 6.969 1.00 0.00 C ATOM 233 C GLU A 387 -1.645 -13.853 7.927 1.00 0.00 C ATOM 234 O GLU A 387 -1.387 -14.258 9.061 1.00 0.00 O ATOM 235 CB GLU A 387 -1.668 -15.868 6.444 1.00 0.00 C ATOM 236 CG GLU A 387 -2.429 -17.185 6.446 1.00 0.00 C ATOM 237 CD GLU A 387 -1.561 -18.360 6.042 1.00 0.00 C ATOM 238 OE1 GLU A 387 -0.368 -18.372 6.409 1.00 0.00 O ATOM 239 OE2 GLU A 387 -2.076 -19.271 5.359 1.00 0.00 O ATOM 0 H GLU A 387 -2.556 -14.100 4.956 1.00 0.00 H new ATOM 0 HA GLU A 387 -3.352 -15.073 7.507 1.00 0.00 H new ATOM 0 HB2 GLU A 387 -1.340 -15.649 5.428 1.00 0.00 H new ATOM 0 HB3 GLU A 387 -0.770 -15.976 7.052 1.00 0.00 H new ATOM 0 HG2 GLU A 387 -2.836 -17.364 7.441 1.00 0.00 H new ATOM 0 HG3 GLU A 387 -3.276 -17.112 5.764 1.00 0.00 H new ATOM 246 N GLU A 388 -1.220 -12.683 7.458 1.00 0.00 N ATOM 247 CA GLU A 388 -0.411 -11.776 8.263 1.00 0.00 C ATOM 248 C GLU A 388 -1.280 -10.697 8.897 1.00 0.00 C ATOM 249 O GLU A 388 -1.055 -10.297 10.040 1.00 0.00 O ATOM 250 CB GLU A 388 0.680 -11.135 7.403 1.00 0.00 C ATOM 251 CG GLU A 388 1.725 -12.122 6.909 1.00 0.00 C ATOM 252 CD GLU A 388 3.105 -11.837 7.467 1.00 0.00 C ATOM 253 OE1 GLU A 388 3.773 -10.913 6.955 1.00 0.00 O ATOM 254 OE2 GLU A 388 3.517 -12.536 8.415 1.00 0.00 O ATOM 0 H GLU A 388 -1.424 -12.341 6.519 1.00 0.00 H new ATOM 0 HA GLU A 388 0.059 -12.352 9.060 1.00 0.00 H new ATOM 0 HB2 GLU A 388 0.216 -10.650 6.544 1.00 0.00 H new ATOM 0 HB3 GLU A 388 1.174 -10.354 7.981 1.00 0.00 H new ATOM 0 HG2 GLU A 388 1.426 -13.132 7.188 1.00 0.00 H new ATOM 0 HG3 GLU A 388 1.764 -12.090 5.820 1.00 0.00 H new ATOM 261 N LEU A 389 -2.272 -10.226 8.146 1.00 0.00 N ATOM 262 CA LEU A 389 -3.182 -9.197 8.637 1.00 0.00 C ATOM 263 C LEU A 389 -4.333 -9.828 9.411 1.00 0.00 C ATOM 264 O LEU A 389 -5.465 -9.347 9.363 1.00 0.00 O ATOM 265 CB LEU A 389 -3.731 -8.363 7.474 1.00 0.00 C ATOM 266 CG LEU A 389 -2.727 -8.034 6.366 1.00 0.00 C ATOM 267 CD1 LEU A 389 -3.346 -7.075 5.361 1.00 0.00 C ATOM 268 CD2 LEU A 389 -1.453 -7.440 6.951 1.00 0.00 C ATOM 0 H LEU A 389 -2.466 -10.541 7.195 1.00 0.00 H new ATOM 0 HA LEU A 389 -2.624 -8.542 9.306 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -4.571 -8.898 7.031 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -4.123 -7.428 7.874 1.00 0.00 H new ATOM 0 HG LEU A 389 -2.467 -8.960 5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -2.621 -6.850 4.579 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -4.229 -7.534 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -3.632 -6.153 5.867 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -0.754 -7.214 6.146 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -1.693 -6.524 7.491 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -0.999 -8.156 7.636 1.00 0.00 H new ATOM 280 N LEU A 390 -4.032 -10.907 10.123 1.00 0.00 N ATOM 281 CA LEU A 390 -5.040 -11.612 10.903 1.00 0.00 C ATOM 282 C LEU A 390 -4.603 -11.755 12.358 1.00 0.00 C ATOM 283 O LEU A 390 -5.436 -11.846 13.260 1.00 0.00 O ATOM 284 CB LEU A 390 -5.306 -12.986 10.292 1.00 0.00 C ATOM 285 CG LEU A 390 -6.684 -13.152 9.659 1.00 0.00 C ATOM 286 CD1 LEU A 390 -6.674 -14.288 8.648 1.00 0.00 C ATOM 287 CD2 LEU A 390 -7.735 -13.394 10.730 1.00 0.00 C ATOM 0 H LEU A 390 -3.098 -11.313 10.176 1.00 0.00 H new ATOM 0 HA LEU A 390 -5.961 -11.029 10.883 1.00 0.00 H new ATOM 0 HB2 LEU A 390 -4.548 -13.183 9.534 1.00 0.00 H new ATOM 0 HB3 LEU A 390 -5.185 -13.742 11.068 1.00 0.00 H new ATOM 0 HG LEU A 390 -6.936 -12.231 9.134 1.00 0.00 H new ATOM 0 HD11 LEU A 390 -7.665 -14.391 8.207 1.00 0.00 H new ATOM 0 HD12 LEU A 390 -5.949 -14.071 7.864 1.00 0.00 H new ATOM 0 HD13 LEU A 390 -6.401 -15.217 9.148 1.00 0.00 H new ATOM 0 HD21 LEU A 390 -8.712 -13.510 10.261 1.00 0.00 H new ATOM 0 HD22 LEU A 390 -7.488 -14.300 11.284 1.00 0.00 H new ATOM 0 HD23 LEU A 390 -7.759 -12.546 11.414 1.00 0.00 H new ATOM 299 N ASP A 391 -3.292 -11.779 12.579 1.00 0.00 N ATOM 300 CA ASP A 391 -2.747 -11.902 13.927 1.00 0.00 C ATOM 301 C ASP A 391 -2.696 -10.540 14.610 1.00 0.00 C ATOM 302 O ASP A 391 -2.676 -9.505 13.946 1.00 0.00 O ATOM 303 CB ASP A 391 -1.349 -12.521 13.883 1.00 0.00 C ATOM 304 CG ASP A 391 -1.292 -13.869 14.573 1.00 0.00 C ATOM 305 OD1 ASP A 391 -1.765 -14.861 13.978 1.00 0.00 O ATOM 306 OD2 ASP A 391 -0.776 -13.935 15.707 1.00 0.00 O ATOM 0 H ASP A 391 -2.588 -11.715 11.843 1.00 0.00 H new ATOM 0 HA ASP A 391 -3.402 -12.556 14.503 1.00 0.00 H new ATOM 0 HB2 ASP A 391 -1.037 -12.634 12.845 1.00 0.00 H new ATOM 0 HB3 ASP A 391 -0.639 -11.843 14.357 1.00 0.00 H new ATOM 311 N ASP A 392 -2.667 -10.546 15.938 1.00 0.00 N ATOM 312 CA ASP A 392 -2.630 -9.306 16.708 1.00 0.00 C ATOM 313 C ASP A 392 -1.260 -8.635 16.629 1.00 0.00 C ATOM 314 O ASP A 392 -1.152 -7.471 16.239 1.00 0.00 O ATOM 315 CB ASP A 392 -2.989 -9.581 18.169 1.00 0.00 C ATOM 316 CG ASP A 392 -4.357 -9.044 18.541 1.00 0.00 C ATOM 317 OD1 ASP A 392 -5.309 -9.249 17.759 1.00 0.00 O ATOM 318 OD2 ASP A 392 -4.477 -8.421 19.617 1.00 0.00 O ATOM 0 H ASP A 392 -2.668 -11.394 16.504 1.00 0.00 H new ATOM 0 HA ASP A 392 -3.364 -8.626 16.275 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -2.962 -10.655 18.350 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -2.237 -9.130 18.816 1.00 0.00 H new ATOM 323 N GLU A 393 -0.217 -9.374 16.996 1.00 0.00 N ATOM 324 CA GLU A 393 1.143 -8.842 16.982 1.00 0.00 C ATOM 325 C GLU A 393 1.690 -8.737 15.562 1.00 0.00 C ATOM 326 O GLU A 393 2.394 -7.784 15.229 1.00 0.00 O ATOM 327 CB GLU A 393 2.064 -9.722 17.829 1.00 0.00 C ATOM 328 CG GLU A 393 1.639 -9.819 19.286 1.00 0.00 C ATOM 329 CD GLU A 393 2.379 -10.906 20.042 1.00 0.00 C ATOM 330 OE1 GLU A 393 3.139 -11.664 19.402 1.00 0.00 O ATOM 331 OE2 GLU A 393 2.200 -11.000 21.274 1.00 0.00 O ATOM 0 H GLU A 393 -0.287 -10.343 17.307 1.00 0.00 H new ATOM 0 HA GLU A 393 1.109 -7.838 17.406 1.00 0.00 H new ATOM 0 HB2 GLU A 393 2.092 -10.723 17.400 1.00 0.00 H new ATOM 0 HB3 GLU A 393 3.078 -9.325 17.780 1.00 0.00 H new ATOM 0 HG2 GLU A 393 1.812 -8.860 19.775 1.00 0.00 H new ATOM 0 HG3 GLU A 393 0.568 -10.013 19.335 1.00 0.00 H new ATOM 338 N GLU A 394 1.365 -9.721 14.729 1.00 0.00 N ATOM 339 CA GLU A 394 1.835 -9.736 13.347 1.00 0.00 C ATOM 340 C GLU A 394 1.310 -8.533 12.570 1.00 0.00 C ATOM 341 O GLU A 394 2.079 -7.816 11.930 1.00 0.00 O ATOM 342 CB GLU A 394 1.413 -11.030 12.651 1.00 0.00 C ATOM 343 CG GLU A 394 2.205 -11.332 11.390 1.00 0.00 C ATOM 344 CD GLU A 394 3.337 -12.311 11.633 1.00 0.00 C ATOM 345 OE1 GLU A 394 3.050 -13.502 11.874 1.00 0.00 O ATOM 346 OE2 GLU A 394 4.511 -11.885 11.584 1.00 0.00 O ATOM 0 H GLU A 394 0.780 -10.516 14.985 1.00 0.00 H new ATOM 0 HA GLU A 394 2.923 -9.681 13.368 1.00 0.00 H new ATOM 0 HB2 GLU A 394 1.526 -11.860 13.348 1.00 0.00 H new ATOM 0 HB3 GLU A 394 0.355 -10.968 12.398 1.00 0.00 H new ATOM 0 HG2 GLU A 394 1.534 -11.738 10.633 1.00 0.00 H new ATOM 0 HG3 GLU A 394 2.612 -10.403 10.990 1.00 0.00 H new ATOM 353 N TYR A 395 -0.001 -8.316 12.628 1.00 0.00 N ATOM 354 CA TYR A 395 -0.621 -7.205 11.927 1.00 0.00 C ATOM 355 C TYR A 395 -0.089 -5.871 12.443 1.00 0.00 C ATOM 356 O TYR A 395 0.251 -4.981 11.658 1.00 0.00 O ATOM 357 CB TYR A 395 -2.139 -7.278 12.095 1.00 0.00 C ATOM 358 CG TYR A 395 -2.859 -6.035 11.646 1.00 0.00 C ATOM 359 CD1 TYR A 395 -2.623 -5.492 10.393 1.00 0.00 C ATOM 360 CD2 TYR A 395 -3.770 -5.402 12.477 1.00 0.00 C ATOM 361 CE1 TYR A 395 -3.274 -4.353 9.979 1.00 0.00 C ATOM 362 CE2 TYR A 395 -4.428 -4.262 12.071 1.00 0.00 C ATOM 363 CZ TYR A 395 -4.178 -3.739 10.819 1.00 0.00 C ATOM 364 OH TYR A 395 -4.832 -2.601 10.409 1.00 0.00 O ATOM 0 H TYR A 395 -0.652 -8.898 13.155 1.00 0.00 H new ATOM 0 HA TYR A 395 -0.374 -7.275 10.868 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -2.517 -8.130 11.530 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -2.371 -7.462 13.144 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -1.917 -5.971 9.731 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -3.967 -5.809 13.458 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -3.078 -3.942 9.000 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -5.136 -3.780 12.729 1.00 0.00 H new ATOM 0 HH TYR A 395 -5.338 -2.791 9.592 1.00 0.00 H new ATOM 374 N GLU A 396 -0.020 -5.739 13.764 1.00 0.00 N ATOM 375 CA GLU A 396 0.478 -4.518 14.385 1.00 0.00 C ATOM 376 C GLU A 396 1.877 -4.195 13.875 1.00 0.00 C ATOM 377 O GLU A 396 2.264 -3.029 13.784 1.00 0.00 O ATOM 378 CB GLU A 396 0.497 -4.668 15.908 1.00 0.00 C ATOM 379 CG GLU A 396 0.610 -3.345 16.649 1.00 0.00 C ATOM 380 CD GLU A 396 1.908 -3.222 17.424 1.00 0.00 C ATOM 381 OE1 GLU A 396 2.977 -3.496 16.840 1.00 0.00 O ATOM 382 OE2 GLU A 396 1.854 -2.851 18.616 1.00 0.00 O ATOM 0 H GLU A 396 -0.303 -6.463 14.425 1.00 0.00 H new ATOM 0 HA GLU A 396 -0.189 -3.698 14.119 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -0.413 -5.176 16.226 1.00 0.00 H new ATOM 0 HB3 GLU A 396 1.334 -5.306 16.191 1.00 0.00 H new ATOM 0 HG2 GLU A 396 0.538 -2.525 15.935 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -0.230 -3.244 17.336 1.00 0.00 H new ATOM 389 N GLU A 397 2.629 -5.239 13.540 1.00 0.00 N ATOM 390 CA GLU A 397 3.986 -5.076 13.035 1.00 0.00 C ATOM 391 C GLU A 397 3.970 -4.615 11.581 1.00 0.00 C ATOM 392 O GLU A 397 4.855 -3.878 11.146 1.00 0.00 O ATOM 393 CB GLU A 397 4.757 -6.391 13.157 1.00 0.00 C ATOM 394 CG GLU A 397 6.175 -6.220 13.672 1.00 0.00 C ATOM 395 CD GLU A 397 6.343 -6.726 15.091 1.00 0.00 C ATOM 396 OE1 GLU A 397 5.974 -5.990 16.031 1.00 0.00 O ATOM 397 OE2 GLU A 397 6.845 -7.856 15.264 1.00 0.00 O ATOM 0 H GLU A 397 2.320 -6.208 13.610 1.00 0.00 H new ATOM 0 HA GLU A 397 4.484 -4.314 13.635 1.00 0.00 H new ATOM 0 HB2 GLU A 397 4.215 -7.059 13.826 1.00 0.00 H new ATOM 0 HB3 GLU A 397 4.790 -6.875 12.181 1.00 0.00 H new ATOM 0 HG2 GLU A 397 6.863 -6.753 13.016 1.00 0.00 H new ATOM 0 HG3 GLU A 397 6.448 -5.166 13.631 1.00 0.00 H new ATOM 404 N ILE A 398 2.960 -5.054 10.836 1.00 0.00 N ATOM 405 CA ILE A 398 2.829 -4.681 9.432 1.00 0.00 C ATOM 406 C ILE A 398 2.724 -3.168 9.278 1.00 0.00 C ATOM 407 O ILE A 398 3.485 -2.554 8.531 1.00 0.00 O ATOM 408 CB ILE A 398 1.595 -5.343 8.788 1.00 0.00 C ATOM 409 CG1 ILE A 398 1.747 -6.865 8.789 1.00 0.00 C ATOM 410 CG2 ILE A 398 1.387 -4.827 7.370 1.00 0.00 C ATOM 411 CD1 ILE A 398 2.986 -7.358 8.070 1.00 0.00 C ATOM 0 H ILE A 398 2.222 -5.667 11.181 1.00 0.00 H new ATOM 0 HA ILE A 398 3.725 -5.034 8.922 1.00 0.00 H new ATOM 0 HB ILE A 398 0.716 -5.082 9.378 1.00 0.00 H new ATOM 0 HG12 ILE A 398 1.773 -7.217 9.820 1.00 0.00 H new ATOM 0 HG13 ILE A 398 0.867 -7.309 8.323 1.00 0.00 H new ATOM 0 HG21 ILE A 398 0.511 -5.307 6.933 1.00 0.00 H new ATOM 0 HG22 ILE A 398 1.236 -3.748 7.394 1.00 0.00 H new ATOM 0 HG23 ILE A 398 2.265 -5.057 6.767 1.00 0.00 H new ATOM 0 HD11 ILE A 398 3.023 -8.446 8.114 1.00 0.00 H new ATOM 0 HD12 ILE A 398 2.954 -7.038 7.029 1.00 0.00 H new ATOM 0 HD13 ILE A 398 3.873 -6.945 8.549 1.00 0.00 H new ATOM 423 N VAL A 399 1.776 -2.574 9.994 1.00 0.00 N ATOM 424 CA VAL A 399 1.567 -1.129 9.941 1.00 0.00 C ATOM 425 C VAL A 399 2.746 -0.375 10.531 1.00 0.00 C ATOM 426 O VAL A 399 3.385 0.438 9.864 1.00 0.00 O ATOM 427 CB VAL A 399 0.292 -0.725 10.716 1.00 0.00 C ATOM 428 CG1 VAL A 399 0.060 -1.610 11.934 1.00 0.00 C ATOM 429 CG2 VAL A 399 0.325 0.746 11.110 1.00 0.00 C ATOM 0 H VAL A 399 1.139 -3.069 10.618 1.00 0.00 H new ATOM 0 HA VAL A 399 1.460 -0.866 8.889 1.00 0.00 H new ATOM 0 HB VAL A 399 -0.550 -0.875 10.040 1.00 0.00 H new ATOM 0 HG11 VAL A 399 -0.846 -1.291 12.449 1.00 0.00 H new ATOM 0 HG12 VAL A 399 -0.050 -2.646 11.615 1.00 0.00 H new ATOM 0 HG13 VAL A 399 0.910 -1.527 12.611 1.00 0.00 H new ATOM 0 HG21 VAL A 399 -0.586 0.998 11.653 1.00 0.00 H new ATOM 0 HG22 VAL A 399 1.190 