USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=15 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 180:sc= 0.943 USER MOD Set 1.2: A 163 SER OG : rot 75:sc= 1.1 USER MOD Set 2.1: A 128 HIS : no HD1:sc= -0.394 X(o=-0.94,f=-0.77) USER MOD Set 2.2: A 157 ASN : amide:sc= -0.549 X(o=-0.94,f=-0.77) 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 Set 4.1: A 107 CYS SG : rot 180:sc= 0 USER MOD Set 4.2: A 176 GLN : amide:sc= 0.0652 K(o=0.065,f=-0.54) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 MET CE :methyl -161:sc= -0.0227 (180deg=-0.76) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot -179:sc= -0.148 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc=-0.00321 X(o=-0.0032,f=0) USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 134 CYS SG : rot -30:sc= 0.57 USER MOD Single : A 138 SER OG : rot 79:sc= 1.04 USER MOD Single : A 145 SER OG : rot -37:sc= 1.21 USER MOD Single : A 146 GLN : amide:sc= -0.0322 X(o=-0.032,f=0) USER MOD Single : A 149 TYR OH : rot 23:sc= 1.24 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0.022 USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 164 TYR OH : rot 30:sc= 0.188 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.964 8.160 -11.172 1.00 25.00 N ATOM 307 CA HIS A 100 63.167 9.560 -10.822 1.00 25.00 C ATOM 308 C HIS A 100 64.263 9.507 -9.772 1.00 25.00 C ATOM 309 O HIS A 100 64.637 8.409 -9.354 1.00 25.00 O ATOM 310 CB HIS A 100 61.882 10.207 -10.267 1.00 25.00 C ATOM 311 CG HIS A 100 61.406 9.606 -8.981 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.562 8.523 -8.893 1.00 25.00 N ATOM 313 CD2 HIS A 100 61.649 9.968 -7.693 1.00 25.00 C ATOM 314 CE1 HIS A 100 60.339 8.275 -7.604 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.976 9.130 -6.828 1.00 25.00 N ATOM 0 HA HIS A 100 63.434 10.172 -11.684 1.00 25.00 H new ATOM 0 HB2 HIS A 100 62.060 11.272 -10.115 1.00 25.00 H new ATOM 0 HB3 HIS A 100 61.092 10.119 -11.012 1.00 25.00 H new ATOM 0 HD2 HIS A 100 62.278 10.792 -7.391 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.714 7.473 -7.239 1.00 25.00 H new ATOM 0 HE2 HIS A 100 60.972 9.164 -5.809 1.00 25.00 H new ATOM 323 N MET A 101 64.776 10.659 -9.361 1.00 25.00 N ATOM 324 CA MET A 101 65.862 10.725 -8.382 1.00 25.00 C ATOM 325 C MET A 101 65.416 11.566 -7.202 1.00 25.00 C ATOM 326 O MET A 101 64.485 12.363 -7.317 1.00 25.00 O ATOM 327 CB MET A 101 67.097 11.372 -9.018 1.00 25.00 C ATOM 328 CG MET A 101 67.491 10.757 -10.363 1.00 25.00 C ATOM 329 SD MET A 101 69.076 11.379 -10.987 1.00 25.00 S ATOM 330 CE MET A 101 68.776 13.195 -11.099 1.00 25.00 C ATOM 0 H MET A 101 64.457 11.570 -9.691 1.00 25.00 H new ATOM 0 HA MET A 101 66.111 9.717 -8.051 1.00 25.00 H new ATOM 0 HB2 MET A 101 66.907 12.436 -9.157 1.00 25.00 H new ATOM 0 HB3 MET A 101 67.937 11.285 -8.329 1.00 25.00 H new ATOM 0 HG2 MET A 101 67.548 9.673 -10.259 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.711 10.966 -11.095 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.513 13.645 -11.765 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.775 13.375 -11.491 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.863 13.640 -10.108 1.00 25.00 H new ATOM 340 N LEU A 102 66.098 11.428 -6.083 1.00 25.00 N ATOM 341 CA LEU A 102 65.838 12.239 -4.898 1.00 25.00 C ATOM 342 C LEU A 102 67.147 12.931 -4.544 1.00 25.00 C ATOM 343 O LEU A 102 68.163 12.265 -4.382 1.00 25.00 O ATOM 344 CB LEU A 102 65.378 11.354 -3.732 1.00 25.00 C ATOM 345 CG LEU A 102 64.967 12.105 -2.452 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.580 12.726 -2.600 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.976 11.154 -1.263 1.00 25.00 C ATOM 0 H LEU A 102 66.851 10.750 -5.964 1.00 25.00 H new ATOM 0 HA LEU A 102 65.048 12.965 -5.091 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.533 10.752 -4.067 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.183 10.662 -3.484 1.00 25.00 H new ATOM 0 HG LEU A 102 65.688 12.905 -2.285 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.316 13.250 -1.681 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.584 13.431 -3.431 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.849 11.941 -2.793 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.684 11.694 -0.363 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.273 10.341 -1.442 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.978 10.745 -1.132 1.00 25.00 H new ATOM 359 N LEU A 103 67.139 14.256 -4.457 1.00 25.00 N ATOM 360 CA LEU A 103 68.356 15.005 -4.124 1.00 25.00 C ATOM 361 C LEU A 103 68.137 15.765 -2.843 1.00 25.00 C ATOM 362 O LEU A 103 67.024 16.189 -2.555 1.00 25.00 O ATOM 363 CB LEU A 103 68.727 15.994 -5.230 1.00 25.00 C ATOM 364 CG LEU A 103 69.134 15.391 -6.581 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.423 16.528 -7.550 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.356 14.512 -6.459 1.00 25.00 C ATOM 0 H LEU A 103 66.313 14.835 -4.610 1.00 25.00 H new ATOM 0 HA LEU A 103 69.172 14.291 -4.013 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.877 16.656 -5.394 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.549 16.614 -4.872 1.00 25.00 H new ATOM 0 HG LEU A 103 68.316 14.769 -6.943 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.714 16.117 -8.517 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.529 17.140 -7.670 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.233 17.143 -7.158 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.611 14.105 -7.438 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.192 15.101 -6.082 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.149 13.694 -5.769 1.00 25.00 H new ATOM 378 N THR A 104 69.200 15.949 -2.081 1.00 25.00 N ATOM 379 CA THR A 104 69.128 16.675 -0.816 1.00 25.00 C ATOM 380 C THR A 104 69.695 18.067 -1.034 1.00 25.00 C ATOM 381 O THR A 104 70.691 18.242 -1.735 1.00 25.00 O ATOM 382 CB THR A 104 69.945 15.945 0.271 1.00 25.00 C ATOM 383 OG1 THR A 104 69.542 14.569 0.317 1.00 25.00 O ATOM 384 CG2 THR A 104 69.726 16.545 1.639 1.00 25.00 C ATOM 0 H THR A 104 70.131 15.605 -2.314 1.00 25.00 H new ATOM 0 HA THR A 104 68.092 16.733 -0.483 1.00 25.00 H new ATOM 0 HB THR A 104 70.999 16.043 0.013 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.059 14.100 1.005 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.320 16.001 2.374 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.030 17.592 1.630 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.670 16.476 1.902 1.00 25.00 H new ATOM 392 N VAL A 105 69.061 19.063 -0.450 1.00 25.00 N ATOM 393 CA VAL A 105 69.490 20.445 -0.569 1.00 25.00 C ATOM 394 C VAL A 105 69.713 20.978 0.834 1.00 25.00 C ATOM 395 O VAL A 105 68.817 20.920 1.671 1.00 25.00 O ATOM 396 CB VAL A 105 68.404 21.303 -1.257 1.00 25.00 C ATOM 397 CG1 VAL A 105 68.880 22.761 -1.426 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.009 20.705 -2.619 1.00 25.00 C ATOM 0 H VAL A 105 68.228 18.937 0.125 1.00 25.00 H new ATOM 0 HA VAL A 105 70.399 20.494 -1.169 1.00 25.00 H new ATOM 0 HB VAL A 105 67.523 21.302 -0.615 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.099 23.345 -1.912 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.096 23.189 -0.447 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.782 22.781 -2.038 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.244 21.328 -3.082 1.00 25.00 H new ATOM 0 HG22 VAL A 105 68.885 20.665 -3.267 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.619 19.698 -2.475 1.00 25.00 H new ATOM 408 N TYR A 106 70.901 21.503 1.087 1.00 25.00 N ATOM 409 CA TYR A 106 71.226 22.096 2.376 1.00 25.00 C ATOM 410 C TYR A 106 71.404 23.593 2.201 1.00 25.00 C ATOM 411 O TYR A 106 72.313 24.030 1.503 1.00 25.00 O ATOM 412 CB TYR A 106 72.506 21.470 2.941 1.00 25.00 C ATOM 413 CG TYR A 106 72.933 22.053 4.276 1.00 25.00 C ATOM 414 CD1 TYR A 106 71.983 22.362 5.267 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.294 22.294 4.556 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.380 22.891 6.514 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.698 22.822 5.812 1.00 25.00 C ATOM 418 CZ TYR A 106 73.729 23.117 6.777 1.00 25.00 C ATOM 419 OH TYR A 106 74.081 23.638 7.992 1.00 25.00 O ATOM 0 H TYR A 106 71.663 21.531 0.410 1.00 25.00 H new ATOM 0 HA TYR A 106 70.415 21.906 3.079 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.355 20.397 3.055 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.314 21.604 2.221 1.00 25.00 H new ATOM 0 HD1 TYR A 106 70.935 22.192 5.071 1.00 25.00 H new ATOM 0 HD2 TYR A 106 75.039 22.074 3.806 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.638 23.121 7.264 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.744 22.994 6.020 1.00 25.00 H new ATOM 0 HH TYR A 106 75.055 23.741 8.034 1.00 25.00 H new ATOM 429 N CYS A 107 70.530 24.378 2.811 1.00 25.00 N ATOM 430 CA CYS A 107 70.610 25.828 2.736 1.00 25.00 C ATOM 431 C CYS A 107 71.302 26.326 3.991 1.00 25.00 C ATOM 432 O CYS A 107 70.962 25.909 5.088 1.00 25.00 O ATOM 433 CB CYS A 107 69.213 26.435 2.650 1.00 25.00 C ATOM 434 SG CYS A 107 69.249 28.246 2.606 1.00 25.00 S ATOM 0 H CYS A 107 69.750 24.031 3.369 1.00 25.00 H new ATOM 0 HA CYS A 107 71.167 26.121 1.846 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.712 26.062 1.756 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.624 26.107 3.506 1.00 25.00 H new ATOM 0 HG CYS A 107 68.034 28.702 2.531 1.00 25.00 H new ATOM 440 N VAL A 108 72.280 27.210 3.837 1.00 25.00 N ATOM 441 CA VAL A 108 73.047 27.723 4.969 1.00 25.00 C ATOM 442 C VAL A 108 73.018 29.250 5.045 