USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 603 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 160 SER OG : rot -165:sc= 1.68 USER MOD Set 1.2: A 163 SER OG : rot 86:sc= 0.878 USER MOD Set 2.1: A 107 CYS SG : rot 163:sc= 0.518 USER MOD Set 2.2: A 138 SER OG : rot -21:sc= 0.767 USER MOD Set 3.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HE2:sc= 0.703 K(o=0.7,f=-2.8!) USER MOD Single : A 101 MET CE :methyl -161:sc= -0.0314 (180deg=-0.142) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot -52:sc= 0.545 USER MOD Single : A 116 THR OG1 : rot 43:sc= 0.599 USER MOD Single : A 120 GLN : amide:sc= -1.02 X(o=-1,f=-0.85) USER MOD Single : A 128 HIS : no HD1:sc= -0.251 X(o=-0.25,f=-0.004) USER MOD Single : A 129 ASN : amide:sc= -0.496 K(o=-0.5,f=-1.1) USER MOD Single : A 134 CYS SG : rot 180:sc= -1.91 USER MOD Single : A 145 SER OG : rot -81:sc= -0.0149 USER MOD Single : A 146 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.19) USER MOD Single : A 149 TYR OH : rot 23:sc= 1.22 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0.0196 USER MOD Single : A 157 ASN : amide:sc= 0.49 K(o=0.49,f=-5.4!) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 164 TYR OH : rot -106:sc= 0.64 USER MOD Single : A 167 LYS NZ :NH3+ 160:sc= 1.24 (180deg=0.785) USER MOD Single : A 176 GLN : amide:sc= 0.428 K(o=0.43,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 61.619 8.769 -10.550 1.00 25.00 N ATOM 307 CA HIS A 100 62.282 10.045 -10.333 1.00 25.00 C ATOM 308 C HIS A 100 63.499 9.688 -9.495 1.00 25.00 C ATOM 309 O HIS A 100 63.630 8.535 -9.071 1.00 25.00 O ATOM 310 CB HIS A 100 61.365 11.015 -9.568 1.00 25.00 C ATOM 311 CG HIS A 100 61.079 10.588 -8.161 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.858 10.914 -7.080 1.00 25.00 N ATOM 313 CD2 HIS A 100 60.064 9.837 -7.650 1.00 25.00 C ATOM 314 CE1 HIS A 100 61.323 10.362 -5.999 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.224 9.695 -6.285 1.00 25.00 N ATOM 0 HA HIS A 100 62.543 10.545 -11.266 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.827 12.002 -9.552 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.423 11.113 -10.108 1.00 25.00 H new ATOM 0 HD1 HIS A 100 62.704 11.483 -7.103 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.254 9.415 -8.226 1.00 25.00 H new ATOM 0 HE1 HIS A 100 61.738 10.449 -5.006 1.00 25.00 H new ATOM 323 N MET A 101 64.342 10.663 -9.208 1.00 25.00 N ATOM 324 CA MET A 101 65.460 10.488 -8.290 1.00 25.00 C ATOM 325 C MET A 101 65.270 11.502 -7.168 1.00 25.00 C ATOM 326 O MET A 101 64.397 12.377 -7.248 1.00 25.00 O ATOM 327 CB MET A 101 66.801 10.683 -9.009 1.00 25.00 C ATOM 328 CG MET A 101 67.052 12.093 -9.503 1.00 25.00 C ATOM 329 SD MET A 101 68.628 12.193 -10.338 1.00 25.00 S ATOM 330 CE MET A 101 68.738 13.948 -10.604 1.00 25.00 C ATOM 0 H MET A 101 64.273 11.601 -9.604 1.00 25.00 H new ATOM 0 HA MET A 101 65.480 9.475 -7.888 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.606 10.401 -8.331 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.846 10.001 -9.858 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.254 12.394 -10.182 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.034 12.787 -8.663 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.467 14.152 -11.388 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.763 14.332 -10.905 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.051 14.437 -9.682 1.00 25.00 H new ATOM 340 N LEU A 102 66.045 11.357 -6.108 1.00 25.00 N ATOM 341 CA LEU A 102 65.926 12.215 -4.935 1.00 25.00 C ATOM 342 C LEU A 102 67.257 12.913 -4.737 1.00 25.00 C ATOM 343 O LEU A 102 68.290 12.275 -4.856 1.00 25.00 O ATOM 344 CB LEU A 102 65.611 11.353 -3.703 1.00 25.00 C ATOM 345 CG LEU A 102 65.328 12.100 -2.388 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.911 12.663 -2.377 1.00 25.00 C ATOM 347 CD2 LEU A 102 65.510 11.154 -1.205 1.00 25.00 C ATOM 0 H LEU A 102 66.772 10.646 -6.033 1.00 25.00 H new ATOM 0 HA LEU A 102 65.127 12.944 -5.071 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.745 10.733 -3.935 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.451 10.678 -3.537 1.00 25.00 H new ATOM 0 HG LEU A 102 66.032 12.928 -2.307 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.735 13.187 -1.437 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.789 13.358 -3.208 1.00 25.00 H new ATOM 0 HD13 LEU A 102 63.195 11.848 -2.478 1.00 25.00 H new ATOM 0 HD21 LEU A 102 65.308 11.689 -0.277 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.818 10.317 -1.299 1.00 25.00 H new ATOM 0 HD23 LEU A 102 66.534 10.780 -1.193 1.00 25.00 H new ATOM 359 N LEU A 103 67.236 14.193 -4.404 1.00 25.00 N ATOM 360 CA LEU A 103 68.457 14.928 -4.066 1.00 25.00 C ATOM 361 C LEU A 103 68.228 15.593 -2.731 1.00 25.00 C ATOM 362 O LEU A 103 67.097 15.943 -2.412 1.00 25.00 O ATOM 363 CB LEU A 103 68.778 15.996 -5.118 1.00 25.00 C ATOM 364 CG LEU A 103 69.192 15.482 -6.503 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.438 16.667 -7.416 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.449 14.632 -6.427 1.00 25.00 C ATOM 0 H LEU A 103 66.385 14.753 -4.359 1.00 25.00 H new ATOM 0 HA LEU A 103 69.300 14.238 -4.031 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.902 16.633 -5.237 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.580 16.626 -4.733 1.00 25.00 H new ATOM 0 HG LEU A 103 68.388 14.859 -6.895 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.733 16.311 -8.403 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.525 17.257 -7.501 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.233 17.287 -7.001 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.714 14.284 -7.425 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.267 15.227 -6.021 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.269 13.774 -5.780 1.00 25.00 H new ATOM 378 N THR A 104 69.285 15.779 -1.961 1.00 25.00 N ATOM 379 CA THR A 104 69.180 16.426 -0.654 1.00 25.00 C ATOM 380 C THR A 104 69.850 17.781 -0.745 1.00 25.00 C ATOM 381 O THR A 104 70.933 17.901 -1.298 1.00 25.00 O ATOM 382 CB THR A 104 69.854 15.575 0.438 1.00 25.00 C ATOM 383 OG1 THR A 104 69.318 14.250 0.390 1.00 25.00 O ATOM 384 CG2 THR A 104 69.594 16.141 1.829 1.00 25.00 C ATOM 0 H THR A 104 70.231 15.492 -2.214 1.00 25.00 H new ATOM 0 HA THR A 104 68.130 16.537 -0.384 1.00 25.00 H new ATOM 0 HB THR A 104 70.928 15.578 0.252 1.00 25.00 H new ATOM 0 HG1 THR A 104 69.743 13.700 1.081 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.085 15.515 2.574 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.990 17.155 1.889 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.521 16.159 2.020 1.00 25.00 H new ATOM 392 N VAL A 105 69.201 18.810 -0.230 1.00 25.00 N ATOM 393 CA VAL A 105 69.735 20.160 -0.292 1.00 25.00 C ATOM 394 C VAL A 105 69.893 20.706 1.115 1.00 25.00 C ATOM 395 O VAL A 105 68.979 20.612 1.930 1.00 25.00 O ATOM 396 CB VAL A 105 68.797 21.100 -1.087 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.410 22.504 -1.195 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.530 20.541 -2.494 1.00 25.00 C ATOM 0 H VAL A 105 68.298 18.736 0.239 1.00 25.00 H new ATOM 0 HA VAL A 105 70.699 20.118 -0.798 1.00 25.00 H new ATOM 0 HB VAL A 105 67.851 21.165 -0.550 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.738 23.152 -1.757 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.559 22.914 -0.196 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.369 22.444 -1.709 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.868 21.218 -3.035 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.473 20.447 -3.033 1.00 25.00 H new ATOM 0 HG23 VAL A 105 68.059 19.561 -2.413 1.00 25.00 H new ATOM 408 N TYR A 106 71.041 21.304 1.388 1.00 25.00 N ATOM 409 CA TYR A 106 71.274 21.985 2.656 1.00 25.00 C ATOM 410 C TYR A 106 71.429 23.474 2.384 1.00 25.00 C ATOM 411 O TYR A 106 72.351 23.890 1.692 1.00 25.00 O ATOM 412 CB TYR A 106 72.526 21.432 3.338 1.00 25.00 C ATOM 413 CG TYR A 106 72.877 22.125 4.645 1.00 25.00 C ATOM 414 CD1 TYR A 106 71.870 22.528 5.554 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.220 22.378 4.985 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.198 23.157 6.775 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.554 23.011 6.215 1.00 25.00 C ATOM 418 CZ TYR A 106 73.538 23.398 7.094 1.00 25.00 C ATOM 419 OH TYR A 106 73.870 24.019 8.270 1.00 25.00 O ATOM 0 H TYR A 106 71.832 21.333 0.745 1.00 25.00 H new ATOM 0 HA TYR A 106 70.429 21.819 3.325 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.383 20.369 3.530 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.369 21.522 2.653 1.00 25.00 H new ATOM 0 HD1 TYR A 106 70.833 22.351 5.310 1.00 25.00 H new ATOM 0 HD2 TYR A 106 75.006 22.088 4.304 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.417 23.451 7.460 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.588 23.192 6.468 1.00 25.00 H new ATOM 0 HH TYR A 106 74.844 24.105 8.331 1.00 25.00 H new ATOM 429 N CYS A 107 70.517 24.278 2.901 1.00 25.00 N ATOM 430 CA CYS A 107 70.579 25.718 2.719 1.00 25.00 C ATOM 431 C CYS A 107 71.216 26.361 3.935 1.00 25.00 C ATOM 432 O CYS A 107 70.807 26.122 5.069 1.00 25.00 O ATOM 433 CB CYS A 107 69.186 26.305 2.506 1.00 25.00 C ATOM 434 SG CYS A 107 69.228 28.108 2.334 1.00 25.00 S ATOM 0 H CYS A 107 69.721 23.957 3.453 1.00 25.00 H new ATOM 0 HA CYS A 107 71.180 25.923 1.833 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.740 25.866 1.613 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.547 26.036 3.347 1.00 25.00 