0.933 11.746 1.00 0.00 H new ATOM 0 HG23 VAL A 399 0.394 1.361 10.213 1.00 0.00 H new ATOM 439 N GLU A 400 3.006 -0.660 11.791 1.00 0.00 N ATOM 440 CA GLU A 400 4.104 -0.035 12.530 1.00 0.00 C ATOM 441 C GLU A 400 5.384 0.044 11.696 1.00 0.00 C ATOM 442 O GLU A 400 5.944 1.124 11.509 1.00 0.00 O ATOM 443 CB GLU A 400 4.377 -0.806 13.824 1.00 0.00 C ATOM 444 CG GLU A 400 5.137 0.001 14.863 1.00 0.00 C ATOM 445 CD GLU A 400 4.220 0.656 15.879 1.00 0.00 C ATOM 446 OE1 GLU A 400 3.736 1.774 15.605 1.00 0.00 O ATOM 447 OE2 GLU A 400 3.986 0.050 16.946 1.00 0.00 O ATOM 0 H GLU A 400 2.467 -1.330 12.339 1.00 0.00 H new ATOM 0 HA GLU A 400 3.797 0.984 12.767 1.00 0.00 H new ATOM 0 HB2 GLU A 400 3.428 -1.131 14.251 1.00 0.00 H new ATOM 0 HB3 GLU A 400 4.945 -1.706 13.588 1.00 0.00 H new ATOM 0 HG2 GLU A 400 5.840 -0.651 15.381 1.00 0.00 H new ATOM 0 HG3 GLU A 400 5.725 0.769 14.362 1.00 0.00 H new ATOM 454 N ASP A 401 5.845 -1.101 11.200 1.00 0.00 N ATOM 455 CA ASP A 401 7.062 -1.150 10.391 1.00 0.00 C ATOM 456 C ASP A 401 6.947 -0.242 9.170 1.00 0.00 C ATOM 457 O ASP A 401 7.813 0.600 8.924 1.00 0.00 O ATOM 458 CB ASP A 401 7.349 -2.585 9.947 1.00 0.00 C ATOM 459 CG ASP A 401 8.740 -2.743 9.366 1.00 0.00 C ATOM 460 OD1 ASP A 401 8.916 -2.464 8.162 1.00 0.00 O ATOM 461 OD2 ASP A 401 9.655 -3.146 10.117 1.00 0.00 O ATOM 0 H ASP A 401 5.396 -2.006 11.343 1.00 0.00 H new ATOM 0 HA ASP A 401 7.888 -0.795 11.007 1.00 0.00 H new ATOM 0 HB2 ASP A 401 7.236 -3.255 10.799 1.00 0.00 H new ATOM 0 HB3 ASP A 401 6.611 -2.887 9.204 1.00 0.00 H new ATOM 466 N VAL A 402 5.873 -0.422 8.408 1.00 0.00 N ATOM 467 CA VAL A 402 5.635 0.379 7.213 1.00 0.00 C ATOM 468 C VAL A 402 5.625 1.870 7.551 1.00 0.00 C ATOM 469 O VAL A 402 5.918 2.712 6.702 1.00 0.00 O ATOM 470 CB VAL A 402 4.300 -0.017 6.540 1.00 0.00 C ATOM 471 CG1 VAL A 402 3.881 1.002 5.491 1.00 0.00 C ATOM 472 CG2 VAL A 402 4.413 -1.402 5.921 1.00 0.00 C ATOM 0 H VAL A 402 5.152 -1.118 8.598 1.00 0.00 H new ATOM 0 HA VAL A 402 6.449 0.183 6.515 1.00 0.00 H new ATOM 0 HB VAL A 402 3.529 -0.035 7.310 1.00 0.00 H new ATOM 0 HG11 VAL A 402 2.939 0.692 5.038 1.00 0.00 H new ATOM 0 HG12 VAL A 402 3.754 1.977 5.961 1.00 0.00 H new ATOM 0 HG13 VAL A 402 4.649 1.068 4.721 1.00 0.00 H new ATOM 0 HG21 VAL A 402 3.467 -1.669 5.451 1.00 0.00 H new ATOM 0 HG22 VAL A 402 5.204 -1.402 5.171 1.00 0.00 H new ATOM 0 HG23 VAL A 402 4.650 -2.129 6.698 1.00 0.00 H new ATOM 482 N ARG A 403 5.303 2.184 8.802 1.00 0.00 N ATOM 483 CA ARG A 403 5.254 3.570 9.260 1.00 0.00 C ATOM 484 C ARG A 403 6.658 4.135 9.445 1.00 0.00 C ATOM 485 O ARG A 403 6.932 5.276 9.071 1.00 0.00 O ATOM 486 CB ARG A 403 4.477 3.666 10.573 1.00 0.00 C ATOM 487 CG ARG A 403 4.162 5.093 10.993 1.00 0.00 C ATOM 488 CD ARG A 403 2.664 5.328 11.086 1.00 0.00 C ATOM 489 NE ARG A 403 2.073 4.650 12.236 1.00 0.00 N ATOM 490 CZ ARG A 403 2.320 4.981 13.501 1.00 0.00 C ATOM 491 NH1 ARG A 403 3.139 5.986 13.781 1.00 0.00 N ATOM 492 NH2 ARG A 403 1.743 4.308 14.488 1.00 0.00 N ATOM 0 H ARG A 403 5.071 1.496 9.519 1.00 0.00 H new ATOM 0 HA ARG A 403 4.744 4.159 8.498 1.00 0.00 H new ATOM 0 HB2 ARG A 403 3.544 3.111 10.474 1.00 0.00 H new ATOM 0 HB3 ARG A 403 5.053 3.183 11.362 1.00 0.00 H new ATOM 0 HG2 ARG A 403 4.624 5.300 11.958 1.00 0.00 H new ATOM 0 HG3 ARG A 403 4.597 5.789 10.276 1.00 0.00 H new ATOM 0 HD2 ARG A 403 2.469 6.398 11.157 1.00 0.00 H new ATOM 0 HD3 ARG A 403 2.185 4.976 10.172 1.00 0.00 H new ATOM 0 HE ARG A 403 1.432 3.876 12.059 1.00 0.00 H new ATOM 0 HH11 ARG A 403 3.582 6.508 13.025 1.00 0.00 H new ATOM 0 HH12 ARG A 403 3.326 6.236 14.752 1.00 0.00 H new ATOM 0 HH21 ARG A 403 1.110 3.537 14.277 1.00 0.00 H new ATOM 0 HH22 ARG A 403 1.933 4.562 15.458 1.00 0.00 H new ATOM 506 N ASP A 404 7.542 3.333 10.029 1.00 0.00 N ATOM 507 CA ASP A 404 8.918 3.753 10.265 1.00 0.00 C ATOM 508 C ASP A 404 9.620 4.091 8.953 1.00 0.00 C ATOM 509 O ASP A 404 10.392 5.047 8.879 1.00 0.00 O ATOM 510 CB ASP A 404 9.689 2.655 11.000 1.00 0.00 C ATOM 511 CG ASP A 404 9.893 2.975 12.467 1.00 0.00 C ATOM 512 OD1 ASP A 404 8.915 3.384 13.128 1.00 0.00 O ATOM 513 OD2 ASP A 404 11.031 2.817 12.957 1.00 0.00 O ATOM 0 H ASP A 404 7.330 2.388 10.348 1.00 0.00 H new ATOM 0 HA ASP A 404 8.895 4.650 10.884 1.00 0.00 H new ATOM 0 HB2 ASP A 404 9.149 1.712 10.908 1.00 0.00 H new ATOM 0 HB3 ASP A 404 10.659 2.515 10.523 1.00 0.00 H new ATOM 518 N GLU A 405 9.345 3.300 7.921 1.00 0.00 N ATOM 519 CA GLU A 405 9.951 3.514 6.612 1.00 0.00 C ATOM 520 C GLU A 405 9.292 4.682 5.884 1.00 0.00 C ATOM 521 O GLU A 405 9.963 5.457 5.203 1.00 0.00 O ATOM 522 CB GLU A 405 9.848 2.245 5.767 1.00 0.00 C ATOM 523 CG GLU A 405 11.067 1.343 5.876 1.00 0.00 C ATOM 524 CD GLU A 405 11.477 1.088 7.313 1.00 0.00 C ATOM 525 OE1 GLU A 405 10.940 0.141 7.924 1.00 0.00 O ATOM 526 OE2 GLU A 405 12.336 1.837 7.827 1.00 0.00 O ATOM 0 H GLU A 405 8.707 2.506 7.966 1.00 0.00 H new ATOM 0 HA GLU A 405 11.003 3.757 6.764 1.00 0.00 H new ATOM 0 HB2 GLU A 405 8.964 1.686 6.072 1.00 0.00 H new ATOM 0 HB3 GLU A 405 9.704 2.524 4.723 1.00 0.00 H new ATOM 0 HG2 GLU A 405 10.855 0.392 5.388 1.00 0.00 H new ATOM 0 HG3 GLU A 405 11.900 1.798 5.340 1.00 0.00 H new ATOM 533 N CYS A 406 7.977 4.801 6.028 1.00 0.00 N ATOM 534 CA CYS A 406 7.233 5.878 5.382 1.00 0.00 C ATOM 535 C CYS A 406 7.636 7.234 5.954 1.00 0.00 C ATOM 536 O CYS A 406 7.597 8.249 5.259 1.00 0.00 O ATOM 537 CB CYS A 406 5.729 5.667 5.557 1.00 0.00 C ATOM 538 SG CYS A 406 4.819 5.521 4.001 1.00 0.00 S ATOM 0 H CYS A 406 7.404 4.167 6.585 1.00 0.00 H new ATOM 0 HA CYS A 406 7.473 5.863 4.319 1.00 0.00 H new ATOM 0 HB2 CYS A 406 5.566 4.765 6.147 1.00 0.00 H new ATOM 0 HB3 CYS A 406 5.320 6.500 6.128 1.00 0.00 H new ATOM 0 HG CYS A 406 4.229 4.364 3.951 1.00 0.00 H new ATOM 544 N SER A 407 8.023 7.241 7.227 1.00 0.00 N ATOM 545 CA SER A 407 8.430 8.471 7.900 1.00 0.00 C ATOM 546 C SER A 407 9.931 8.709 7.752 1.00 0.00 C ATOM 547 O SER A 407 10.548 9.370 8.589 1.00 0.00 O ATOM 548 CB SER A 407 8.053 8.411 9.381 1.00 0.00 C ATOM 549 OG SER A 407 7.061 9.373 9.696 1.00 0.00 O ATOM 0 H SER A 407 8.063 6.408 7.814 1.00 0.00 H new ATOM 0 HA SER A 407 7.905 9.303 7.430 1.00 0.00 H new ATOM 0 HB2 SER A 407 7.687 7.414 9.626 1.00 0.00 H new ATOM 0 HB3 SER A 407 8.939 8.585 9.992 1.00 0.00 H new ATOM 0 HG SER A 407 6.837 9.312 10.648 1.00 0.00 H new ATOM 555 N LYS A 408 10.513 8.172 6.684 1.00 0.00 N ATOM 556 CA LYS A 408 11.942 8.329 6.430 1.00 0.00 C ATOM 557 C LYS A 408 12.182 9.342 5.317 1.00 0.00 C ATOM 558 O LYS A 408 13.273 9.898 5.194 1.00 0.00 O ATOM 559 CB LYS A 408 12.572 6.986 6.059 1.00 0.00 C ATOM 560 CG LYS A 408 13.642 6.523 7.033 1.00 0.00 C ATOM 561 CD LYS A 408 13.485 5.049 7.372 1.00 0.00 C ATOM 562 CE LYS A 408 14.504 4.604 8.407 1.00 0.00 C ATOM 563 NZ LYS A 408 14.020 4.833 9.798 1.00 0.00 N ATOM 0 H LYS A 408 10.018 7.624 5.980 1.00 0.00 H new ATOM 0 HA LYS A 408 12.410 8.696 7.343 1.00 0.00 H new ATOM 0 HB2 LYS A 408 11.789 6.230 6.007 1.00 0.00 H new ATOM 0 HB3 LYS A 408 13.008 7.062 5.063 1.00 0.00 H new ATOM 0 HG2 LYS A 408 14.628 6.695 6.601 1.00 0.00 H new ATOM 0 HG3 LYS A 408 13.586 7.116 7.946 1.00 0.00 H new ATOM 0 HD2 LYS A 408 12.479 4.866 7.749 1.00 0.00 H new ATOM 0 HD3 LYS A 408 13.600 4.452 6.467 1.00 0.00 H new ATOM 0 HE2 LYS A 408 14.723 3.545 8.269 1.00 0.00 H new ATOM 0 HE3 LYS A 408 15.437 5.146 8.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 14.744 4.516 10.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 13.835 5.847 9.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 13.143 4.296 9.953 1.00 0.00 H new ATOM 577 N TYR A 409 11.154 9.574 4.509 1.00 0.00 N ATOM 578 CA TYR A 409 11.244 10.522 3.407 1.00 0.00 C ATOM 579 C TYR A 409 10.481 11.795 3.742 1.00 0.00 C ATOM 580 O TYR A 409 10.617 12.812 3.062 1.00 0.00 O ATOM 581 CB TYR A 409 10.685 9.906 2.122 1.00 0.00 C ATOM 582 CG TYR A 409 10.992 8.434 1.967 1.00 0.00 C ATOM 583 CD1 TYR A 409 12.176 8.013 1.376 1.00 0.00 C ATOM 584 CD2 TYR A 409 10.097 7.467 2.410 1.00 0.00 C ATOM 585 CE1 TYR A 409 12.462 6.669 1.229 1.00 0.00 C ATOM 586 CE2 TYR A 409 10.376 6.120 2.266 1.00 0.00 C ATOM 587 CZ TYR A 409 11.560 5.728 1.675 1.00 0.00 C ATOM 588 OH TYR A 409 11.841 4.389 1.529 1.00 0.00 O ATOM 0 H TYR A 409 10.247 9.117 4.598 1.00 0.00 H new ATOM 0 HA TYR A 409 12.295 10.767 3.252 1.00 0.00 H new ATOM 0 HB2 TYR A 409 9.604 10.046 2.103 1.00 0.00 H new ATOM 0 HB3 TYR A 409 11.091 10.444 1.266 1.00 0.00 H new ATOM 0 HD1 TYR A 409 12.885 8.748 1.025 1.00 0.00 H new ATOM 0 HD2 TYR A 409 9.170 7.772 2.873 1.00 0.00 H new ATOM 0 HE1 TYR A 409 13.387 6.358 0.767 1.00 0.00 H new ATOM 0 HE2 TYR A 409 9.671 5.379 2.614 1.00 0.00 H new ATOM 0 HH TYR A 409 11.707 3.931 2.385 1.00 0.00 H new ATOM 598 N GLY A 410 9.679 11.726 4.798 1.00 0.00 N ATOM 599 CA GLY A 410 8.901 12.875 5.213 1.00 0.00 C ATOM 600 C GLY A 410 8.002 12.574 6.394 1.00 0.00 C ATOM 601 O GLY A 410 8.387 11.844 7.307 1.00 0.00 O ATOM 0 H GLY A 410 9.554 10.893 5.374 1.00 0.00 H new ATOM 0 HA2 GLY A 410 9.575 13.691 5.473 1.00 0.00 H new ATOM 0 HA3 GLY A 410 8.293 13.219 4.376 1.00 0.00 H new ATOM 605 N LEU A 411 6.801 13.141 6.374 1.00 0.00 N ATOM 606 CA LEU A 411 5.840 12.941 7.451 1.00 0.00 C ATOM 607 C LEU A 411 4.609 12.182 6.967 1.00 0.00 C ATOM 608 O LEU A 411 3.969 12.577 5.992 1.00 0.00 O ATOM 609 CB LEU A 411 5.414 14.293 8.031 1.00 0.00 C ATOM 610 CG LEU A 411 6.068 14.675 9.360 1.00 0.00 C ATOM 611 CD1 LEU A 411 5.668 13.700 10.456 1.00 0.00 C ATOM 612 CD2 LEU A 411 7.579 14.726 9.211 1.00 0.00 C ATOM 0 H LEU A 411 6.470 13.744 5.621 1.00 0.00 H new ATOM 0 HA LEU A 411 6.326 12.345 8.224 1.00 0.00 H new ATOM 0 HB2 LEU A 411 5.638 15.069 7.299 1.00 0.00 H new ATOM 0 HB3 LEU A 411 4.333 14.286 8.167 1.00 0.00 H new ATOM 0 HG LEU A 411 5.716 15.667 9.645 1.00 0.00 H new ATOM 0 HD11 LEU A 411 6.144 13.990 11.393 1.00 0.00 H new ATOM 0 HD12 LEU A 411 4.585 13.716 10.579 1.00 0.00 H new ATOM 0 HD13 LEU A 411 5.988 12.694 10.183 1.00 0.00 H new ATOM 0 HD21 LEU A 411 8.030 14.999 10.165 1.00 0.00 H new ATOM 0 HD22 LEU A 411 7.947 13.748 8.903 1.00 0.00 H new ATOM 0 HD23 LEU A 411 7.846 15.468 8.458 1.00 0.00 H new ATOM 624 N VAL A 412 4.284 11.090 7.652 1.00 0.00 N ATOM 625 CA VAL A 412 3.118 10.287 7.303 1.00 0.00 C ATOM 626 C VAL A 412 2.054 10.396 8.396 1.00 0.00 C ATOM 627 O VAL A 412 2.240 9.906 9.511 1.00 0.00 O ATOM 628 CB VAL A 412 3.489 8.803 7.071 1.00 0.00 C ATOM 629 CG1 VAL A 412 4.197 8.219 8.283 1.00 0.00 C ATOM 630 CG2 VAL A 412 2.250 7.987 6.732 1.00 0.00 C ATOM 0 H VAL A 412 4.812 10.741 8.452 1.00 0.00 H new ATOM 0 HA VAL A 412 2.718 10.679 6.368 1.00 0.00 H new ATOM 0 HB VAL A 412 4.176 8.758 6.226 1.00 0.00 H new ATOM 0 HG11 VAL A 412 4.446 7.175 8.091 1.00 0.00 H new ATOM 0 HG12 VAL A 412 5.111 8.780 8.476 1.00 0.00 H new ATOM 0 HG13 VAL A 412 3.542 8.282 9.152 1.00 0.00 H new ATOM 0 HG21 VAL A 412 2.532 6.946 6.572 1.00 0.00 H new ATOM 0 HG22 VAL A 412 1.538 8.048 7.555 1.00 0.00 H new ATOM 0 HG23 VAL A 412 1.791 8.382 5.825 1.00 0.00 H new ATOM 640 N LYS A 413 0.945 11.059 8.073 1.00 0.00 N ATOM 641 CA LYS A 413 -0.143 11.248 9.029 1.00 0.00 C ATOM 642 C LYS A 413 -0.539 9.932 9.691 1.00 0.00 C ATOM 643 O LYS A 413 -0.599 9.844 10.918 1.00 0.00 O ATOM 644 CB LYS A 413 -1.361 11.874 8.345 1.00 0.00 C ATOM 645 CG LYS A 413 -1.245 13.377 8.155 1.00 0.00 C ATOM 646 CD LYS A 413 -1.944 13.833 6.885 1.00 0.00 C ATOM 647 CE LYS A 413 -2.828 15.043 7.140 1.00 0.00 C ATOM 648 NZ LYS A 413 -3.641 15.398 5.944 1.00 0.00 N ATOM 0 H LYS A 413 0.777 11.474 7.157 1.00 0.00 H new ATOM 0 HA LYS A 413 0.217 11.925 9.804 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -1.503 11.403 7.372 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -2.251 11.658 8.937 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -1.679 13.888 9.014 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -0.193 13.660 8.114 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -1.200 14.078 6.127 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -2.548 13.017 6.488 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -3.490 14.838 7.981 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -2.207 15.893 7.