1.00 25.00 C ATOM 443 O VAL A 108 73.246 29.951 4.045 1.00 25.00 O ATOM 444 CB VAL A 108 74.538 27.276 4.891 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.138 27.174 6.293 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.677 25.925 4.161 1.00 25.00 C ATOM 0 H VAL A 108 72.563 27.590 2.934 1.00 25.00 H new ATOM 0 HA VAL A 108 72.573 27.309 5.859 1.00 25.00 H new ATOM 0 HB VAL A 108 75.083 28.030 4.323 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.180 26.861 6.221 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.084 28.146 6.783 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.579 26.442 6.876 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.728 25.639 4.122 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.113 25.162 4.697 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.288 26.018 3.147 1.00 25.00 H new ATOM 456 N ARG A 109 72.796 29.766 6.249 1.00 25.00 N ATOM 457 CA ARG A 109 72.863 31.201 6.523 1.00 25.00 C ATOM 458 C ARG A 109 73.845 31.419 7.650 1.00 25.00 C ATOM 459 O ARG A 109 73.920 30.628 8.564 1.00 25.00 O ATOM 460 CB ARG A 109 71.496 31.770 6.932 1.00 25.00 C ATOM 461 CG ARG A 109 70.600 32.175 5.759 1.00 25.00 C ATOM 462 CD ARG A 109 69.525 33.167 6.219 1.00 25.00 C ATOM 463 NE ARG A 109 68.724 33.713 5.109 1.00 25.00 N ATOM 464 CZ ARG A 109 69.051 34.765 4.362 1.00 25.00 C ATOM 465 NH1 ARG A 109 70.173 35.418 4.521 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 68.226 35.180 3.440 1.00 25.00 N ATOM 0 H ARG A 109 72.564 29.201 7.066 1.00 25.00 H new ATOM 0 HA ARG A 109 73.178 31.715 5.615 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.972 31.027 7.533 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.655 32.640 7.569 1.00 25.00 H new ATOM 0 HG2 ARG A 109 71.204 32.625 4.971 1.00 25.00 H new ATOM 0 HG3 ARG A 109 70.128 31.290 5.333 1.00 25.00 H new ATOM 0 HD2 ARG A 109 68.861 32.671 6.927 1.00 25.00 H new ATOM 0 HD3 ARG A 109 70.003 33.989 6.752 1.00 25.00 H new ATOM 0 HE ARG A 109 67.844 33.245 4.895 1.00 25.00 H new ATOM 0 HH11 ARG A 109 70.836 35.126 5.239 1.00 25.00 H new ATOM 0 HH12 ARG A 109 70.385 36.219 3.927 1.00 25.00 H new ATOM 0 HH21 ARG A 109 67.338 34.699 3.296 1.00 25.00 H new ATOM 0 HH22 ARG A 109 68.469 35.985 2.863 1.00 25.00 H new ATOM 480 N ARG A 110 74.555 32.538 7.618 1.00 25.00 N ATOM 481 CA ARG A 110 75.483 32.892 8.704 1.00 25.00 C ATOM 482 C ARG A 110 74.681 33.245 9.954 1.00 25.00 C ATOM 483 O ARG A 110 75.195 33.250 11.059 1.00 25.00 O ATOM 484 CB ARG A 110 76.377 34.068 8.284 1.00 25.00 C ATOM 485 CG ARG A 110 77.563 34.292 9.211 1.00 25.00 C ATOM 486 CD ARG A 110 78.419 35.464 8.775 1.00 25.00 C ATOM 487 NE ARG A 110 79.600 35.598 9.649 1.00 25.00 N ATOM 488 CZ ARG A 110 80.535 36.535 9.548 1.00 25.00 C ATOM 489 NH1 ARG A 110 80.506 37.464 8.621 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 81.522 36.534 10.400 1.00 25.00 N ATOM 0 H ARG A 110 74.513 33.219 6.860 1.00 25.00 H new ATOM 0 HA ARG A 110 76.129 32.041 8.921 1.00 25.00 H new ATOM 0 HB2 ARG A 110 76.745 33.891 7.273 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.776 34.977 8.250 1.00 25.00 H new ATOM 0 HG2 ARG A 110 77.202 34.466 10.225 1.00 25.00 H new ATOM 0 HG3 ARG A 110 78.174 33.390 9.241 1.00 25.00 H new ATOM 0 HD2 ARG A 110 78.738 35.324 7.742 1.00 25.00 H new ATOM 0 HD3 ARG A 110 77.831 36.382 8.805 1.00 25.00 H new ATOM 0 HE ARG A 110 79.707 34.911 10.395 1.00 25.00 H new ATOM 0 HH11 ARG A 110 79.744 37.484 7.943 1.00 25.00 H new ATOM 0 HH12 ARG A 110 81.245 38.166 8.579 1.00 25.00 H new ATOM 0 HH21 ARG A 110 81.566 35.821 11.128 1.00 25.00 H new ATOM 0 HH22 ARG A 110 82.250 37.246 10.338 1.00 25.00 H new ATOM 504 N ASP A 111 73.402 33.508 9.743 1.00 25.00 N ATOM 505 CA ASP A 111 72.463 33.849 10.809 1.00 25.00 C ATOM 506 C ASP A 111 71.874 32.575 11.459 1.00 25.00 C ATOM 507 O ASP A 111 70.859 32.621 12.137 1.00 25.00 O ATOM 508 CB ASP A 111 71.356 34.718 10.210 1.00 25.00 C ATOM 509 CG ASP A 111 70.650 35.577 11.249 1.00 25.00 C ATOM 510 OD1 ASP A 111 71.333 36.088 12.165 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.444 35.845 11.068 1.00 25.00 O1- ATOM 0 H ASP A 111 72.977 33.492 8.816 1.00 25.00 H new ATOM 0 HA ASP A 111 72.981 34.398 11.596 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.783 35.363 9.442 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.624 34.077 9.718 1.00 25.00 H new ATOM 516 N LEU A 112 72.525 31.441 11.192 1.00 25.00 N ATOM 517 CA LEU A 112 72.168 30.116 11.744 1.00 25.00 C ATOM 518 C LEU A 112 70.742 29.674 11.417 1.00 25.00 C ATOM 519 O LEU A 112 70.146 28.859 12.115 1.00 25.00 O ATOM 520 CB LEU A 112 72.416 30.068 13.262 1.00 25.00 C ATOM 521 CG LEU A 112 73.833 30.462 13.711 1.00 25.00 C ATOM 522 CD1 LEU A 112 73.895 30.480 15.235 1.00 25.00 C ATOM 523 CD2 LEU A 112 74.888 29.488 13.165 1.00 25.00 C ATOM 0 H LEU A 112 73.335 31.409 10.573 1.00 25.00 H new ATOM 0 HA LEU A 112 72.826 29.402 11.249 1.00 25.00 H new ATOM 0 HB2 LEU A 112 71.701 30.730 13.751 1.00 25.00 H new ATOM 0 HB3 LEU A 112 72.209 29.058 13.615 1.00 25.00 H new ATOM 0 HG LEU A 112 74.052 31.453 13.314 1.00 25.00 H new ATOM 0 HD11 LEU A 112 74.899 30.759 15.555 1.00 25.00 H new ATOM 0 HD12 LEU A 112 73.177 31.204 15.620 1.00 25.00 H new ATOM 0 HD13 LEU A 112 73.654 29.490 15.621 1.00 25.00 H new ATOM 0 HD21 LEU A 112 75.877 29.797 13.502 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.678 28.482 13.530 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.858 29.493 12.075 1.00 25.00 H new ATOM 535 N SER A 113 70.214 30.205 10.324 1.00 25.00 N ATOM 536 CA SER A 113 68.873 29.879 9.838 1.00 25.00 C ATOM 537 C SER A 113 68.908 28.702 8.863 1.00 25.00 C ATOM 538 O SER A 113 68.116 28.629 7.930 1.00 25.00 O ATOM 539 CB SER A 113 68.296 31.096 9.144 1.00 25.00 C ATOM 540 OG SER A 113 69.029 32.253 9.508 1.00 25.00 O ATOM 0 H SER A 113 70.706 30.882 9.741 1.00 25.00 H new ATOM 0 HA SER A 113 68.252 29.594 10.687 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.330 30.959 8.063 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.248 31.218 9.417 1.00 25.00 H new ATOM 0 HG SER A 113 68.642 33.038 9.067 1.00 25.00 H new ATOM 546 N GLU A 114 69.922 27.865 9.011 1.00 25.00 N ATOM 547 CA GLU A 114 70.177 26.785 8.064 1.00 25.00 C ATOM 548 C GLU A 114 69.149 25.651 8.183 1.00 25.00 C ATOM 549 O GLU A 114 68.601 25.390 9.259 1.00 25.00 O ATOM 550 CB GLU A 114 71.598 26.246 8.270 1.00 25.00 C ATOM 551 CG GLU A 114 71.929 25.787 9.703 1.00 25.00 C ATOM 552 CD GLU A 114 73.333 26.228 10.125 1.00 25.00 C ATOM 553 OE1 GLU A 114 73.624 27.448 10.029 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.148 25.374 10.525 1.00 25.00 O1- ATOM 0 H GLU A 114 70.588 27.911 9.783 1.00 25.00 H new ATOM 0 HA GLU A 114 70.081 27.194 7.058 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.751 25.406 7.593 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.308 27.021 7.982 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.194 26.197 10.396 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.854 24.701 9.765 1.00 25.00 H new ATOM 561 N VAL A 115 68.862 25.018 7.050 1.00 25.00 N ATOM 562 CA VAL A 115 67.828 23.985 6.957 1.00 25.00 C ATOM 563 C VAL A 115 68.215 23.034 5.828 1.00 25.00 C ATOM 564 O VAL A 115 68.888 23.435 4.880 1.00 25.00 O ATOM 565 CB VAL A 115 66.413 24.636 6.679 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.367 25.348 5.311 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.287 23.595 6.777 1.00 25.00 C ATOM 0 H VAL A 115 69.339 25.205 6.168 1.00 25.00 H new ATOM 0 HA VAL A 115 67.756 23.440 7.898 1.00 25.00 H new ATOM 0 HB VAL A 115 66.255 25.387 7.453 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.378 25.781 5.159 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.117 26.138 5.287 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.573 24.628 4.519 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.329 24.076 6.581 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.455 22.807 6.043 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.277 23.162 7.777 1.00 25.00 H new ATOM 577 N THR A 116 67.806 21.780 5.916 1.00 25.00 N ATOM 578 CA THR A 116 68.081 20.806 4.865 1.00 25.00 C ATOM 579 C THR A 116 66.777 20.091 4.548 1.00 25.00 C ATOM 580 O THR A 116 65.944 19.890 5.433 1.00 25.00 O ATOM 581 CB THR A 116 69.205 19.805 5.279 1.00 25.00 C ATOM 582 OG1 THR A 116 69.322 18.776 4.293 1.00 25.00 O ATOM 583 CG2 THR A 116 68.932 19.158 6.630 1.00 25.00 C ATOM 0 H THR A 116 67.280 21.408 6.707 1.00 25.00 H new ATOM 0 HA THR A 116 68.454 21.314 3.976 1.00 25.00 H new ATOM 0 HB THR A 116 70.131 20.375 5.355 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.029 18.151 4.555 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.742 18.470 6.874 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.868 19.930 7.397 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.991 18.610 6.587 1.00 25.00 H new ATOM 591 N PHE A 117 66.571 19.770 3.280 1.00 25.00 N ATOM 592 CA PHE A 117 65.340 19.132 2.811 1.00 25.00 C ATOM 593 C PHE A 117 65.698 18.333 1.567 1.00 25.00 C ATOM 594 O PHE A 117 66.815 18.437 1.081 1.00 25.00 O ATOM 595 CB PHE A 117 64.261 20.185 2.504 1.00 25.00 C ATOM 596 CG PHE A 117 64.712 21.282 1.576 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.554 21.155 0.182 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.265 22.473 2.096 1.00 25.00 C ATOM 599 CE1 PHE A 117 64.935 22.210 -0.697 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.648 23.532 1.234 1.00 25.00 C ATOM 601 CZ PHE A 117 65.477 23.408 -0.158 1.00 25.00 C ATOM 0 H PHE A 117 67.252 19.943 2.541 1.00 25.00 H new ATOM 0 HA PHE A 117 64.927 18.477 3.578 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.397 19.686 2.065 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.929 20.632 3.441 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.138 20.246 -0.226 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.398 22.579 3.163 1.00 25.00 H new ATOM 0 HE1 PHE A 117 64.813 22.100 -1.764 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.072 24.436 1.646 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.757 24.220 -0.813 1.00 25.00 H new ATOM 611 N SER A 118 64.769 17.541 1.055 1.00 25.00 N ATOM 612 CA SER A 118 65.026 16.720 -0.126 1.00 25.00 C ATOM 613 C SER A 118 63.907 16.913 -1.132 1.00 25.00 C ATOM 614 O SER A 118 62.774 17.183 -0.764 1.00 25.00 O ATOM 615 CB SER A 118 65.140 15.238 0.255 1.00 25.00 C ATOM 616 OG SER A 118 66.211 15.022 1.160 1.00 25.00 O ATOM 0 H SER A 118 63.828 17.447 1.437 1.00 25.00 H new ATOM 0 HA SER A 118 65.972 17.032 -0.569 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.206 14.903 0.706 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.293 14.640 -0.643 1.00 25.00 H new ATOM 0 HG SER A 118 66.260 14.070 1.388 1.00 25.00 H new ATOM 622 N LEU A 119 64.241 16.786 -2.404 1.00 25.00 N ATOM 623 CA LEU A 119 63.297 16.995 -3.494 1.00 25.00 C ATOM 624 C LEU A 119 63.382 15.866 -4.504 1.00 25.00 C ATOM 625 O LEU A 119 64.462 15.377 -4.818 1.00 25.00 O ATOM 626 CB LEU A 119 63.621 18.297 -4.219 1.00 25.00 C ATOM 627 CG LEU A 119 63.006 19.575 -3.633 1.00 25.00 C ATOM 628 CD1 LEU A 119 63.621 20.766 -4.331 1.00 25.00 C ATOM 629 CD2 LEU A 119 61.487 19.587 -3.830 1.00 25.00 C ATOM 0 H LEU A 119 65.179 16.534 -2.714 1.00 25.00 H new ATOM 0 HA LEU A 119 62.296 17.032 -3.065 1.00 25.00 H new ATOM 0 HB2 LEU A 119 64.704 18.417 -4.238 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.292 18.203 -5.254 1.00 25.00 H new ATOM 0 HG LEU A 119 63.208 19.616 -2.563 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.195 21.684 -3.927 1.00 25.00 H new ATOM 0 HD12 LEU A 119 64.699 20.765 -4.171 1.00 25.00 H new ATOM 0 HD13 LEU A 119 63.413 20.709 -5.399 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.072 20.502 -3.407 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.258 19.543 -4.895 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.048 18.724 -3.329 1.00 25.00 H new ATOM 641 N GLN A 120 62.237 15.499 -5.051 1.00 25.00 N ATOM 642 CA GLN A 120 62.169 14.490 -6.105 1.00 25.00 C ATOM 643 C GLN A 120 62.269 15.205 -7.453 1.00 25.00 C ATOM 644 O GLN A 120 61.595 16.206 -7.695 1.00 25.00 O ATOM 645 CB GLN A 120 60.883 13.646 -6.005 1.00 25.00 C ATOM 646 CG GLN A 120 59.578 14.451 -6.011 1.00 25.00 C ATOM 647 CD GLN A 120 58.354 13.566 -5.977 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.161 12.782 -5.068 1.00 25.00 O ATOM 649 NE2 GLN A 120 57.523 13.686 -6.986 1.00 25.00 N ATOM 0 H GLN A 120 61.332 15.886 -4.783 1.00 25.00 H new ATOM 0 HA GLN A 120 62.997 13.790 -5.996 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.862 12.943 -6.837 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.924 13.056 -5.090 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.563 15.120 -5.150 1.00 25.00 H new ATOM 0 HG3 GLN A 120 59.545 15.078 -6.902 1.00 25.00 H new ATOM 0 HE21 GLN A 120 57.718 14.355 -7.731 1.00 25.00 H new ATOM 0 HE22 GLN A 120 56.682 13.110 -7.025 1.00 25.00 H new ATOM 658 N VAL A 121 63.169 14.727 -8.293 1.00 25.00 N ATOM 659 CA VAL A 121 63.453 15.359 -9.580 1.00 25.00 C ATOM 660 C VAL A 121 63.650 14.305 -10.659 1.00 25.00 C ATOM 661 O VAL A 121 63.864 13.133 -10.366 1.00 25.00 O ATOM 662 CB VAL A 121 64.749 16.226 -9.499 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.561 17.397 -8.538 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.953 15.370 -9.040 1.00 25.00 C ATOM 0 H VAL A 121 63.725 13.892 -8.108 1.00 25.00 H new ATOM 0 HA VAL A 121 62.602 15.993 -9.828 1.00 25.00 H new ATOM 0 HB VAL A 121 64.949 16.616 -10.497 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.477 17.986 -8.499 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.741 18.025 -8.886 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.331 17.017 -7.543 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.845 15.994 -8.991 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.748 14.952 -8.055 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.116 14.560 -9.751 1.00 25.00 H new ATOM 674 N ASP A 122 63.560 14.718 -11.911 1.00 25.00 N ATOM 675 CA ASP A 122 63.770 13.809 -13.036 1.00 25.00 C ATOM 676 C ASP A 122 65.247 13.806 -13.428 1.00 25.00 C ATOM 677 O ASP A 122 66.010 14.666 -12.987 1.00 25.00 O ATOM 678 CB ASP A 122 62.918 14.235 -14.225 1.00 25.00 C ATOM 679 CG ASP A 122 62.297 13.056 -14.928 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.996 12.022 -15.079 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 61.111 13.139 -15.305 1.00 25.00 O1- ATOM 0 H ASP A 122 63.343 15.678 -12.180 1.00 25.00 H new ATOM 0 HA ASP A 122 63.475 12.803 -12.737 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.132 14.909 -13.884 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.533 14.794 -14.930 1.00 25.00 H new ATOM 686 N ALA A 123 65.662 12.851 -14.248 1.00 25.00 N ATOM 687 CA ALA A 123 67.072 12.756 -14.639 1.00 25.00 C ATOM 688 C ALA A 123 67.505 13.955 -15.493 1.00 25.00 C ATOM 689 O ALA A 123 68.588 14.519 -15.306 1.00 25.00 O ATOM 690 CB ALA A 123 67.306 11.451 -15.411 1.00 25.00 C ATOM 0 H ALA A 123 65.057 12.137 -14.654 1.00 25.00 H new ATOM 0 HA ALA A 123 67.675 12.761 -13.731 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.355 11.383 -15.701 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.048 10.602 -14.777 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.681 11.440 -16.304 1.00 25.00 H new ATOM 696 N ASP A 124 66.655 14.335 -16.438 1.00 25.00 N ATOM 697 CA ASP A 124 66.973 15.402 -17.383 1.00 25.00 C ATOM 698 C ASP A 124 66.412 16.734 -16.912 1.00 25.00 C ATOM 699 O ASP A 124 66.328 17.694 -17.669 1.00 25.00 O ATOM 700 CB ASP A 124 66.448 15.036 -18.772 1.00 25.00 C ATOM 701 CG ASP A 124 67.243 13.915 -19.400 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.486 14.032 -19.467 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.639 12.894 -19.795 1.00 25.00 O1- ATOM 0 H ASP A 124 65.734 13.918 -16.572 1.00 25.00 H new ATOM 0 HA ASP A 124 68.056 15.511 -17.440 1.00 25.00 H new ATOM 0 HB2 ASP A 124 65.401 14.741 -18.698 1.00 25.00 H new ATOM 0 HB3 ASP A 124 66.487 15.914 -19.417 1.00 25.00 H new ATOM 708 N PHE A 125 66.042 16.784 -15.645 1.00 25.00 N ATOM 709 CA PHE A 125 65.551 18.011 -15.035 1.00 25.00 C ATOM 710 C PHE A 125 66.685 19.032 -15.072 1.00 25.00 C ATOM 711 O PHE A 125 67.828 18.718 -14.722 1.00 25.00 O ATOM 712 CB PHE A 125 65.131 17.705 -13.598 1.00 25.00 C ATOM 713 CG PHE A 125 64.083 18.622 -13.047 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.737 18.474 -13.430 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.419 19.605 -12.102 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.730 19.308 -12.877 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.419 20.429 -11.532 1.00 25.00 C ATOM 718 CZ PHE A 125 62.073 20.282 -11.927 1.00 25.00 C ATOM 0 H PHE A 125 66.072 15.984 -15.013 1.00 25.00 H new ATOM 0 HA PHE A 125 64.688 18.412 -15.567 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.760 16.681 -13.552 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.012 17.754 -12.958 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.467 17.718 -14.152 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.450 19.734 -11.807 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.702 19.193 -13.187 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.687 21.171 -10.794 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.310 20.916 -11.500 1.00 25.00 H new ATOM 728 N GLU A 126 66.392 20.240 -15.527 1.00 25.00 N ATOM 729 CA GLU A 126 67.428 21.267 -15.668 1.00 25.00 C ATOM 730 C GLU A 126 67.895 21.745 -14.309 1.00 25.00 C ATOM 731 O GLU A 126 67.089 21.857 -13.386 1.00 25.00 O ATOM 732 CB GLU A 126 66.867 22.495 -16.386 1.00 25.00 C ATOM 733 CG GLU A 126 66.354 22.281 -17.785 1.00 25.00 C ATOM 734 CD GLU A 126 65.771 23.575 -18.344 1.00 25.00 C ATOM 735 OE1 GLU A 126 64.830 24.114 -17.709 1.00 25.00 O ATOM 736 OE2 GLU A 126 66.291 24.093 -19.345 1.00 25.00 O1- ATOM 0 H GLU A 126 65.457 20.538 -15.804 1.00 25.00 H new ATOM 0 HA GLU A 126 68.248 20.819 -16.229 1.00 25.00 H new ATOM 0 HB2 GLU A 126 66.054 22.901 -15.783 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.647 23.255 -16.422 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.164 21.933 -18.426 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.591 21.502 -17.784 1.00 25.00 H new ATOM 743 N LEU A 127 69.152 22.155 -14.208 1.00 25.00 N ATOM 744 CA LEU A 127 69.638 22.814 -12.993 1.00 25.00 C ATOM 745 C LEU A 127 68.880 24.138 -12.850 1.00 25.00 C ATOM 746 O LEU A 127 68.560 24.574 -11.746 1.00 25.00 O ATOM 747 CB LEU A 127 71.164 23.023 -13.075 1.00 25.00 C ATOM 748 CG LEU A 127 71.947 23.519 -11.841 1.00 25.00 C ATOM 749 CD1 LEU A 127 71.952 25.048 -11.683 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.439 22.877 -10.544 1.00 25.00 C ATOM 0 H LEU A 127 69.852 22.047 -14.942 1.00 25.00 H new ATOM 0 HA LEU A 127 69.456 22.200 -12.111 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.605 22.073 -13.377 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.350 23.731 -13.882 1.00 25.00 