H new ATOM 0 HG CYS A 107 68.111 28.520 1.812 1.00 25.00 H new ATOM 440 N VAL A 108 72.207 27.197 3.680 1.00 25.00 N ATOM 441 CA VAL A 108 72.907 27.925 4.720 1.00 25.00 C ATOM 442 C VAL A 108 72.595 29.403 4.573 1.00 25.00 C ATOM 443 O VAL A 108 72.734 29.983 3.489 1.00 25.00 O ATOM 444 CB VAL A 108 74.432 27.684 4.649 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.152 28.424 5.793 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.721 26.182 4.736 1.00 25.00 C ATOM 0 H VAL A 108 72.550 27.390 2.739 1.00 25.00 H new ATOM 0 HA VAL A 108 72.570 27.568 5.693 1.00 25.00 H new ATOM 0 HB VAL A 108 74.804 28.071 3.700 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.225 28.242 5.726 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.960 29.494 5.712 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.782 28.060 6.751 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.797 26.015 4.686 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.337 25.792 5.678 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.235 25.669 3.906 1.00 25.00 H new ATOM 456 N ARG A 109 72.161 30.003 5.670 1.00 25.00 N ATOM 457 CA ARG A 109 71.780 31.404 5.715 1.00 25.00 C ATOM 458 C ARG A 109 72.647 32.054 6.761 1.00 25.00 C ATOM 459 O ARG A 109 72.877 31.475 7.812 1.00 25.00 O ATOM 460 CB ARG A 109 70.323 31.512 6.154 1.00 25.00 C ATOM 461 CG ARG A 109 69.290 31.036 5.121 1.00 25.00 C ATOM 462 CD ARG A 109 68.807 32.174 4.230 1.00 25.00 C ATOM 463 NE ARG A 109 68.183 33.254 5.012 1.00 25.00 N ATOM 464 CZ ARG A 109 66.915 33.308 5.395 1.00 25.00 C ATOM 465 NH1 ARG A 109 66.039 32.378 5.098 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 66.531 34.327 6.107 1.00 25.00 N ATOM 0 H ARG A 109 72.063 29.524 6.565 1.00 25.00 H new ATOM 0 HA ARG A 109 71.900 31.877 4.741 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.192 30.933 7.068 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.112 32.552 6.403 1.00 25.00 H new ATOM 0 HG2 ARG A 109 69.730 30.253 4.503 1.00 25.00 H new ATOM 0 HG3 ARG A 109 68.438 30.593 5.638 1.00 25.00 H new ATOM 0 HD2 ARG A 109 69.648 32.574 3.664 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.090 31.789 3.505 1.00 25.00 H new ATOM 0 HE ARG A 109 68.782 34.033 5.284 1.00 25.00 H new ATOM 0 HH11 ARG A 109 66.323 31.567 4.548 1.00 25.00 H new ATOM 0 HH12 ARG A 109 65.074 32.466 5.417 1.00 25.00 H new ATOM 0 HH21 ARG A 109 67.199 35.056 6.356 1.00 25.00 H new ATOM 0 HH22 ARG A 109 65.562 34.397 6.417 1.00 25.00 H new ATOM 480 N ARG A 110 73.099 33.270 6.501 1.00 25.00 N ATOM 481 CA ARG A 110 73.916 33.999 7.476 1.00 25.00 C ATOM 482 C ARG A 110 73.114 34.374 8.713 1.00 25.00 C ATOM 483 O ARG A 110 73.676 34.683 9.752 1.00 25.00 O ATOM 484 CB ARG A 110 74.482 35.270 6.852 1.00 25.00 C ATOM 485 CG ARG A 110 75.646 35.009 5.924 1.00 25.00 C ATOM 486 CD ARG A 110 76.300 36.315 5.508 1.00 25.00 C ATOM 487 NE ARG A 110 77.685 36.099 5.052 1.00 25.00 N ATOM 488 CZ ARG A 110 78.749 36.027 5.846 1.00 25.00 C ATOM 489 NH1 ARG A 110 78.664 36.134 7.152 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 79.924 35.833 5.317 1.00 25.00 N ATOM 0 H ARG A 110 72.920 33.775 5.633 1.00 25.00 H new ATOM 0 HA ARG A 110 74.728 33.335 7.773 1.00 25.00 H new ATOM 0 HB2 ARG A 110 73.692 35.779 6.300 1.00 25.00 H new ATOM 0 HB3 ARG A 110 74.802 35.945 7.645 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.378 34.371 6.420 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.301 34.471 5.041 1.00 25.00 H new ATOM 0 HD2 ARG A 110 75.720 36.776 4.709 1.00 25.00 H new ATOM 0 HD3 ARG A 110 76.296 37.010 6.348 1.00 25.00 H new ATOM 0 HE ARG A 110 77.839 35.997 4.049 1.00 25.00 H new ATOM 0 HH11 ARG A 110 77.756 36.278 7.594 1.00 25.00 H new ATOM 0 HH12 ARG A 110 79.506 36.073 7.725 1.00 25.00 H new ATOM 0 HH21 ARG A 110 80.019 35.739 4.306 1.00 25.00 H new ATOM 0 HH22 ARG A 110 80.749 35.776 5.914 1.00 25.00 H new ATOM 504 N ASP A 111 71.801 34.336 8.579 1.00 25.00 N ATOM 505 CA ASP A 111 70.878 34.726 9.642 1.00 25.00 C ATOM 506 C ASP A 111 70.602 33.599 10.644 1.00 25.00 C ATOM 507 O ASP A 111 69.635 33.673 11.392 1.00 25.00 O ATOM 508 CB ASP A 111 69.554 35.148 8.999 1.00 25.00 C ATOM 509 CG ASP A 111 69.757 35.844 7.669 1.00 25.00 C ATOM 510 OD1 ASP A 111 70.302 36.963 7.637 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.453 35.208 6.630 1.00 25.00 O1- ATOM 0 H ASP A 111 71.336 34.032 7.724 1.00 25.00 H new ATOM 0 HA ASP A 111 71.342 35.542 10.197 1.00 25.00 H new ATOM 0 HB2 ASP A 111 68.926 34.269 8.854 1.00 25.00 H new ATOM 0 HB3 ASP A 111 69.019 35.813 9.677 1.00 25.00 H new ATOM 516 N LEU A 112 71.419 32.545 10.600 1.00 25.00 N ATOM 517 CA LEU A 112 71.252 31.334 11.436 1.00 25.00 C ATOM 518 C LEU A 112 69.881 30.701 11.179 1.00 25.00 C ATOM 519 O LEU A 112 69.202 30.194 12.068 1.00 25.00 O ATOM 520 CB LEU A 112 71.459 31.636 12.931 1.00 25.00 C ATOM 521 CG LEU A 112 72.821 32.243 13.310 1.00 25.00 C ATOM 522 CD1 LEU A 112 72.806 32.640 14.787 1.00 25.00 C ATOM 523 CD2 LEU A 112 73.971 31.259 13.052 1.00 25.00 C ATOM 0 H LEU A 112 72.227 32.499 9.979 1.00 25.00 H new ATOM 0 HA LEU A 112 72.024 30.619 11.151 1.00 25.00 H new ATOM 0 HB2 LEU A 112 70.675 32.320 13.256 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.327 30.710 13.491 1.00 25.00 H new ATOM 0 HG LEU A 112 72.986 33.121 12.686 1.00 25.00 H new ATOM 0 HD11 LEU A 112 73.770 33.070 15.058 1.00 25.00 H new ATOM 0 HD12 LEU A 112 72.020 33.375 14.958 1.00 25.00 H new ATOM 0 HD13 LEU A 112 72.618 31.758 15.399 1.00 25.00 H new ATOM 0 HD21 LEU A 112 74.917 31.723 13.332 1.00 25.00 H new ATOM 0 HD22 LEU A 112 73.819 30.358 13.646 1.00 25.00 H new ATOM 0 HD23 LEU A 112 73.995 30.996 11.994 1.00 25.00 H new ATOM 535 N SER A 113 69.487 30.809 9.923 1.00 25.00 N ATOM 536 CA SER A 113 68.187 30.376 9.413 1.00 25.00 C ATOM 537 C SER A 113 68.322 29.092 8.591 1.00 25.00 C ATOM 538 O SER A 113 67.609 28.901 7.605 1.00 25.00 O ATOM 539 CB SER A 113 67.565 31.494 8.590 1.00 25.00 C ATOM 540 OG SER A 113 66.238 31.191 8.194 1.00 25.00 O ATOM 0 H SER A 113 70.081 31.215 9.200 1.00 25.00 H new ATOM 0 HA SER A 113 67.531 30.154 10.255 1.00 25.00 H new ATOM 0 HB2 SER A 113 67.568 32.416 9.172 1.00 25.00 H new ATOM 0 HB3 SER A 113 68.175 31.674 7.705 1.00 25.00 H new ATOM 0 HG SER A 113 66.218 30.311 7.763 1.00 25.00 H new ATOM 546 N GLU A 114 69.346 28.307 8.878 1.00 25.00 N ATOM 547 CA GLU A 114 69.718 27.192 7.999 1.00 25.00 C ATOM 548 C GLU A 114 68.705 26.052 8.102 1.00 25.00 C ATOM 549 O GLU A 114 68.087 25.833 9.140 1.00 25.00 O ATOM 550 CB GLU A 114 71.075 26.612 8.421 1.00 25.00 C ATOM 551 CG GLU A 114 72.240 27.567 8.288 1.00 25.00 C ATOM 552 CD GLU A 114 72.695 28.153 9.606 1.00 25.00 C ATOM 553 OE1 GLU A 114 71.848 28.370 10.489 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.904 28.444 9.735 1.00 25.00 O1- ATOM 0 H GLU A 114 69.935 28.413 9.704 1.00 25.00 H new ATOM 0 HA GLU A 114 69.753 27.585 6.983 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.008 26.285 9.459 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.279 25.726 7.820 1.00 25.00 H new ATOM 0 HG2 GLU A 114 73.076 27.044 7.824 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.959 28.378 7.617 1.00 25.00 H new ATOM 561 N VAL A 115 68.524 25.348 6.991 1.00 25.00 N ATOM 562 CA VAL A 115 67.505 24.302 6.883 1.00 25.00 C ATOM 563 C VAL A 115 67.977 23.300 5.834 1.00 25.00 C ATOM 564 O VAL A 115 68.758 23.650 4.955 1.00 25.00 O ATOM 565 CB VAL A 115 66.109 24.933 6.480 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.147 25.544 5.063 1.00 25.00 C ATOM 567 CG2 VAL A 115 64.966 23.909 6.590 1.00 25.00 C ATOM 0 H VAL A 115 69.074 25.482 6.142 1.00 25.00 H new ATOM 0 HA VAL A 115 67.368 23.799 7.840 1.00 25.00 H new ATOM 0 HB VAL A 115 65.913 25.735 7.191 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.171 25.967 4.823 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.902 26.329 5.026 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.394 24.768 4.339 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.026 24.381 6.305 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.166 23.068 5.926 1.00 25.00 H new ATOM 0 HG23 VAL A 115 64.896 23.551 7.617 1.00 25.00 H new ATOM 577 N THR A 116 67.509 22.066 5.905 1.00 25.00 N ATOM 578 CA THR A 116 67.829 21.068 4.890 1.00 25.00 C ATOM 579 C THR A 116 66.543 20.334 4.552 1.00 25.00 C ATOM 580 O THR A 116 65.654 20.208 5.395 1.00 25.00 O ATOM 581 CB THR A 116 68.955 20.095 5.355 1.00 25.00 C ATOM 582 OG1 THR A 116 69.116 19.043 4.400 1.00 25.00 O ATOM 583 CG2 THR A 116 68.666 19.494 6.719 1.00 25.00 C ATOM 0 H THR A 116 66.905 21.727 6.654 1.00 25.00 H new ATOM 0 HA THR A 116 68.226 21.556 4.000 1.00 25.00 H new ATOM 0 HB THR A 116 69.873 20.677 5.433 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.090 19.417 3.494 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.478 18.823 7.000 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.581 20.291 7.457 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.731 18.935 6.680 1.00 25.00 H new ATOM 591 N PHE A 117 66.420 19.929 3.298 1.00 25.00 N ATOM 592 CA PHE A 117 65.215 19.298 2.777 1.00 25.00 C ATOM 593 C PHE A 117 65.645 18.437 1.596 1.00 25.00 C ATOM 594 O PHE A 117 66.804 18.490 1.192 1.00 25.00 O ATOM 595 CB PHE A 117 64.205 20.369 2.336 1.00 25.00 C ATOM 596 CG PHE A 117 64.783 21.407 1.409 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.799 21.197 0.018 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.295 22.616 1.925 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.322 