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -4.230 16.228 6.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -3.009 15.618 5.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -4.252 14.596 5.689 1.00 0.00 H new ATOM 662 N SER A 414 -0.806 8.908 8.883 1.00 0.00 N ATOM 663 CA SER A 414 -1.193 7.607 9.425 1.00 0.00 C ATOM 664 C SER A 414 -1.202 6.519 8.355 1.00 0.00 C ATOM 665 O SER A 414 -0.878 6.766 7.194 1.00 0.00 O ATOM 666 CB SER A 414 -2.576 7.696 10.076 1.00 0.00 C ATOM 667 OG SER A 414 -3.482 8.410 9.253 1.00 0.00 O ATOM 0 H SER A 414 -0.763 8.951 7.865 1.00 0.00 H new ATOM 0 HA SER A 414 -0.448 7.335 10.173 1.00 0.00 H new ATOM 0 HB2 SER A 414 -2.960 6.693 10.260 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.494 8.189 11.045 1.00 0.00 H new ATOM 0 HG SER A 414 -4.358 8.451 9.690 1.00 0.00 H new ATOM 673 N ILE A 415 -1.574 5.309 8.770 1.00 0.00 N ATOM 674 CA ILE A 415 -1.643 4.163 7.868 1.00 0.00 C ATOM 675 C ILE A 415 -2.896 3.339 8.147 1.00 0.00 C ATOM 676 O ILE A 415 -3.275 3.143 9.303 1.00 0.00 O ATOM 677 CB ILE A 415 -0.407 3.250 8.011 1.00 0.00 C ATOM 678 CG1 ILE A 415 0.880 4.065 7.852 1.00 0.00 C ATOM 679 CG2 ILE A 415 -0.462 2.114 6.996 1.00 0.00 C ATOM 680 CD1 ILE A 415 2.144 3.249 8.018 1.00 0.00 C ATOM 0 H ILE A 415 -1.834 5.097 9.733 1.00 0.00 H new ATOM 0 HA ILE A 415 -1.673 4.557 6.852 1.00 0.00 H new ATOM 0 HB ILE A 415 -0.411 2.812 9.009 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.885 4.530 6.866 1.00 0.00 H new ATOM 0 HG13 ILE A 415 0.881 4.872 8.585 1.00 0.00 H new ATOM 0 HG21 ILE A 415 0.417 1.480 7.111 1.00 0.00 H new ATOM 0 HG22 ILE A 415 -1.361 1.521 7.162 1.00 0.00 H new ATOM 0 HG23 ILE A 415 -0.482 2.528 5.988 1.00 0.00 H new ATOM 0 HD11 ILE A 415 3.013 3.895 7.892 1.00 0.00 H new ATOM 0 HD12 ILE A 415 2.163 2.806 9.014 1.00 0.00 H new ATOM 0 HD13 ILE A 415 2.168 2.458 7.268 1.00 0.00 H new ATOM 692 N GLU A 416 -3.536 2.859 7.087 1.00 0.00 N ATOM 693 CA GLU A 416 -4.745 2.057 7.227 1.00 0.00 C ATOM 694 C GLU A 416 -4.633 0.754 6.441 1.00 0.00 C ATOM 695 O GLU A 416 -4.271 0.751 5.260 1.00 0.00 O ATOM 696 CB GLU A 416 -5.966 2.847 6.756 1.00 0.00 C ATOM 697 CG GLU A 416 -6.022 4.265 7.300 1.00 0.00 C ATOM 698 CD GLU A 416 -7.442 4.750 7.513 1.00 0.00 C ATOM 699 OE1 GLU A 416 -8.052 5.247 6.543 1.00 0.00 O ATOM 700 OE2 GLU A 416 -7.945 4.633 8.651 1.00 0.00 O ATOM 0 H GLU A 416 -3.239 3.011 6.123 1.00 0.00 H new ATOM 0 HA GLU A 416 -4.865 1.812 8.282 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -5.965 2.885 5.667 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -6.869 2.316 7.056 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -5.481 4.310 8.245 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -5.512 4.936 6.609 1.00 0.00 H new ATOM 707 N ILE A 417 -4.938 -0.353 7.117 1.00 0.00 N ATOM 708 CA ILE A 417 -4.876 -1.676 6.506 1.00 0.00 C ATOM 709 C ILE A 417 -6.058 -2.542 6.949 1.00 0.00 C ATOM 710 O ILE A 417 -6.477 -2.473 8.105 1.00 0.00 O ATOM 711 CB ILE A 417 -3.566 -2.404 6.877 1.00 0.00 C ATOM 712 CG1 ILE A 417 -2.576 -1.431 7.530 1.00 0.00 C ATOM 713 CG2 ILE A 417 -2.954 -3.051 5.647 1.00 0.00 C ATOM 714 CD1 ILE A 417 -1.338 -2.097 8.089 1.00 0.00 C ATOM 0 H ILE A 417 -5.232 -0.357 8.094 1.00 0.00 H new ATOM 0 HA ILE A 417 -4.914 -1.528 5.427 1.00 0.00 H new ATOM 0 HB ILE A 417 -3.797 -3.188 7.598 1.00 0.00 H new ATOM 0 HG12 ILE A 417 -2.274 -0.686 6.793 1.00 0.00 H new ATOM 0 HG13 ILE A 417 -3.083 -0.897 8.334 1.00 0.00 H new ATOM 0 HG21 ILE A 417 -2.031 -3.560 5.925 1.00 0.00 H new ATOM 0 HG22 ILE A 417 -3.655 -3.773 5.229 1.00 0.00 H new ATOM 0 HG23 ILE A 417 -2.736 -2.285 4.903 1.00 0.00 H new ATOM 0 HD11 ILE A 417 -0.688 -1.343 8.533 1.00 0.00 H new ATOM 0 HD12 ILE A 417 -1.627 -2.821 8.851 1.00 0.00 H new ATOM 0 HD13 ILE A 417 -0.806 -2.607 7.286 1.00 0.00 H new ATOM 726 N PRO A 418 -6.617 -3.369 6.041 1.00 0.00 N ATOM 727 CA PRO A 418 -7.745 -4.249 6.372 1.00 0.00 C ATOM 728 C PRO A 418 -7.370 -5.281 7.432 1.00 0.00 C ATOM 729 O PRO A 418 -6.197 -5.620 7.593 1.00 0.00 O ATOM 730 CB PRO A 418 -8.074 -4.939 5.043 1.00 0.00 C ATOM 731 CG PRO A 418 -6.835 -4.811 4.225 1.00 0.00 C ATOM 732 CD PRO A 418 -6.207 -3.510 4.632 1.00 0.00 C ATOM 0 HA PRO A 418 -8.585 -3.695 6.790 1.00 0.00 H new ATOM 0 HB2 PRO A 418 -8.339 -5.985 5.196 1.00 0.00 H new ATOM 0 HB3 PRO A 418 -8.923 -4.464 4.551 1.00 0.00 H new ATOM 0 HG2 PRO A 418 -6.158 -5.646 4.408 1.00 0.00 H new ATOM 0 HG3 PRO A 418 -7.068 -4.816 3.160 1.00 0.00 H new ATOM 0 HD2 PRO A 418 -5.122 -3.536 4.528 1.00 0.00 H new ATOM 0 HD3 PRO A 418 -6.566 -2.681 4.022 1.00 0.00 H new ATOM 740 N ARG A 419 -8.372 -5.781 8.152 1.00 0.00 N ATOM 741 CA ARG A 419 -8.140 -6.770 9.199 1.00 0.00 C ATOM 742 C ARG A 419 -9.297 -7.765 9.284 1.00 0.00 C ATOM 743 O ARG A 419 -10.133 -7.677 10.184 1.00 0.00 O ATOM 744 CB ARG A 419 -7.946 -6.078 10.550 1.00 0.00 C ATOM 745 CG ARG A 419 -7.211 -6.934 11.570 1.00 0.00 C ATOM 746 CD ARG A 419 -8.150 -7.437 12.655 1.00 0.00 C ATOM 747 NE ARG A 419 -7.849 -8.813 13.045 1.00 0.00 N ATOM 748 CZ ARG A 419 -7.832 -9.234 14.307 1.00 0.00 C ATOM 749 NH1 ARG A 419 -8.097 -8.391 15.296 1.00 0.00 N ATOM 750 NH2 ARG A 419 -7.553 -10.502 14.579 1.00 0.00 N ATOM 0 H ARG A 419 -9.350 -5.518 8.029 1.00 0.00 H new ATOM 0 HA ARG A 419 -7.234 -7.320 8.946 1.00 0.00 H new ATOM 0 HB2 ARG A 419 -7.392 -5.151 10.398 1.00 0.00 H new ATOM 0 HB3 ARG A 419 -8.921 -5.804 10.952 1.00 0.00 H new ATOM 0 HG2 ARG A 419 -6.746 -7.782 11.067 1.00 0.00 H new ATOM 0 HG3 ARG A 419 -6.408 -6.353 12.023 1.00 0.00 H new ATOM 0 HD2 ARG A 419 -8.076 -6.788 13.528 1.00 0.00 H new ATOM 0 HD3 ARG A 419 -9.179 -7.378 12.300 1.00 0.00 H new ATOM 0 HE ARG A 419 -7.640 -9.488 12.309 1.00 0.00 H new ATOM 0 HH11 ARG A 419 -8.315 -7.416 15.090 1.00 0.00 H new ATOM 0 HH12 ARG A 419 -8.083 -8.718 16.262 1.00 0.00 H new ATOM 0 HH21 ARG A 419 -7.352 -11.154 13.821 1.00 0.00 H new ATOM 0 HH22 ARG A 419 -7.540 -10.825 15.546 1.00 0.00 H new ATOM 764 N PRO A 420 -9.361 -8.724 8.342 1.00 0.00 N ATOM 765 CA PRO A 420 -10.417 -9.741 8.321 1.00 0.00 C ATOM 766 C PRO A 420 -10.580 -10.430 9.672 1.00 0.00 C ATOM 767 O PRO A 420 -9.627 -11.005 10.198 1.00 0.00 O ATOM 768 CB PRO A 420 -9.920 -10.741 7.277 1.00 0.00 C ATOM 769 CG PRO A 420 -9.054 -9.944 6.366 1.00 0.00 C ATOM 770 CD PRO A 420 -8.412 -8.886 7.221 1.00 0.00 C ATOM 0 HA PRO A 420 -11.393 -9.312 8.095 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -9.362 -11.553 7.742 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -10.751 -11.194 6.736 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -8.300 -10.574 5.894 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -9.641 -9.495 5.565 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -7.427 -9.196 7.571 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -8.277 -7.954 6.672 1.00 0.00 H new ATOM 778 N VAL A 421 -11.786 -10.370 10.235 1.00 0.00 N ATOM 779 CA VAL A 421 -12.039 -10.998 11.526 1.00 0.00 C ATOM 780 C VAL A 421 -12.045 -12.512 11.399 1.00 0.00 C ATOM 781 O VAL A 421 -13.055 -13.112 11.042 1.00 0.00 O ATOM 782 CB VAL A 421 -13.362 -10.526 12.157 1.00 0.00 C ATOM 783 CG1 VAL A 421 -13.577 -11.201 13.504 1.00 0.00 C ATOM 784 CG2 VAL A 421 -13.368 -9.013 12.304 1.00 0.00 C ATOM 0 H VAL A 421 -12.592 -9.899 9.823 1.00 0.00 H new ATOM 0 HA VAL A 421 -11.226 -10.693 12.185 1.00 0.00 H new ATOM 0 HB VAL A 421 -14.184 -10.808 11.499 1.00 0.00 H new ATOM 0 HG11 VAL A 421 -14.516 -10.857 13.937 1.00 0.00 H new ATOM 0 HG12 VAL A 421 -13.614 -12.282 13.368 1.00 0.00 H new ATOM 0 HG13 VAL A 421 -12.755 -10.948 14.173 1.00 0.00 H new ATOM 0 HG21 VAL A 421 -14.310 -8.695 12.751 1.00 0.00 H new ATOM 0 HG22 VAL A 421 -12.540 -8.706 12.944 1.00 0.00 H new ATOM 0 HG23 VAL A 421 -13.258 -8.552 11.323 1.00 0.00 H new ATOM 794 N ASP A 422 -10.906 -13.128 11.700 1.00 0.00 N ATOM 795 CA ASP A 422 -10.780 -14.572 11.588 1.00 0.00 C ATOM 796 C ASP A 422 -11.111 -14.975 10.161 1.00 0.00 C ATOM 797 O ASP A 422 -11.395 -16.136 9.867 1.00 0.00 O ATOM 798 CB ASP A 422 -11.711 -15.282 12.575 1.00 0.00 C ATOM 799 CG ASP A 422 -10.963 -16.218 13.504 1.00 0.00 C ATOM 800 OD1 ASP A 422 -10.552 -17.305 13.045 1.00 0.00 O ATOM 801 OD2 ASP A 422 -10.789 -15.865 14.689 1.00 0.00 O ATOM 0 H ASP A 422 -10.064 -12.651 12.021 1.00 0.00 H new ATOM 0 HA ASP A 422 -9.759 -14.868 11.831 1.00 0.00 H new ATOM 0 HB2 ASP A 422 -12.245 -14.538 13.166 1.00 0.00 H new ATOM 0 HB3 ASP A 422 -12.461 -15.847 12.021 1.00 0.00 H new ATOM 806 N GLY A 423 -11.064 -13.978 9.282 1.00 0.00 N ATOM 807 CA GLY A 423 -11.373 -14.180 7.888 1.00 0.00 C ATOM 808 C GLY A 423 -12.731 -13.611 7.526 1.00 0.00 C ATOM 809 O GLY A 423 -13.421 -14.146 6.657 1.00 0.00 O ATOM 0 H GLY A 423 -10.812 -13.019 9.522 1.00 0.00 H new ATOM 0 HA2 GLY A 423 -10.606 -13.709 7.273 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -11.353 -15.246 7.662 1.00 0.00 H new ATOM 813 N VAL A 424 -13.121 -12.522 8.195 1.00 0.00 N ATOM 814 CA VAL A 424 -14.414 -11.900 7.933 1.00 0.00 C ATOM 815 C VAL A 424 -14.319 -10.833 6.839 1.00 0.00 C ATOM 816 O VAL A 424 -14.559 -11.120 5.665 1.00 0.00 O ATOM 817 CB VAL A 424 -15.048 -11.296 9.209 1.00 0.00 C ATOM 818 CG1 VAL A 424 -16.162 -10.315 8.864 1.00 0.00 C ATOM 819 CG2 VAL A 424 -15.590 -12.402 10.100 1.00 0.00 C ATOM 0 H VAL A 424 -12.564 -12.060 8.914 1.00 0.00 H new ATOM 0 HA VAL A 424 -15.066 -12.700 7.582 1.00 0.00 H new ATOM 0 HB VAL A 424 -14.269 -10.751 9.743 1.00 0.00 H new ATOM 0 HG11 VAL A 424 -16.586 -9.909 9.782 1.00 0.00 H new ATOM 0 HG12 VAL A 424 -15.757 -9.502 8.261 1.00 0.00 H new ATOM 0 HG13 VAL A 424 -16.940 -10.831 8.302 1.00 0.00 H new ATOM 0 HG21 VAL A 424 -16.033 -11.964 10.994 1.00 0.00 H new ATOM 0 HG22 VAL A 424 -16.349 -12.967 9.558 1.00 0.00 H new ATOM 0 HG23 VAL A 424 -14.777 -13.069 10.387 1.00 0.00 H new ATOM 829 N GLU A 425 -13.970 -9.605 7.223 1.00 0.00 N ATOM 830 CA GLU A 425 -13.863 -8.512 6.273 1.00 0.00 C ATOM 831 C GLU A 425 -12.680 -8.696 5.329 1.00 0.00 C ATOM 832 O GLU A 425 -11.547 -8.333 5.642 1.00 0.00 O ATOM 833 CB GLU A 425 -13.761 -7.172 7.013 1.00 0.00 C ATOM 834 CG GLU A 425 -12.606 -7.084 8.001 1.00 0.00 C ATOM 835 CD GLU A 425 -12.581 -5.765 8.751 1.00 0.00 C ATOM 836 OE1 GLU A 425 -13.670 -5.227 9.041 1.00 0.00 O ATOM 837 OE2 GLU A 425 -11.473 -5.272 9.049 1.00 0.00 O ATOM 0 H GLU A 425 -13.758 -9.348 8.187 1.00 0.00 H new ATOM 0 HA GLU A 425 -14.767 -8.512 5.664 1.00 0.00 H new ATOM 0 HB2 GLU A 425 -13.657 -6.373 6.279 1.00 0.00 H new ATOM 0 HB3 GLU A 425 -14.694 -6.994 7.547 1.00 0.00 H new ATOM 0 HG2 GLU A 425 -12.681 -7.903 8.716 1.00 0.00 H new ATOM 0 HG3 GLU A 425 -11.665 -7.212 7.467 1.00 0.00 H new ATOM 844 N VAL A 426 -12.959 -9.270 4.162 1.00 0.00 N ATOM 845 CA VAL A 426 -11.936 -9.484 3.144 1.00 0.00 C ATOM 846 C VAL A 426 -12.421 -8.950 1.797 1.00 0.00 C ATOM 847 O VAL A 426 -12.559 -9.703 0.831 1.00 0.00 O ATOM 848 CB VAL A 426 -11.579 -10.972 2.990 1.00 0.00 C ATOM 849 CG1 VAL A 426 -10.190 -11.126 2.393 1.00 0.00 C ATOM 850 CG2 VAL A 426 -11.677 -11.695 4.325 1.00 0.00 C ATOM 0 H VAL A 426 -13.889 -9.596 3.898 1.00 0.00 H new ATOM 0 HA VAL A 426 -11.043 -8.949 3.466 1.00 0.00 H new ATOM 0 HB VAL A 426 -12.298 -11.427 2.309 1.00 0.00 H new ATOM 0 HG11 VAL A 426 -9.953 -12.185 2.291 