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 -169:sc= 1.63 USER MOD Set 1.2: A 163 SER OG : rot 78:sc= 0.957 USER MOD Set 2.1: A 157 ASN : amide:sc= 0.0252 K(o=0.029,f=-0.91) USER MOD Set 2.2: A 158 HIS : no HE2:sc= 0.00403 K(o=0.029,f=-0.56) USER MOD Set 3.1: A 107 CYS SG : rot -53:sc= 0.41 USER MOD Set 3.2: A 138 SER OG : rot 156:sc= 0.63 USER MOD Single : A 100 HIS : no HE2:sc= 0.762 K(o=0.76,f=-2.8!) USER MOD Single : A 101 MET CE :methyl -146:sc= -0.25 (180deg=-1.25) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot -14:sc= 1.27 USER MOD Single : A 113 SER OG : rot -120:sc= -0.238 USER MOD Single : A 116 THR OG1 : rot 30:sc= 0.884 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 128 HIS : no HD1:sc= -0.0154 X(o=-0.015,f=-0.21) USER MOD Single : A 129 ASN : amide:sc= -0.0124 K(o=-0.012,f=-0.54) USER MOD Single : A 134 CYS SG : rot -23:sc= 0.35 USER MOD Single : A 145 SER OG : rot 92:sc= 0.885 USER MOD Single : A 146 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.27) USER MOD Single : A 149 TYR OH : rot 149:sc= 0.597 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 80:sc= 0.228 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.32 K(o=0.32,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 61.760 8.594 -10.127 1.00 25.00 N ATOM 307 CA HIS A 100 62.361 9.916 -10.082 1.00 25.00 C ATOM 308 C HIS A 100 63.609 9.754 -9.223 1.00 25.00 C ATOM 309 O HIS A 100 63.781 8.713 -8.585 1.00 25.00 O ATOM 310 CB HIS A 100 61.387 10.914 -9.445 1.00 25.00 C ATOM 311 CG HIS A 100 61.047 10.593 -8.022 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.770 11.023 -6.939 1.00 25.00 N ATOM 313 CD2 HIS A 100 60.034 9.850 -7.498 1.00 25.00 C ATOM 314 CE1 HIS A 100 61.199 10.546 -5.840 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.140 9.815 -6.121 1.00 25.00 N ATOM 0 HA HIS A 100 62.602 10.298 -11.074 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.822 11.913 -9.490 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.469 10.939 -10.033 1.00 25.00 H new ATOM 0 HD1 HIS A 100 62.604 11.609 -6.972 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.262 9.361 -8.073 1.00 25.00 H new ATOM 0 HE1 HIS A 100 61.558 10.734 -4.839 1.00 25.00 H new ATOM 323 N MET A 101 64.455 10.769 -9.185 1.00 25.00 N ATOM 324 CA MET A 101 65.619 10.780 -8.306 1.00 25.00 C ATOM 325 C MET A 101 65.249 11.602 -7.084 1.00 25.00 C ATOM 326 O MET A 101 64.330 12.430 -7.139 1.00 25.00 O ATOM 327 CB MET A 101 66.825 11.432 -8.985 1.00 25.00 C ATOM 328 CG MET A 101 67.204 10.811 -10.315 1.00 25.00 C ATOM 329 SD MET A 101 68.862 11.322 -10.838 1.00 25.00 S ATOM 330 CE MET A 101 68.711 13.147 -10.914 1.00 25.00 C ATOM 0 H MET A 101 64.358 11.607 -9.759 1.00 25.00 H new ATOM 0 HA MET A 101 65.889 9.756 -8.048 1.00 25.00 H new ATOM 0 HB2 MET A 101 66.612 12.490 -9.139 1.00 25.00 H new ATOM 0 HB3 MET A 101 67.681 11.373 -8.313 1.00 25.00 H new ATOM 0 HG2 MET A 101 67.165 9.725 -10.235 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.477 11.101 -11.073 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.333 13.530 -11.723 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.671 13.419 -11.096 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.039 13.579 -9.969 1.00 25.00 H new ATOM 340 N LEU A 102 65.981 11.413 -5.999 1.00 25.00 N ATOM 341 CA LEU A 102 65.777 12.190 -4.784 1.00 25.00 C ATOM 342 C LEU A 102 67.126 12.775 -4.396 1.00 25.00 C ATOM 343 O LEU A 102 68.105 12.041 -4.278 1.00 25.00 O ATOM 344 CB LEU A 102 65.233 11.292 -3.667 1.00 25.00 C ATOM 345 CG LEU A 102 64.790 12.010 -2.382 