H new ATOM 0 HG LEU A 127 72.975 23.206 -12.024 1.00 25.00 H new ATOM 0 HD11 LEU A 127 72.521 25.320 -10.794 1.00 25.00 H new ATOM 0 HD12 LEU A 127 72.410 25.503 -12.561 1.00 25.00 H new ATOM 0 HD13 LEU A 127 70.928 25.407 -11.581 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.018 23.254 -9.701 1.00 25.00 H new ATOM 0 HD22 LEU A 127 70.387 23.126 -10.403 1.00 25.00 H new ATOM 0 HD23 LEU A 127 71.551 21.795 -10.606 1.00 25.00 H new ATOM 762 N HIS A 128 68.510 24.732 -13.980 1.00 25.00 N ATOM 763 CA HIS A 128 67.695 25.948 -13.993 1.00 25.00 C ATOM 764 C HIS A 128 66.361 25.745 -13.286 1.00 25.00 C ATOM 765 O HIS A 128 65.910 26.603 -12.530 1.00 25.00 O ATOM 766 CB HIS A 128 67.407 26.368 -15.442 1.00 25.00 C ATOM 767 CG HIS A 128 66.910 27.772 -15.575 1.00 25.00 C ATOM 768 ND1 HIS A 128 66.214 28.253 -16.653 1.00 25.00 N ATOM 769 CD2 HIS A 128 67.021 28.829 -14.726 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.951 29.539 -16.439 1.00 25.00 C ATOM 771 NE2 HIS A 128 66.429 29.944 -15.278 1.00 25.00 N ATOM 0 H HIS A 128 68.763 24.390 -14.907 1.00 25.00 H new ATOM 0 HA HIS A 128 68.260 26.718 -13.468 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.318 26.257 -16.031 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.668 25.689 -15.867 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.503 28.799 -13.760 1.00 25.00 H new ATOM 0 HE1 HIS A 128 65.413 30.172 -17.129 1.00 25.00 H new ATOM 0 HE2 HIS A 128 66.373 30.880 -14.876 1.00 25.00 H new ATOM 779 N ASN A 129 65.738 24.606 -13.535 1.00 25.00 N ATOM 780 CA ASN A 129 64.445 24.294 -12.940 1.00 25.00 C ATOM 781 C ASN A 129 64.638 23.851 -11.485 1.00 25.00 C ATOM 782 O ASN A 129 63.878 24.218 -10.605 1.00 25.00 O ATOM 783 CB ASN A 129 63.767 23.191 -13.751 1.00 25.00 C ATOM 784 CG ASN A 129 62.269 23.331 -13.770 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.622 23.393 -12.746 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.716 23.403 -14.954 1.00 25.00 N ATOM 0 H ASN A 129 66.106 23.878 -14.147 1.00 25.00 H new ATOM 0 HA ASN A 129 63.811 25.181 -12.951 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.144 23.212 -14.773 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.033 22.220 -13.333 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.706 23.515 -15.039 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.295 23.347 -15.792 1.00 25.00 H new ATOM 793 N PHE A 130 65.704 23.108 -11.234 1.00 25.00 N ATOM 794 CA PHE A 130 66.014 22.629 -9.888 1.00 25.00 C ATOM 795 C PHE A 130 66.258 23.758 -8.900 1.00 25.00 C ATOM 796 O PHE A 130 65.763 23.718 -7.776 1.00 25.00 O ATOM 797 CB PHE A 130 67.240 21.717 -9.930 1.00 25.00 C ATOM 798 CG PHE A 130 67.579 21.096 -8.599 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.624 20.315 -7.918 1.00 25.00 C ATOM 800 CD2 PHE A 130 68.852 21.274 -8.027 1.00 25.00 C ATOM 801 CE1 PHE A 130 66.938 19.688 -6.680 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.181 20.653 -6.804 1.00 25.00 C ATOM 803 CZ PHE A 130 68.223 19.852 -6.129 1.00 25.00 C ATOM 0 H PHE A 130 66.375 22.820 -11.946 1.00 25.00 H new ATOM 0 HA PHE A 130 65.140 22.077 -9.541 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.067 20.924 -10.657 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.097 22.291 -10.282 1.00 25.00 H new ATOM 0 HD1 PHE A 130 65.639 20.190 -8.342 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.583 21.891 -8.528 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.197 19.092 -6.168 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.165 20.787 -6.380 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.479 19.370 -5.197 1.00 25.00 H new ATOM 813 N ARG A 131 67.008 24.775 -9.299 1.00 25.00 N ATOM 814 CA ARG A 131 67.271 25.897 -8.396 1.00 25.00 C ATOM 815 C ARG A 131 65.985 26.662 -8.095 1.00 25.00 C ATOM 816 O ARG A 131 65.840 27.203 -7.013 1.00 25.00 O ATOM 817 CB ARG A 131 68.367 26.826 -8.943 1.00 25.00 C ATOM 818 CG ARG A 131 67.967 27.668 -10.140 1.00 25.00 C ATOM 819 CD ARG A 131 69.121 28.518 -10.637 1.00 25.00 C ATOM 820 NE ARG A 131 68.671 29.447 -11.692 1.00 25.00 N ATOM 821 CZ ARG A 131 69.460 30.264 -12.389 1.00 25.00 C ATOM 822 NH1 ARG A 131 70.754 30.315 -12.201 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 68.933 31.045 -13.293 1.00 25.00 N ATOM 0 H ARG A 131 67.439 24.852 -10.220 1.00 25.00 H new ATOM 0 HA ARG A 131 67.645 25.487 -7.458 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.688 27.492 -8.142 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.230 26.220 -9.218 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.621 27.018 -10.944 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.131 28.312 -9.869 1.00 25.00 H new ATOM 0 HD2 ARG A 131 69.547 29.082 -9.807 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.911 27.875 -11.025 1.00 25.00 H new ATOM 0 HE ARG A 131 67.674 29.465 -11.905 1.00 25.00 H new ATOM 0 HH11 ARG A 131 71.192 29.716 -11.501 1.00 25.00 H new ATOM 0 HH12 ARG A 131 71.325 30.954 -12.755 1.00 25.00 H new ATOM 0 HH21 ARG A 131 67.927 31.026 -13.460 1.00 25.00 H new ATOM 0 HH22 ARG A 131 69.527 31.674 -13.832 1.00 25.00 H new ATOM 837 N ALA A 132 65.039 26.671 -9.033 1.00 25.00 N ATOM 838 CA ALA A 132 63.749 27.326 -8.807 1.00 25.00 C ATOM 839 C ALA A 132 62.899 26.476 -7.850 1.00 25.00 C ATOM 840 O ALA A 132 62.210 26.996 -6.978 1.00 25.00 O ATOM 841 CB ALA A 132 63.017 27.531 -10.133 1.00 25.00 C ATOM 0 H ALA A 132 65.139 26.236 -9.950 1.00 25.00 H new ATOM 0 HA ALA A 132 63.920 28.304 -8.357 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.060 28.019 -9.949 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.622 28.156 -10.790 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.846 26.565 -10.607 1.00 25.00 H new ATOM 847 N LEU A 133 62.982 25.164 -8.002 1.00 25.00 N ATOM 848 CA LEU A 133 62.263 24.250 -7.117 1.00 25.00 C ATOM 849 C LEU A 133 62.763 24.402 -5.680 1.00 25.00 C ATOM 850 O LEU A 133 61.975 24.466 -4.751 1.00 25.00 O ATOM 851 CB LEU A 133 62.463 22.806 -7.577 1.00 25.00 C ATOM 852 CG LEU A 133 61.176 22.019 -7.833 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.418 22.573 -9.040 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.519 20.540 -8.065 1.00 25.00 C ATOM 0 H LEU A 133 63.536 24.706 -8.725 1.00 25.00 H new ATOM 0 HA LEU A 133 61.202 24.496 -7.154 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.054 22.812 -8.493 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.048 22.279 -6.823 1.00 25.00 H new ATOM 0 HG LEU A 133 60.533 22.117 -6.959 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.509 21.993 -9.196 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.157 23.616 -8.858 1.00 25.00 H new ATOM 0 HD13 LEU A 133 61.048 22.506 -9.927 1.00 25.00 H new ATOM 0 HD21 LEU A 133 60.603 19.978 -8.247 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.178 20.450 -8.929 1.00 25.00 H new ATOM 0 HD23 LEU A 133 62.020 20.140 -7.184 1.00 25.00 H new ATOM 866 N CYS A 134 64.073 24.493 -5.495 1.00 25.00 N ATOM 867 CA CYS A 134 64.615 24.636 -4.144 1.00 25.00 C ATOM 868 C CYS A 134 64.377 26.045 -3.592 1.00 25.00 C ATOM 869 O CYS A 134 64.333 26.239 -2.383 1.00 25.00 O ATOM 870 CB CYS A 134 66.102 24.271 -4.098 1.00 25.00 C ATOM 871 SG CYS A 134 67.242 25.548 -4.707 1.00 25.00 S ATOM 0 H CYS A 134 64.768 24.472 -6.241 1.00 25.00 H new ATOM 0 HA CYS A 134 64.081 23.935 -3.503 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.368 24.033 -3.068 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.254 23.364 -4.684 1.00 25.00 H new ATOM 0 HG CYS A 134 66.652 26.254 -5.626 1.00 25.00 H new ATOM 877 N GLU A 135 64.217 27.023 -4.477 1.00 25.00 N ATOM 878 CA GLU A 135 63.926 28.402 -4.071 1.00 25.00 C ATOM 879 C GLU A 135 62.542 28.437 -3.431 1.00 25.00 C ATOM 880 O GLU A 135 62.339 29.076 -2.403 1.00 25.00 O ATOM 881 CB GLU A 135 63.970 29.325 -5.293 1.00 25.00 C ATOM 882 CG GLU A 135 63.679 30.787 -5.029 1.00 25.00 C ATOM 883 CD GLU A 135 63.751 31.619 -6.307 1.00 25.00 C ATOM 884 OE1 GLU A 135 62.886 31.459 -7.190 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.707 32.425 -6.432 1.00 25.00 O1- ATOM 0 H GLU A 135 64.283 26.890 -5.486 1.00 25.00 H new ATOM 0 HA GLU A 135 64.671 28.747 -3.354 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.958 29.248 -5.747 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.252 28.959 -6.027 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.688 30.886 -4.586 1.00 25.00 H new ATOM 0 HG3 GLU A 135 64.393 31.174 -4.302 1.00 25.00 H new ATOM 892 N LEU A 136 61.610 27.701 -4.023 1.00 25.00 N ATOM 893 CA LEU A 136 60.245 27.613 -3.509 1.00 25.00 C ATOM 894 C LEU A 136 60.222 26.970 -2.122 1.00 25.00 C ATOM 895 O LEU A 136 59.544 27.453 -1.221 1.00 25.00 O ATOM 896 CB LEU A 136 59.399 26.785 -4.487 1.00 25.00 C ATOM 897 CG LEU A 136 57.901 26.643 -4.160 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.176 27.992 -4.247 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.269 25.646 -5.137 1.00 25.00 C ATOM 0 H LEU A 136 61.775 27.151 -4.866 1.00 25.00 H new ATOM 0 HA LEU A 136 59.834 28.618 -3.418 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.490 27.232 -5.477 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.830 25.786 -4.547 1.00 25.00 H new ATOM 0 HG LEU A 136 57.802 26.281 -3.137 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.121 27.854 -4.010 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.619 28.690 -3.536 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.272 28.392 -5.256 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.208 25.539 -4.912 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.389 26.010 -6.157 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.760 24.678 -5.037 1.00 25.00 H new ATOM 911 N GLU A 137 60.985 25.899 -1.955 1.00 25.00 N ATOM 912 CA GLU A 137 61.058 25.192 -0.670 1.00 25.00 C ATOM 913 C GLU A 137 61.742 26.039 0.407 1.00 25.00 C ATOM 914 O GLU A 137 61.353 26.019 1.570 1.00 25.00 O ATOM 915 CB GLU A 137 61.849 23.895 -0.832 1.00 25.00 C ATOM 916 CG GLU A 137 61.203 22.860 -1.739 1.00 25.00 C ATOM 917 CD GLU A 137 59.889 22.321 -1.196 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.876 21.823 -0.054 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.883 22.354 -1.938 1.00 25.00 O1- ATOM 0 H GLU A 137 61.565 25.495 -2.690 1.00 25.00 H new ATOM 0 HA GLU A 137 60.034 24.984 -0.359 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.837 24.136 -1.225 1.00 25.00 H new ATOM 0 HB3 GLU A 137 61.997 23.452 0.153 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.028 23.304 -2.719 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.896 22.031 -1.884 1.00 25.00 H new ATOM 926 N SER A 138 62.786 26.761 0.017 1.00 25.00 N ATOM 927 CA SER A 138 63.549 27.574 0.963 1.00 25.00 C ATOM 928 C SER A 138 62.809 28.861 1.326 1.00 25.00 C ATOM 929 O SER A 138 63.027 29.427 2.392 1.00 25.00 O ATOM 930 CB SER A 138 64.914 27.929 0.380 1.00 25.00 C ATOM 931 OG SER A 138 65.631 26.757 0.021 1.00 25.00 O ATOM 0 H SER A 138 63.125 26.802 -0.944 1.00 25.00 H new ATOM 0 HA SER A 138 63.677 26.981 1.868 1.00 25.00 H new ATOM 0 HB2 SER A 138 64.786 28.565 -0.496 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.487 28.502 1.109 1.00 25.00 H new ATOM 0 HG SER A 138 65.296 26.418 -0.835 1.00 25.00 H new ATOM 937 N GLY A 139 61.951 29.330 0.423 1.00 25.00 N ATOM 938 CA GLY A 139 61.175 30.539 0.667 1.00 25.00 C ATOM 939 C GLY A 139 61.985 31.825 0.576 1.00 25.00 C ATOM 940 O GLY A 139 61.530 32.886 0.999 1.00 25.00 O ATOM 0 H GLY A 139 61.777 28.891 -0.481 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.358 30.585 -0.053 1.00 25.00 H new ATOM 0 HA3 GLY A 139 60.724 30.475 1.657 1.00 25.00 H new ATOM 944 N ILE A 140 63.196 31.731 0.043 1.00 25.00 N ATOM 945 CA ILE A 140 64.109 32.875 -0.035 1.00 25.00 C ATOM 946 C ILE A 140 64.730 32.869 -1.438 1.00 25.00 C ATOM 947 O ILE A 140 65.175 31.816 -1.898 1.00 25.00 O ATOM 948 CB ILE A 140 65.259 32.753 1.029 1.00 25.00 C ATOM 949 CG1 ILE A 140 64.694 32.633 2.462 1.00 25.00 C ATOM 950 CG2 ILE A 140 66.201 33.985 0.950 1.00 25.00 C ATOM 951 CD1 ILE A 140 65.708 32.136 3.502 1.00 25.00 C ATOM 0 H ILE A 140 63.576 30.868 -0.346 1.00 25.00 H new ATOM 0 HA ILE A 140 63.560 33.796 0.162 1.00 25.00 H new ATOM 0 HB ILE A 140 65.820 31.847 0.801 1.00 25.00 H new ATOM 0 HG12 ILE A 140 64.319 33.607 2.775 1.00 25.00 H new ATOM 0 HG13 ILE A 140 63.842 31.953 2.448 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.992 33.886 1.693 1.00 25.00 H new ATOM 0 HG22 ILE A 140 66.642 34.042 -0.045 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.630 34.893 1.147 1.00 25.00 H new ATOM 0 HD11 ILE A 140 65.229 32.081 4.480 1.00 25.00 H new ATOM 0 HD12 ILE A 140 66.066 31.147 3.217 1.00 25.00 H new ATOM 0 HD13 ILE A 140 66.550 32.827 3.549 1.00 25.00 H new ATOM 963 N PRO A 141 64.764 34.025 -2.138 1.00 25.00 N ATOM 964 CA PRO A 141 65.282 34.004 -3.512 1.00 25.00 C ATOM 965 C PRO A 141 66.698 33.447 -3.701 1.00 25.00 C ATOM 966 O PRO A 141 67.660 33.851 -3.041 1.00 25.00 O ATOM 967 CB PRO A 141 65.242 35.481 -3.919 1.00 25.00 C ATOM 968 CG PRO A 141 64.169 36.054 -3.094 1.00 25.00 C ATOM 969 CD PRO A 141 64.304 35.381 -1.770 1.00 25.00 C ATOM 0 HA PRO A 141 64.680 33.325 -4.116 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.196 35.972 -3.729 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.031 35.595 -4.982 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.276 37.135 -3.001 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.189 35.868 -3.534 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.022 35.891 -1.128 1.00 25.00 H new ATOM 0 HD3 PRO A 141 63.357 35.355 -1.231 1.00 25.00 H new ATOM 977 N ALA A 142 66.814 32.545 -4.662 1.00 25.00 N ATOM 978 CA ALA A 142 68.082 31.945 -5.060 1.00 25.00 C ATOM 979 C ALA A 142 68.968 32.999 -5.721 1.00 25.00 C ATOM 980 O ALA A 142 70.183 32.857 -5.764 1.00 25.00 O ATOM 981 CB ALA A 142 67.825 30.781 -6.021 1.00 25.00 C ATOM 0 H ALA A 142 66.017 32.202 -5.198 1.00 25.00 H new ATOM 0 HA ALA A 142 68.595 31.562 -4.177 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.775 30.336 -6.316 1.00 25.00 H new ATOM 0 HB2 ALA A 142 67.210 30.029 -5.526 1.00 25.00 H new ATOM 0 HB3 ALA A 142 67.306 31.148 -6.907 1.00 25.00 H new ATOM 987 N ALA A 143 68.343 34.049 -6.239 1.00 25.00 N ATOM 988 CA ALA A 143 69.057 35.145 -6.891 1.00 25.00 C ATOM 989 C ALA A 143 70.041 35.841 -5.942 1.00 25.00 C ATOM 990 O ALA A 143 71.029 36.417 -6.379 1.00 25.00 O ATOM 991 CB ALA A 143 68.040 36.157 -7.447 1.00 25.00 C ATOM 0 H ALA A 143 67.330 34.167 -6.220 1.00 25.00 H new ATOM 0 HA ALA A 143 69.646 34.726 -7.707 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.570 36.976 -7.934 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.393 35.662 -8.171 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.435 36.551 -6.630 1.00 25.00 H new ATOM 997 N GLU A 144 69.767 35.763 -4.647 1.00 25.00 N ATOM 998 CA GLU A 144 70.622 36.391 -3.633 1.00 25.00 C ATOM 999 C GLU A 144 71.572 35.362 -3.019 1.00 25.00 C ATOM 1000 O GLU A 144 72.017 35.512 -1.884 1.00 25.00 O ATOM 1001 CB GLU A 144 69.746 37.016 -2.536 1.00 25.00 C ATOM 1002 CG GLU A 144 68.780 38.082 -3.053 1.00 25.00 C ATOM 1003 CD GLU A 144 68.054 38.811 -1.922 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.983 38.265 -0.794 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 67.564 39.935 -2.163 1.00 25.00 O1- ATOM 0 H GLU A 144 68.958 35.271 -4.267 1.00 25.00 H new ATOM 0 HA GLU A 144 71.218 37.170 -4.109 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.175 36.227 -2.047 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.391 37.460 -1.778 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.330 38.806 -3.653 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.046 37.615 -3.710 1.00 25.00 H new ATOM 1012 N SER A 145 71.825 34.279 -3.737 1.00 25.00 N ATOM 1013 CA SER A 145 72.613 33.178 -3.201 1.00 25.00 C ATOM 1014 C SER A 145 73.531 32.515 -4.219 1.00 25.00 C ATOM 1015 O SER A 145 73.529 32.850 -5.403 1.00 25.00 O ATOM 1016 CB SER A 145 71.656 32.125 -2.645 1.00 25.00 C ATOM 1017 OG SER A 145 71.086 31.351 -3.684 1.00 25.00 O ATOM 0 H SER A 145 71.497 34.138 -4.692 1.00 25.00 H new ATOM 0 HA SER A 145 73.259 33.600 -2.431 1.00 25.00 H new ATOM 0 HB2 SER A 145 72.190 31.473 -1.954 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.865 32.613 -2.076 1.00 25.00 H new ATOM 0 HG SER A 145 70.910 31.924 -4.460 1.00 25.00 H new ATOM 1023 N GLN A 146 74.283 31.530 -3.749 1.00 25.00 N ATOM 1024 CA GLN A 146 75.137 30.700 -4.590 1.00 25.00 C ATOM 1025 C GLN A 146 74.820 29.260 -4.247 1.00 25.00 C ATOM 1026 O GLN A 146 74.582 28.956 -3.091 1.00 25.00 O ATOM 1027 CB GLN A 146 76.607 31.002 -4.301 1.00 25.00 C ATOM 1028 CG GLN A 146 77.579 30.010 -4.925 1.00 25.00 C ATOM 1029 CD GLN A 146 79.015 30.379 -4.701 1.00 25.00 C ATOM 1030 OE1 GLN A 146 79.498 30.461 -3.576 1.00 25.00 O ATOM 1031 NE2 GLN A 146 79.716 30.584 -5.777 1.00 25.00 N ATOM 0 H GLN A 146 74.318 31.281 -2.761 1.00 25.00 H new ATOM 0 HA GLN A 146 74.959 30.896 -5.647 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.840 32.002 -4.667 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.759 31.014 -3.222 1.00 25.00 H new ATOM 0 HG2 GLN A 146 77.395 29.019 -4.510 1.00 25.00 H new ATOM 0 HG3 GLN A 146 77.388 29.947 -5.996 1.00 25.00 H new ATOM 0 HE21 GLN A 146 79.277 30.506 -6.694 1.00 25.00 H new ATOM 0 HE22 GLN A 146 80.705 30.823 -5.704 1.00 25.00 H new ATOM 1040 N ILE A 147 74.854 28.374 -5.230 1.00 25.00 N ATOM 1041 CA ILE A 147 74.572 26.959 -5.009 1.00 25.00 C ATOM 1042 C ILE A 147 75.749 26.143 -5.559 1.00 25.00 C ATOM 1043 O ILE A 147 76.269 26.432 -6.643 1.00 25.00 O ATOM 1044 CB ILE A 147 73.187 26.576 -5.626 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.785 25.152 -5.183 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.191 26.761 -7.163 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.403 24.684 -5.679 1.00 25.00 C ATOM 0 H ILE A 147 75.076 28.610 -6.197 1.00 25.00 H new ATOM 0 HA ILE A 147 74.484 26.733 -3.946 1.00 25.00 H new ATOM 0 HB ILE A 147 72.423 27.255 -5.247 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.539 24.450 -5.539 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.798 25.109 -4.094 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.215 26.487 -7.565 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.403 27.803 -7.404 1.00 25.00 H new ATOM 0 HG23 ILE A 147 73.957 26.123 -7.604 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.210 23.674 -5.318 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.634 25.358 -5.302 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.387 24.689 -6.769 1.00 25.00 H new ATOM 1059 N VAL A 148 76.222 25.199 -4.763 1.00 25.00 N ATOM 1060 CA VAL A 148 77.396 24.392 -5.092 1.00 25.00 C ATOM 1061 C VAL A 148 77.075 22.907 -4.906 1.00 25.00 C ATOM 1062 O VAL A 148 76.219 22.548 -4.103 1.00 25.00 O ATOM 1063 CB VAL A 148 78.658 24.786 -4.221 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.015 26.273 -4.407 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.444 24.504 -2.745 1.00 25.00 C ATOM 0 H VAL A 148 75.803 24.966 -3.863 1.00 25.00 H new ATOM 0 HA VAL A 148 77.647 24.589 -6.134 1.00 25.00 H new ATOM 0 HB VAL A 148 79.483 24.166 -4.573 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.885 26.517 -3.798 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.241 26.464 -5.456 1.00 25.00 H new ATOM 0 HG13 VAL A 148 78.172 26.891 -4.099 1.00 25.00 H new ATOM 0 HG21 VAL A 148 79.336 24.790 -2.187 1.00 25.00 H new ATOM 0 HG22 VAL A 148 77.591 25.079 -2.385 1.00 25.00 H new ATOM 0 HG23 VAL A 148 78.252 23.441 -2.602 1.00 25.00 H new ATOM 1075 N TYR A 149 77.766 22.059 -5.643 1.00 25.00 N ATOM 1076 CA TYR A 149 77.624 20.607 -5.539 1.00 25.00 C ATOM 1077 C TYR A 149 79.032 20.055 -5.498 1.00 25.00 C ATOM 1078 O TYR A 149 79.877 20.481 -6.280 1.00 25.00 O ATOM 1079 CB TYR A 149 76.889 20.061 -6.763 1.00 25.00 C ATOM 1080 CG TYR A 149 77.072 18.579 -6.986 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.722 17.642 -5.990 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.584 18.103 -8.206 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.880 16.240 -6.229 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.734 16.719 -8.444 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.375 15.804 -7.461 1.00 25.00 C ATOM 1086 OH TYR A 149 77.520 14.467 -7.721 1.00 25.00 O ATOM 0 H TYR A 149 78.450 22.355 -6.339 1.00 25.00 H new ATOM 0 HA TYR A 149 77.052 20.324 -4.655 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.825 20.272 -6.658 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.234 20.595 -7.648 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.333 17.985 -5.043 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.867 18.808 -8.974 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.619 15.525 -5.463 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.127 16.372 -9.388 1.00 25.00 H new ATOM 0 HH TYR A 149 76.924 13.954 -7.137 1.00 25.00 H new ATOM 1096 N ALA A 150 79.299 19.168 -4.543 1.00 25.00 N ATOM 1097 CA ALA A 150 80.629 18.592 -4.348 1.00 25.00 C ATOM 1098 C ALA A 150 81.697 19.705 -4.276 1.00 25.00 C ATOM 1099 O ALA A 150 82.756 19.613 -4.897 1.00 25.00 O ATOM 1100 CB ALA A 150 80.931 17.576 -5.463 1.00 25.00 C ATOM 0 H ALA A 150 78.601 18.828 -3.882 1.00 25.00 H new ATOM 0 HA ALA A 150 80.654 18.060 -3.397 1.00 25.00 H new ATOM 0 HB1 ALA A 150 81.923 17.152 -5.310 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.188 16.779 -5.440 1.00 25.00 H new ATOM 0 HB3 ALA A 150 80.896 18.077 -6.431 1.00 25.00 H new ATOM 1106 N GLU A 151 81.363 20.766 -3.541 1.00 25.00 N ATOM 1107 CA GLU A 151 82.219 21.950 -3.339 1.00 25.00 C ATOM 1108 C GLU A 151 82.586 22.746 -4.609 1.00 25.00 C ATOM 1109 O GLU A 151 83.484 23.587 -4.576 1.00 25.00 O ATOM 1110 CB GLU A 151 83.493 21.573 -2.564 1.00 25.00 C ATOM 1111 CG GLU A 151 83.209 20.904 -1.225 1.00 25.00 C ATOM 1112 CD GLU A 151 84.470 20.727 -0.395 1.00 25.00 C ATOM 1113 OE1 GLU A 151 85.375 19.974 -0.824 1.00 25.00 O ATOM 1114 OE2 GLU A 151 84.561 21.347 0.683 1.00 25.00 O1- ATOM 0 H GLU A 151 80.469 20.834 -3.055 1.00 25.00 H new ATOM 0 HA GLU A 151 81.598 22.630 -2.756 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.097 20.903 -3.176 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.086 22.472 -2.395 1.00 25.00 H new ATOM 0 HG2 GLU A 151 82.489 21.503 -0.667 1.00 25.00 H new ATOM 0 HG3 GLU A 151 82.749 19.931 -1.397 1.00 25.00 H new ATOM 1121 N ARG A 152 81.870 22.525 -5.705 1.00 25.00 N ATOM 1122 CA ARG A 152 82.104 23.274 -6.953 1.00 25.00 C ATOM 1123 C ARG A 152 80.793 23.920 -7.400 1.00 25.00 C ATOM 1124 O ARG A 152 79.725 23.362 -7.181 1.00 25.00 O ATOM 1125 CB ARG A 152 82.646 22.326 -8.025 1.00 25.00 C ATOM 1126 CG ARG A 152 84.148 22.089 -7.892 1.00 25.00 C ATOM 1127 CD ARG A 152 84.554 20.702 -8.373 1.00 25.00 C ATOM 1128 NE ARG A 152 84.264 19.681 -7.351 1.00 25.00 N ATOM 1129 CZ ARG A 152 84.557 18.390 -7.443 1.00 25.00 C ATOM 1130 NH1 ARG A 152 85.148 17.871 -8.491 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 84.257 17.609 -6.443 1.00 25.00 N ATOM 0 H ARG A 152 81.121 21.835 -5.764 1.00 25.00 H new ATOM 0 HA ARG A 152 82.842 24.059 -6.790 1.00 25.00 H new ATOM 0 HB2 ARG A 152 82.124 21.372 -7.959 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.433 22.738 -9.011 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.686 22.843 -8.466 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.443 22.212 -6.850 1.00 25.00 H new ATOM 0 HD2 ARG A 152 84.021 20.462 -9.293 1.00 25.00 H new ATOM 0 HD3 ARG A 152 85.618 20.693 -8.610 1.00 25.00 H new ATOM 0 HE ARG A 152 83.798 19.993 -6.499 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.402 18.466 -9.280 1.00 25.00 H new ATOM 0 HH12 ARG A 152 85.354 16.872 -8.518 1.00 25.00 H new ATOM 0 HH21 ARG A 152 83.807 17.994 -5.613 1.00 25.00 H new ATOM 0 HH22 ARG A 152 84.473 16.613 -6.491 1.00 25.00 H new ATOM 1145 N PRO A 153 80.844 25.146 -7.945 1.00 25.00 N ATOM 1146 CA PRO A 153 79.560 25.795 -8.224 1.00 25.00 C ATOM 1147 C PRO A 153 78.800 25.229 -9.415 1.00 25.00 C ATOM 1148 O PRO A 153 79.387 24.782 -10.398 1.00 25.00 O ATOM 1149 CB PRO A 153 79.966 27.247 -8.475 1.00 25.00 C ATOM 1150 CG PRO A 153 81.324 27.145 -9.057 1.00 25.00 C ATOM 1151 CD PRO A 153 81.977 26.035 -8.270 1.00 25.00 C ATOM 0 HA PRO A 153 78.861 25.648 -7.401 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.275 27.742 -9.158 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.970 27.825 -7.551 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.286 26.911 -10.121 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.873 28.082 -8.956 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.739 25.520 -8.855 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.465 26.411 -7.371 1.00 25.00 H new ATOM 1159 N LEU A 154 77.482 25.283 -9.328 1.00 25.00 N ATOM 1160 CA LEU A 154 76.602 24.812 -10.394 1.00 25.00 C ATOM 1161 C LEU A 154 76.250 26.006 -11.284 1.00 0.00 C ATOM 1162 O LEU A 154 75.128 26.497 -11.275 1.00 25.00 O ATOM 1163 CB LEU A 154 75.330 24.211 -9.792 1.00 25.00 C ATOM 1164 CG LEU A 154 75.509 22.948 -8.935 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.588 22.997 -7.729 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.226 21.712 -9.757 1.00 25.00 C ATOM 0 H LEU A 154 76.987 25.654 -8.517 1.00 25.00 H new ATOM 0 HA LEU A 154 77.100 24.041 -10.982 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.849 24.974 -9.180 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.645 23.977 -10.606 1.00 25.00 H new ATOM 0 HG LEU A 154 76.541 22.907 -8.587 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.725 22.097 -7.130 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.825 23.873 -7.126 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.553 23.056 -8.064 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.357 20.825 -9.137 1.00 25.00 H new ATOM 0 HD22 LEU A 154 74.202 21.748 -10.127 1.00 25.00 H new ATOM 0 HD23 LEU A 154 75.915 21.670 -10.600 1.00 25.00 H new ATOM 1178 N THR A 155 77.248 26.515 -11.993 1.00 25.00 N ATOM 1179 CA THR A 155 77.088 27.722 -12.804 1.00 25.00 C ATOM 1180 C THR A 155 76.253 27.496 -14.065 1.00 25.00 C ATOM 1181 O THR A 155 75.555 28.396 -14.533 1.00 25.00 O ATOM 1182 CB THR A 155 78.460 28.238 -13.267 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.237 27.129 -13.746 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.230 28.866 -12.115 1.00 25.00 C ATOM 0 H THR A 155 78.184 26.111 -12.025 1.00 25.00 H new ATOM 0 HA THR A 155 76.576 28.438 -12.162 1.00 25.00 H new ATOM 0 HB THR A 155 78.294 28.984 -14.045 1.00 25.00 H new ATOM 0 HG1 THR A 155 80.114 27.449 -14.045 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.196 29.221 -12.474 1.00 25.00 H new ATOM 0 HG22 THR A 155 78.662 29.704 -11.712 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.385 28.123 -11.333 1.00 25.00 H new ATOM 1192 N ASP A 156 76.335 26.304 -14.633 1.00 25.00 N ATOM 1193 CA ASP A 156 75.663 26.018 -15.887 1.00 25.00 C ATOM 1194 C ASP A 156 74.229 25.592 -15.634 1.00 25.00 C ATOM 1195 O ASP A 156 73.932 24.410 -15.514 1.00 25.00 O ATOM 1196 CB ASP A 156 76.388 24.912 -16.655 1.00 25.00 C ATOM 1197 CG ASP A 156 77.798 25.298 -17.024 1.00 25.00 C ATOM 1198 OD1 ASP A 156 77.974 26.206 -17.856 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.737 24.687 -16.467 1.00 25.00 O1- ATOM 0 H ASP A 156 76.860 25.520 -14.245 1.00 25.00 H new ATOM 0 HA ASP A 156 75.672 26.930 -16.484 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.409 24.006 -16.049 1.00 25.00 H new ATOM 0 HB3 ASP A 156 75.830 24.676 -17.561 1.00 25.00 H new ATOM 1204 N ASN A 157 73.324 26.558 -15.579 1.00 25.00 N ATOM 1205 CA ASN A 157 71.907 26.269 -15.362 1.00 25.00 C ATOM 1206 C ASN A 157 71.314 25.520 -16.557 1.00 25.00 C ATOM 1207 O ASN A 157 70.251 24.913 -16.450 1.00 25.00 O ATOM 1208 CB ASN A 157 71.125 27.564 -15.102 1.00 25.00 C ATOM 1209 CG ASN A 157 71.078 28.463 -16.306 1.00 25.00 C ATOM 1210 OD1 ASN A 157 72.044 29.125 -16.620 1.00 25.00 O ATOM 1211 ND2 ASN A 157 69.961 28.497 -16.980 1.00 25.00 N ATOM 0 H ASN A 157 73.542 27.549 -15.681 1.00 25.00 H new ATOM 0 HA ASN A 157 71.824 25.631 -14.482 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.108 27.315 -14.799 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.583 28.100 -14.271 1.00 25.00 H new ATOM 0 HD21 ASN A 157 69.879 29.095 -17.802 1.00 25.00 H new ATOM 0 HD22 ASN A 157 69.170 27.925 -16.685 1.00 25.00 H new ATOM 1218 N HIS A 158 72.024 25.558 -17.678 1.00 25.00 N ATOM 1219 CA HIS A 158 71.620 24.866 -18.897 