1.00 0.00 H new ATOM 0 HG12 VAL A 426 -10.161 -10.651 1.412 1.00 0.00 H new ATOM 0 HG13 VAL A 426 -9.458 -10.652 3.047 1.00 0.00 H new ATOM 0 HG21 VAL A 426 -11.420 -12.746 4.190 1.00 0.00 H new ATOM 0 HG22 VAL A 426 -10.987 -11.241 5.036 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -12.695 -11.617 4.707 1.00 0.00 H new ATOM 860 N PRO A 427 -12.687 -7.636 1.721 1.00 0.00 N ATOM 861 CA PRO A 427 -13.171 -6.976 0.521 1.00 0.00 C ATOM 862 C PRO A 427 -12.033 -6.416 -0.321 1.00 0.00 C ATOM 863 O PRO A 427 -12.154 -5.347 -0.922 1.00 0.00 O ATOM 864 CB PRO A 427 -14.038 -5.840 1.091 1.00 0.00 C ATOM 865 CG PRO A 427 -13.662 -5.712 2.545 1.00 0.00 C ATOM 866 CD PRO A 427 -12.525 -6.663 2.795 1.00 0.00 C ATOM 0 HA PRO A 427 -13.707 -7.651 -0.146 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -13.856 -4.907 0.558 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -15.098 -6.067 0.982 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -13.366 -4.689 2.777 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -14.512 -5.951 3.185 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -11.558 -6.162 2.746 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -12.594 -7.128 3.778 1.00 0.00 H new ATOM 874 N GLY A 428 -10.927 -7.148 -0.360 1.00 0.00 N ATOM 875 CA GLY A 428 -9.769 -6.716 -1.119 1.00 0.00 C ATOM 876 C GLY A 428 -8.519 -6.665 -0.266 1.00 0.00 C ATOM 877 O GLY A 428 -7.584 -5.921 -0.567 1.00 0.00 O ATOM 0 H GLY A 428 -10.811 -8.039 0.124 1.00 0.00 H new ATOM 0 HA2 GLY A 428 -9.610 -7.396 -1.956 1.00 0.00 H new ATOM 0 HA3 GLY A 428 -9.960 -5.730 -1.542 1.00 0.00 H new ATOM 881 N CYS A 429 -8.508 -7.456 0.804 1.00 0.00 N ATOM 882 CA CYS A 429 -7.368 -7.508 1.714 1.00 0.00 C ATOM 883 C CYS A 429 -6.066 -7.725 0.950 1.00 0.00 C ATOM 884 O CYS A 429 -5.993 -8.562 0.051 1.00 0.00 O ATOM 885 CB CYS A 429 -7.559 -8.622 2.746 1.00 0.00 C ATOM 886 SG CYS A 429 -6.015 -9.303 3.396 1.00 0.00 S ATOM 0 H CYS A 429 -9.279 -8.072 1.062 1.00 0.00 H new ATOM 0 HA CYS A 429 -7.308 -6.550 2.231 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.150 -8.235 3.576 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.136 -9.428 2.292 1.00 0.00 H new ATOM 0 HG CYS A 429 -6.247 -9.904 4.525 1.00 0.00 H new ATOM 892 N GLY A 430 -5.039 -6.961 1.316 1.00 0.00 N ATOM 893 CA GLY A 430 -3.751 -7.080 0.659 1.00 0.00 C ATOM 894 C GLY A 430 -3.298 -5.775 0.035 1.00 0.00 C ATOM 895 O GLY A 430 -2.367 -5.756 -0.771 1.00 0.00 O ATOM 0 H GLY A 430 -5.078 -6.261 2.057 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -3.006 -7.411 1.383 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -3.809 -7.848 -0.113 1.00 0.00 H new ATOM 899 N LYS A 431 -3.957 -4.684 0.410 1.00 0.00 N ATOM 900 CA LYS A 431 -3.620 -3.366 -0.118 1.00 0.00 C ATOM 901 C LYS A 431 -3.545 -2.331 1.000 1.00 0.00 C ATOM 902 O LYS A 431 -4.564 -1.960 1.583 1.00 0.00 O ATOM 903 CB LYS A 431 -4.654 -2.933 -1.160 1.00 0.00 C ATOM 904 CG LYS A 431 -4.789 -3.900 -2.325 1.00 0.00 C ATOM 905 CD LYS A 431 -6.243 -4.105 -2.714 1.00 0.00 C ATOM 906 CE LYS A 431 -6.697 -3.077 -3.738 1.00 0.00 C ATOM 907 NZ LYS A 431 -7.897 -3.534 -4.490 1.00 0.00 N ATOM 0 H LYS A 431 -4.728 -4.686 1.078 1.00 0.00 H new ATOM 0 HA LYS A 431 -2.640 -3.433 -0.591 1.00 0.00 H new ATOM 0 HB2 LYS A 431 -5.624 -2.826 -0.674 1.00 0.00 H new ATOM 0 HB3 LYS A 431 -4.380 -1.951 -1.545 1.00 0.00 H new ATOM 0 HG2 LYS A 431 -4.233 -3.519 -3.181 1.00 0.00 H new ATOM 0 HG3 LYS A 431 -4.345 -4.858 -2.057 1.00 0.00 H new ATOM 0 HD2 LYS A 431 -6.374 -5.108 -3.121 1.00 0.00 H new ATOM 0 HD3 LYS A 431 -6.871 -4.037 -1.826 1.00 0.00 H new ATOM 0 HE2 LYS A 431 -6.921 -2.137 -3.234 1.00 0.00 H new ATOM 0 HE3 LYS A 431 -5.885 -2.878 -4.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 -8.174 -2.805 -5.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 -7.676 -4.418 -4.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 -8.680 -3.699 -3.826 1.00 0.00 H new ATOM 921 N ILE A 432 -2.333 -1.867 1.295 1.00 0.00 N ATOM 922 CA ILE A 432 -2.130 -0.872 2.342 1.00 0.00 C ATOM 923 C ILE A 432 -2.054 0.531 1.759 1.00 0.00 C ATOM 924 O ILE A 432 -1.574 0.722 0.643 1.00 0.00 O ATOM 925 CB ILE A 432 -0.831 -1.121 3.136 1.00 0.00 C ATOM 926 CG1 ILE A 432 -0.522 -2.617 3.234 1.00 0.00 C ATOM 927 CG2 ILE A 432 -0.936 -0.500 4.522 1.00 0.00 C ATOM 928 CD1 ILE A 432 0.773 -2.920 3.960 1.00 0.00 C ATOM 0 H ILE A 432 -1.479 -2.164 0.824 1.00 0.00 H new ATOM 0 HA ILE A 432 -2.987 -0.962 3.010 1.00 0.00 H new ATOM 0 HB ILE A 432 -0.007 -0.647 2.602 1.00 0.00 H new ATOM 0 HG12 ILE A 432 -1.343 -3.117 3.748 1.00 0.00 H new ATOM 0 HG13 ILE A 432 -0.473 -3.036 2.229 1.00 0.00 H new ATOM 0 HG21 ILE A 432 -0.013 -0.682 5.073 1.00 0.00 H new ATOM 0 HG22 ILE A 432 -1.097 0.574 4.428 1.00 0.00 H new ATOM 0 HG23 ILE A 432 -1.773 -0.947 5.058 1.00 0.00 H new ATOM 0 HD11 ILE A 432 0.928 -3.998 3.992 1.00 0.00 H new ATOM 0 HD12 ILE A 432 1.604 -2.449 3.434 1.00 0.00 H new ATOM 0 HD13 ILE A 432 0.720 -2.531 4.977 1.00 0.00 H new ATOM 940 N PHE A 433 -2.534 1.510 2.517 1.00 0.00 N ATOM 941 CA PHE A 433 -2.485 2.898 2.078 1.00 0.00 C ATOM 942 C PHE A 433 -2.247 3.817 3.269 1.00 0.00 C ATOM 943 O PHE A 433 -2.831 3.633 4.337 1.00 0.00 O ATOM 944 CB PHE A 433 -3.761 3.293 1.329 1.00 0.00 C ATOM 945 CG PHE A 433 -5.020 3.142 2.129 1.00 0.00 C ATOM 946 CD1 PHE A 433 -5.719 1.946 2.130 1.00 0.00 C ATOM 947 CD2 PHE A 433 -5.512 4.202 2.868 1.00 0.00 C ATOM 948 CE1 PHE A 433 -6.887 1.812 2.855 1.00 0.00 C ATOM 949 CE2 PHE A 433 -6.676 4.075 3.597 1.00 0.00 C ATOM 950 CZ PHE A 433 -7.366 2.879 3.590 1.00 0.00 C ATOM 0 H PHE A 433 -2.959 1.369 3.433 1.00 0.00 H new ATOM 0 HA PHE A 433 -1.653 3.005 1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 433 -3.672 4.330 1.006 1.00 0.00 H new ATOM 0 HB3 PHE A 433 -3.842 2.685 0.428 1.00 0.00 H new ATOM 0 HD1 PHE A 433 -5.347 1.109 1.558 1.00 0.00 H new ATOM 0 HD2 PHE A 433 -4.978 5.141 2.874 1.00 0.00 H new ATOM 0 HE1 PHE A 433 -7.424 0.875 2.847 1.00 0.00 H new ATOM 0 HE2 PHE A 433 -7.047 4.910 4.173 1.00 0.00 H new ATOM 0 HZ PHE A 433 -8.279 2.778 4.158 1.00 0.00 H new ATOM 960 N VAL A 434 -1.384 4.806 3.076 1.00 0.00 N ATOM 961 CA VAL A 434 -1.042 5.742 4.139 1.00 0.00 C ATOM 962 C VAL A 434 -1.415 7.171 3.770 1.00 0.00 C ATOM 963 O VAL A 434 -1.387 7.554 2.600 1.00 0.00 O ATOM 964 CB VAL A 434 0.467 5.679 4.473 1.00 0.00 C ATOM 965 CG1 VAL A 434 0.969 4.247 4.393 1.00 0.00 C ATOM 966 CG2 VAL A 434 1.276 6.580 3.547 1.00 0.00 C ATOM 0 H VAL A 434 -0.907 4.981 2.191 1.00 0.00 H new ATOM 0 HA VAL A 434 -1.617 5.445 5.016 1.00 0.00 H new ATOM 0 HB VAL A 434 0.600 6.041 5.493 1.00 0.00 H new ATOM 0 HG11 VAL A 434 2.032 4.220 4.631 1.00 0.00 H new ATOM 0 HG12 VAL A 434 0.422 3.629 5.106 1.00 0.00 H new ATOM 0 HG13 VAL A 434 0.813 3.862 3.385 1.00 0.00 H new ATOM 0 HG21 VAL A 434 2.333 6.514 3.807 1.00 0.00 H new ATOM 0 HG22 VAL A 434 1.136 6.260 2.514 1.00 0.00 H new ATOM 0 HG23 VAL A 434 0.939 7.611 3.657 1.00 0.00 H new ATOM 976 N GLU A 435 -1.772 7.953 4.781 1.00 0.00 N ATOM 977 CA GLU A 435 -2.131 9.344 4.579 1.00 0.00 C ATOM 978 C GLU A 435 -0.913 10.224 4.806 1.00 0.00 C ATOM 979 O GLU A 435 -0.412 10.327 5.926 1.00 0.00 O ATOM 980 CB GLU A 435 -3.260 9.752 5.527 1.00 0.00 C ATOM 981 CG GLU A 435 -3.959 11.038 5.121 1.00 0.00 C ATOM 982 CD GLU A 435 -4.907 11.551 6.188 1.00 0.00 C ATOM 983 OE1 GLU A 435 -4.755 11.148 7.361 1.00 0.00 O ATOM 984 OE2 GLU A 435 -5.801 12.355 5.851 1.00 0.00 O ATOM 0 H GLU A 435 -1.820 7.643 5.751 1.00 0.00 H new ATOM 0 HA GLU A 435 -2.482 9.471 3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -3.994 8.948 5.572 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -2.855 9.870 6.532 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -3.211 11.802 4.908 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -4.514 10.869 4.198 1.00 0.00 H new ATOM 991 N PHE A 436 -0.429 10.834 3.732 1.00 0.00 N ATOM 992 CA PHE A 436 0.739 11.700 3.801 1.00 0.00 C ATOM 993 C PHE A 436 0.345 13.145 4.091 1.00 0.00 C ATOM 994 O PHE A 436 -0.822 13.518 3.967 1.00 0.00 O ATOM 995 CB PHE A 436 1.517 11.632 2.488 1.00 0.00 C ATOM 996 CG PHE A 436 2.893 11.053 2.632 1.00 0.00 C ATOM 997 CD1 PHE A 436 3.067 9.706 2.905 1.00 0.00 C ATOM 998 CD2 PHE A 436 4.012 11.856 2.490 1.00 0.00 C ATOM 999 CE1 PHE A 436 4.333 9.170 3.034 1.00 0.00 C ATOM 1000 CE2 PHE A 436 5.281 11.325 2.618 1.00 0.00 C ATOM 1001 CZ PHE A 436 5.442 9.981 2.890 1.00 0.00 C ATOM 0 H PHE A 436 -0.830 10.744 2.799 1.00 0.00 H new ATOM 0 HA PHE A 436 1.368 11.349 4.619 1.00 0.00 H new ATOM 0 HB2 PHE A 436 0.953 11.033 1.773 1.00 0.00 H new ATOM 0 HB3 PHE A 436 1.597 12.636 2.071 1.00 0.00 H new ATOM 0 HD1 PHE A 436 2.203 9.068 3.018 1.00 0.00 H new ATOM 0 HD2 PHE A 436 3.892 12.908 2.277 1.00 0.00 H new ATOM 0 HE1 PHE A 436 4.456 8.118 3.247 1.00 0.00 H new ATOM 0 HE2 PHE A 436 6.147 11.961 2.505 1.00 0.00 H new ATOM 0 HZ PHE A 436 6.433 9.564 2.990 1.00 0.00 H new ATOM 1011 N THR A 437 1.330 13.951 4.478 1.00 0.00 N ATOM 1012 CA THR A 437 1.095 15.358 4.784 1.00 0.00 C ATOM 1013 C THR A 437 1.320 16.230 3.553 1.00 0.00 C ATOM 1014 O THR A 437 0.534 17.134 3.269 1.00 0.00 O ATOM 1015 CB THR A 437 2.015 15.849 5.918 1.00 0.00 C ATOM 1016 OG1 THR A 437 3.369 15.913 5.457 1.00 0.00 O ATOM 1017 CG2 THR A 437 1.929 14.927 7.125 1.00 0.00 C ATOM 0 H THR A 437 2.299 13.653 4.587 1.00 0.00 H new ATOM 0 HA THR A 437 0.057 15.443 5.106 1.00 0.00 H new ATOM 0 HB THR A 437 1.685 16.844 6.217 1.00 0.00 H new ATOM 0 HG1 THR A 437 3.476 16.684 4.862 1.00 0.00 H new ATOM 0 HG21 THR A 437 2.588 15.295 7.912 1.00 0.00 H new ATOM 0 HG22 THR A 437 0.903 14.903 7.492 1.00 0.00 H new ATOM 0 HG23 THR A 437 2.235 13.921 6.837 1.00 0.00 H new ATOM 1025 N SER A 438 2.399 15.952 2.828 1.00 0.00 N ATOM 1026 CA SER A 438 2.733 16.708 1.626 1.00 0.00 C ATOM 1027 C SER A 438 3.083 15.771 0.474 1.00 0.00 C ATOM 1028 O SER A 438 3.711 14.731 0.675 1.00 0.00 O ATOM 1029 CB SER A 438 3.905 17.653 1.904 1.00 0.00 C ATOM 1030 OG SER A 438 4.060 17.878 3.294 1.00 0.00 O ATOM 0 H SER A 438 3.058 15.207 3.053 1.00 0.00 H new ATOM 0 HA SER A 438 1.860 17.295 1.341 1.00 0.00 H new ATOM 0 HB2 SER A 438 4.823 17.229 1.497 1.00 0.00 H new ATOM 0 HB3 SER A 438 3.739 18.602 1.395 1.00 0.00 H new ATOM 0 HG SER A 438 4.816 18.483 3.445 1.00 0.00 H new ATOM 1036 N VAL A 439 2.673 16.148 -0.732 1.00 0.00 N ATOM 1037 CA VAL A 439 2.940 15.341 -1.914 1.00 0.00 C ATOM 1038 C VAL A 439 4.414 15.389 -2.298 1.00 0.00 C ATOM 1039 O VAL A 439 4.863 14.649 -3.174 1.00 0.00 O ATOM 1040 CB VAL A 439 2.102 15.806 -3.114 1.00 0.00 C ATOM 1041 CG1 VAL A 439 0.625 15.595 -2.837 1.00 0.00 C ATOM 1042 CG2 VAL A 439 2.392 17.262 -3.442 1.00 0.00 C ATOM 0 H VAL A 439 2.155 17.007 -0.916 1.00 0.00 H new ATOM 0 HA VAL A 439 2.666 14.317 -1.659 1.00 0.00 H new ATOM 0 HB VAL A 439 2.377 15.207 -3.982 1.00 0.00 H new ATOM 0 HG11 VAL A 439 0.042 15.929 -3.696 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.436 14.536 -2.660 1.00 0.00 H new ATOM 0 HG13 VAL A 439 0.334 16.168 -1.957 1.00 0.00 H new ATOM 0 HG21 VAL A 439 1.788 17.570 -4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 439 2.148 17.884 -2.581 1.00 0.00 H new ATOM 0 HG23 VAL A 439 3.448 17.377 -3.685 1.00 0.00 H new ATOM 1052 N PHE A 440 5.165 16.266 -1.638 1.00 0.00 N ATOM 1053 CA PHE A 440 6.588 16.411 -1.914 1.00 0.00 C ATOM 1054 C PHE A 440 7.346 15.191 -1.413 1.00 0.00 C ATOM 1055 O PHE A 440 8.095 14.558 -2.159 1.00 0.00 O ATOM 1056 CB PHE A 440 7.135 17.677 -1.252 1.00 0.00 C ATOM 1057 CG PHE A 440 8.119 18.424 -2.107 1.00 0.00 C ATOM 1058 CD1 PHE A 440 7.709 19.051 -3.273 1.00 0.00 C ATOM 1059 CD2 PHE A 440 9.454 18.498 -1.745 1.00 0.00 C ATOM 1060 CE1 PHE A 440 8.612 19.738 -4.060 1.00 