22.182 -0.858 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.821 23.608 1.061 1.00 25.00 C ATOM 601 CZ PHE A 117 65.833 23.390 -0.332 1.00 25.00 C ATOM 0 H PHE A 117 67.161 20.030 2.605 1.00 25.00 H new ATOM 0 HA PHE A 117 64.727 18.688 3.537 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.365 19.881 1.841 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.808 20.867 3.221 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.409 20.275 -0.387 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.286 22.787 2.991 1.00 25.00 H new ATOM 0 HE1 PHE A 117 65.330 22.009 -1.924 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.212 24.529 1.468 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.231 24.144 -0.995 1.00 25.00 H new ATOM 611 N SER A 118 64.732 17.661 1.034 1.00 25.00 N ATOM 612 CA SER A 118 65.045 16.822 -0.120 1.00 25.00 C ATOM 613 C SER A 118 64.004 17.044 -1.204 1.00 25.00 C ATOM 614 O SER A 118 62.845 17.306 -0.906 1.00 25.00 O ATOM 615 CB SER A 118 65.079 15.347 0.281 1.00 25.00 C ATOM 616 OG SER A 118 66.061 15.111 1.277 1.00 25.00 O ATOM 0 H SER A 118 63.767 17.592 1.356 1.00 25.00 H new ATOM 0 HA SER A 118 66.029 17.096 -0.500 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.100 15.045 0.653 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.290 14.734 -0.595 1.00 25.00 H new ATOM 0 HG SER A 118 66.061 14.161 1.517 1.00 25.00 H new ATOM 622 N LEU A 119 64.431 16.949 -2.455 1.00 25.00 N ATOM 623 CA LEU A 119 63.563 17.200 -3.603 1.00 25.00 C ATOM 624 C LEU A 119 63.472 15.988 -4.503 1.00 25.00 C ATOM 625 O LEU A 119 64.441 15.248 -4.671 1.00 25.00 O ATOM 626 CB LEU A 119 64.104 18.373 -4.422 1.00 25.00 C ATOM 627 CG LEU A 119 63.845 19.770 -3.844 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.586 20.796 -4.681 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.350 20.081 -3.840 1.00 25.00 C ATOM 0 H LEU A 119 65.387 16.696 -2.706 1.00 25.00 H new ATOM 0 HA LEU A 119 62.570 17.431 -3.217 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.180 18.243 -4.539 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.667 18.327 -5.419 1.00 25.00 H new ATOM 0 HG LEU A 119 64.203 19.804 -2.815 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.407 21.793 -4.277 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.654 20.581 -4.658 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.229 20.752 -5.710 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.186 21.076 -3.426 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.968 20.045 -4.860 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.827 19.344 -3.230 1.00 25.00 H new ATOM 641 N GLN A 120 62.301 15.808 -5.093 1.00 25.00 N ATOM 642 CA GLN A 120 62.031 14.699 -6.004 1.00 25.00 C ATOM 643 C GLN A 120 62.057 15.268 -7.413 1.00 25.00 C ATOM 644 O GLN A 120 61.231 16.109 -7.756 1.00 25.00 O ATOM 645 CB GLN A 120 60.655 14.085 -5.710 1.00 25.00 C ATOM 646 CG GLN A 120 60.503 13.524 -4.288 1.00 25.00 C ATOM 647 CD GLN A 120 60.262 14.613 -3.254 1.00 25.00 C ATOM 648 OE1 GLN A 120 59.407 15.458 -3.424 1.00 25.00 O ATOM 649 NE2 GLN A 120 61.033 14.607 -2.197 1.00 25.00 N ATOM 0 H GLN A 120 61.504 16.429 -4.955 1.00 25.00 H new ATOM 0 HA GLN A 120 62.776 13.912 -5.884 1.00 25.00 H new ATOM 0 HB2 GLN A 120 59.890 14.844 -5.872 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.467 13.285 -6.426 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.673 12.817 -4.267 1.00 25.00 H new ATOM 0 HG3 GLN A 120 61.402 12.968 -4.022 1.00 25.00 H new ATOM 0 HE21 GLN A 120 61.741 13.881 -2.087 1.00 25.00 H new ATOM 0 HE22 GLN A 120 60.926 15.328 -1.483 1.00 25.00 H new ATOM 658 N VAL A 121 63.033 14.858 -8.206 1.00 25.00 N ATOM 659 CA VAL A 121 63.234 15.429 -9.541 1.00 25.00 C ATOM 660 C VAL A 121 63.584 14.342 -10.536 1.00 25.00 C ATOM 661 O VAL A 121 63.975 13.251 -10.149 1.00 25.00 O ATOM 662 CB VAL A 121 64.387 16.479 -9.528 1.00 25.00 C ATOM 663 CG1 VAL A 121 63.967 17.717 -8.748 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.673 15.886 -8.908 1.00 25.00 C ATOM 0 H VAL A 121 63.703 14.131 -7.954 1.00 25.00 H new ATOM 0 HA VAL A 121 62.303 15.914 -9.834 1.00 25.00 H new ATOM 0 HB VAL A 121 64.596 16.757 -10.561 1.00 25.00 H new ATOM 0 HG11 VAL A 121 64.782 18.441 -8.748 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.088 18.161 -9.215 1.00 25.00 H new ATOM 0 HG13 VAL A 121 63.730 17.437 -7.722 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.460 16.640 -8.912 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.473 15.576 -7.882 1.00 25.00 H new ATOM 0 HG23 VAL A 121 65.994 15.023 -9.492 1.00 25.00 H new ATOM 674 N ASP A 122 63.458 14.635 -11.816 1.00 25.00 N ATOM 675 CA ASP A 122 63.863 13.685 -12.846 1.00 25.00 C ATOM 676 C ASP A 122 65.371 13.790 -13.064 1.00 25.00 C ATOM 677 O ASP A 122 65.991 14.784 -12.692 1.00 25.00 O ATOM 678 CB ASP A 122 63.149 13.965 -14.166 1.00 25.00 C ATOM 679 CG ASP A 122 63.500 12.940 -15.226 1.00 25.00 C ATOM 680 OD1 ASP A 122 63.479 11.731 -14.904 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 64.007 13.342 -16.287 1.00 25.00 O1- ATOM 0 H ASP A 122 63.082 15.515 -12.170 1.00 25.00 H new ATOM 0 HA ASP A 122 63.595 12.683 -12.512 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.071 13.965 -14.003 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.417 14.960 -14.520 1.00 25.00 H new ATOM 686 N ALA A 123 65.950 12.785 -13.700 1.00 25.00 N ATOM 687 CA ALA A 123 67.367 12.799 -14.028 1.00 25.00 C ATOM 688 C ALA A 123 67.701 13.958 -14.983 1.00 25.00 C ATOM 689 O ALA A 123 68.750 14.600 -14.849 1.00 25.00 O ATOM 690 CB ALA A 123 67.757 11.458 -14.662 1.00 25.00 C ATOM 0 H ALA A 123 65.457 11.944 -14.001 1.00 25.00 H new ATOM 0 HA ALA A 123 67.937 12.947 -13.111 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.819 11.467 -14.908 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.555 10.650 -13.958 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.175 11.302 -15.570 1.00 25.00 H new ATOM 696 N ASP A 124 66.825 14.218 -15.946 1.00 25.00 N ATOM 697 CA ASP A 124 67.095 15.233 -16.967 1.00 25.00 C ATOM 698 C ASP A 124 66.495 16.602 -16.613 1.00 25.00 C ATOM 699 O ASP A 124 66.408 17.499 -17.447 1.00 25.00 O ATOM 700 CB ASP A 124 66.606 14.761 -18.339 1.00 25.00 C ATOM 701 CG ASP A 124 67.527 15.214 -19.478 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.764 15.321 -19.252 1.00 25.00 O ATOM 703 OD2 ASP A 124 67.035 15.386 -20.611 1.00 25.00 O1- ATOM 0 H ASP A 124 65.926 13.746 -16.045 1.00 25.00 H new ATOM 0 HA ASP A 124 68.176 15.366 -17.005 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.537 13.673 -18.342 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.601 15.144 -18.515 1.00 25.00 H new ATOM 708 N PHE A 125 66.119 16.768 -15.354 1.00 25.00 N ATOM 709 CA PHE A 125 65.601 18.044 -14.854 1.00 25.00 C ATOM 710 C PHE A 125 66.731 19.079 -14.938 1.00 25.00 C ATOM 711 O PHE A 125 67.860 18.792 -14.542 1.00 25.00 O ATOM 712 CB PHE A 125 65.159 17.845 -13.402 1.00 25.00 C ATOM 713 CG PHE A 125 64.078 18.778 -12.935 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.741 18.557 -13.313 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.371 19.846 -12.066 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.703 19.384 -12.823 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.338 20.669 -11.559 1.00 25.00 C ATOM 718 CZ PHE A 125 62.003 20.434 -11.935 1.00 25.00 C ATOM 0 H PHE A 125 66.162 16.031 -14.650 1.00 25.00 H new ATOM 0 HA PHE A 125 64.750 18.391 -15.441 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.810 16.819 -13.281 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.027 17.965 -12.754 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.504 17.746 -13.986 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.395 20.039 -11.783 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.682 19.210 -13.130 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.574 21.478 -10.883 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.212 21.056 -11.544 1.00 25.00 H new ATOM 728 N GLU A 126 66.450 20.259 -15.475 1.00 25.00 N ATOM 729 CA GLU A 126 67.486 21.291 -15.650 1.00 25.00 C ATOM 730 C GLU A 126 67.992 21.813 -14.315 1.00 25.00 C ATOM 731 O GLU A 126 67.233 21.897 -13.355 1.00 25.00 O ATOM 732 CB GLU A 126 66.941 22.495 -16.419 1.00 25.00 C ATOM 733 CG GLU A 126 66.957 22.353 -17.926 1.00 25.00 C ATOM 734 CD GLU A 126 66.610 23.671 -18.614 1.00 25.00 C ATOM 735 OE1 GLU A 126 67.210 24.712 -18.244 1.00 25.00 O ATOM 736 OE2 GLU A 126 65.713 23.681 -19.480 1.00 25.00 O1- ATOM 0 H GLU A 126 65.522 20.533 -15.798 1.00 25.00 H new ATOM 0 HA GLU A 126 68.296 20.812 -16.200 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.916 22.679 -16.097 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.523 23.375 -16.146 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.943 22.020 -18.251 1.00 25.00 H new ATOM 0 HG3 GLU A 126 66.245 21.585 -18.228 1.00 25.00 H new ATOM 743 N LEU A 127 69.241 22.261 -14.276 1.00 25.00 N ATOM 744 CA LEU A 127 69.790 22.899 -13.078 1.00 25.00 C ATOM 745 C LEU A 127 69.032 24.207 -12.838 1.00 25.00 C ATOM 746 O LEU A 127 68.742 24.567 -11.701 1.00 25.00 O ATOM 747 CB LEU A 127 71.298 23.145 -13.269 1.00 25.00 C ATOM 748 CG LEU A 127 72.220 23.467 -12.071 1.00 25.00 C ATOM 749 CD1 LEU A 127 71.995 24.850 -11.457 1.00 25.00 C ATOM 750 CD2 LEU A 127 72.079 22.394 -10.995 1.00 25.00 C ATOM 0 H LEU A 127 69.894 22.196 -15.057 1.00 25.00 H new ATOM 0 HA LEU A 127 69.669 22.257 -12.206 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.705 