1.00 25.00 C ATOM 1220 C HIS A 158 71.789 23.340 -18.770 1.00 25.00 C ATOM 1221 O HIS A 158 71.133 22.578 -19.470 1.00 25.00 O ATOM 1222 CB HIS A 158 72.487 25.381 -20.053 1.00 25.00 C ATOM 1223 CG HIS A 158 72.173 24.747 -21.370 1.00 25.00 C ATOM 1224 ND1 HIS A 158 70.990 24.892 -22.044 1.00 25.00 N ATOM 1225 CD2 HIS A 158 72.926 23.933 -22.158 1.00 25.00 C ATOM 1226 CE1 HIS A 158 71.059 24.189 -23.168 1.00 25.00 C ATOM 1227 NE2 HIS A 158 72.224 23.588 -23.294 1.00 25.00 N ATOM 0 H HIS A 158 72.900 26.072 -17.768 1.00 25.00 H new ATOM 0 HA HIS A 158 70.564 25.066 -19.079 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.358 26.460 -20.139 1.00 25.00 H new ATOM 0 HB3 HIS A 158 73.536 25.204 -19.816 1.00 25.00 H new ATOM 0 HD2 HIS A 158 73.929 23.604 -21.927 1.00 25.00 H new ATOM 0 HE1 HIS A 158 70.259 24.119 -23.890 1.00 25.00 H new ATOM 0 HE2 HIS A 158 72.538 22.997 -24.063 1.00 25.00 H new ATOM 1235 N ARG A 159 72.670 22.892 -17.884 1.00 25.00 N ATOM 1236 CA ARG A 159 72.901 21.450 -17.733 1.00 25.00 C ATOM 1237 C ARG A 159 71.757 20.809 -16.976 1.00 25.00 C ATOM 1238 O ARG A 159 71.176 21.418 -16.083 1.00 25.00 O ATOM 1239 CB ARG A 159 74.189 21.184 -16.966 1.00 25.00 C ATOM 1240 CG ARG A 159 75.439 21.366 -17.800 1.00 25.00 C ATOM 1241 CD ARG A 159 76.655 20.899 -17.016 1.00 25.00 C ATOM 1242 NE ARG A 159 77.896 21.072 -17.788 1.00 25.00 N ATOM 1243 CZ ARG A 159 79.079 20.589 -17.446 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.252 19.883 -16.356 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 80.105 20.809 -18.220 1.00 25.00 N ATOM 0 H ARG A 159 73.227 23.485 -17.270 1.00 25.00 H new ATOM 0 HA ARG A 159 72.975 21.023 -18.733 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.235 21.853 -16.107 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.167 20.166 -16.577 1.00 25.00 H new ATOM 0 HG2 ARG A 159 75.354 20.800 -18.728 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.554 22.414 -18.076 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.725 21.459 -16.084 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.535 19.849 -16.749 1.00 25.00 H new ATOM 0 HE ARG A 159 77.839 21.606 -18.655 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.461 19.691 -15.742 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.178 19.525 -16.122 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.990 21.348 -19.078 1.00 25.00 H new ATOM 0 HH22 ARG A 159 81.022 20.442 -17.967 1.00 25.00 H new ATOM 1259 N SER A 160 71.503 19.547 -17.270 1.00 25.00 N ATOM 1260 CA SER A 160 70.579 18.762 -16.475 1.00 25.00 C ATOM 1261 C SER A 160 71.340 18.263 -15.260 1.00 25.00 C ATOM 1262 O SER A 160 72.569 18.286 -15.239 1.00 25.00 O ATOM 1263 CB SER A 160 70.038 17.577 -17.274 1.00 25.00 C ATOM 1264 OG SER A 160 71.074 16.681 -17.647 1.00 25.00 O ATOM 0 H SER A 160 71.923 19.045 -18.052 1.00 25.00 H new ATOM 0 HA SER A 160 69.726 19.374 -16.181 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.294 17.046 -16.680 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.532 17.941 -18.168 1.00 25.00 H new ATOM 0 HG SER A 160 70.694 15.934 -18.155 1.00 25.00 H new ATOM 1270 N LEU A 161 70.625 17.793 -14.254 1.00 25.00 N ATOM 1271 CA LEU A 161 71.258 17.281 -13.037 1.00 25.00 C ATOM 1272 C LEU A 161 72.096 16.029 -13.354 1.00 25.00 C ATOM 1273 O LEU A 161 73.201 15.838 -12.820 1.00 25.00 O ATOM 1274 CB LEU A 161 70.167 16.969 -12.006 1.00 25.00 C ATOM 1275 CG LEU A 161 69.288 18.183 -11.641 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.042 17.726 -10.910 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.039 19.200 -10.787 1.00 25.00 C ATOM 0 H LEU A 161 69.606 17.752 -14.249 1.00 25.00 H new ATOM 0 HA LEU A 161 71.933 18.032 -12.627 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.530 16.175 -12.395 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.636 16.586 -11.099 1.00 25.00 H new ATOM 0 HG LEU A 161 69.010 18.672 -12.575 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.430 18.592 -10.658 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.472 17.052 -11.549 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.327 17.205 -9.996 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.381 20.037 -10.555 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.365 18.727 -9.861 1.00 25.00 H new ATOM 0 HD23 LEU A 161 70.909 19.564 -11.335 1.00 25.00 H new ATOM 1289 N ALA A 162 71.618 15.223 -14.293 1.00 25.00 N ATOM 1290 CA ALA A 162 72.348 14.036 -14.723 1.00 25.00 C ATOM 1291 C ALA A 162 73.671 14.425 -15.387 1.00 25.00 C ATOM 1292 O ALA A 162 74.656 13.708 -15.286 1.00 25.00 O ATOM 1293 CB ALA A 162 71.488 13.211 -15.688 1.00 25.00 C ATOM 0 H ALA A 162 70.729 15.369 -14.771 1.00 25.00 H new ATOM 0 HA ALA A 162 72.573 13.430 -13.845 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.042 12.327 -16.004 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.570 12.905 -15.186 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.240 13.815 -16.561 1.00 25.00 H new ATOM 1299 N SER A 163 73.703 15.591 -16.020 1.00 25.00 N ATOM 1300 CA SER A 163 74.930 16.093 -16.653 1.00 25.00 C ATOM 1301 C SER A 163 75.961 16.527 -15.617 1.00 25.00 C ATOM 1302 O SER A 163 77.143 16.671 -15.926 1.00 25.00 O ATOM 1303 CB SER A 163 74.618 17.272 -17.579 1.00 25.00 C ATOM 1304 OG SER A 163 73.698 16.905 -18.589 1.00 25.00 O ATOM 0 H SER A 163 72.898 16.211 -16.112 1.00 25.00 H new ATOM 0 HA SER A 163 75.348 15.272 -17.235 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.210 18.097 -16.995 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.540 17.631 -18.037 1.00 25.00 H new ATOM 0 HG SER A 163 72.799 16.840 -18.205 1.00 25.00 H new ATOM 1310 N TYR A 164 75.527 16.724 -14.381 1.00 25.00 N ATOM 1311 CA TYR A 164 76.446 17.032 -13.290 1.00 25.00 C ATOM 1312 C TYR A 164 76.822 15.756 -12.546 1.00 25.00 C ATOM 1313 O TYR A 164 77.697 15.759 -11.691 1.00 25.00 O ATOM 1314 CB TYR A 164 75.812 18.008 -12.304 1.00 25.00 C ATOM 1315 CG TYR A 164 76.014 19.450 -12.679 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.281 20.044 -12.539 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.950 20.232 -13.166 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.489 21.406 -12.871 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.149 21.607 -13.489 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.428 22.174 -13.333 1.00 25.00 C ATOM 1321 OH TYR A 164 76.689 23.487 -13.620 1.00 25.00 O ATOM 0 H TYR A 164 74.546 16.677 -14.106 1.00 25.00 H new ATOM 0 HA TYR A 164 77.337 17.488 -13.722 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.743 17.804 -12.238 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.231 17.836 -11.313 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.108 19.453 -12.173 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.975 19.787 -13.296 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.470 21.845 -12.765 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.327 22.207 -13.850 1.00 25.00 H new ATOM 0 HH TYR A 164 77.621 23.580 -13.909 1.00 25.00 H new ATOM 1331 N GLY A 165 76.131 14.669 -12.856 1.00 25.00 N ATOM 1332 CA GLY A 165 76.345 13.414 -12.160 1.00 25.00 C ATOM 1333 C GLY A 165 75.618 13.388 -10.828 1.00 25.00 C ATOM 1334 O GLY A 165 75.976 12.610 -9.939 1.00 25.00 O ATOM 0 H GLY A 165 75.418 14.633 -13.585 1.00 25.00 H new ATOM 0 HA2 GLY A 165 75.999 12.588 -12.781 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.412 13.264 -11.997 1.00 25.00 H new ATOM 1338 N LEU A 166 74.595 14.227 -10.688 1.00 25.00 N ATOM 1339 CA LEU A 166 73.849 14.313 -9.437 1.00 25.00 C ATOM 1340 C LEU A 166 73.001 13.063 -9.214 1.00 25.00 C ATOM 1341 O LEU A 166 71.839 12.991 -9.595 1.00 25.00 O ATOM 1342 CB LEU A 166 72.982 15.573 -9.426 1.00 25.00 C ATOM 1343 CG LEU A 166 73.756 16.783 -8.890 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.229 18.093 -9.410 1.00 25.00 C ATOM 1345 CD2 LEU A 166 73.690 16.776 -7.371 1.00 25.00 C ATOM 0 H LEU A 166 74.265 14.854 -11.422 1.00 25.00 H new ATOM 0 HA LEU A 166 74.562 14.376 -8.615 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.631 15.783 -10.436 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.099 15.403 -8.810 1.00 25.00 H new ATOM 0 HG LEU A 166 74.785 16.695 -9.238 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.817 18.912 -8.996 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.301 18.108 -10.497 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.186 18.209 -9.114 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.238 17.633 -6.979 1.00 25.00 H new ATOM 0 HD22 LEU A 166 72.649 16.834 -7.052 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.136 15.856 -6.992 1.00 25.00 H new ATOM 1357 N LYS A 167 73.630 12.064 -8.614 1.00 25.00 N ATOM 1358 CA LYS A 167 72.975 10.796 -8.274 1.00 25.00 C ATOM 1359 C LYS A 167 71.952 10.981 -7.174 1.00 25.00 C ATOM 1360 O LYS A 167 72.051 11.884 -6.365 1.00 25.00 O ATOM 1361 CB LYS A 167 74.004 9.774 -7.775 1.00 25.00 C ATOM 1362 CG LYS A 167 75.088 9.423 -8.791 1.00 25.00 C ATOM 1363 CD LYS A 167 74.490 8.858 -10.067 1.00 25.00 C ATOM 1364 CE LYS A 167 75.580 8.451 -11.043 1.00 25.00 C ATOM 1365 NZ LYS A 167 74.942 7.975 -12.309 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.613 12.103 -8.345 1.00 25.00 H new ATOM 0 HA LYS A 167 72.487 10.442 -9.182 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.479 10.165 -6.875 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.482 8.861 -7.489 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.672 10.313 -9.024 