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.487 12.787 -2.599 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.590 10.987 -1.267 1.00 25.00 C ATOM 0 H LEU A 102 66.729 10.722 -5.933 1.00 25.00 H new ATOM 0 HA LEU A 102 65.049 12.985 -4.946 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.383 10.733 -4.059 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.001 10.564 -3.407 1.00 25.00 H new ATOM 0 HG LEU A 102 65.570 12.719 -2.104 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.201 13.283 -1.672 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.634 13.533 -3.380 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.698 12.098 -2.900 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.276 11.498 -0.357 1.00 25.00 H new ATOM 0 HD22 LEU A 102 63.824 10.270 -1.564 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.527 10.461 -1.083 1.00 25.00 H new ATOM 359 N LEU A 103 67.187 14.087 -4.244 1.00 25.00 N ATOM 360 CA LEU A 103 68.434 14.777 -3.907 1.00 25.00 C ATOM 361 C LEU A 103 68.230 15.518 -2.609 1.00 25.00 C ATOM 362 O LEU A 103 67.112 15.902 -2.293 1.00 25.00 O ATOM 363 CB LEU A 103 68.805 15.787 -4.998 1.00 25.00 C ATOM 364 CG LEU A 103 69.068 15.223 -6.402 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.353 16.375 -7.354 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.237 14.262 -6.405 1.00 25.00 C ATOM 0 H LEU A 103 66.383 14.706 -4.348 1.00 25.00 H new ATOM 0 HA LEU A 103 69.237 14.045 -3.819 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.001 16.519 -5.071 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.697 16.324 -4.675 1.00 25.00 H new ATOM 0 HG LEU A 103 68.183 14.674 -6.724 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.541 15.983 -8.354 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.493 17.045 -7.383 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.229 16.924 -7.009 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.394 13.883 -7.415 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.135 14.780 -6.068 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.025 13.430 -5.734 1.00 25.00 H new ATOM 378 N THR A 104 69.306 15.751 -1.877 1.00 25.00 N ATOM 379 CA THR A 104 69.227 16.497 -0.625 1.00 25.00 C ATOM 380 C THR A 104 69.813 17.881 -0.850 1.00 25.00 C ATOM 381 O THR A 104 70.857 18.015 -1.475 1.00 25.00 O ATOM 382 CB THR A 104 70.019 15.781 0.485 1.00 25.00 C ATOM 383 OG1 THR A 104 69.651 14.400 0.508 1.00 25.00 O ATOM 384 CG2 THR A 104 69.725 16.373 1.853 1.00 25.00 C ATOM 0 H THR A 104 70.244 15.437 -2.124 1.00 25.00 H new ATOM 0 HA THR A 104 68.185 16.568 -0.314 1.00 25.00 H new ATOM 0 HB THR A 104 71.080 15.904 0.270 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.154 13.939 1.212 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.302 15.842 2.611 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.000 17.428 1.860 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.662 16.274 2.071 1.00 25.00 H new ATOM 392 N VAL A 105 69.152 18.912 -0.353 1.00 25.00 N ATOM 393 CA VAL A 105 69.651 20.277 -0.473 1.00 25.00 C ATOM 394 C VAL A 105 69.819 20.831 0.933 1.00 25.00 C ATOM 395 O VAL A 105 68.904 20.765 1.749 1.00 25.00 O ATOM 396 CB VAL A 105 68.682 21.170 -1.288 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.230 22.607 -1.416 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.458 20.578 -2.687 1.00 25.00 C ATOM 0 H VAL A 105 68.263 18.832 0.141 1.00 25.00 H new ATOM 0 HA VAL A 105 70.602 20.272 -1.006 1.00 25.00 H new ATOM 0 HB VAL A 105 67.732 21.205 -0.755 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.531 