22.257 -13.753 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.398 23.968 -13.976 1.00 25.00 H new ATOM 0 HG LEU A 127 73.233 23.476 -12.473 1.00 25.00 H new ATOM 0 HD11 LEU A 127 72.682 24.994 -10.623 1.00 25.00 H new ATOM 0 HD12 LEU A 127 72.174 25.616 -12.211 1.00 25.00 H new ATOM 0 HD13 LEU A 127 70.969 24.926 -11.098 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.733 22.632 -10.156 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.046 22.358 -10.650 1.00 25.00 H new ATOM 0 HD23 LEU A 127 72.357 21.425 -11.409 1.00 25.00 H new ATOM 762 N HIS A 128 68.651 24.877 -13.918 1.00 25.00 N ATOM 763 CA HIS A 128 67.843 26.094 -13.836 1.00 25.00 C ATOM 764 C HIS A 128 66.525 25.811 -13.119 1.00 25.00 C ATOM 765 O HIS A 128 66.116 26.541 -12.219 1.00 25.00 O ATOM 766 CB HIS A 128 67.536 26.616 -15.246 1.00 25.00 C ATOM 767 CG HIS A 128 66.947 27.993 -15.264 1.00 25.00 C ATOM 768 ND1 HIS A 128 67.579 29.097 -15.779 1.00 25.00 N ATOM 769 CD2 HIS A 128 65.739 28.450 -14.827 1.00 25.00 C ATOM 770 CE1 HIS A 128 66.771 30.143 -15.635 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.637 29.807 -15.057 1.00 25.00 N ATOM 0 H HIS A 128 68.889 24.598 -14.870 1.00 25.00 H new ATOM 0 HA HIS A 128 68.407 26.841 -13.278 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.455 26.616 -15.832 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.846 25.929 -15.736 1.00 25.00 H new ATOM 0 HD2 HIS A 128 64.975 27.840 -14.369 1.00 25.00 H new ATOM 0 HE1 HIS A 128 67.015 31.146 -15.953 1.00 25.00 H new ATOM 0 HE2 HIS A 128 64.853 30.418 -14.829 1.00 25.00 H new ATOM 779 N ASN A 129 65.867 24.734 -13.516 1.00 25.00 N ATOM 780 CA ASN A 129 64.588 24.367 -12.925 1.00 25.00 C ATOM 781 C ASN A 129 64.810 23.905 -11.483 1.00 25.00 C ATOM 782 O ASN A 129 64.057 24.240 -10.582 1.00 25.00 O ATOM 783 CB ASN A 129 63.941 23.254 -13.759 1.00 25.00 C ATOM 784 CG ASN A 129 62.441 23.206 -13.602 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.892 23.643 -12.612 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.771 22.691 -14.597 1.00 25.00 N ATOM 0 H ASN A 129 66.196 24.099 -14.243 1.00 25.00 H new ATOM 0 HA ASN A 129 63.920 25.228 -12.917 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.188 23.403 -14.810 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.364 22.293 -13.466 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.753 22.647 -14.557 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.266 22.333 -15.414 1.00 25.00 H new ATOM 793 N PHE A 130 65.886 23.168 -11.263 1.00 25.00 N ATOM 794 CA PHE A 130 66.209 22.663 -9.935 1.00 25.00 C ATOM 795 C PHE A 130 66.469 23.769 -8.930 1.00 25.00 C ATOM 796 O PHE A 130 65.986 23.705 -7.813 1.00 25.00 O ATOM 797 CB PHE A 130 67.437 21.764 -9.993 1.00 25.00 C ATOM 798 CG PHE A 130 67.797 21.167 -8.666 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.956 20.215 -8.072 1.00 25.00 C ATOM 800 CD2 PHE A 130 68.969 21.560 -7.994 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.278 19.641 -6.822 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.303 20.993 -6.740 1.00 25.00 C ATOM 803 CZ PHE A 130 68.456 20.026 -6.157 1.00 25.00 C ATOM 0 H PHE A 130 66.554 22.904 -11.988 1.00 25.00 H new ATOM 0 HA PHE A 130 65.335 22.102 -9.603 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.258 20.961 -10.708 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.284 22.340 -10.366 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.049 19.916 -8.577 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.619 22.300 -8.438 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.621 18.908 -6.378 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.204 21.300 -6.231 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.711 19.584 -5.205 1.00 25.00 H new ATOM 813 N ARG A 131 67.228 24.791 -9.305 1.00 25.00 N ATOM 814 CA ARG A 131 67.514 25.869 -8.357 1.00 25.00 C ATOM 815 C ARG A 131 66.252 26.681 -8.077 1.00 25.00 C ATOM 816 O ARG A 131 66.094 27.186 -6.982 1.00 25.00 O ATOM 817 CB ARG A 131 68.690 26.752 -8.813 1.00 25.00 C ATOM 818 CG ARG A 131 68.436 27.626 -10.035 1.00 25.00 C ATOM 819 CD ARG A 131 69.721 28.317 -10.488 1.00 25.00 C ATOM 820 NE ARG A 131 70.230 29.291 -9.501 1.00 25.00 N ATOM 821 CZ ARG A 131 71.465 29.785 -9.480 1.00 25.00 C ATOM 822 NH1 ARG A 131 72.376 29.433 -10.355 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 71.794 30.652 -8.560 1.00 25.00 N ATOM 0 H ARG A 131 67.647 24.900 -10.229 1.00 25.00 H new ATOM 0 HA ARG A 131 67.833 25.414 -7.419 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.977 27.398 -7.983 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.543 26.106 -9.024 1.00 25.00 H new ATOM 0 HG2 ARG A 131 68.041 27.016 -10.847 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.679 28.374 -9.801 1.00 25.00 H new ATOM 0 HD2 ARG A 131 70.486 27.563 -10.675 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.539 28.827 -11.434 1.00 25.00 H new ATOM 0 HE ARG A 131 69.584 29.610 -8.779 1.00 25.00 H new ATOM 0 HH11 ARG A 131 72.148 28.758 -11.085 1.00 25.00 H new ATOM 0 HH12 ARG A 131 73.312 29.834 -10.306 1.00 25.00 H new ATOM 0 HH21 ARG A 131 71.106 30.945 -7.866 1.00 25.00 H new ATOM 0 HH22 ARG A 131 72.739 31.036 -8.536 1.00 25.00 H new ATOM 837 N ALA A 132 65.325 26.737 -9.026 1.00 25.00 N ATOM 838 CA ALA A 132 64.042 27.401 -8.792 1.00 25.00 C ATOM 839 C ALA A 132 63.188 26.562 -7.824 1.00 25.00 C ATOM 840 O ALA A 132 62.551 27.091 -6.921 1.00 25.00 O ATOM 841 CB ALA A 132 63.306 27.609 -10.123 1.00 25.00 C ATOM 0 H ALA A 132 65.433 26.336 -9.957 1.00 25.00 H new ATOM 0 HA ALA A 132 64.220 28.377 -8.342 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.353 28.104 -9.938 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.914 28.228 -10.782 1.00 25.00 H new ATOM 0 HB3 ALA A 132 63.128 26.643 -10.595 1.00 25.00 H new ATOM 847 N LEU A 133 63.211 25.248 -7.999 1.00 25.00 N ATOM 848 CA LEU A 133 62.474 24.336 -7.122 1.00 25.00 C ATOM 849 C LEU A 133 63.069 24.382 -5.709 1.00 25.00 C ATOM 850 O LEU A 133 62.366 24.343 -4.710 1.00 25.00 O ATOM 851 CB LEU A 133 62.552 22.915 -7.697 1.00 25.00 C ATOM 852 CG LEU A 133 61.502 21.908 -7.205 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.104 22.285 -7.692 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.855 20.518 -7.729 1.00 25.00 C ATOM 0 H LEU A 133 63.733 24.784 -8.742 1.00 25.00 H new ATOM 0 HA LEU A 133 61.429 24.639 -7.064 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.474 22.983 -8.782 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.540 22.512 -7.473 1.00 25.00 H new ATOM 0 HG LEU A 133 61.502 21.917 -6.115 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.382 21.554 -7.328 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.841 23.273 -7.314 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.089 22.297 -8.782 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.113 19.799 -7.382 1.00 25.00 H new ATOM 0 HD22 LEU A 133 61.866 20.532 -8.819 1.00 25.00 H new ATOM 0 HD23 LEU A 133 62.839 20.229 -7.360 1.00 25.00 H new ATOM 866 N CYS A 134 64.382 24.527 -5.653 1.00 25.00 N ATOM 867 CA CYS A 134 65.109 24.685 -4.399 1.00 25.00 C ATOM 868 C CYS A 134 64.708 25.983 -3.701 1.00 25.00 C ATOM 869 O CYS A 134 64.593 26.030 -2.482 1.00 25.00 O ATOM 870 CB CYS A 134 66.609 24.714 -4.700 1.00 25.00 C ATOM 871 SG CYS A 134 67.637 24.969 -3.260 1.00 25.00 S ATOM 0 H CYS A 134 64.980 24.539 -6.480 1.00 25.00 H new ATOM 0 HA CYS A 134 64.868 23.850 -3.741 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.892 23.774 -5.173 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.809 25.507 -5.421 1.00 25.00 H new ATOM 0 HG CYS A 134 68.887 24.976 -3.615 1.00 25.00 H new ATOM 877 N GLU A 135 64.513 27.037 -4.479 1.00 25.00 N ATOM 878 CA GLU A 135 64.131 28.343 -3.946 1.00 25.00 C ATOM 879 C GLU A 135 62.756 28.279 -3.284 1.00 25.00 C ATOM 880 O GLU A 135 62.540 28.892 -2.237 1.00 25.00 O ATOM 881 CB GLU A 135 64.173 29.380 -5.083 1.00 25.00 C ATOM 882 CG GLU A 135 63.011 30.381 -5.159 1.00 25.00 C ATOM 883 CD GLU A 135 63.234 31.439 -6.240 1.00 25.00 C ATOM 884 OE1 GLU A 135 64.276 31.379 -6.940 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 62.427 32.385 -6.328 1.00 25.00 O1- ATOM 0 H GLU A 135 64.614 27.015 -5.494 1.00 25.00 H new ATOM 0 HA GLU A 135 64.837 28.645 -3.173 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.101 29.945 -4.992 1.00 25.00 H new ATOM 0 HB3 GLU A 135 64.219 28.842 -6.030 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.084 29.845 -5.363 1.00 25.00 H new ATOM 0 HG3 GLU A 135 62.891 30.870 -4.193 1.00 25.00 H new ATOM 892 N LEU A 136 61.856 27.487 -3.853 1.00 25.00 N ATOM 893 CA LEU A 136 60.511 27.331 -3.302 1.00 25.00 C ATOM 894 C LEU A 136 60.557 26.764 -1.886 1.00 25.00 C ATOM 895 O LEU A 136 59.941 27.306 -0.973 1.00 25.00 O ATOM 896 CB LEU A 136 59.687 26.400 -4.203 1.00 25.00 C ATOM 897 CG LEU A 136 58.218 26.182 -3.806 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.396 27.468 -3.955 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.622 25.079 -4.679 1.00 25.00 C ATOM 0 H LEU A 136 62.031 26.941 -4.697 1.00 25.00 H new ATOM 0 HA LEU A 136 60.044 28.315 -3.262 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.710 26.799 -5.217 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.180 25.428 -4.231 1.00 25.00 H new ATOM 0 HG LEU A 136 58.185 25.889 -2.757 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.363 27.275 -3.665 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.814 28.243 -3.313 