0.00 C ATOM 1061 CE2 PHE A 440 10.362 19.184 -2.528 1.00 0.00 C ATOM 1062 CZ PHE A 440 9.941 19.805 -3.687 1.00 0.00 C ATOM 0 H PHE A 440 4.811 16.886 -0.909 1.00 0.00 H new ATOM 0 HA PHE A 440 6.725 16.495 -2.992 1.00 0.00 H new ATOM 0 HB2 PHE A 440 6.303 18.338 -1.008 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.615 17.407 -0.311 1.00 0.00 H new ATOM 0 HD1 PHE A 440 6.672 19.002 -3.569 1.00 0.00 H new ATOM 0 HD2 PHE A 440 9.789 18.014 -0.840 1.00 0.00 H new ATOM 0 HE1 PHE A 440 8.280 20.223 -4.966 1.00 0.00 H new ATOM 0 HE2 PHE A 440 11.400 19.235 -2.234 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.649 20.342 -4.301 1.00 0.00 H new ATOM 1072 N ASP A 441 7.138 14.863 -0.144 1.00 0.00 N ATOM 1073 CA ASP A 441 7.784 13.710 0.458 1.00 0.00 C ATOM 1074 C ASP A 441 7.098 12.434 -0.010 1.00 0.00 C ATOM 1075 O ASP A 441 7.707 11.366 -0.054 1.00 0.00 O ATOM 1076 CB ASP A 441 7.741 13.808 1.984 1.00 0.00 C ATOM 1077 CG ASP A 441 8.463 15.034 2.507 1.00 0.00 C ATOM 1078 OD1 ASP A 441 9.572 15.326 2.014 1.00 0.00 O ATOM 1079 OD2 ASP A 441 7.919 15.701 3.413 1.00 0.00 O ATOM 0 H ASP A 441 6.526 15.381 0.486 1.00 0.00 H new ATOM 0 HA ASP A 441 8.828 13.688 0.146 1.00 0.00 H new ATOM 0 HB2 ASP A 441 6.703 13.833 2.314 1.00 0.00 H new ATOM 0 HB3 ASP A 441 8.191 12.914 2.415 1.00 0.00 H new ATOM 1084 N CYS A 442 5.819 12.561 -0.358 1.00 0.00 N ATOM 1085 CA CYS A 442 5.040 11.430 -0.843 1.00 0.00 C ATOM 1086 C CYS A 442 5.608 10.929 -2.165 1.00 0.00 C ATOM 1087 O CYS A 442 5.717 9.725 -2.394 1.00 0.00 O ATOM 1088 CB CYS A 442 3.575 11.834 -1.024 1.00 0.00 C ATOM 1089 SG CYS A 442 2.394 10.507 -0.685 1.00 0.00 S ATOM 0 H CYS A 442 5.302 13.439 -0.312 1.00 0.00 H new ATOM 0 HA CYS A 442 5.096 10.628 -0.107 1.00 0.00 H new ATOM 0 HB2 CYS A 442 3.358 12.676 -0.366 1.00 0.00 H new ATOM 0 HB3 CYS A 442 3.429 12.183 -2.046 1.00 0.00 H new ATOM 0 HG CYS A 442 2.474 10.164 0.566 1.00 0.00 H new ATOM 1095 N GLN A 443 5.972 11.872 -3.026 1.00 0.00 N ATOM 1096 CA GLN A 443 6.537 11.550 -4.329 1.00 0.00 C ATOM 1097 C GLN A 443 7.936 10.962 -4.181 1.00 0.00 C ATOM 1098 O GLN A 443 8.282 9.980 -4.839 1.00 0.00 O ATOM 1099 CB GLN A 443 6.587 12.809 -5.197 1.00 0.00 C ATOM 1100 CG GLN A 443 6.992 12.549 -6.638 1.00 0.00 C ATOM 1101 CD GLN A 443 7.717 13.729 -7.254 1.00 0.00 C ATOM 1102 OE1 GLN A 443 8.664 13.558 -8.023 1.00 0.00 O ATOM 1103 NE2 GLN A 443 7.278 14.936 -6.917 1.00 0.00 N ATOM 0 H GLN A 443 5.885 12.872 -2.843 1.00 0.00 H new ATOM 0 HA GLN A 443 5.901 10.806 -4.809 1.00 0.00 H new ATOM 0 HB2 GLN A 443 5.606 13.285 -5.186 1.00 0.00 H new ATOM 0 HB3 GLN A 443 7.289 13.516 -4.755 1.00 0.00 H new ATOM 0 HG2 GLN A 443 7.634 11.669 -6.679 1.00 0.00 H new ATOM 0 HG3 GLN A 443 6.103 12.323 -7.228 1.00 0.00 H new ATOM 0 HE21 GLN A 443 6.490 15.032 -6.276 1.00 0.00 H new ATOM 0 HE22 GLN A 443 7.729 15.768 -7.299 1.00 0.00 H new ATOM 1112 N LYS A 444 8.735 11.570 -3.308 1.00 0.00 N ATOM 1113 CA LYS A 444 10.098 11.112 -3.069 1.00 0.00 C ATOM 1114 C LYS A 444 10.105 9.791 -2.302 1.00 0.00 C ATOM 1115 O LYS A 444 11.122 9.100 -2.246 1.00 0.00 O ATOM 1116 CB LYS A 444 10.881 12.173 -2.293 1.00 0.00 C ATOM 1117 CG LYS A 444 12.375 11.900 -2.221 1.00 0.00 C ATOM 1118 CD LYS A 444 12.895 12.026 -0.798 1.00 0.00 C ATOM 1119 CE LYS A 444 13.370 13.439 -0.500 1.00 0.00 C ATOM 1120 NZ LYS A 444 14.720 13.449 0.128 1.00 0.00 N ATOM 0 H LYS A 444 8.460 12.382 -2.755 1.00 0.00 H new ATOM 0 HA LYS A 444 10.576 10.949 -4.035 1.00 0.00 H new ATOM 0 HB2 LYS A 444 10.720 13.144 -2.760 1.00 0.00 H new ATOM 0 HB3 LYS A 444 10.483 12.237 -1.280 1.00 0.00 H new ATOM 0 HG2 LYS A 444 12.582 10.898 -2.598 1.00 0.00 H new ATOM 0 HG3 LYS A 444 12.906 12.600 -2.867 1.00 0.00 H new ATOM 0 HD2 LYS A 444 12.108 11.750 -0.096 1.00 0.00 H new ATOM 0 HD3 LYS A 444 13.716 11.326 -0.647 1.00 0.00 H new ATOM 0 HE2 LYS A 444 13.395 14.016 -1.424 1.00 0.00 H new ATOM 0 HE3 LYS A 444 12.657 13.930 0.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 15.008 14.430 0.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 14.691 12.920 1.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 15.405 13.004 -0.515 1.00 0.00 H new ATOM 1134 N ALA A 445 8.963 9.447 -1.714 1.00 0.00 N ATOM 1135 CA ALA A 445 8.838 8.210 -0.952 1.00 0.00 C ATOM 1136 C ALA A 445 8.638 7.015 -1.875 1.00 0.00 C ATOM 1137 O ALA A 445 9.438 6.081 -1.878 1.00 0.00 O ATOM 1138 CB ALA A 445 7.686 8.313 0.036 1.00 0.00 C ATOM 0 H ALA A 445 8.112 10.008 -1.751 1.00 0.00 H new ATOM 0 HA ALA A 445 9.765 8.058 -0.399 1.00 0.00 H new ATOM 0 HB1 ALA A 445 7.604 7.383 0.598 1.00 0.00 H new ATOM 0 HB2 ALA A 445 7.870 9.138 0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 445 6.757 8.493 -0.505 1.00 0.00 H new ATOM 1144 N MET A 446 7.565 7.053 -2.659 1.00 0.00 N ATOM 1145 CA MET A 446 7.256 5.972 -3.586 1.00 0.00 C ATOM 1146 C MET A 446 8.382 5.778 -4.594 1.00 0.00 C ATOM 1147 O MET A 446 8.656 4.658 -5.022 1.00 0.00 O ATOM 1148 CB MET A 446 5.947 6.263 -4.321 1.00 0.00 C ATOM 1149 CG MET A 446 5.914 7.631 -4.985 1.00 0.00 C ATOM 1150 SD MET A 446 4.350 7.962 -5.822 1.00 0.00 S ATOM 1151 CE MET A 446 4.292 6.607 -6.992 1.00 0.00 C ATOM 0 H MET A 446 6.895 7.822 -2.670 1.00 0.00 H new ATOM 0 HA MET A 446 7.148 5.054 -3.009 1.00 0.00 H new ATOM 0 HB2 MET A 446 5.787 5.496 -5.079 1.00 0.00 H new ATOM 0 HB3 MET A 446 5.120 6.191 -3.615 1.00 0.00 H new ATOM 0 HG2 MET A 446 6.088 8.400 -4.232 1.00 0.00 H new ATOM 0 HG3 MET A 446 6.729 7.700 -5.706 1.00 0.00 H new ATOM 0 HE1 MET A 446 3.550 6.822 -7.761 1.00 0.00 H new ATOM 0 HE2 MET A 446 5.271 6.485 -7.456 1.00 0.00 H new ATOM 0 HE3 MET A 446 4.020 5.689 -6.472 1.00 0.00 H new ATOM 1161 N GLN A 447 9.033 6.877 -4.968 1.00 0.00 N ATOM 1162 CA GLN A 447 10.131 6.831 -5.927 1.00 0.00 C ATOM 1163 C GLN A 447 11.214 5.855 -5.477 1.00 0.00 C ATOM 1164 O GLN A 447 11.919 5.272 -6.302 1.00 0.00 O ATOM 1165 CB GLN A 447 10.731 8.226 -6.112 1.00 0.00 C ATOM 1166 CG GLN A 447 11.703 8.322 -7.277 1.00 0.00 C ATOM 1167 CD GLN A 447 12.931 9.149 -6.946 1.00 0.00 C ATOM 1168 OE1 GLN A 447 13.113 10.247 -7.472 1.00 0.00 O ATOM 1169 NE2 GLN A 447 13.780 8.625 -6.070 1.00 0.00 N ATOM 0 H GLN A 447 8.818 7.811 -4.620 1.00 0.00 H new ATOM 0 HA GLN A 447 9.731 6.483 -6.879 1.00 0.00 H new ATOM 0 HB2 GLN A 447 9.924 8.942 -6.264 1.00 0.00 H new ATOM 0 HB3 GLN A 447 11.246 8.515 -5.196 1.00 0.00 H new ATOM 0 HG2 GLN A 447 12.013 7.319 -7.570 1.00 0.00 H new ATOM 0 HG3 GLN A 447 11.194 8.762 -8.135 1.00 0.00 H new ATOM 0 HE21 GLN A 447 13.589 7.711 -5.659 1.00 0.00 H new ATOM 0 HE22 GLN A 447 14.623 9.136 -5.808 1.00 0.00 H new ATOM 1178 N GLY A 448 11.340 5.681 -4.165 1.00 0.00 N ATOM 1179 CA GLY A 448 12.339 4.776 -3.629 1.00 0.00 C ATOM 1180 C GLY A 448 11.754 3.439 -3.219 1.00 0.00 C ATOM 1181 O GLY A 448 12.488 2.499 -2.915 1.00 0.00 O ATOM 0 H GLY A 448 10.768 6.151 -3.464 1.00 0.00 H new ATOM 0 HA2 GLY A 448 13.116 4.615 -4.376 1.00 0.00 H new ATOM 0 HA3 GLY A 448 12.818 5.239 -2.766 1.00 0.00 H new ATOM 1185 N LEU A 449 10.426 3.351 -3.210 1.00 0.00 N ATOM 1186 CA LEU A 449 9.745 2.118 -2.834 1.00 0.00 C ATOM 1187 C LEU A 449 9.341 1.319 -4.070 1.00 0.00 C ATOM 1188 O LEU A 449 8.782 0.227 -3.958 1.00 0.00 O ATOM 1189 CB LEU A 449 8.510 2.430 -1.982 1.00 0.00 C ATOM 1190 CG LEU A 449 8.785 3.167 -0.667 1.00 0.00 C ATOM 1191 CD1 LEU A 449 7.500 3.333 0.128 1.00 0.00 C ATOM 1192 CD2 LEU A 449 9.829 2.428 0.159 1.00 0.00 C ATOM 0 H LEU A 449 9.802 4.119 -3.459 1.00 0.00 H new ATOM 0 HA LEU A 449 10.437 1.515 -2.247 1.00 0.00 H new ATOM 0 HB2 LEU A 449 7.822 3.030 -2.577 1.00 0.00 H new ATOM 0 HB3 LEU A 449 8.001 1.493 -1.754 1.00 0.00 H new ATOM 0 HG LEU A 449 9.176 4.156 -0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 449 7.713 3.858 1.059 1.00 0.00 H new ATOM 0 HD12 LEU A 449 6.782 3.908 -0.457 1.00 0.00 H new ATOM 0 HD13 LEU A 449 7.082 2.352 0.353 1.00 0.00 H new ATOM 0 HD21 LEU A 449 10.008 2.970 1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 449 9.469 1.425 0.387 1.00 0.00 H new ATOM 0 HD23 LEU A 449 10.759 2.360 -0.406 1.00 0.00 H new ATOM 1204 N THR A 450 9.625 1.869 -5.248 1.00 0.00 N ATOM 1205 CA THR A 450 9.293 1.202 -6.503 1.00 0.00 C ATOM 1206 C THR A 450 10.297 0.100 -6.819 1.00 0.00 C ATOM 1207 O THR A 450 11.507 0.297 -6.704 1.00 0.00 O ATOM 1208 CB THR A 450 9.254 2.197 -7.679 1.00 0.00 C ATOM 1209 OG1 THR A 450 8.624 3.417 -7.272 1.00 0.00 O ATOM 1210 CG2 THR A 450 8.504 1.606 -8.864 1.00 0.00 C ATOM 0 H THR A 450 10.084 2.773 -5.359 1.00 0.00 H new ATOM 0 HA THR A 450 8.302 0.765 -6.376 1.00 0.00 H new ATOM 0 HB THR A 450 10.280 2.403 -7.983 1.00 0.00 H new ATOM 0 HG1 THR A 450 8.555 3.439 -6.295 1.00 0.00 H new ATOM 0 HG21 THR A 450 8.490 2.327 -9.682 1.00 0.00 H new ATOM 0 HG22 THR A 450 9.003 0.694 -9.192 1.00 0.00 H new ATOM 0 HG23 THR A 450 7.481 1.373 -8.568 1.00 0.00 H new ATOM 1218 N GLY A 451 9.788 -1.061 -7.219 1.00 0.00 N ATOM 1219 CA GLY A 451 10.653 -2.179 -7.545 1.00 0.00 C ATOM 1220 C GLY A 451 11.337 -2.757 -6.323 1.00 0.00 C ATOM 1221 O GLY A 451 12.535 -3.041 -6.349 1.00 0.00 O ATOM 0 H GLY A 451 8.791 -1.247 -7.323 1.00 0.00 H new ATOM 0 HA2 GLY A 451 10.067 -2.958 -8.032 1.00 0.00 H new ATOM 0 HA3 GLY A 451 11.408 -1.854 -8.261 1.00 0.00 H new ATOM 1225 N ARG A 452 10.574 -2.931 -5.249 1.00 0.00 N ATOM 1226 CA ARG A 452 11.107 -3.477 -4.006 1.00 0.00 C ATOM 1227 C ARG A 452 10.516 -4.857 -3.723 1.00 0.00 C ATOM 1228 O ARG A 452 10.234 -5.617 -4.648 1.00 0.00 O ATOM 1229 CB ARG A 452 10.810 -2.523 -2.846 1.00 0.00 C ATOM 1230 CG ARG A 452 11.658 -1.262 -2.864 1.00 0.00 C ATOM 1231 CD ARG A 452 12.980 -1.469 -2.143 1.00 0.00 C ATOM 1232 NE ARG A 452 14.122 -1.333 -3.043 1.00 0.00 N ATOM 1233 CZ ARG A 452 14.865 -0.234 -3.133 1.00 0.00 C ATOM 1234 NH1 ARG A 452 14.590 0.821 -2.378 1.00 0.00 N ATOM 1235 NH2 ARG A 452 15.887 -0.190 -3.978 1.00 0.00 N ATOM 0 H ARG A 452 9.581 -2.701 -5.215 1.00 0.00 H new ATOM 0 HA ARG A 452 12.187 -3.584 -4.109 1.00 0.00 H new ATOM 0 HB2 ARG A 452 9.757 -2.243 -2.877 1.00 0.00 H new ATOM 0 HB3 ARG A 452 10.973 -3.047 -1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 452 11.848 -0.965 -3.895 1.00 0.00 H new ATOM 0 HG3 ARG A 452 11.109 -0.447 -2.393 1.00 0.00 H new ATOM 0 HD2 ARG A 452 13.068 -0.745 -1.333 1.00 0.00 H new ATOM 0 HD3 ARG A 452 12.993 -2.459 -1.688 1.00 0.00 H new ATOM 0 HE ARG A 452 14.364 -2.127 -3.637 1.00 0.00 H new ATOM 0 HH11 ARG A 452 13.806 0.791 -1.726 1.00 0.00 H new ATOM 0 HH12 ARG A 452 15.162 1.662 -2.450 1.00 0.00 H new ATOM 0 HH21 ARG A 452 16.103 -1.000 -4.559 1.00 0.00 H new ATOM 0 HH22 ARG A 452 16.456 0.654 -4.046 1.00 0.00 H new ATOM 1249 N LYS A 453 10.337 -5.174 -2.441 1.00 0.00 N ATOM 1250 CA LYS A 453 9.776 -6.460 -2.032 1.00 0.00 C ATOM 1251 C LYS A 453 9.620 -6.512 -0.513 1.00 0.00 C ATOM 1252 O LYS A 453 10.609 -6.568 0.219 1.00 0.00 O ATOM 1253 CB LYS A 453 10.672 -7.608 -2.505 1.00 0.00 C ATOM 1254 CG LYS A 453 10.014 -8.521 -3.532 1.00 0.00 C ATOM 1255 CD LYS A 453 11.040 -9.392 -4.236 1.00 0.00 C ATOM 1256 CE LYS A 453 10.640 -9.669 -5.676 1.00 0.00 C ATOM 1257 NZ LYS A 453 10.511 -11.127 -5.946 1.00 0.00 N ATOM 0 H LYS A 453 10.574 -4.555 -1.666 1.00 0.00 H new ATOM 0 HA LYS A 453 8.794 -6.569 -2.491 1.00 0.00 H new ATOM 0 HB2 LYS A 453 11.583 -7.192 -2.934 1.00 0.00 H new ATOM 0 HB3 LYS A 453 10.969 -8.203 -1.642 1.00 0.00 H new ATOM 0 HG2 LYS A 453 9.275 -9.153 -3.039 1.00 0.00 H new ATOM 0 HG3 LYS A 453 9.480 -7.919 -4.267 1.00 0.00 H new ATOM 0 HD2 LYS A 453 12.012 -8.900 -4.215 1.00 0.00 H new ATOM 0 HD3 LYS A 453 11.148 -10.335 -3.699 1.00 0.00 H new ATOM 0 HE2 LYS A 453 9.693 -9.175 -5.891 1.00 0.00 H new ATOM 0 HE3 LYS A 453 11.383 -9.240 -6.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 453 10.237 -11.273 -6.