23.213 -1.992 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.352 23.040 -0.423 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.195 22.585 -1.923 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.775 21.217 -3.247 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.411 20.516 -3.213 1.00 25.00 H new ATOM 0 HG23 VAL A 105 68.029 19.580 -2.595 1.00 25.00 H new ATOM 408 N TYR A 106 71.000 21.350 1.222 1.00 25.00 N ATOM 409 CA TYR A 106 71.307 21.922 2.527 1.00 25.00 C ATOM 410 C TYR A 106 71.457 23.430 2.357 1.00 25.00 C ATOM 411 O TYR A 106 72.395 23.896 1.717 1.00 25.00 O ATOM 412 CB TYR A 106 72.595 21.298 3.069 1.00 25.00 C ATOM 413 CG TYR A 106 72.764 21.443 4.568 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.946 22.708 5.165 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.743 20.307 5.403 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.117 22.833 6.572 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.909 20.431 6.810 1.00 25.00 C ATOM 418 CZ TYR A 106 73.100 21.692 7.378 1.00 25.00 C ATOM 419 OH TYR A 106 73.276 21.796 8.733 1.00 25.00 O ATOM 0 H TYR A 106 71.775 21.388 0.560 1.00 25.00 H new ATOM 0 HA TYR A 106 70.509 21.716 3.241 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.610 20.239 2.812 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.448 21.759 2.571 1.00 25.00 H new ATOM 0 HD1 TYR A 106 72.956 23.593 4.546 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.599 19.329 4.968 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.260 23.807 7.016 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.887 19.552 7.437 1.00 25.00 H new ATOM 0 HH TYR A 106 73.620 22.687 8.951 1.00 25.00 H new ATOM 429 N CYS A 107 70.512 24.187 2.889 1.00 25.00 N ATOM 430 CA CYS A 107 70.509 25.639 2.750 1.00 25.00 C ATOM 431 C CYS A 107 71.111 26.277 3.988 1.00 25.00 C ATOM 432 O CYS A 107 70.600 26.110 5.085 1.00 25.00 O ATOM 433 CB CYS A 107 69.079 26.142 2.569 1.00 25.00 C ATOM 434 SG CYS A 107 68.987 27.935 2.405 1.00 25.00 S ATOM 0 H CYS A 107 69.728 23.818 3.427 1.00 25.00 H new ATOM 0 HA CYS A 107 71.102 25.910 1.876 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.644 25.678 1.684 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.477 25.828 3.422 1.00 25.00 H new ATOM 0 HG CYS A 107 69.594 28.494 3.409 1.00 25.00 H new ATOM 440 N VAL A 108 72.199 27.008 3.807 1.00 25.00 N ATOM 441 CA VAL A 108 72.909 27.644 4.912 1.00 25.00 C ATOM 442 C VAL A 108 72.661 29.150 4.934 1.00 25.00 C ATOM 443 O VAL A 108 72.967 29.861 3.964 1.00 25.00 O ATOM 444 CB VAL A 108 74.442 27.386 4.811 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.180 27.968 6.034 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.731 25.883 4.707 1.00 25.00 C ATOM 0 H VAL A 108 72.617 27.179 2.892 1.00 25.00 H new ATOM 0 HA VAL A 108 72.527 27.205 5.833 1.00 25.00 H new ATOM 0 HB VAL A 108 74.803 27.884 3.911 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.249 27.775 5.940 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.009 29.043 6.085 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.805 27.498 6.943 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.807 25.723 4.637 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.345 25.376 5.592 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.246 25.480 3.818 1.00 25.00 H new ATOM 456 N ARG A 109 72.168 29.641 6.064 1.00 25.00 N ATOM 457 CA ARG A 109 72.025 31.076 6.303 1.00 25.00 C ATOM 458 C ARG A 109 73.095 31.460 7.307 1.00 25.00 C ATOM 459 O ARG A 109 73.388 30.696 8.214 1.00 25.00 O ATOM 460 CB ARG A 109 70.631 