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.774 8.696 -8.356 1.00 25.00 H new ATOM 0 HD2 LYS A 167 73.867 7.995 -9.830 1.00 25.00 H new ATOM 0 HD3 LYS A 167 73.841 9.602 -10.530 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.238 9.296 -11.247 1.00 25.00 H new ATOM 0 HE3 LYS A 167 76.197 7.663 -10.612 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 75.680 7.693 -12.985 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 74.331 7.159 -12.104 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 74.371 8.741 -12.719 1.00 25.00 H new ATOM 1379 N ASP A 168 70.996 10.074 -7.118 1.00 25.00 N ATOM 1380 CA ASP A 168 70.021 10.053 -6.046 1.00 25.00 C ATOM 1381 C ASP A 168 70.780 9.885 -4.731 1.00 25.00 C ATOM 1382 O ASP A 168 71.670 9.047 -4.613 1.00 25.00 O ATOM 1383 CB ASP A 168 69.000 8.917 -6.255 1.00 25.00 C ATOM 1384 CG ASP A 168 69.652 7.576 -6.631 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.273 7.478 -7.724 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.432 6.597 -5.889 1.00 25.00 O1- ATOM 0 H ASP A 168 70.874 9.335 -7.810 1.00 25.00 H new ATOM 0 HA ASP A 168 69.454 10.984 -6.030 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.419 8.787 -5.342 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.301 9.206 -7.040 1.00 25.00 H new ATOM 1391 N GLY A 169 70.470 10.749 -3.777 1.00 25.00 N ATOM 1392 CA GLY A 169 71.152 10.758 -2.493 1.00 25.00 C ATOM 1393 C GLY A 169 72.212 11.836 -2.377 1.00 25.00 C ATOM 1394 O GLY A 169 72.644 12.152 -1.270 1.00 25.00 O ATOM 0 H GLY A 169 69.744 11.459 -3.870 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.416 10.897 -1.701 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.616 9.785 -2.330 1.00 25.00 H new ATOM 1398 N ASP A 170 72.622 12.429 -3.489 1.00 25.00 N ATOM 1399 CA ASP A 170 73.622 13.502 -3.449 1.00 25.00 C ATOM 1400 C ASP A 170 73.065 14.742 -2.759 1.00 25.00 C ATOM 1401 O ASP A 170 71.848 14.985 -2.740 1.00 25.00 O ATOM 1402 CB ASP A 170 74.097 13.902 -4.848 1.00 25.00 C ATOM 1403 CG ASP A 170 75.188 12.986 -5.388 1.00 25.00 C ATOM 1404 OD1 ASP A 170 75.834 12.278 -4.595 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.489 13.090 -6.596 1.00 25.00 O1- ATOM 0 H ASP A 170 72.286 12.194 -4.423 1.00 25.00 H new ATOM 0 HA ASP A 170 74.469 13.107 -2.887 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.248 13.890 -5.532 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.470 14.926 -4.821 1.00 25.00 H new ATOM 1410 N VAL A 171 73.965 15.528 -2.193 1.00 25.00 N ATOM 1411 CA VAL A 171 73.603 16.735 -1.455 1.00 25.00 C ATOM 1412 C VAL A 171 74.174 17.964 -2.161 1.00 25.00 C ATOM 1413 O VAL A 171 75.365 17.980 -2.514 1.00 25.00 O ATOM 1414 CB VAL A 171 74.168 16.686 0.002 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.611 17.848 0.844 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.824 15.337 0.676 1.00 25.00 C ATOM 0 H VAL A 171 74.969 15.351 -2.230 1.00 25.00 H new ATOM 0 HA VAL A 171 72.515 16.794 -1.416 1.00 25.00 H new ATOM 0 HB VAL A 171 75.252 16.784 -0.056 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.018 17.793 1.854 1.00 25.00 H new ATOM 0 HG12 VAL A 171 73.896 18.796 0.389 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.524 17.778 0.887 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.226 15.323 1.689 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.742 15.215 0.714 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.262 14.521 0.101 1.00 25.00 H new ATOM 1426 N VAL A 172 73.365 19.004 -2.337 1.00 25.00 N ATOM 1427 CA VAL A 172 73.859 20.273 -2.861 1.00 25.00 C ATOM 1428 C VAL A 172 73.796 21.269 -1.717 1.00 25.00 C ATOM 1429 O VAL A 172 73.036 21.091 -0.776 1.00 25.00 O ATOM 1430 CB VAL A 172 73.059 20.788 -4.101 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.132 19.761 -5.241 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.610 21.068 -3.750 1.00 25.00 C ATOM 0 H VAL A 172 72.367 18.994 -2.125 1.00 25.00 H new ATOM 0 HA VAL A 172 74.878 20.141 -3.226 1.00 25.00 H new ATOM 0 HB VAL A 172 73.514 21.724 -4.426 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.571 20.130 -6.100 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.173 19.607 -5.526 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.704 18.816 -4.907 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.083 21.424 -4.635 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.139 20.153 -3.392 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.565 21.828 -2.970 1.00 25.00 H new ATOM 1442 N ILE A 173 74.632 22.286 -1.775 1.00 25.00 N ATOM 1443 CA ILE A 173 74.755 23.255 -0.698 1.00 25.00 C ATOM 1444 C ILE A 173 74.456 24.635 -1.266 1.00 25.00 C ATOM 1445 O ILE A 173 75.090 25.070 -2.221 1.00 25.00 O ATOM 1446 CB ILE A 173 76.190 23.204 -0.084 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.368 21.883 0.705 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.464 24.442 0.796 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.817 21.563 1.106 1.00 25.00 C ATOM 0 H ILE A 173 75.246 22.466 -2.569 1.00 25.00 H new ATOM 0 HA ILE A 173 74.049 23.025 0.100 1.00 25.00 H new ATOM 0 HB ILE A 173 76.925 23.225 -0.889 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.758 21.930 1.607 1.00 25.00 H new ATOM 0 HG13 ILE A 173 75.983 21.061 0.102 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.470 24.379 1.210 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.376 25.345 0.191 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.739 24.478 1.609 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.843 20.621 1.654 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.432 21.479 0.210 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.204 22.362 1.739 1.00 25.00 H new ATOM 1461 N LEU A 174 73.483 25.310 -0.687 1.00 25.00 N ATOM 1462 CA LEU A 174 73.093 26.646 -1.103 1.00 25.00 C ATOM 1463 C LEU A 174 73.524 27.604 -0.001 1.00 25.00 C ATOM 1464 O LEU A 174 73.227 27.396 1.171 1.00 25.00 O ATOM 1465 CB LEU A 174 71.580 26.700 -1.353 1.00 25.00 C ATOM 1466 CG LEU A 174 71.038 28.000 -1.974 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.850 27.689 -2.880 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.617 28.993 -0.910 1.00 25.00 C ATOM 0 H LEU A 174 72.935 24.945 0.092 1.00 25.00 H new ATOM 0 HA LEU A 174 73.573 26.928 -2.040 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.311 25.870 -2.007 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.070 26.536 -0.404 1.00 25.00 H new ATOM 0 HG LEU A 174 71.842 28.448 -2.558 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.472 28.614 -3.315 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.166 27.016 -3.677 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.061 27.215 -2.296 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.240 29.898 -1.386 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.833 28.554 -0.292 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.475 29.242 -0.285 1.00 25.00 H new ATOM 1480 N ARG A 175 74.258 28.638 -0.371 1.00 25.00 N ATOM 1481 CA ARG A 175 74.760 29.607 0.600 1.00 25.00 C ATOM 1482 C ARG A 175 74.006 30.909 0.448 1.00 25.00 C ATOM 1483 O ARG A 175 74.227 31.671 -0.489 1.00 25.00 O ATOM 1484 CB ARG A 175 76.260 29.849 0.396 1.00 25.00 C ATOM 1485 CG ARG A 175 77.119 28.607 0.603 1.00 25.00 C ATOM 1486 CD ARG A 175 78.598 28.950 0.539 1.00 25.00 C ATOM 1487 NE ARG A 175 79.013 29.784 1.678 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.216 30.325 1.843 1.00 25.00 C ATOM 1489 NH1 ARG A 175 81.184 30.166 0.972 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.447 31.050 2.905 1.00 25.00 N ATOM 0 H ARG A 175 74.523 28.833 -1.337 1.00 25.00 H new ATOM 0 HA ARG A 175 74.608 29.210 1.604 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.423 30.228 -0.613 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.590 30.626 1.085 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.888 28.158 1.569 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.881 27.865 -0.159 1.00 25.00 H new ATOM 0 HD2 ARG A 175 79.184 28.031 0.528 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.810 29.475 -0.393 1.00 25.00 H new ATOM 0 HE ARG A 175 78.318 29.962 2.403 1.00 25.00 H new ATOM 0 HH11 ARG A 175 81.027 29.610 0.131 1.00 25.00 H new ATOM 0 HH12 ARG A 175 82.093 30.598 1.136 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.709 31.195 3.594 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.365 31.471 3.045 1.00 25.00 H new ATOM 1504 N GLN A 176 73.133 31.150 1.418 1.00 25.00 N ATOM 1505 CA GLN A 176 72.298 32.352 1.504 1.00 25.00 C ATOM 1506 C GLN A 176 72.743 33.309 2.617 1.00 25.00 C ATOM 1507 O GLN A 176 72.499 34.492 2.632 1.00 25.00 O ATOM 1508 CB GLN A 176 70.837 31.914 1.698 1.00 25.00 C ATOM 1509 CG GLN A 176 69.879 32.669 0.753 1.00 25.00 C ATOM 1510 CD GLN A 176 68.707 31.780 0.404 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.224 31.006 1.179 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.229 31.887 -0.824 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.355 32.789 3.508 1.00 25.00 O ATOM 0 H GLN A 176 72.979 30.501 2.189 1.00 25.00 H new ATOM 0 HA GLN A 176 72.404 32.914 0.576 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.753 30.842 1.519 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.540 32.089 2.732 1.00 25.00 H new ATOM 0 HG2 GLN A 176 69.526 33.583 1.231 1.00 25.00 H new ATOM 0 HG3 GLN A 176 70.406 32.966 -0.154 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.647 32.549 -1.478 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.443 31.307 -1.117 1.00 25.00 H new