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 453 11.422 -11.595 -5.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 453 9.784 -11.532 -5.323 1.00 0.00 H new ATOM 1271 N PHE A 454 8.373 -6.493 -0.046 1.00 0.00 N ATOM 1272 CA PHE A 454 8.087 -6.528 1.389 1.00 0.00 C ATOM 1273 C PHE A 454 8.764 -7.720 2.061 1.00 0.00 C ATOM 1274 O PHE A 454 8.983 -7.722 3.272 1.00 0.00 O ATOM 1275 CB PHE A 454 6.578 -6.586 1.628 1.00 0.00 C ATOM 1276 CG PHE A 454 6.195 -6.438 3.072 1.00 0.00 C ATOM 1277 CD1 PHE A 454 6.354 -5.226 3.724 1.00 0.00 C ATOM 1278 CD2 PHE A 454 5.674 -7.512 3.778 1.00 0.00 C ATOM 1279 CE1 PHE A 454 6.003 -5.088 5.053 1.00 0.00 C ATOM 1280 CE2 PHE A 454 5.322 -7.380 5.107 1.00 0.00 C ATOM 1281 CZ PHE A 454 5.487 -6.166 5.746 1.00 0.00 C ATOM 0 H PHE A 454 7.544 -6.454 -0.639 1.00 0.00 H new ATOM 0 HA PHE A 454 8.487 -5.615 1.830 1.00 0.00 H new ATOM 0 HB2 PHE A 454 6.096 -5.798 1.050 1.00 0.00 H new ATOM 0 HB3 PHE A 454 6.195 -7.536 1.254 1.00 0.00 H new ATOM 0 HD1 PHE A 454 6.757 -4.380 3.187 1.00 0.00 H new ATOM 0 HD2 PHE A 454 5.542 -8.463 3.283 1.00 0.00 H new ATOM 0 HE1 PHE A 454 6.132 -4.138 5.550 1.00 0.00 H new ATOM 0 HE2 PHE A 454 4.918 -8.224 5.646 1.00 0.00 H new ATOM 0 HZ PHE A 454 5.213 -6.060 6.785 1.00 0.00 H new ATOM 1291 N ALA A 455 9.081 -8.731 1.264 1.00 0.00 N ATOM 1292 CA ALA A 455 9.738 -9.933 1.761 1.00 0.00 C ATOM 1293 C ALA A 455 10.125 -10.829 0.595 1.00 0.00 C ATOM 1294 O ALA A 455 11.276 -11.248 0.470 1.00 0.00 O ATOM 1295 CB ALA A 455 8.829 -10.679 2.729 1.00 0.00 C ATOM 0 H ALA A 455 8.892 -8.742 0.262 1.00 0.00 H new ATOM 0 HA ALA A 455 10.641 -9.644 2.299 1.00 0.00 H new ATOM 0 HB1 ALA A 455 9.337 -11.574 3.089 1.00 0.00 H new ATOM 0 HB2 ALA A 455 8.589 -10.033 3.574 1.00 0.00 H new ATOM 0 HB3 ALA A 455 7.910 -10.965 2.218 1.00 0.00 H new ATOM 1301 N ASN A 456 9.147 -11.117 -0.255 1.00 0.00 N ATOM 1302 CA ASN A 456 9.369 -11.945 -1.432 1.00 0.00 C ATOM 1303 C ASN A 456 8.374 -11.596 -2.533 1.00 0.00 C ATOM 1304 O ASN A 456 8.310 -12.267 -3.563 1.00 0.00 O ATOM 1305 CB ASN A 456 9.258 -13.429 -1.075 1.00 0.00 C ATOM 1306 CG ASN A 456 10.613 -14.074 -0.856 1.00 0.00 C ATOM 1307 OD1 ASN A 456 10.795 -14.867 0.068 1.00 0.00 O ATOM 1308 ND2 ASN A 456 11.573 -13.735 -1.709 1.00 0.00 N ATOM 0 H ASN A 456 8.188 -10.787 -0.149 1.00 0.00 H new ATOM 0 HA ASN A 456 10.376 -11.747 -1.799 1.00 0.00 H new ATOM 0 HB2 ASN A 456 8.656 -13.539 -0.173 1.00 0.00 H new ATOM 0 HB3 ASN A 456 8.734 -13.954 -1.874 1.00 0.00 H new ATOM 0 HD21 ASN A 456 12.506 -14.136 -1.613 1.00 0.00 H new ATOM 0 HD22 ASN A 456 11.377 -13.074 -2.460 1.00 0.00 H new ATOM 1315 N ARG A 457 7.599 -10.540 -2.306 1.00 0.00 N ATOM 1316 CA ARG A 457 6.607 -10.090 -3.274 1.00 0.00 C ATOM 1317 C ARG A 457 6.748 -8.594 -3.517 1.00 0.00 C ATOM 1318 O ARG A 457 6.432 -7.783 -2.645 1.00 0.00 O ATOM 1319 CB ARG A 457 5.187 -10.407 -2.790 1.00 0.00 C ATOM 1320 CG ARG A 457 5.122 -10.912 -1.357 1.00 0.00 C ATOM 1321 CD ARG A 457 5.354 -12.412 -1.287 1.00 0.00 C ATOM 1322 NE ARG A 457 5.615 -12.864 0.077 1.00 0.00 N ATOM 1323 CZ ARG A 457 6.141 -14.048 0.376 1.00 0.00 C ATOM 1324 NH1 ARG A 457 6.470 -14.896 -0.591 1.00 0.00 N ATOM 1325 NH2 ARG A 457 6.343 -14.384 1.641 1.00 0.00 N ATOM 0 H ARG A 457 7.640 -9.978 -1.456 1.00 0.00 H new ATOM 0 HA ARG A 457 6.781 -10.623 -4.209 1.00 0.00 H new ATOM 0 HB2 ARG A 457 4.575 -9.509 -2.876 1.00 0.00 H new ATOM 0 HB3 ARG A 457 4.748 -11.156 -3.449 1.00 0.00 H new ATOM 0 HG2 ARG A 457 5.871 -10.398 -0.754 1.00 0.00 H new ATOM 0 HG3 ARG A 457 4.149 -10.672 -0.929 1.00 0.00 H new ATOM 0 HD2 ARG A 457 4.481 -12.932 -1.680 1.00 0.00 H new ATOM 0 HD3 ARG A 457 6.197 -12.678 -1.924 1.00 0.00 H new ATOM 0 HE ARG A 457 5.380 -12.235 0.845 1.00 0.00 H new ATOM 0 HH11 ARG A 457 6.319 -14.640 -1.567 1.00 0.00 H new ATOM 0 HH12 ARG A 457 6.873 -15.803 -0.358 1.00 0.00 H new ATOM 0 HH21 ARG A 457 6.095 -13.734 2.387 1.00 0.00 H new ATOM 0 HH22 ARG A 457 6.747 -15.293 1.869 1.00 0.00 H new ATOM 1339 N VAL A 458 7.234 -8.239 -4.703 1.00 0.00 N ATOM 1340 CA VAL A 458 7.428 -6.855 -5.077 1.00 0.00 C ATOM 1341 C VAL A 458 6.230 -6.002 -4.691 1.00 0.00 C ATOM 1342 O VAL A 458 5.091 -6.461 -4.728 1.00 0.00 O ATOM 1343 CB VAL A 458 7.680 -6.748 -6.583 1.00 0.00 C ATOM 1344 CG1 VAL A 458 6.431 -7.132 -7.348 1.00 0.00 C ATOM 1345 CG2 VAL A 458 8.138 -5.356 -6.943 1.00 0.00 C ATOM 0 H VAL A 458 7.502 -8.907 -5.426 1.00 0.00 H new ATOM 0 HA VAL A 458 8.297 -6.481 -4.536 1.00 0.00 H new ATOM 0 HB VAL A 458 8.474 -7.441 -6.861 1.00 0.00 H new ATOM 0 HG11 VAL A 458 6.621 -7.052 -8.418 1.00 0.00 H new ATOM 0 HG12 VAL A 458 6.156 -8.158 -7.104 1.00 0.00 H new ATOM 0 HG13 VAL A 458 5.616 -6.462 -7.073 1.00 0.00 H new ATOM 0 HG21 VAL A 458 8.313 -5.297 -8.017 1.00 0.00 H new ATOM 0 HG22 VAL A 458 7.370 -4.636 -6.660 1.00 0.00 H new ATOM 0 HG23 VAL A 458 9.062 -5.128 -6.412 1.00 0.00 H new ATOM 1355 N VAL A 459 6.499 -4.759 -4.323 1.00 0.00 N ATOM 1356 CA VAL A 459 5.449 -3.849 -3.906 1.00 0.00 C ATOM 1357 C VAL A 459 5.184 -2.762 -4.941 1.00 0.00 C ATOM 1358 O VAL A 459 6.105 -2.105 -5.427 1.00 0.00 O ATOM 1359 CB VAL A 459 5.798 -3.206 -2.553 1.00 0.00 C ATOM 1360 CG1 VAL A 459 7.042 -2.337 -2.667 1.00 0.00 C ATOM 1361 CG2 VAL A 459 4.624 -2.405 -2.016 1.00 0.00 C ATOM 0 H VAL A 459 7.437 -4.359 -4.305 1.00 0.00 H new ATOM 0 HA VAL A 459 4.539 -4.440 -3.804 1.00 0.00 H new ATOM 0 HB VAL A 459 6.012 -4.007 -1.845 1.00 0.00 H new ATOM 0 HG11 VAL A 459 7.267 -1.894 -1.697 1.00 0.00 H new ATOM 0 HG12 VAL A 459 7.884 -2.948 -2.991 1.00 0.00 H new ATOM 0 HG13 VAL A 459 6.867 -1.545 -3.395 1.00 0.00 H new ATOM 0 HG21 VAL A 459 4.895 -1.960 -1.059 1.00 0.00 H new ATOM 0 HG22 VAL A 459 4.368 -1.616 -2.723 1.00 0.00 H new ATOM 0 HG23 VAL A 459 3.766 -3.063 -1.880 1.00 0.00 H new ATOM 1371 N VAL A 460 3.912 -2.593 -5.280 1.00 0.00 N ATOM 1372 CA VAL A 460 3.497 -1.582 -6.244 1.00 0.00 C ATOM 1373 C VAL A 460 3.189 -0.264 -5.541 1.00 0.00 C ATOM 1374 O VAL A 460 2.399 -0.224 -4.596 1.00 0.00 O ATOM 1375 CB VAL A 460 2.258 -2.037 -7.042 1.00 0.00 C ATOM 1376 CG1 VAL A 460 1.211 -2.620 -6.111 1.00 0.00 C ATOM 1377 CG2 VAL A 460 1.678 -0.884 -7.851 1.00 0.00 C ATOM 0 H VAL A 460 3.145 -3.147 -4.899 1.00 0.00 H new ATOM 0 HA VAL A 460 4.324 -1.439 -6.939 1.00 0.00 H new ATOM 0 HB VAL A 460 2.569 -2.814 -7.740 1.00 0.00 H new ATOM 0 HG11 VAL A 460 0.344 -2.936 -6.691 1.00 0.00 H new ATOM 0 HG12 VAL A 460 1.629 -3.479 -5.586 1.00 0.00 H new ATOM 0 HG13 VAL A 460 0.907 -1.864 -5.386 1.00 0.00 H new ATOM 0 HG21 VAL A 460 0.805 -1.231 -8.405 1.00 0.00 H new ATOM 0 HG22 VAL A 460 1.384 -0.079 -7.178 1.00 0.00 H new ATOM 0 HG23 VAL A 460 2.429 -0.516 -8.550 1.00 0.00 H new ATOM 1387 N THR A 461 3.815 0.811 -6.005 1.00 0.00 N ATOM 1388 CA THR A 461 3.608 2.127 -5.414 1.00 0.00 C ATOM 1389 C THR A 461 2.754 3.013 -6.315 1.00 0.00 C ATOM 1390 O THR A 461 3.251 3.602 -7.275 1.00 0.00 O ATOM 1391 CB THR A 461 4.946 2.835 -5.136 1.00 0.00 C ATOM 1392 OG1 THR A 461 5.692 2.973 -6.351 1.00 0.00 O ATOM 1393 CG2 THR A 461 5.766 2.056 -4.119 1.00 0.00 C ATOM 0 H THR A 461 4.469 0.797 -6.788 1.00 0.00 H new ATOM 0 HA THR A 461 3.086 1.967 -4.471 1.00 0.00 H new ATOM 0 HB THR A 461 4.731 3.823 -4.730 1.00 0.00 H new ATOM 0 HG1 THR A 461 5.089 3.237 -7.077 1.00 0.00 H new ATOM 0 HG21 THR A 461 6.708 2.574 -3.937 1.00 0.00 H new ATOM 0 HG22 THR A 461 5.209 1.978 -3.185 1.00 0.00 H new ATOM 0 HG23 THR A 461 5.970 1.057 -4.505 1.00 0.00 H new ATOM 1401 N LYS A 462 1.466 3.101 -5.998 1.00 0.00 N ATOM 1402 CA LYS A 462 0.543 3.922 -6.772 1.00 0.00 C ATOM 1403 C LYS A 462 -0.075 5.005 -5.893 1.00 0.00 C ATOM 1404 O LYS A 462 -0.459 4.748 -4.751 1.00 0.00 O ATOM 1405 CB LYS A 462 -0.554 3.056 -7.400 1.00 0.00 C ATOM 1406 CG LYS A 462 -1.452 2.365 -6.385 1.00 0.00 C ATOM 1407 CD LYS A 462 -2.783 3.084 -6.241 1.00 0.00 C ATOM 1408 CE LYS A 462 -3.861 2.161 -5.695 1.00 0.00 C ATOM 1409 NZ LYS A 462 -4.693 1.574 -6.783 1.00 0.00 N ATOM 0 H LYS A 462 1.038 2.614 -5.211 1.00 0.00 H new ATOM 0 HA LYS A 462 1.104 4.403 -7.573 1.00 0.00 H new ATOM 0 HB2 LYS A 462 -1.169 3.680 -8.049 1.00 0.00 H new ATOM 0 HB3 LYS A 462 -0.089 2.300 -8.033 1.00 0.00 H new ATOM 0 HG2 LYS A 462 -1.625 1.334 -6.693 1.00 0.00 H new ATOM 0 HG3 LYS A 462 -0.950 2.329 -5.418 1.00 0.00 H new ATOM 0 HD2 LYS A 462 -2.665 3.940 -5.576 1.00 0.00 H new ATOM 0 HD3 LYS A 462 -3.094 3.474 -7.210 1.00 0.00 H new ATOM 0 HE2 LYS A 462 -3.396 1.360 -5.121 1.00 0.00 H new ATOM 0 HE3 LYS A 462 -4.500 2.716 -5.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 -5.186 0.731 -6.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 -5.392 2.275 -7.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 -4.082 1.306 -7.581 1.00 0.00 H new ATOM 1423 N TYR A 463 -0.163 6.216 -6.430 1.00 0.00 N ATOM 1424 CA TYR A 463 -0.728 7.342 -5.694 1.00 0.00 C ATOM 1425 C TYR A 463 -2.212 7.130 -5.413 1.00 0.00 C ATOM 1426 O TYR A 463 -2.851 6.266 -6.016 1.00 0.00 O ATOM 1427 CB TYR A 463 -0.529 8.640 -6.479 1.00 0.00 C ATOM 1428 CG TYR A 463 0.532 9.547 -5.897 1.00 0.00 C ATOM 1429 CD1 TYR A 463 0.496 9.926 -4.561 1.00 0.00 C ATOM 1430 CD2 TYR A 463 1.571 10.027 -6.686 1.00 0.00 C ATOM 1431 CE1 TYR A 463 1.463 10.754 -4.027 1.00 0.00 C ATOM 1432 CE2 TYR A 463 2.542 10.856 -6.159 1.00 0.00 C ATOM 1433 CZ TYR A 463 2.484 11.217 -4.830 1.00 0.00 C ATOM 1434 OH TYR A 463 3.448 12.044 -4.303 1.00 0.00 O ATOM 0 H TYR A 463 0.150 6.444 -7.374 1.00 0.00 H new ATOM 0 HA TYR A 463 -0.206 7.413 -4.740 1.00 0.00 H new ATOM 0 HB2 TYR A 463 -0.261 8.395 -7.507 1.00 0.00 H new ATOM 0 HB3 TYR A 463 -1.475 9.180 -6.517 1.00 0.00 H new ATOM 0 HD1 TYR A 463 -0.303 9.567 -3.929 1.00 0.00 H new ATOM 0 HD2 TYR A 463 1.620 9.747 -7.728 1.00 0.00 H new ATOM 0 HE1 TYR A 463 1.420 11.038 -2.986 1.00 0.00 H new ATOM 0 HE2 TYR A 463 3.343 11.220 -6.785 1.00 0.00 H new ATOM 0 HH TYR A 463 3.081 12.946 -4.194 1.00 0.00 H new ATOM 1444 N CYS A 464 -2.755 7.926 -4.495 1.00 0.00 N ATOM 1445 CA CYS A 464 -4.164 7.828 -4.133 1.00 0.00 C ATOM 1446 C CYS A 464 -4.720 9.188 -3.718 1.00 0.00 C ATOM 1447 O CYS A 464 -4.056 9.965 -3.020 1.00 0.00 O ATOM 1448 CB CYS A 464 -4.356 6.813 -3.006 1.00 0.00 C ATOM 1449 SG CYS A 464 -5.281 5.338 -3.493 1.00 0.00 S ATOM 0 H CYS A 464 -2.239 8.646 -3.989 1.00 0.00 H new ATOM 0 HA CYS A 464 -4.714 7.489 -5.011 1.00 0.00 H new ATOM 0 HB2 CYS A 464 -3.377 6.509 -2.634 1.00 0.00 H new ATOM 0 HB3 CYS A 464 -4.875 7.298 -2.179 1.00 0.00 H new ATOM 0 HG CYS A 464 -4.816 4.304 -2.856 1.00 0.00 H new ATOM 1455 N ASP A 465 -5.946 9.468 -4.153 1.00 0.00 N ATOM 1456 CA ASP A 465 -6.602 10.732 -3.843 1.00 0.00 C ATOM 1457 C ASP A 465 -7.371 10.648 -2.526 1.00 0.00 C ATOM 1458 O ASP A 465 -7.924 9.600 -2.189 1.00 0.00 O ATOM 1459 CB ASP A 465 -7.551 11.128 -4.975 1.00 0.00 C ATOM 1460 CG ASP A 465 -6.894 12.047 -5.986 1.00 0.00 C ATOM 1461 OD1 ASP A 465 -5.977 11.588 -6.697 1.00 0.00 O ATOM 1462 OD2 ASP A 465 -7.299 13.226 -6.067 1.00 0.00 O ATOM 0 H ASP A 465 -6.505 8.833 -4.723 1.00 0.00 H new ATOM 0 HA ASP A 465 -5.829 11.493 -3.739 1.00 0.00 H new ATOM 0 HB2 ASP A 465 -7.904 10.229 -5.481 1.00 0.00 H new ATOM 0 HB3 ASP A 465 -8.427 11.622 -4.555 1.00 0.00 H new ATOM 1467 N PRO A 466 -7.415 11.758 -1.760 1.00 0.00 N ATOM 1468 CA PRO A 466 -8.121 11.811 -0.478 1.00 0.00 C ATOM 1469 C PRO A 466 -9.592 11.427 -0.606 1.00 0.00 C ATOM 1470 O PRO A 466 -10.245 11.100 0.385 1.00 0.00 O ATOM 1471 CB PRO A 466 -7.992 13.277 -0.039 1.00 0.00 C ATOM 1472 CG PRO A 466 -7.549 14.019 -1.250 1.00 0.00 C ATOM 1473 CD PRO A 466 -6.771 13.040 -2.077 1.00 0.00 C ATOM 0 HA PRO A 466 -7.699 11.104 0.236 1.00 0.00 H new ATOM 0 HB2 PRO A 466 -8.943 13.661 0.330 1.00 0.00 H new ATOM 0 