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.426 27.801 -4.993 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.580 24.919 -4.402 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.678 25.374 -5.727 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.182 24.156 -4.531 1.00 25.00 H new ATOM 911 N GLU A 137 61.303 25.684 -1.705 1.00 25.00 N ATOM 912 CA GLU A 137 61.399 25.032 -0.397 1.00 25.00 C ATOM 913 C GLU A 137 62.236 25.848 0.584 1.00 25.00 C ATOM 914 O GLU A 137 62.012 25.819 1.791 1.00 25.00 O ATOM 915 CB GLU A 137 62.042 23.653 -0.549 1.00 25.00 C ATOM 916 CG GLU A 137 61.274 22.695 -1.448 1.00 25.00 C ATOM 917 CD GLU A 137 59.853 22.440 -0.968 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.678 22.013 0.194 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.910 22.638 -1.766 1.00 25.00 O1- ATOM 0 H GLU A 137 61.851 25.238 -2.441 1.00 25.00 H new ATOM 0 HA GLU A 137 60.386 24.944 -0.005 1.00 25.00 H new ATOM 0 HB2 GLU A 137 63.049 23.777 -0.948 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.144 23.202 0.438 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.243 23.101 -2.459 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.809 21.747 -1.501 1.00 25.00 H new ATOM 926 N SER A 138 63.229 26.558 0.068 1.00 25.00 N ATOM 927 CA SER A 138 64.130 27.328 0.923 1.00 25.00 C ATOM 928 C SER A 138 63.541 28.677 1.332 1.00 25.00 C ATOM 929 O SER A 138 63.991 29.282 2.310 1.00 25.00 O ATOM 930 CB SER A 138 65.460 27.559 0.218 1.00 25.00 C ATOM 931 OG SER A 138 66.381 28.148 1.116 1.00 25.00 O ATOM 0 H SER A 138 63.433 26.619 -0.930 1.00 25.00 H new ATOM 0 HA SER A 138 64.279 26.739 1.828 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.854 26.613 -0.154 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.316 28.207 -0.647 1.00 25.00 H new ATOM 0 HG SER A 138 65.894 28.572 1.853 1.00 25.00 H new ATOM 937 N GLY A 139 62.569 29.165 0.573 1.00 25.00 N ATOM 938 CA GLY A 139 61.906 30.418 0.903 1.00 25.00 C ATOM 939 C GLY A 139 62.696 31.662 0.540 1.00 25.00 C ATOM 940 O GLY A 139 62.362 32.758 0.989 1.00 25.00 O ATOM 0 H GLY A 139 62.223 28.713 -0.273 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.944 30.451 0.391 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.698 30.434 1.973 1.00 25.00 H new ATOM 944 N ILE A 140 63.753 31.504 -0.248 1.00 25.00 N ATOM 945 CA ILE A 140 64.597 32.628 -0.656 1.00 25.00 C ATOM 946 C ILE A 140 64.908 32.531 -2.150 1.00 25.00 C ATOM 947 O ILE A 140 65.035 31.431 -2.684 1.00 25.00 O ATOM 948 CB ILE A 140 65.938 32.665 0.142 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.661 31.302 0.088 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.675 33.064 1.611 1.00 25.00 C ATOM 951 CD1 ILE A 140 68.152 31.375 0.375 1.00 25.00 C ATOM 0 H ILE A 140 64.050 30.602 -0.621 1.00 25.00 H new ATOM 0 HA ILE A 140 64.046 33.544 -0.444 1.00 25.00 H new ATOM 0 HB ILE A 140 66.583 33.410 -0.323 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.196 30.628 0.808 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.514 30.864 -0.899 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.618 33.086 2.157 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.214 34.051 1.643 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.007 32.337 2.072 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.583 30.376 0.317 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.633 32.021 -0.360 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.311 31.781 1.374 1.00 25.00 H new ATOM 963 N PRO A 141 65.025 33.680 -2.849 1.00 25.00 N ATOM 964 CA PRO A 141 65.298 33.561 -4.285 1.00 25.00 C ATOM 965 C PRO A 141 66.641 32.911 -4.604 1.00 25.00 C ATOM 966 O PRO A 141 67.669 33.250 -4.010 1.00 25.00 O ATOM 967 CB PRO A 141 65.296 35.018 -4.765 1.00 25.00 C ATOM 968 CG PRO A 141 64.516 35.753 -3.737 1.00 25.00 C ATOM 969 CD PRO A 141 64.895 35.093 -2.450 1.00 25.00 C ATOM 0 HA PRO A 141 64.563 32.919 -4.770 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.310 35.409 -4.847 1.00 25.00 H new ATOM 0 HB3 PRO A 141 64.838 35.110 -5.750 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.766 36.814 -3.730 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.444 35.680 -3.922 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.827 35.490 -2.049 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.133 35.231 -1.682 1.00 25.00 H new ATOM 977 N ALA A 142 66.636 32.003 -5.568 1.00 25.00 N ATOM 978 CA ALA A 142 67.848 31.324 -6.012 1.00 25.00 C ATOM 979 C ALA A 142 68.829 32.307 -6.642 1.00 25.00 C ATOM 980 O ALA A 142 70.025 32.043 -6.703 1.00 25.00 O ATOM 981 CB ALA A 142 67.490 30.228 -7.008 1.00 25.00 C ATOM 0 H ALA A 142 65.793 31.715 -6.065 1.00 25.00 H new ATOM 0 HA ALA A 142 68.330 30.878 -5.142 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.399 29.724 -7.337 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.827 29.506 -6.532 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.988 30.669 -7.869 1.00 25.00 H new ATOM 987 N ALA A 143 68.307 33.416 -7.149 1.00 25.00 N ATOM 988 CA ALA A 143 69.128 34.443 -7.787 1.00 25.00 C ATOM 989 C ALA A 143 69.965 35.197 -6.746 1.00 25.00 C ATOM 990 O ALA A 143 71.087 35.607 -7.013 1.00 25.00 O ATOM 991 CB ALA A 143 68.225 35.425 -8.545 1.00 25.00 C ATOM 0 H ALA A 143 67.310 33.631 -7.131 1.00 25.00 H new ATOM 0 HA ALA A 143 69.809 33.960 -8.487 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.838 36.190 -9.020 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.661 34.887 -9.307 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.533 35.896 -7.847 1.00 25.00 H new ATOM 997 N GLU A 144 69.406 35.349 -5.554 1.00 25.00 N ATOM 998 CA GLU A 144 70.047 36.095 -4.468 1.00 25.00 C ATOM 999 C GLU A 144 70.864 35.151 -3.587 1.00 25.00 C ATOM 1000 O GLU A 144 71.168 35.453 -2.435 1.00 25.00 O ATOM 1001 CB GLU A 144 68.977 36.797 -3.619 1.00 25.00 C ATOM 1002 CG GLU A 144 68.128 37.798 -4.399 1.00 25.00 C ATOM 1003 CD GLU A 144 68.967 38.875 -5.068 1.00 25.00 C ATOM 1004 OE1 GLU A 144 69.799 39.506 -4.377 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 68.801 39.084 -6.288 1.00 25.00 O1- ATOM 0 H GLU A 144 68.496 34.961 -5.307 1.00 25.00 H new ATOM 0 HA GLU A 144 70.714 36.841 -4.900 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.322 36.043 -3.181 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.464 37.315 -2.793 1.00 25.00 H new ATOM 0 HG2 GLU A 144 67.551 37.268 -5.157 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.412 38.267 -3.724 1.00 25.00 H new ATOM 1012 N SER A 145 71.184 33.987 -4.125 1.00 25.00 N ATOM 1013 CA SER A 145 71.906 32.957 -3.395 1.00 25.00 C ATOM 1014 C SER A 145 72.816 32.223 -4.375 1.00 25.00 C ATOM 1015 O SER A 145 72.727 32.430 -5.582 1.00 25.00 O ATOM 1016 CB SER A 145 70.899 31.993 -2.764 1.00 25.00 C ATOM 1017 OG SER A 145 71.526 31.137 -1.825 1.00 25.00 O ATOM 0 H SER A 145 70.950 33.728 -5.083 1.00 25.00 H new ATOM 0 HA SER A 145 72.511 33.394 -2.601 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.109 32.560 -2.272 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.425 31.397 -3.544 1.00 25.00 H new ATOM 0 HG SER A 145 71.961 30.397 -2.297 1.00 25.00 H new ATOM 1023 N GLN A 146 73.699 31.376 -3.870 1.00 25.00 N ATOM 1024 CA GLN A 146 74.599 30.604 -4.726 1.00 25.00 C ATOM 1025 C GLN A 146 74.460 29.126 -4.422 1.00 25.00 C ATOM 1026 O GLN A 146 74.532 28.711 -3.271 1.00 25.00 O ATOM 1027 CB GLN A 146 76.047 31.053 -4.521 1.00 25.00 C ATOM 1028 CG GLN A 146 76.340 32.415 -5.144 1.00 25.00 C ATOM 1029 CD GLN A 146 76.222 32.387 -6.656 1.00 25.00 C ATOM 1030 OE1 GLN A 146 76.948 31.671 -7.328 1.00 25.00 O ATOM 1031 NE2 GLN A 146 75.301 33.142 -7.192 1.00 25.00 N ATOM 0 H GLN A 146 73.815 31.203 -2.872 1.00 25.00 H new ATOM 0 HA GLN A 146 74.328 30.778 -5.767 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.262 31.094 -3.453 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.717 30.310 -4.953 1.00 25.00 H new ATOM 0 HG2 GLN A 146 75.648 33.154 -4.740 1.00 25.00 H new ATOM 0 HG3 GLN A 146 77.345 32.733 -4.865 1.00 25.00 H new ATOM 0 HE21 GLN A 146 74.713 33.727 -6.599 1.00 25.00 H new ATOM 0 HE22 GLN A 146 75.170 33.146 -8.204 1.00 25.00 H new ATOM 1040 N ILE A 147 74.232 28.343 -5.463 1.00 25.00 N ATOM 1041 CA ILE A 147 74.056 26.899 -5.328 1.00 25.00 C ATOM 1042 C ILE A 147 75.402 26.221 -5.630 1.00 25.00 C ATOM 1043 O ILE A 147 76.119 26.601 -6.563 1.00 25.00 O ATOM 1044 CB ILE A 147 72.880 26.396 -6.236 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.605 24.906 -5.956 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.158 26.686 -7.734 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.375 24.338 -6.678 1.00 25.00 C ATOM 0 H ILE A 147 74.163 28.684 -6.422 1.00 25.00 H new ATOM 0 HA ILE A 147 73.767 26.633 -4.311 1.00 25.00 H new ATOM 0 HB ILE A 147 71.975 26.950 -5.988 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.481 24.327 -6.248 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.476 24.769 -4.882 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.324 26.325 -8.335 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.274 27.760 -7.881 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.072 26.177 -8.039 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.258 23.285 -6.423 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.486 24.887 -6.369 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.507 24.438 -7.755 1.00 25.00 H new ATOM 1059 N VAL A 148 75.781 25.299 -4.758 1.00 25.00 N ATOM 1060 CA VAL A 148 77.106 24.683 -4.750 1.00 25.00 C ATOM 1061 C VAL A 148 76.984 23.158 -4.734 1.00 25.00 C ATOM 1062 O VAL A 148 76.210 22.603 -3.960 1.00 25.00 O ATOM 1063 CB VAL A 148 77.881 25.154 -3.466 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.269 24.530 -3.376 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.008 26.689 -3.452 1.00 25.00 C ATOM 0 H VAL A 148 75.168 24.949 -4.022 1.00 25.00 H new ATOM 0 HA VAL A 148 77.645 24.984 -5.648 1.00 25.00 H new ATOM 0 HB VAL A 148 77.304 24.822 -2.603 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.769 24.883 -2.474 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.178 23.444 -3.339 1.00 25.00 H new ATOM 0 HG13 VAL A 148 79.854 24.816 -4.250 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.547 27.001 -2.557 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.553 27.017 -4.337 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.014 27.136 -3.452 1.00 25.00 H new ATOM 1075 N TYR A 149 77.773 22.490 -5.563 1.00 25.00 N ATOM 1076 CA TYR A 149 77.826 21.027 -5.607 1.00 25.00 C ATOM 1077 C TYR A 149 79.287 20.616 -5.685 1.00 25.00 C ATOM 1078 O TYR A 149 80.067 21.274 -6.369 1.00 25.00 O ATOM 1079 CB TYR A 149 77.084 20.499 -6.833 1.00 25.00 C ATOM 1080 CG TYR A 149 77.306 19.025 -7.059 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.862 18.075 -6.118 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.980 18.566 -8.211 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.085 16.694 -6.324 1.00 25.00 C ATOM 1084 CE2 TYR A 149 78.197 17.178 -8.420 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.743 16.256 -7.476 1.00 25.00 C ATOM 1086 OH TYR A 149 77.949 14.919 -7.688 1.00 25.00 O ATOM 0 H TYR A 149 78.398 22.944 -6.228 1.00 25.00 H new ATOM 0 HA TYR A 149 77.352 20.614 -4.717 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.017 20.687 -6.715 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.410 21.050 -7.715 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.345 18.405 -5.229 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.335 19.278 -8.942 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.746 15.977 -5.590 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.712 16.837 -9.306 1.00 25.00 H new ATOM 0 HH TYR A 149 77.293 14.402 -7.175 1.00 25.00 H new ATOM 1096 N ALA A 150 79.661 19.570 -4.951 1.00 25.00 N ATOM 1097 CA ALA A 150 81.056 19.109 -4.867 1.00 25.00 C ATOM 1098 C ALA A 150 81.987 20.285 -4.509 1.00 25.00 C ATOM 1099 O ALA A 150 83.053 20.456 -5.093 1.00 25.00 O ATOM 1100 CB ALA A 150 81.483 18.432 -6.189 1.00 25.00 C ATOM 0 H ALA A 150 79.010 19.015 -4.396 1.00 25.00 H new ATOM 0 HA ALA A 150 81.135 18.365 -4.074 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.517 18.097 -6.109 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.838 17.575 -6.384 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.395 19.146 -7.008 1.00 25.00 H new ATOM 1106 N GLU A 151 81.507 21.111 -3.581 1.00 25.00 N ATOM 1107 CA GLU A 151 82.190 22.330 -3.100 1.00 25.00 C ATOM 1108 C GLU A 151 82.502 23.386 -4.181 1.00 25.00 C ATOM 1109 O GLU A 151 83.194 24.368 -3.917 1.00 25.00 O ATOM 1110 CB GLU A 151 83.455 21.972 -2.305 1.00 25.00 C ATOM 1111 CG GLU A 151 83.163 21.064 -1.114 1.00 25.00 C ATOM 1112 CD GLU A 151 84.284 21.077 -0.090 1.00 25.00 C ATOM 1113 OE1 GLU A 151 84.257 21.958 0.800 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.178 20.208 -0.158 1.00 25.00 O1- ATOM 0 H GLU A 151 80.608 20.954 -3.125 1.00 25.00 H new ATOM 0 HA GLU A 151 81.464 22.811 -2.445 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.168 21.479 -2.966 1.00 25.00 H new ATOM 0 HB3 GLU A 151 83.929 22.888 -1.951 1.00 25.00 H new ATOM 0 HG2 GLU A 151 82.235 21.381 -0.638 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.008 20.044 -1.467 1.00 25.00 H new ATOM 1121 N ARG A 152 81.926 23.235 -5.368 1.00 25.00 N ATOM 1122 CA ARG A 152 82.089 24.213 -6.450 1.00 25.00 C ATOM 1123 C ARG A 152 80.745 24.854 -6.791 1.00 25.00 C ATOM 1124 O ARG A 152 79.727 24.169 -6.835 1.00 25.00 O ATOM 1125 CB ARG A 152 82.618 23.515 -7.698 1.00 25.00 C ATOM 1126 CG ARG A 152 84.014 22.918 -7.544 1.00 25.00 C ATOM 1127 CD ARG A 152 84.420 22.131 -8.795 1.00 25.00 C ATOM 1128 NE ARG A 152 84.553 22.998 -9.985 1.00 25.00 N ATOM 1129 CZ ARG A 152 83.628 23.167 -10.928 1.00 25.00 C ATOM 1130 NH1 ARG A 152 82.472 22.547 -10.910 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 83.875 23.981 -11.917 1.00 25.00 N ATOM 0 H ARG A 152 81.336 22.439 -5.612 1.00 25.00 H new ATOM 0 HA ARG A 152 82.790 24.980 -6.119 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.925 22.721 -7.976 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.631 24.230 -8.521 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.735 23.715 -7.362 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.038 22.262 -6.674 1.00 25.00 H new ATOM 0 HD2 ARG A 152 85.367 21.623 -8.611 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.677 21.358 -8.992 1.00 25.00 H new ATOM 0 HE ARG A 152 85.428 23.511 -10.093 1.00 25.00 H new ATOM 0 HH11 ARG A 152 82.250 21.903 -10.151 1.00 25.00 H new ATOM 0 HH12 ARG A 152 81.795 22.709 -11.655 1.00 25.00 H new ATOM 0 HH21 ARG A 152 84.766 24.476 -11.960 1.00 25.00 H new ATOM 0 HH22 ARG A 152 83.178 24.122 -12.648 1.00 25.00 H new ATOM 1145 N PRO A 153 80.717 26.174 -7.051 1.00 25.00 N ATOM 1146 CA PRO A 153 79.411 26.724 -7.423 1.00 25.00 C ATOM 1147 C PRO A 153 78.983 26.286 -8.818 1.00 25.00 C ATOM 1148 O PRO A 153 79.817 26.054 -9.699 1.00 25.00 O ATOM 1149 CB PRO A 153 79.650 28.235 -7.368 1.00 25.00 C ATOM 1150 CG PRO A 153 81.078 28.385 -7.724 1.00 25.00 C ATOM 1151 CD PRO A 153 81.760 27.215 -7.056 1.00 25.00 C ATOM 0 HA PRO A 153 78.609 26.385 -6.768 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.006 28.767 -8.069 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.442 28.636 -6.376 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.222 28.364 -8.804 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.478 29.334 -7.367 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.644 26.896 -7.608 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.086 27.463 -6.046 1.00 25.00 H new ATOM 1159 N LEU A 154 77.681 26.188 -9.019 1.00 25.00 N ATOM 1160 CA LEU A 154 77.125 25.828 -10.324 1.00 25.00 C ATOM 1161 C LEU A 154 76.705 27.107 -11.037 1.00 0.00 C ATOM 1162 O LEU A 154 75.621 27.641 -10.806 1.00 25.00 O ATOM 1163 CB LEU A 154 75.918 24.897 -10.180 1.00 25.00 C ATOM 1164 CG LEU A 154 76.181 23.542 -9.504 1.00 25.00 C ATOM 1165 CD1 LEU A 154 75.192 23.349 -8.361 1.00 25.00 C ATOM 1166 CD2 LEU A 154 76.049 22.404 -10.511 1.00 25.00 C ATOM 0 H LEU A 154 76.981 26.352 -8.296 1.00 25.00 H new ATOM 0 HA LEU A 154 77.884 25.298 -10.899 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.149 25.419 -9.612 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.509 24.710 -11.173 1.00 25.00 H new ATOM 0 HG LEU A 154 77.198 23.532 -9.112 1.00 25.00 H new ATOM 0 HD11 LEU A 154 75.376 22.389 -7.879 1.00 25.00 H new ATOM 0 HD12 LEU A 154 75.317 24.150 -7.633 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.175 23.370 -8.752 1.00 25.00 H new ATOM 0 HD21 LEU A 154 76.239 21.453 -10.013 1.00 25.00 H new ATOM 0 HD22 LEU A 154 75.041 22.401 -10.927 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.772 22.543 -11.314 1.00 25.00 H new ATOM 1178 N THR A 155 77.589 27.617 -11.877 1.00 25.00 N ATOM 1179 CA THR A 155 77.320 28.840 -12.630 1.00 25.00 C ATOM 1180 C THR A 155 76.528 28.521 -13.893 1.00 25.00 C ATOM 1181 O THR A 155 75.845 29.376 -14.452 1.00 25.00 O ATOM 1182 CB THR A 155 78.644 29.508 -13.039 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.491 28.532 -13.656 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.379 30.043 -11.814 1.00 25.00 C ATOM 0 H THR A 155 78.504 27.205 -12.058 1.00 25.00 H new ATOM 0 HA THR A 155 76.743 29.512 -11.994 1.00 25.00 H new ATOM 0 HB THR A 155 78.416 30.327 -13.722 1.00 25.00 H new ATOM 0 HG1 THR A 155 80.336 28.952 -13.920 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.313 30.511 -12.126 1.00 25.00 H new ATOM 0 HG22 THR A 155 78.755 30.779 -11.308 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.596 29.221 -11.132 1.00 25.00 H new ATOM 1192 N ASP A 156 76.637 27.281 -14.341 1.00 25.00 N ATOM 1193 CA ASP A 156 75.978 26.833 -15.560 1.00 25.00 C ATOM 1194 C ASP A 156 74.599 26.281 -15.219 1.00 25.00 C ATOM 1195 O ASP A 156 74.476 25.320 -14.471 1.00 25.00 O ATOM 1196 CB ASP A 156 76.825 25.753 -16.228 1.00 25.00 C ATOM 1197 CG ASP A 156 78.171 26.270 -16.669 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.216 27.123 -17.575 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 79.190 25.835 -16.091 1.00 25.00 O1- ATOM 0 H ASP A 156 77.183 26.558 -13.873 1.00 25.00 H new ATOM 0 HA ASP A 156 75.865 27.672 -16.246 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.967 24.925 -15.534 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.290 25.357 -17.091 1.00 25.00 H new ATOM 1204 N ASN A 157 73.560 26.934 -15.715 1.00 25.00 N ATOM 1205 CA ASN A 157 72.181 26.542 -15.404 1.00 25.00 C ATOM 1206 C ASN A 157 71.514 25.606 -16.423 1.00 25.00 C ATOM 1207 O ASN A 157 70.507 24.984 -16.124 1.00 25.00 O ATOM 1208 CB ASN A 157 71.328 27.805 -15.273 1.00 25.00 C ATOM 1209 CG ASN A 157 71.783 28.695 -14.149 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.801 28.296 -12.996 1.00 25.00 O ATOM 1211 ND2 ASN A 157 72.141 29.908 -14.473 1.00 25.00 N ATOM 0 H ASN A 157 73.638 27.740 -16.336 1.00 25.00 H new ATOM 0 HA ASN A 157 72.242 25.974 -14.476 