HB3 PRO A 466 -7.270 13.382 0.771 1.00 0.00 H new ATOM 0 HG2 PRO A 466 -8.404 14.405 -1.805 1.00 0.00 H new ATOM 0 HG3 PRO A 466 -6.933 14.876 -0.978 1.00 0.00 H new ATOM 0 HD2 PRO A 466 -6.832 13.271 -3.140 1.00 0.00 H new ATOM 0 HD3 PRO A 466 -5.714 13.038 -1.812 1.00 0.00 H new ATOM 1481 N ASP A 467 -10.109 11.471 -1.832 1.00 0.00 N ATOM 1482 CA ASP A 467 -11.504 11.127 -2.087 1.00 0.00 C ATOM 1483 C ASP A 467 -11.796 9.689 -1.665 1.00 0.00 C ATOM 1484 O ASP A 467 -12.338 9.448 -0.585 1.00 0.00 O ATOM 1485 CB ASP A 467 -11.836 11.313 -3.568 1.00 0.00 C ATOM 1486 CG ASP A 467 -11.627 12.741 -4.032 1.00 0.00 C ATOM 1487 OD1 ASP A 467 -12.400 13.624 -3.603 1.00 0.00 O ATOM 1488 OD2 ASP A 467 -10.691 12.977 -4.825 1.00 0.00 O ATOM 0 H ASP A 467 -9.583 11.741 -2.663 1.00 0.00 H new ATOM 0 HA ASP A 467 -12.130 11.795 -1.496 1.00 0.00 H new ATOM 0 HB2 ASP A 467 -11.213 10.645 -4.164 1.00 0.00 H new ATOM 0 HB3 ASP A 467 -12.872 11.024 -3.744 1.00 0.00 H new ATOM 1493 N SER A 468 -11.433 8.739 -2.522 1.00 0.00 N ATOM 1494 CA SER A 468 -11.656 7.327 -2.235 1.00 0.00 C ATOM 1495 C SER A 468 -10.950 6.918 -0.948 1.00 0.00 C ATOM 1496 O SER A 468 -11.358 5.969 -0.275 1.00 0.00 O ATOM 1497 CB SER A 468 -11.166 6.463 -3.396 1.00 0.00 C ATOM 1498 OG SER A 468 -9.796 6.703 -3.668 1.00 0.00 O ATOM 0 H SER A 468 -10.984 8.922 -3.419 1.00 0.00 H new ATOM 0 HA SER A 468 -12.727 7.173 -2.107 1.00 0.00 H new ATOM 0 HB2 SER A 468 -11.313 5.410 -3.157 1.00 0.00 H new ATOM 0 HB3 SER A 468 -11.759 6.674 -4.286 1.00 0.00 H new ATOM 0 HG SER A 468 -9.506 6.137 -4.414 1.00 0.00 H new ATOM 1504 N TYR A 469 -9.886 7.639 -0.611 1.00 0.00 N ATOM 1505 CA TYR A 469 -9.133 7.354 0.596 1.00 0.00 C ATOM 1506 C TYR A 469 -10.039 7.461 1.819 1.00 0.00 C ATOM 1507 O TYR A 469 -10.223 6.492 2.555 1.00 0.00 O ATOM 1508 CB TYR A 469 -7.955 8.318 0.733 1.00 0.00 C ATOM 1509 CG TYR A 469 -7.472 8.454 2.154 1.00 0.00 C ATOM 1510 CD1 TYR A 469 -6.842 7.397 2.786 1.00 0.00 C ATOM 1511 CD2 TYR A 469 -7.673 9.625 2.867 1.00 0.00 C ATOM 1512 CE1 TYR A 469 -6.419 7.499 4.091 1.00 0.00 C ATOM 1513 CE2 TYR A 469 -7.249 9.740 4.174 1.00 0.00 C ATOM 1514 CZ TYR A 469 -6.623 8.673 4.785 1.00 0.00 C ATOM 1515 OH TYR A 469 -6.203 8.780 6.091 1.00 0.00 O ATOM 0 H TYR A 469 -9.529 8.423 -1.158 1.00 0.00 H new ATOM 0 HA TYR A 469 -8.746 6.337 0.529 1.00 0.00 H new ATOM 0 HB2 TYR A 469 -7.133 7.971 0.107 1.00 0.00 H new ATOM 0 HB3 TYR A 469 -8.249 9.299 0.359 1.00 0.00 H new ATOM 0 HD1 TYR A 469 -6.679 6.476 2.246 1.00 0.00 H new ATOM 0 HD2 TYR A 469 -8.169 10.459 2.393 1.00 0.00 H new ATOM 0 HE1 TYR A 469 -5.930 6.664 4.570 1.00 0.00 H new ATOM 0 HE2 TYR A 469 -7.406 10.660 4.717 1.00 0.00 H new ATOM 0 HH TYR A 469 -5.784 7.939 6.370 1.00 0.00 H new ATOM 1525 N HIS A 470 -10.595 8.651 2.030 1.00 0.00 N ATOM 1526 CA HIS A 470 -11.494 8.884 3.154 1.00 0.00 C ATOM 1527 C HIS A 470 -12.709 7.973 3.043 1.00 0.00 C ATOM 1528 O HIS A 470 -13.373 7.678 4.037 1.00 0.00 O ATOM 1529 CB HIS A 470 -11.936 10.349 3.192 1.00 0.00 C ATOM 1530 CG HIS A 470 -11.414 11.100 4.378 1.00 0.00 C ATOM 1531 ND1 HIS A 470 -11.956 10.986 5.641 1.00 0.00 N ATOM 1532 CD2 HIS A 470 -10.389 11.979 4.488 1.00 0.00 C ATOM 1533 CE1 HIS A 470 -11.288 11.763 6.476 1.00 0.00 C ATOM 1534 NE2 HIS A 470 -10.333 12.375 5.802 1.00 0.00 N ATOM 0 H HIS A 470 -10.439 9.467 1.438 1.00 0.00 H new ATOM 0 HA HIS A 470 -10.963 8.659 4.079 1.00 0.00 H new ATOM 0 HB2 HIS A 470 -11.600 10.845 2.281 1.00 0.00 H new ATOM 0 HB3 HIS A 470 -13.025 10.392 3.196 1.00 0.00 H new ATOM 0 HD2 HIS A 470 -9.738 12.307 3.691 1.00 0.00 H new ATOM 0 HE1 HIS A 470 -11.490 11.877 7.531 1.00 0.00 H new ATOM 0 HE2 HIS A 470 -9.662 13.036 6.194 1.00 0.00 H new ATOM 1543 N ARG A 471 -12.990 7.535 1.819 1.00 0.00 N ATOM 1544 CA ARG A 471 -14.113 6.645 1.562 1.00 0.00 C ATOM 1545 C ARG A 471 -13.831 5.260 2.133 1.00 0.00 C ATOM 1546 O ARG A 471 -14.754 4.513 2.460 1.00 0.00 O ATOM 1547 CB ARG A 471 -14.378 6.552 0.055 1.00 0.00 C ATOM 1548 CG ARG A 471 -15.383 5.478 -0.330 1.00 0.00 C ATOM 1549 CD ARG A 471 -16.042 5.785 -1.666 1.00 0.00 C ATOM 1550 NE ARG A 471 -15.489 4.973 -2.747 1.00 0.00 N ATOM 1551 CZ ARG A 471 -16.208 4.127 -3.480 1.00 0.00 C ATOM 1552 NH1 ARG A 471 -17.507 3.983 -3.252 1.00 0.00 N ATOM 1553 NH2 ARG A 471 -15.628 3.425 -4.443 1.00 0.00 N ATOM 0 H ARG A 471 -12.452 7.784 0.989 1.00 0.00 H new ATOM 0 HA ARG A 471 -14.999 7.050 2.051 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -14.739 7.517 -0.301 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -13.437 6.355 -0.458 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -14.882 4.512 -0.384 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -16.147 5.398 0.444 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -17.115 5.607 -1.591 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.910 6.841 -1.901 1.00 0.00 H new ATOM 0 HE ARG A 471 -14.494 5.060 -2.952 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -17.958 4.522 -2.513 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -18.055 3.333 -3.816 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -14.630 3.533 -4.623 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -16.180 2.777 -5.005 1.00 0.00 H new ATOM 1567 N ARG A 472 -12.545 4.927 2.259 1.00 0.00 N ATOM 1568 CA ARG A 472 -12.138 3.629 2.788 1.00 0.00 C ATOM 1569 C ARG A 472 -12.813 2.499 2.019 1.00 0.00 C ATOM 1570 O ARG A 472 -13.123 1.448 2.581 1.00 0.00 O ATOM 1571 CB ARG A 472 -12.480 3.523 4.277 1.00 0.00 C ATOM 1572 CG ARG A 472 -12.305 4.827 5.037 1.00 0.00 C ATOM 1573 CD ARG A 472 -12.565 4.643 6.523 1.00 0.00 C ATOM 1574 NE ARG A 472 -13.704 5.432 6.983 1.00 0.00 N ATOM 1575 CZ ARG A 472 -14.070 5.524 8.258 1.00 0.00 C ATOM 1576 NH1 ARG A 472 -13.391 4.877 9.196 1.00 0.00 N ATOM 1577 NH2 ARG A 472 -15.117 6.265 8.596 1.00 0.00 N ATOM 0 H ARG A 472 -11.770 5.539 2.002 1.00 0.00 H new ATOM 0 HA ARG A 472 -11.058 3.539 2.668 1.00 0.00 H new ATOM 0 HB2 ARG A 472 -13.512 3.188 4.381 1.00 0.00 H new ATOM 0 HB3 ARG A 472 -11.849 2.760 4.732 1.00 0.00 H new ATOM 0 HG2 ARG A 472 -11.293 5.204 4.887 1.00 0.00 H new ATOM 0 HG3 ARG A 472 -12.987 5.577 4.637 1.00 0.00 H new ATOM 0 HD2 ARG A 472 -12.747 3.589 6.731 1.00 0.00 H new ATOM 0 HD3 ARG A 472 -11.676 4.929 7.084 1.00 0.00 H new ATOM 0 HE ARG A 472 -14.249 5.941 6.288 1.00 0.00 H new ATOM 0 HH11 ARG A 472 -12.585 4.306 8.940 1.00 0.00 H new ATOM 0 HH12 ARG A 472 -13.675 4.950 10.173 1.00 0.00 H new ATOM 0 HH21 ARG A 472 -15.642 6.764 7.878 1.00 0.00 H new ATOM 0 HH22 ARG A 472 -15.398 6.335 9.574 1.00 0.00 H new ATOM 1591 N ASP A 473 -13.041 2.731 0.729 1.00 0.00 N ATOM 1592 CA ASP A 473 -13.678 1.740 -0.134 1.00 0.00 C ATOM 1593 C ASP A 473 -13.004 0.376 0.001 1.00 0.00 C ATOM 1594 O ASP A 473 -13.616 -0.658 -0.265 1.00 0.00 O ATOM 1595 CB ASP A 473 -13.629 2.201 -1.591 1.00 0.00 C ATOM 1596 CG ASP A 473 -14.277 1.208 -2.536 1.00 0.00 C ATOM 1597 OD1 ASP A 473 -15.469 0.892 -2.338 1.00 0.00 O ATOM 1598 OD2 ASP A 473 -13.593 0.746 -3.473 1.00 0.00 O ATOM 0 H ASP A 473 -12.793 3.600 0.257 1.00 0.00 H new ATOM 0 HA ASP A 473 -14.717 1.640 0.179 1.00 0.00 H new ATOM 0 HB2 ASP A 473 -14.131 3.164 -1.681 1.00 0.00 H new ATOM 0 HB3 ASP A 473 -12.591 2.354 -1.886 1.00 0.00 H new ATOM 1603 N PHE A 474 -11.740 0.385 0.416 1.00 0.00 N ATOM 1604 CA PHE A 474 -10.982 -0.848 0.590 1.00 0.00 C ATOM 1605 C PHE A 474 -11.686 -1.791 1.558 1.00 0.00 C ATOM 1606 O PHE A 474 -12.364 -2.731 1.143 1.00 0.00 O ATOM 1607 CB PHE A 474 -9.575 -0.537 1.102 1.00 0.00 C ATOM 1608 CG PHE A 474 -8.693 0.113 0.076 1.00 0.00 C ATOM 1609 CD1 PHE A 474 -8.782 1.473 -0.169 1.00 0.00 C ATOM 1610 CD2 PHE A 474 -7.775 -0.636 -0.641 1.00 0.00 C ATOM 1611 CE1 PHE A 474 -7.970 2.075 -1.111 1.00 0.00 C ATOM 1612 CE2 PHE A 474 -6.961 -0.041 -1.584 1.00 0.00 C ATOM 1613 CZ PHE A 474 -7.058 1.317 -1.821 1.00 0.00 C ATOM 0 H PHE A 474 -11.220 1.234 0.638 1.00 0.00 H new ATOM 0 HA PHE A 474 -10.911 -1.339 -0.381 1.00 0.00 H new ATOM 0 HB2 PHE A 474 -9.650 0.116 1.971 1.00 0.00 H new ATOM 0 HB3 PHE A 474 -9.107 -1.462 1.438 1.00 0.00 H new ATOM 0 HD1 PHE A 474 -9.494 2.070 0.382 1.00 0.00 H new ATOM 0 HD2 PHE A 474 -7.695 -1.698 -0.460 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -8.048 3.137 -1.292 1.00 0.00 H new ATOM 0 HE2 PHE A 474 -6.249 -0.636 -2.136 1.00 0.00 H new ATOM 0 HZ PHE A 474 -6.423 1.785 -2.559 1.00 0.00 H new ATOM 1623 N TRP A 475 -11.523 -1.530 2.852 1.00 0.00 N ATOM 1624 CA TRP A 475 -12.142 -2.357 3.882 1.00 0.00 C ATOM 1625 C TRP A 475 -13.266 -1.601 4.588 1.00 0.00 C ATOM 1626 O TRP A 475 -14.188 -2.265 5.109 1.00 0.00 O ATOM 1627 CB TRP A 475 -11.085 -2.827 4.892 1.00 0.00 C ATOM 1628 CG TRP A 475 -11.105 -2.084 6.197 1.00 0.00 C ATOM 1629 CD1 TRP A 475 -11.563 -2.551 7.396 1.00 0.00 C ATOM 1630 CD2 TRP A 475 -10.648 -0.747 6.434 1.00 0.00 C ATOM 1631 NE1 TRP A 475 -11.420 -1.586 8.363 1.00 0.00 N ATOM 1632 CE2 TRP A 475 -10.861 -0.470 7.797 1.00 0.00 C ATOM 1633 CE3 TRP A 475 -10.081 0.243 5.626 1.00 0.00 C ATOM 1634 CZ2 TRP A 475 -10.526 0.754 8.371 1.00 0.00 C ATOM 1635 CZ3 TRP A 475 -9.749 1.457 6.196 1.00 0.00 C ATOM 1636 CH2 TRP A 475 -9.972 1.704 7.557 1.00 0.00 C ATOM 1637 OXT TRP A 475 -13.214 -0.353 4.615 1.00 0.00 O ATOM 0 H TRP A 475 -10.968 -0.753 3.211 1.00 0.00 H new ATOM 0 HA TRP A 475 -12.579 -3.233 3.402 1.00 0.00 H new ATOM 0 HB2 TRP A 475 -11.234 -3.889 5.089 1.00 0.00 H new ATOM 0 HB3 TRP A 475 -10.098 -2.722 4.442 1.00 0.00 H new ATOM 0 HD1 TRP A 475 -11.977 -3.535 7.560 1.00 0.00 H new ATOM 0 HE1 TRP A 475 -11.686 -1.684 9.343 1.00 0.00 H new ATOM 0 HE3 TRP A 475 -9.906 0.062 4.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 475 -10.697 0.946 9.420 1.00 0.00 H new ATOM 0 HZ3 TRP A 475 -9.310 2.229 5.582 1.00 0.00 H new ATOM 0 HH2 TRP A 475 -9.701 2.664 7.972 1.00 0.00 H new TER 1648 TRP A 475 ATOM 1649 N PRO B 13 18.155 -0.977 11.521 1.00 0.00 N ATOM 1650 CA PRO B 13 16.981 -1.807 11.816 1.00 0.00 C ATOM 1651 C PRO B 13 15.871 -1.015 12.499 1.00 0.00 C ATOM 1652 O PRO B 13 16.106 -0.328 13.494 1.00 0.00 O ATOM 1653 CB PRO B 13 17.527 -2.882 12.760 1.00 0.00 C ATOM 1654 CG PRO B 13 18.983 -2.953 12.458 1.00 0.00 C ATOM 1655 CD PRO B 13 19.395 -1.560 12.071 1.00 0.00 C ATOM 0 HA PRO B 13 16.531 -2.209 10.909 1.00 0.00 H new ATOM 0 HB2 PRO B 13 17.352 -2.618 13.803 1.00 0.00 H new ATOM 0 HB3 PRO B 13 17.041 -3.842 12.589 1.00 0.00 H new ATOM 0 HG2 PRO B 13 19.545 -3.299 13.326 1.00 0.00 H new ATOM 0 HG3 PRO B 13 19.180 -3.657 11.649 1.00 0.00 H new ATOM 0 HD2 PRO B 13 19.758 -0.995 12.930 1.00 0.00 H new ATOM 0 HD3 PRO B 13 20.197 -1.569 11.333 1.00 0.00 H new ATOM 1663 N SER B 14 14.661 -1.116 11.958 1.00 0.00 N ATOM 1664 CA SER B 14 13.512 -0.407 12.511 1.00 0.00 C ATOM 1665 C SER B 14 13.152 -0.940 13.894 1.00 0.00 C ATOM 1666 O SER B 14 12.543 -0.238 14.701 1.00 0.00 O ATOM 1667 CB SER B 14 12.308 -0.534 11.575 1.00 0.00 C ATOM 1668 OG SER B 14 12.259 0.545 10.657 1.00 0.00 O ATOM 0 H SER B 14 14.451 -1.683 11.136 1.00 0.00 H new ATOM 0 HA SER B 14 13.781 0.645 12.607 1.00 0.00 H new ATOM 0 HB2 SER B 14 12.365 -1.476 11.030 1.00 0.00 H new ATOM 0 HB3 SER B 14 11.389 -0.559 12.161 1.00 0.00 H new ATOM 0 HG SER B 14 11.796 0.260 9.842 1.00 0.00 H new ATOM 1674 N LYS B 15 13.532 -2.186 14.161 1.00 0.00 N ATOM 1675 CA LYS B 15 13.249 -2.813 15.447 1.00 0.00 C ATOM 1676 C LYS B 15 14.522 -3.374 16.072 1.00 0.00 C ATOM 1677 O LYS B 15 15.038 -2.828 17.048 1.00 0.00 O ATOM 1678 CB LYS B 15 12.215 -3.929 15.277 1.00 0.00 C ATOM 1679 CG LYS B 15 10.949 -3.481 14.566 1.00 0.00 C ATOM 1680 CD LYS B 15 10.034 -2.697 15.494 1.00 0.00 C ATOM 1681 CE LYS B 15 8.734 -2.317 14.805 1.00 0.00 C ATOM 1682 NZ LYS B 15 8.965 -1.423 13.635 1.00 0.00 N ATOM 0 H LYS B 15 14.037 -2.781 13.504 1.00 0.00 H new ATOM 0 HA LYS B 15 12.845 -2.051 16.113 1.00 0.00 H new ATOM 0 HB2 LYS B 15 12.666 -4.748 14.717 1.00 0.00 H new ATOM 0 HB3 LYS B 15 11.951 -4.321 16.259 1.00 0.00 H new ATOM 0 HG2 LYS B 15 11.212 -2.864 13.707 1.00 0.00 H new ATOM 0 HG3 LYS B 15 10.419 -4.352 14.182 1.00 0.00 H new ATOM 0 HD2 LYS B 15 9.816 -3.293 16.380 1.00 0.00 H new ATOM 0 HD3 LYS B 15 10.544 -1.795 15.833 1.00 0.00 H new ATOM 0 HE2 LYS B 15 8.220 -3.220 14.476 1.00 0.00 H new ATOM 0 HE3 LYS B 15 8.077 -1.819 15.