1.00 25.00 H new ATOM 0 HB2 ASN A 157 71.363 28.362 -16.209 1.00 25.00 H new ATOM 0 HB3 ASN A 157 70.288 27.522 -15.109 1.00 25.00 H new ATOM 0 HD21 ASN A 157 72.449 30.559 -13.751 1.00 25.00 H new ATOM 0 HD22 ASN A 157 72.112 30.205 -15.448 1.00 25.00 H new ATOM 1218 N HIS A 158 72.000 25.606 -17.655 1.00 25.00 N ATOM 1219 CA HIS A 158 71.249 25.004 -18.768 1.00 25.00 C ATOM 1220 C HIS A 158 71.370 23.495 -18.987 1.00 25.00 C ATOM 1221 O HIS A 158 70.645 22.943 -19.803 1.00 25.00 O ATOM 1222 CB HIS A 158 71.632 25.716 -20.064 1.00 25.00 C ATOM 1223 CG HIS A 158 71.269 27.166 -20.067 1.00 25.00 C ATOM 1224 ND1 HIS A 158 69.980 27.637 -20.087 1.00 25.00 N ATOM 1225 CD2 HIS A 158 72.052 28.280 -20.039 1.00 25.00 C ATOM 1226 CE1 HIS A 158 70.021 28.964 -20.073 1.00 25.00 C ATOM 1227 NE2 HIS A 158 71.261 29.411 -20.035 1.00 25.00 N ATOM 0 H HIS A 158 72.900 26.009 -17.917 1.00 25.00 H new ATOM 0 HA HIS A 158 70.208 25.142 -18.477 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.706 25.616 -20.222 1.00 25.00 H new ATOM 0 HB3 HIS A 158 71.139 25.223 -20.902 1.00 25.00 H new ATOM 0 HD2 HIS A 158 73.132 28.279 -20.022 1.00 25.00 H new ATOM 0 HE1 HIS A 158 69.147 29.599 -20.091 1.00 25.00 H new ATOM 0 HE2 HIS A 158 71.569 30.383 -20.008 1.00 25.00 H new ATOM 1235 N ARG A 159 72.269 22.814 -18.292 1.00 25.00 N ATOM 1236 CA ARG A 159 72.341 21.355 -18.434 1.00 25.00 C ATOM 1237 C ARG A 159 71.477 20.733 -17.356 1.00 25.00 C ATOM 1238 O ARG A 159 71.133 21.382 -16.367 1.00 25.00 O ATOM 1239 CB ARG A 159 73.760 20.823 -18.293 1.00 25.00 C ATOM 1240 CG ARG A 159 74.714 21.204 -19.392 1.00 25.00 C ATOM 1241 CD ARG A 159 76.008 20.434 -19.179 1.00 25.00 C ATOM 1242 NE ARG A 159 76.985 20.654 -20.256 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.134 19.999 -20.382 1.00 25.00 C ATOM 1244 NH1 ARG A 159 78.508 19.070 -19.533 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.915 20.274 -21.389 1.00 25.00 N ATOM 0 H ARG A 159 72.941 23.224 -17.643 1.00 25.00 H new ATOM 0 HA ARG A 159 71.994 21.095 -19.434 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.168 21.175 -17.345 1.00 25.00 H new ATOM 0 HB3 ARG A 159 73.716 19.735 -18.236 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.286 20.968 -20.367 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.903 22.277 -19.378 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.450 20.731 -18.228 1.00 25.00 H new ATOM 0 HD3 ARG A 159 75.785 19.369 -19.109 1.00 25.00 H new ATOM 0 HE ARG A 159 76.764 21.361 -20.957 1.00 25.00 H new ATOM 0 HH11 ARG A 159 77.909 18.830 -18.743 1.00 25.00 H new ATOM 0 HH12 ARG A 159 79.398 18.589 -19.663 1.00 25.00 H new ATOM 0 HH21 ARG A 159 78.641 20.984 -22.068 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.800 19.779 -21.498 1.00 25.00 H new ATOM 1259 N SER A 160 71.162 19.464 -17.534 1.00 25.00 N ATOM 1260 CA SER A 160 70.392 18.727 -16.554 1.00 25.00 C ATOM 1261 C SER A 160 71.245 18.263 -15.385 1.00 25.00 C ATOM 1262 O SER A 160 72.472 18.260 -15.451 1.00 25.00 O ATOM 1263 CB SER A 160 69.755 17.527 -17.222 1.00 25.00 C ATOM 1264 OG SER A 160 70.725 16.686 -17.826 1.00 25.00 O ATOM 0 H SER A 160 71.430 18.920 -18.354 1.00 25.00 H new ATOM 0 HA SER A 160 69.628 19.396 -16.158 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.189 16.958 -16.485 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.046 17.865 -17.977 1.00 25.00 H new ATOM 0 HG SER A 160 70.282 16.063 -18.439 1.00 25.00 H new ATOM 1270 N LEU A 161 70.585 17.854 -14.315 1.00 25.00 N ATOM 1271 CA LEU A 161 71.256 17.396 -13.099 1.00 25.00 C ATOM 1272 C LEU A 161 72.140 16.175 -13.344 1.00 25.00 C ATOM 1273 O LEU A 161 73.280 16.115 -12.861 1.00 25.00 O ATOM 1274 CB LEU A 161 70.192 17.063 -12.055 1.00 25.00 C ATOM 1275 CG LEU A 161 69.439 18.283 -11.507 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.173 17.823 -10.826 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.308 19.070 -10.527 1.00 25.00 C ATOM 0 H LEU A 161 69.567 17.828 -14.260 1.00 25.00 H new ATOM 0 HA LEU A 161 71.910 18.195 -12.749 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.471 16.374 -12.495 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.666 16.540 -11.224 1.00 25.00 H new ATOM 0 HG LEU A 161 69.190 18.943 -12.338 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.635 18.687 -10.435 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.543 17.298 -11.545 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.425 17.151 -10.006 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.750 19.929 -10.154 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.587 18.428 -9.691 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.208 19.415 -11.035 1.00 25.00 H new ATOM 1289 N ALA A 162 71.649 15.230 -14.135 1.00 25.00 N ATOM 1290 CA ALA A 162 72.426 14.040 -14.476 1.00 25.00 C ATOM 1291 C ALA A 162 73.702 14.423 -15.232 1.00 25.00 C ATOM 1292 O ALA A 162 74.734 13.776 -15.088 1.00 25.00 O ATOM 1293 CB ALA A 162 71.579 13.085 -15.318 1.00 25.00 C ATOM 0 H ALA A 162 70.719 15.262 -14.553 1.00 25.00 H new ATOM 0 HA ALA A 162 72.714 13.539 -13.552 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.166 12.201 -15.567 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.696 12.786 -14.752 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.270 13.586 -16.235 1.00 25.00 H new ATOM 1299 N SER A 163 73.644 15.506 -15.995 1.00 25.00 N ATOM 1300 CA SER A 163 74.810 15.985 -16.740 1.00 25.00 C ATOM 1301 C SER A 163 75.875 16.588 -15.821 1.00 25.00 C ATOM 1302 O SER A 163 77.027 16.747 -16.229 1.00 25.00 O ATOM 1303 CB SER A 163 74.394 17.029 -17.771 1.00 25.00 C ATOM 1304 OG SER A 163 73.444 16.508 -18.684 1.00 25.00 O ATOM 0 H SER A 163 72.804 16.072 -16.117 1.00 25.00 H new ATOM 0 HA SER A 163 75.241 15.118 -17.240 1.00 25.00 H new ATOM 0 HB2 SER A 163 73.974 17.897 -17.262 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.273 17.374 -18.316 1.00 25.00 H new ATOM 0 HG SER A 163 72.543 16.608 -18.311 1.00 25.00 H new ATOM 1310 N TYR A 164 75.501 16.911 -14.586 1.00 25.00 N ATOM 1311 CA TYR A 164 76.458 17.404 -13.589 1.00 25.00 C ATOM 1312 C TYR A 164 76.829 16.293 -12.610 1.00 25.00 C ATOM 1313 O TYR A 164 77.655 16.490 -11.726 1.00 25.00 O ATOM 1314 CB TYR A 164 75.876 18.588 -12.817 1.00 25.00 C ATOM 1315 CG TYR A 164 75.675 19.814 -13.667 1.00 25.00 C ATOM 1316 CD1 TYR A 164 76.780 20.527 -14.181 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.381 20.273 -13.969 1.00 25.00 C ATOM 1318 CE1 TYR A 164 76.586 21.669 -15.001 1.00 25.00 C ATOM 1319 CE2 TYR A 164 74.190 21.405 -14.783 1.00 25.00 C ATOM 1320 CZ TYR A 164 75.289 22.086 -15.299 1.00 25.00 C ATOM 1321 OH TYR A 164 75.079 23.156 -16.124 1.00 25.00 O ATOM 0 H TYR A 164 74.541 16.841 -14.247 1.00 25.00 H new ATOM 0 HA TYR A 164 77.353 17.732 -14.118 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.920 18.295 -12.383 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.540 18.834 -11.988 1.00 25.00 H new ATOM 0 HD1 TYR A 164 77.783 20.200 -13.948 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.523 19.751 -13.572 1.00 25.00 H new ATOM 0 HE1 TYR A 164 77.435 22.210 -15.391 1.00 25.00 H new ATOM 0 HE2 TYR A 164 73.190 21.746 -15.008 1.00 25.00 H new ATOM 0 HH TYR A 164 74.784 23.925 -15.593 1.00 25.00 H new ATOM 1331 N GLY A 165 76.216 15.129 -12.776 1.00 25.00 N ATOM 1332 CA GLY A 165 76.497 13.996 -11.909 1.00 25.00 C ATOM 1333 C GLY A 165 75.691 13.976 -10.622 1.00 25.00 C ATOM 1334 O GLY A 165 76.026 13.228 -9.702 1.00 25.00 O ATOM 0 H GLY A 165 75.523 14.946 -13.502 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.302 13.076 -12.460 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.558 14.000 -11.659 1.00 25.00 H new ATOM 1338 N LEU A 166 74.620 14.760 -10.545 1.00 25.00 N ATOM 1339 CA LEU A 166 73.788 14.782 -9.337 1.00 25.00 C ATOM 1340 C LEU A 166 72.941 13.511 -9.283 1.00 25.00 C ATOM 1341 O LEU A 166 71.792 13.492 -9.711 1.00 25.00 O ATOM 1342 CB LEU A 166 72.874 16.019 -9.312 1.00 25.00 C ATOM 1343 CG LEU A 166 73.374 17.317 -8.660 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.637 17.120 -7.173 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.606 17.866 -9.344 1.00 25.00 C ATOM 0 H LEU A 166 74.307 15.382 -11.291 1.00 25.00 H new ATOM 0 HA LEU A 166 74.443 14.830 -8.467 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.612 16.252 -10.344 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.952 15.733 -8.806 1.00 25.00 H new ATOM 0 HG LEU A 166 72.578 18.052 -8.780 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.990 18.056 -6.739 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.715 16.815 -6.678 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.395 16.348 -7.037 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.920 18.783 -8.846 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.409 17.131 -9.291 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.378 18.080 -10.388 1.00 25.00 H new ATOM 1357 N LYS A 167 73.548 12.435 -8.811 1.00 25.00 N ATOM 1358 CA LYS A 167 72.883 11.131 -8.735 1.00 25.00 C ATOM 1359 C LYS A 167 71.965 11.007 -7.512 1.00 25.00 C ATOM 1360 O LYS A 167 71.971 11.845 -6.621 1.00 25.00 O ATOM 1361 CB LYS A 167 73.938 10.008 -8.784 1.00 25.00 C ATOM 1362 CG LYS A 167 74.994 9.988 -7.636 1.00 25.00 C ATOM 1363 CD LYS A 167 74.537 9.235 -6.375 1.00 25.00 C ATOM 1364 CE LYS A 167 74.332 7.727 -6.625 1.00 25.00 C ATOM 1365 NZ LYS A 167 73.651 7.055 -5.468 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.509 12.433 -8.470 1.00 25.00 H new ATOM 0 