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 8.053 -1.065 13.286 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 9.564 -0.623 13.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 9.439 -1.957 12.879 1.00 0.00 H new ATOM 1696 N LYS B 16 15.023 -4.467 15.505 1.00 0.00 N ATOM 1697 CA LYS B 16 16.235 -5.101 16.007 1.00 0.00 C ATOM 1698 C LYS B 16 16.975 -5.824 14.886 1.00 0.00 C ATOM 1699 O LYS B 16 18.150 -5.558 14.634 1.00 0.00 O ATOM 1700 CB LYS B 16 15.894 -6.086 17.127 1.00 0.00 C ATOM 1701 CG LYS B 16 16.897 -6.076 18.269 1.00 0.00 C ATOM 1702 CD LYS B 16 17.197 -7.484 18.757 1.00 0.00 C ATOM 1703 CE LYS B 16 16.790 -7.669 20.210 1.00 0.00 C ATOM 1704 NZ LYS B 16 17.534 -6.753 21.117 1.00 0.00 N ATOM 0 H LYS B 16 14.608 -4.931 14.697 1.00 0.00 H new ATOM 0 HA LYS B 16 16.885 -4.321 16.404 1.00 0.00 H new ATOM 0 HB2 LYS B 16 14.905 -5.849 17.520 1.00 0.00 H new ATOM 0 HB3 LYS B 16 15.839 -7.092 16.711 1.00 0.00 H new ATOM 0 HG2 LYS B 16 17.820 -5.599 17.940 1.00 0.00 H new ATOM 0 HG3 LYS B 16 16.506 -5.479 19.093 1.00 0.00 H new ATOM 0 HD2 LYS B 16 16.668 -8.206 18.135 1.00 0.00 H new ATOM 0 HD3 LYS B 16 18.262 -7.689 18.648 1.00 0.00 H new ATOM 0 HE2 LYS B 16 15.720 -7.491 20.312 1.00 0.00 H new ATOM 0 HE3 LYS B 16 16.971 -8.701 20.509 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 17.553 -7.155 22.076 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 18.508 -6.637 20.771 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 17.061 -5.827 21.139 1.00 0.00 H new ATOM 1718 N ARG B 17 16.280 -6.737 14.218 1.00 0.00 N ATOM 1719 CA ARG B 17 16.867 -7.499 13.126 1.00 0.00 C ATOM 1720 C ARG B 17 16.124 -7.226 11.822 1.00 0.00 C ATOM 1721 O ARG B 17 14.892 -7.210 11.789 1.00 0.00 O ATOM 1722 CB ARG B 17 16.838 -8.996 13.456 1.00 0.00 C ATOM 1723 CG ARG B 17 17.048 -9.900 12.254 1.00 0.00 C ATOM 1724 CD ARG B 17 18.525 -10.080 11.941 1.00 0.00 C ATOM 1725 NE ARG B 17 19.129 -8.857 11.423 1.00 0.00 N ATOM 1726 CZ ARG B 17 20.348 -8.440 11.750 1.00 0.00 C ATOM 1727 NH1 ARG B 17 21.096 -9.152 12.582 1.00 0.00 N ATOM 1728 NH2 ARG B 17 20.821 -7.310 11.242 1.00 0.00 N ATOM 0 H ARG B 17 15.306 -6.967 14.415 1.00 0.00 H new ATOM 0 HA ARG B 17 17.904 -7.187 13.000 1.00 0.00 H new ATOM 0 HB2 ARG B 17 17.609 -9.209 14.196 1.00 0.00 H new ATOM 0 HB3 ARG B 17 15.880 -9.237 13.916 1.00 0.00 H new ATOM 0 HG2 ARG B 17 16.595 -10.873 12.446 1.00 0.00 H new ATOM 0 HG3 ARG B 17 16.540 -9.477 11.387 1.00 0.00 H new ATOM 0 HD2 ARG B 17 19.051 -10.390 12.844 1.00 0.00 H new ATOM 0 HD3 ARG B 17 18.646 -10.881 11.211 1.00 0.00 H new ATOM 0 HE ARG B 17 18.585 -8.290 10.773 1.00 0.00 H new ATOM 0 HH11 ARG B 17 20.736 -10.023 12.973 1.00 0.00 H new ATOM 0 HH12 ARG B 17 22.031 -8.829 12.831 1.00 0.00 H new ATOM 0 HH21 ARG B 17 20.249 -6.761 10.600 1.00 0.00 H new ATOM 0 HH22 ARG B 17 21.756 -6.990 11.493 1.00 0.00 H new ATOM 1742 N LYS B 18 16.879 -7.008 10.750 1.00 0.00 N ATOM 1743 CA LYS B 18 16.293 -6.736 9.443 1.00 0.00 C ATOM 1744 C LYS B 18 16.816 -7.718 8.398 1.00 0.00 C ATOM 1745 O LYS B 18 17.717 -7.396 7.624 1.00 0.00 O ATOM 1746 CB LYS B 18 16.596 -5.299 9.013 1.00 0.00 C ATOM 1747 CG LYS B 18 15.508 -4.680 8.152 1.00 0.00 C ATOM 1748 CD LYS B 18 15.001 -3.377 8.747 1.00 0.00 C ATOM 1749 CE LYS B 18 13.593 -3.058 8.269 1.00 0.00 C ATOM 1750 NZ LYS B 18 13.529 -2.915 6.790 1.00 0.00 N ATOM 0 H LYS B 18 17.899 -7.015 10.761 1.00 0.00 H new ATOM 0 HA LYS B 18 15.213 -6.861 9.522 1.00 0.00 H new ATOM 0 HB2 LYS B 18 16.738 -4.685 9.902 1.00 0.00 H new ATOM 0 HB3 LYS B 18 17.536 -5.284 8.462 1.00 0.00 H new ATOM 0 HG2 LYS B 18 15.896 -4.497 7.150 1.00 0.00 H new ATOM 0 HG3 LYS B 18 14.680 -5.381 8.050 1.00 0.00 H new ATOM 0 HD2 LYS B 18 15.011 -3.444 9.835 1.00 0.00 H new ATOM 0 HD3 LYS B 18 15.673 -2.564 8.472 1.00 0.00 H new ATOM 0 HE2 LYS B 18 12.914 -3.849 8.587 1.00 0.00 H new ATOM 0 HE3 LYS B 18 13.250 -2.136 8.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 12.547 -2.731 6.501 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 14.132 -2.122 6.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 13.864 -3.792 6.342 1.00 0.00 H new ATOM 1764 N ARG B 19 16.245 -8.919 8.385 1.00 0.00 N ATOM 1765 CA ARG B 19 16.650 -9.949 7.435 1.00 0.00 C ATOM 1766 C ARG B 19 15.749 -9.936 6.205 1.00 0.00 C ATOM 1767 O ARG B 19 16.014 -10.624 5.219 1.00 0.00 O ATOM 1768 CB ARG B 19 16.615 -11.329 8.098 1.00 0.00 C ATOM 1769 CG ARG B 19 15.228 -11.759 8.547 1.00 0.00 C ATOM 1770 CD ARG B 19 15.294 -12.664 9.767 1.00 0.00 C ATOM 1771 NE ARG B 19 13.966 -13.082 10.210 1.00 0.00 N ATOM 1772 CZ ARG B 19 13.426 -12.719 11.369 1.00 0.00 C ATOM 1773 NH1 ARG B 19 14.098 -11.937 12.202 1.00 0.00 N ATOM 1774 NH2 ARG B 19 12.211 -13.137 11.695 1.00 0.00 N ATOM 0 H ARG B 19 15.500 -9.202 9.022 1.00 0.00 H new ATOM 0 HA ARG B 19 17.671 -9.736 7.117 1.00 0.00 H new ATOM 0 HB2 ARG B 19 17.005 -12.068 7.398 1.00 0.00 H new ATOM 0 HB3 ARG B 19 17.281 -11.324 8.961 1.00 0.00 H new ATOM 0 HG2 ARG B 19 14.630 -10.878 8.778 1.00 0.00 H new ATOM 0 HG3 ARG B 19 14.726 -12.281 7.732 1.00 0.00 H new ATOM 0 HD2 ARG B 19 15.892 -13.545 9.533 1.00 0.00 H new ATOM 0 HD3 ARG B 19 15.800 -12.142 10.579 1.00 0.00 H new ATOM 0 HE ARG B 19 13.422 -13.687 9.595 1.00 0.00 H new ATOM 0 HH11 ARG B 19 15.033 -11.612 11.954 1.00 0.00 H new ATOM 0 HH12 ARG B 19 13.681 -11.660 13.091 1.00 0.00 H new ATOM 0 HH21 ARG B 19 11.690 -13.738 11.056 1.00 0.00 H new ATOM 0 HH22 ARG B 19 11.797 -12.858 12.585 1.00 0.00 H new ATOM 1788 N SER B 20 14.684 -9.144 6.273 1.00 0.00 N ATOM 1789 CA SER B 20 13.736 -9.031 5.172 1.00 0.00 C ATOM 1790 C SER B 20 13.216 -7.602 5.055 1.00 0.00 C ATOM 1791 O SER B 20 13.896 -6.655 5.453 1.00 0.00 O ATOM 1792 CB SER B 20 12.572 -10.002 5.379 1.00 0.00 C ATOM 1793 OG SER B 20 12.241 -10.668 4.173 1.00 0.00 O ATOM 0 H SER B 20 14.456 -8.569 7.084 1.00 0.00 H new ATOM 0 HA SER B 20 14.250 -9.287 4.245 1.00 0.00 H new ATOM 0 HB2 SER B 20 12.837 -10.735 6.141 1.00 0.00 H new ATOM 0 HB3 SER B 20 11.702 -9.458 5.748 1.00 0.00 H new ATOM 0 HG SER B 20 11.496 -11.284 4.333 1.00 0.00 H new ATOM 1799 N ARG B 21 12.009 -7.453 4.505 1.00 0.00 N ATOM 1800 CA ARG B 21 11.390 -6.140 4.339 1.00 0.00 C ATOM 1801 C ARG B 21 12.178 -5.278 3.356 1.00 0.00 C ATOM 1802 O ARG B 21 13.353 -4.983 3.576 1.00 0.00 O ATOM 1803 CB ARG B 21 11.277 -5.428 5.689 1.00 0.00 C ATOM 1804 CG ARG B 21 10.560 -6.246 6.750 1.00 0.00 C ATOM 1805 CD ARG B 21 9.068 -5.955 6.764 1.00 0.00 C ATOM 1806 NE ARG B 21 8.302 -7.046 7.362 1.00 0.00 N ATOM 1807 CZ ARG B 21 8.208 -7.250 8.673 1.00 0.00 C ATOM 1808 NH1 ARG B 21 8.826 -6.440 9.522 1.00 0.00 N ATOM 1809 NH2 ARG B 21 7.493 -8.267 9.137 1.00 0.00 N ATOM 0 H ARG B 21 11.441 -8.229 4.167 1.00 0.00 H new ATOM 0 HA ARG B 21 10.390 -6.292 3.933 1.00 0.00 H new ATOM 0 HB2 ARG B 21 12.277 -5.183 6.046 1.00 0.00 H new ATOM 0 HB3 ARG B 21 10.748 -4.485 5.550 1.00 0.00 H new ATOM 0 HG2 ARG B 21 10.723 -7.308 6.564 1.00 0.00 H new ATOM 0 HG3 ARG B 21 10.984 -6.025 7.730 1.00 0.00 H new ATOM 0 HD2 ARG B 21 8.883 -5.036 7.320 1.00 0.00 H new ATOM 0 HD3 ARG B 21 8.722 -5.786 5.744 1.00 0.00 H new ATOM 0 HE ARG B 21 7.812 -7.688 6.739 1.00 0.00 H new ATOM 0 HH11 ARG B 21 9.376 -5.656 9.170 1.00 0.00 H new ATOM 0 HH12 ARG B 21 8.751 -6.601 10.526 1.00 0.00 H new ATOM 0 HH21 ARG B 21 7.015 -8.893 8.488 1.00 0.00 H new ATOM 0 HH22 ARG B 21 7.421 -8.423 10.142 1.00 0.00 H new ATOM 1823 N TRP B 22 11.518 -4.875 2.273 1.00 0.00 N ATOM 1824 CA TRP B 22 12.151 -4.047 1.251 1.00 0.00 C ATOM 1825 C TRP B 22 13.412 -4.717 0.716 1.00 0.00 C ATOM 1826 O TRP B 22 14.523 -4.416 1.155 1.00 0.00 O ATOM 1827 CB TRP B 22 12.487 -2.665 1.817 1.00 0.00 C ATOM 1828 CG TRP B 22 11.317 -1.982 2.458 1.00 0.00 C ATOM 1829 CD1 TRP B 22 11.140 -1.740 3.790 1.00 0.00 C ATOM 1830 CD2 TRP B 22 10.162 -1.454 1.796 1.00 0.00 C ATOM 1831 NE1 TRP B 22 9.946 -1.094 3.997 1.00 0.00 N ATOM 1832 CE2 TRP B 22 9.327 -0.906 2.788 1.00 0.00 C ATOM 1833 CE3 TRP B 22 9.752 -1.390 0.461 1.00 0.00 C ATOM 1834 CZ2 TRP B 22 8.109 -0.301 2.486 1.00 0.00 C ATOM 1835 CZ3 TRP B 22 8.542 -0.791 0.163 1.00 0.00 C ATOM 1836 CH2 TRP B 22 7.733 -0.253 1.172 1.00 0.00 C ATOM 0 H TRP B 22 10.544 -5.109 2.081 1.00 0.00 H new ATOM 0 HA TRP B 22 11.448 -3.928 0.426 1.00 0.00 H new ATOM 0 HB2 TRP B 22 13.286 -2.766 2.552 1.00 0.00 H new ATOM 0 HB3 TRP B 22 12.870 -2.035 1.014 1.00 0.00 H new ATOM 0 HD1 TRP B 22 11.837 -2.016 4.567 1.00 0.00 H new ATOM 0 HE1 TRP B 22 9.579 -0.802 4.903 1.00 0.00 H new ATOM 0 HE3 TRP B 22 10.370 -1.801 -0.324 1.00 0.00 H new ATOM 0 HZ2 TRP B 22 7.484 0.115 3.262 1.00 0.00 H new ATOM 0 HZ3 TRP B 22 8.215 -0.737 -0.865 1.00 0.00 H new ATOM 0 HH2 TRP B 22 6.793 0.209 0.907 1.00 0.00 H new ATOM 1847 N ASN B 23 13.232 -5.627 -0.235 1.00 0.00 N ATOM 1848 CA ASN B 23 14.351 -6.346 -0.833 1.00 0.00 C ATOM 1849 C ASN B 23 14.667 -5.803 -2.223 1.00 0.00 C ATOM 1850 O ASN B 23 14.111 -4.787 -2.642 1.00 0.00 O ATOM 1851 CB ASN B 23 14.036 -7.840 -0.918 1.00 0.00 C ATOM 1852 CG ASN B 23 15.241 -8.705 -0.599 1.00 0.00 C ATOM 1853 OD1 ASN B 23 15.580 -9.618 -1.350 1.00 0.00 O ATOM 1854 ND2 ASN B 23 15.894 -8.420 0.522 1.00 0.00 N ATOM 0 H ASN B 23 12.319 -5.885 -0.609 1.00 0.00 H new ATOM 0 HA ASN B 23 15.225 -6.200 -0.198 1.00 0.00 H new ATOM 0 HB2 ASN B 23 13.228 -8.078 -0.226 1.00 0.00 H new ATOM 0 HB3 ASN B 23 13.678 -8.076 -1.920 1.00 0.00 H new ATOM 0 HD21 ASN B 23 16.712 -8.968 0.789 1.00 0.00 H new ATOM 0 HD22 ASN B 23 15.578 -7.653 1.116 1.00 0.00 H new ATOM 1861 N GLN B 24 15.564 -6.487 -2.928 1.00 0.00 N ATOM 1862 CA GLN B 24 15.958 -6.079 -4.273 1.00 0.00 C ATOM 1863 C GLN B 24 16.501 -4.654 -4.273 1.00 0.00 C ATOM 1864 O GLN B 24 16.460 -3.962 -5.291 1.00 0.00 O ATOM 1865 CB GLN B 24 14.771 -6.188 -5.231 1.00 0.00 C ATOM 1866 CG GLN B 24 15.175 -6.450 -6.672 1.00 0.00 C ATOM 1867 CD GLN B 24 14.893 -7.874 -7.108 1.00 0.00 C ATOM 1868 OE1 GLN B 24 13.839 -8.431 -6.803 1.00 0.00 O ATOM 1869 NE2 GLN B 24 15.836 -8.472 -7.826 1.00 0.00 N ATOM 0 H GLN B 24 16.032 -7.328 -2.589 1.00 0.00 H new ATOM 0 HA GLN B 24 16.749 -6.748 -4.611 1.00 0.00 H new ATOM 0 HB2 GLN B 24 14.116 -6.991 -4.894 1.00 0.00 H new ATOM 0 HB3 GLN B 24 14.193 -5.265 -5.187 1.00 0.00 H new ATOM 0 HG2 GLN B 24 14.640 -5.761 -7.326 1.00 0.00 H new ATOM 0 HG3 GLN B 24 16.238 -6.242 -6.791 1.00 0.00 H new ATOM 0 HE21 GLN B 24 16.695 -7.973 -8.056 1.00 0.00 H new ATOM 0 HE22 GLN B 24 15.701 -9.431 -8.147 1.00 0.00 H new ATOM 1878 N ASP B 25 17.008 -4.223 -3.124 1.00 0.00 N ATOM 1879 CA ASP B 25 17.562 -2.881 -2.984 1.00 0.00 C ATOM 1880 C ASP B 25 18.813 -2.716 -3.841 1.00 0.00 C ATOM 1881 O ASP B 25 18.783 -1.889 -4.777 1.00 0.00 O ATOM 1882 CB ASP B 25 17.892 -2.590 -1.519 1.00 0.00 C ATOM 1883 CG ASP B 25 17.921 -1.105 -1.216 1.00 0.00 C ATOM 1884 OD1 ASP B 25 18.626 -0.366 -1.936 1.00 0.00 O ATOM 1885 OD2 ASP B 25 17.239 -0.681 -0.260 1.00 0.00 O ATOM 1886 OXT ASP B 25 19.812 -3.414 -3.570 1.00 0.00 O ATOM 0 H ASP B 25 17.047 -4.785 -2.274 1.00 0.00 H new ATOM 0 HA ASP B 25 16.811 -2.169 -3.327 1.00 0.00 H new ATOM 0 HB2 ASP B 25 17.153 -3.074 -0.880 1.00 0.00 H new ATOM 0 HB3 ASP B 25 18.860 -3.027 -1.274 1.00 0.00 H new TER 1891 ASP B 25