HA LYS A 167 72.228 11.033 -9.601 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.416 9.051 -8.783 1.00 25.00 H new ATOM 0 HB3 LYS A 167 74.469 10.081 -9.733 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.910 9.529 -8.008 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.239 11.015 -7.364 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.277 9.371 -5.587 1.00 25.00 H new ATOM 0 HD3 LYS A 167 73.605 9.670 -6.015 1.00 25.00 H new ATOM 0 HE2 LYS A 167 73.737 7.586 -7.528 1.00 25.00 H new ATOM 0 HE3 LYS A 167 75.298 7.254 -6.802 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 73.231 6.158 -5.786 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 74.346 6.865 -4.718 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 72.903 7.675 -5.097 1.00 25.00 H new ATOM 1379 N ASP A 168 71.187 9.937 -7.471 1.00 25.00 N ATOM 1380 CA ASP A 168 70.244 9.675 -6.381 1.00 25.00 C ATOM 1381 C ASP A 168 70.878 9.721 -4.982 1.00 25.00 C ATOM 1382 O ASP A 168 71.755 8.935 -4.646 1.00 25.00 O ATOM 1383 CB ASP A 168 69.581 8.302 -6.594 1.00 25.00 C ATOM 1384 CG ASP A 168 70.604 7.167 -6.733 1.00 25.00 C ATOM 1385 OD1 ASP A 168 71.320 7.128 -7.763 1.00 25.00 O ATOM 1386 OD2 ASP A 168 70.712 6.326 -5.815 1.00 25.00 O1- ATOM 0 H ASP A 168 71.188 9.218 -8.195 1.00 25.00 H new ATOM 0 HA ASP A 168 69.508 10.478 -6.414 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.919 8.088 -5.755 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.960 8.338 -7.489 1.00 25.00 H new ATOM 1391 N GLY A 169 70.408 10.647 -4.164 1.00 25.00 N ATOM 1392 CA GLY A 169 70.887 10.774 -2.799 1.00 25.00 C ATOM 1393 C GLY A 169 72.064 11.717 -2.641 1.00 25.00 C ATOM 1394 O GLY A 169 72.554 11.893 -1.528 1.00 25.00 O ATOM 0 H GLY A 169 69.691 11.325 -4.424 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.069 11.123 -2.169 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.173 9.788 -2.433 1.00 25.00 H new ATOM 1398 N ASP A 170 72.524 12.326 -3.726 1.00 25.00 N ATOM 1399 CA ASP A 170 73.648 13.261 -3.635 1.00 25.00 C ATOM 1400 C ASP A 170 73.202 14.566 -2.957 1.00 25.00 C ATOM 1401 O ASP A 170 71.997 14.856 -2.856 1.00 25.00 O ATOM 1402 CB ASP A 170 74.237 13.536 -5.020 1.00 25.00 C ATOM 1403 CG ASP A 170 75.738 13.744 -4.979 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.272 14.149 -3.922 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.395 13.482 -6.006 1.00 25.00 O1- ATOM 0 H ASP A 170 72.148 12.196 -4.665 1.00 25.00 H new ATOM 0 HA ASP A 170 74.429 12.808 -3.024 1.00 25.00 H new ATOM 0 HB2 ASP A 170 74.007 12.701 -5.682 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.762 14.420 -5.445 1.00 25.00 H new ATOM 1410 N VAL A 171 74.170 15.319 -2.452 1.00 25.00 N ATOM 1411 CA VAL A 171 73.896 16.505 -1.638 1.00 25.00 C ATOM 1412 C VAL A 171 74.342 17.799 -2.318 1.00 25.00 C ATOM 1413 O VAL A 171 75.482 17.935 -2.770 1.00 25.00 O ATOM 1414 CB VAL A 171 74.588 16.389 -0.242 1.00 25.00 C ATOM 1415 CG1 VAL A 171 74.208 17.581 0.667 1.00 25.00 C ATOM 1416 CG2 VAL A 171 74.179 15.072 0.451 1.00 25.00 C ATOM 0 H VAL A 171 75.163 15.130 -2.591 1.00 25.00 H new ATOM 0 HA VAL A 171 72.814 16.549 -1.512 1.00 25.00 H new ATOM 0 HB VAL A 171 75.666 16.398 -0.404 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.703 17.475 1.632 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.524 18.512 0.197 1.00 25.00 H new ATOM 0 HG13 VAL A 171 73.128 17.597 0.813 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.669 15.005 1.422 1.00 25.00 H new ATOM 0 HG22 VAL A 171 73.098 15.053 0.588 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.481 14.227 -0.167 1.00 25.00 H new ATOM 1426 N VAL A 172 73.432 18.762 -2.354 1.00 25.00 N ATOM 1427 CA VAL A 172 73.690 20.085 -2.915 1.00 25.00 C ATOM 1428 C VAL A 172 73.619 21.076 -1.759 1.00 25.00 C ATOM 1429 O VAL A 172 72.927 20.829 -0.774 1.00 25.00 O ATOM 1430 CB VAL A 172 72.631 20.466 -3.997 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.314 21.137 -5.190 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.855 19.217 -4.477 1.00 25.00 C ATOM 0 H VAL A 172 72.485 18.648 -1.992 1.00 25.00 H new ATOM 0 HA VAL A 172 74.665 20.098 -3.401 1.00 25.00 H new ATOM 0 HB VAL A 172 71.923 21.162 -3.546 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.566 21.398 -5.938 1.00 25.00 H new ATOM 0 HG12 VAL A 172 73.824 22.041 -4.856 1.00 25.00 H new ATOM 0 HG13 VAL A 172 74.040 20.451 -5.627 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.124 19.510 -5.230 1.00 25.00 H new ATOM 0 HG22 VAL A 172 72.552 18.499 -4.908 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.341 18.760 -3.631 1.00 25.00 H new ATOM 1442 N ILE A 173 74.340 22.181 -1.848 1.00 25.00 N ATOM 1443 CA ILE A 173 74.360 23.168 -0.770 1.00 25.00 C ATOM 1444 C ILE A 173 73.999 24.534 -1.339 1.00 25.00 C ATOM 1445 O ILE A 173 74.616 24.998 -2.284 1.00 25.00 O ATOM 1446 CB ILE A 173 75.760 23.241 -0.072 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.190 21.837 0.420 1.00 25.00 C ATOM 1448 CG2 ILE A 173 75.715 24.230 1.132 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.632 21.760 0.958 1.00 25.00 C ATOM 0 H ILE A 173 74.920 22.421 -2.652 1.00 25.00 H new ATOM 0 HA ILE A 173 73.632 22.865 -0.017 1.00 25.00 H new ATOM 0 HB ILE A 173 76.488 23.601 -0.799 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.506 21.516 1.205 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.085 21.130 -0.403 1.00 25.00 H new ATOM 0 HG21 ILE A 173 76.695 24.270 1.607 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.443 25.224 0.776 1.00 25.00 H new ATOM 0 HG23 ILE A 173 74.975 23.889 1.856 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.846 20.741 1.280 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.330 22.046 0.171 1.00 25.00 H new ATOM 0 HD13 ILE A 173 77.741 22.438 1.804 1.00 25.00 H new ATOM 1461 N LEU A 174 73.005 25.181 -0.758 1.00 25.00 N ATOM 1462 CA LEU A 174 72.603 26.521 -1.175 1.00 25.00 C ATOM 1463 C LEU A 174 73.165 27.484 -0.138 1.00 25.00 C ATOM 1464 O LEU A 174 73.045 27.234 1.047 1.00 25.00 O ATOM 1465 CB LEU A 174 71.072 26.613 -1.230 1.00 25.00 C ATOM 1466 CG LEU A 174 70.509 27.953 -1.733 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.796 28.137 -3.221 1.00 25.00 C ATOM 1468 CD2 LEU A 174 69.013 28.037 -1.494 1.00 25.00 C ATOM 0 H LEU A 174 72.454 24.800 0.011 1.00 25.00 H new ATOM 0 HA LEU A 174 72.980 26.762 -2.169 1.00 25.00 H new ATOM 0 HB2 LEU A 174 70.700 25.817 -1.875 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.678 26.424 -0.232 1.00 25.00 H new ATOM 0 HG LEU A 174 71.002 28.747 -1.173 1.00 25.00 H new ATOM 0 HD11 LEU A 174 70.389 29.091 -3.555 1.00 25.00 H new ATOM 0 HD12 LEU A 174 71.873 28.124 -3.388 1.00 25.00 H new ATOM 0 HD13 LEU A 174 70.331 27.327 -3.784 1.00 25.00 H new ATOM 0 HD21 LEU A 174 68.639 28.994 -1.858 1.00 25.00 H new ATOM 0 HD22 LEU A 174 68.514 27.227 -2.025 1.00 25.00 H new ATOM 0 HD23 LEU A 174 68.810 27.951 -0.427 1.00 25.00 H new ATOM 1480 N ARG A 175 73.823 28.553 -0.562 1.00 25.00 N ATOM 1481 CA ARG A 175 74.435 29.498 0.381 1.00 25.00 C ATOM 1482 C ARG A 175 74.033 30.938 0.112 1.00 25.00 C ATOM 1483 O ARG A 175 74.426 31.537 -0.888 1.00 25.00 O ATOM 1484 CB ARG A 175 75.960 29.381 0.329 1.00 25.00 C ATOM 1485 CG ARG A 175 76.477 28.023 0.784 1.00 25.00 C ATOM 1486 CD ARG A 175 77.990 28.039 0.949 1.00 25.00 C ATOM 1487 NE ARG A 175 78.504 26.749 1.447 1.00 25.00 N ATOM 1488 CZ ARG A 175 78.579 26.390 2.727 1.00 25.00 C ATOM 1489 NH1 ARG A 175 78.178 27.168 3.703 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 79.069 25.220 3.030 1.00 25.00 N ATOM 0 H ARG A 175 73.950 28.793 -1.545 1.00 25.00 H new ATOM 0 HA ARG A 175 74.069 29.233 1.373 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.297 29.567 -0.691 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.398 30.157 0.956 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.008 27.750 1.729 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.196 27.261 0.057 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.457 28.270 -0.008 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.271 28.833 1.641 1.00 25.00 H new ATOM 0 HE ARG A 175 78.829 26.076 0.753 1.00 25.00 H new ATOM 0 HH11 ARG A 175 77.790 28.088 3.495 1.00 25.00 H new ATOM 0 HH12 ARG A 175 78.254 26.853 4.670 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.388 24.594 2.291 1.00 25.00 H new ATOM 0 HH22 ARG A 175 79.133 24.931 4.006 1.00 25.00 H new ATOM 1504 N GLN A 176 73.288 31.509 1.060 1.00 25.00 N ATOM 1505 CA GLN A 176 72.909 32.924 1.038 1.00 25.00 C ATOM 1506 C GLN A 176 73.637 33.707 2.139 1.00 25.00 C ATOM 1507 O GLN A 176 73.563 33.460 3.330 1.00 25.00 O ATOM 1508 CB GLN A 176 71.389 33.103 1.146 1.00 25.00 C ATOM 1509 CG GLN A 176 71.011 34.559 0.834 1.00 25.00 C ATOM 1510 CD GLN A 176 69.520 34.740 0.818 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.818 34.525 1.772 1.00 25.00 O ATOM 1512 NE2 GLN A 176 69.001 35.148 -0.326 1.00 25.00 N ATOM 1513 OXT GLN A 176 74.339 34.582 1.714 1.00 25.00 O ATOM 0 H GLN A 176 72.929 31.001 1.868 1.00 25.00 H new ATOM 0 HA GLN A 176 73.218 33.331 0.075 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.885 32.430 0.452 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.053 32.838 2.148 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.453 35.220 1.580 1.00 25.00 H new ATOM 0 HG3 GLN A 176 71.426 34.846 -0.132 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.608 35.326 -1.126 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.994 35.285 -0.409 1.00 25.00 H new