31.399 6.860 1.00 25.00 C ATOM 461 CG ARG A 109 69.929 32.461 6.039 1.00 25.00 C ATOM 462 CD ARG A 109 68.515 32.789 6.526 1.00 25.00 C ATOM 463 NE ARG A 109 68.493 33.545 7.798 1.00 25.00 N ATOM 464 CZ ARG A 109 67.394 33.990 8.403 1.00 25.00 C ATOM 465 NH1 ARG A 109 66.198 33.800 7.899 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 67.489 34.635 9.536 1.00 25.00 N ATOM 0 H ARG A 109 71.856 29.059 6.841 1.00 25.00 H new ATOM 0 HA ARG A 109 72.138 31.635 5.374 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.026 30.492 6.874 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.722 31.738 7.892 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.528 33.372 6.053 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.878 32.129 5.002 1.00 25.00 H new ATOM 0 HD2 ARG A 109 67.999 33.367 5.759 1.00 25.00 H new ATOM 0 HD3 ARG A 109 67.958 31.861 6.654 1.00 25.00 H new ATOM 0 HE ARG A 109 69.389 33.740 8.245 1.00 25.00 H new ATOM 0 HH11 ARG A 109 66.090 33.298 7.018 1.00 25.00 H new ATOM 0 HH12 ARG A 109 65.376 34.154 8.388 1.00 25.00 H new ATOM 0 HH21 ARG A 109 68.405 34.797 9.956 1.00 25.00 H new ATOM 0 HH22 ARG A 109 66.648 34.976 10.001 1.00 25.00 H new ATOM 480 N ARG A 110 73.666 32.650 7.166 1.00 25.00 N ATOM 481 CA ARG A 110 74.726 33.108 8.084 1.00 25.00 C ATOM 482 C ARG A 110 74.242 33.265 9.517 1.00 25.00 C ATOM 483 O ARG A 110 75.034 33.307 10.443 1.00 25.00 O ATOM 484 CB ARG A 110 75.286 34.454 7.630 1.00 25.00 C ATOM 485 CG ARG A 110 76.049 34.398 6.313 1.00 25.00 C ATOM 486 CD ARG A 110 76.898 35.658 6.117 1.00 25.00 C ATOM 487 NE ARG A 110 77.936 35.777 7.161 1.00 25.00 N ATOM 488 CZ ARG A 110 79.124 35.181 7.144 1.00 25.00 C ATOM 489 NH1 ARG A 110 79.514 34.418 6.151 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 79.935 35.352 8.152 1.00 25.00 N ATOM 0 H ARG A 110 73.422 33.318 6.434 1.00 25.00 H new ATOM 0 HA ARG A 110 75.494 32.335 8.058 1.00 25.00 H new ATOM 0 HB2 ARG A 110 74.464 35.163 7.531 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.948 34.840 8.405 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.690 33.517 6.297 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.347 34.296 5.486 1.00 25.00 H new ATOM 0 HD2 ARG A 110 77.369 35.632 5.135 1.00 25.00 H new ATOM 0 HD3 ARG A 110 76.256 36.538 6.139 1.00 25.00 H new ATOM 0 HE ARG A 110 77.723 36.368 7.965 1.00 25.00 H new ATOM 0 HH11 ARG A 110 78.897 34.264 5.353 1.00 25.00 H new ATOM 0 HH12 ARG A 110 80.434 33.979 6.176 1.00 25.00 H new ATOM 0 HH21 ARG A 110 79.654 35.937 8.939 1.00 25.00 H new ATOM 0 HH22 ARG A 110 80.850 34.901 8.153 1.00 25.00 H new ATOM 504 N ASP A 111 72.935 33.368 9.669 1.00 25.00 N ATOM 505 CA ASP A 111 72.287 33.591 10.960 1.00 25.00 C ATOM 506 C ASP A 111 71.906 32.259 11.637 1.00 25.00 C ATOM 507 O ASP A 111 70.983 32.197 12.436 1.00 25.00 O ATOM 508 CB ASP A 111 71.049 34.447 10.689 1.00 25.00 C ATOM 509 CG ASP A 111 70.492 35.098 11.934 1.00 25.00 C ATOM 510 OD1 ASP A 111 71.267 35.433 12.852 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.276 35.395 11.917 1.00 25.00 O1- ATOM 0 H ASP A 111 72.279 33.299 8.891 1.00 25.00 H new ATOM 0 HA ASP A 111 72.965 34.096 11.647 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.302 35.221 9.964 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.277 33.825 10.235 1.00 25.00 H new ATOM 516 N LEU A 112 72.601 31.188 11.243 1.00 25.00 N ATOM 517 CA LEU A 112 72.387 29.814 11.759 1.00 25.00 C ATOM 518 C LEU A 112 70.945 29.322 11.605 1.00 25.00 C ATOM 519 O LEU A 112 70.501 28.410 12.287 1.00 25.00 O ATOM 520 CB LEU A 112 72.834 29.694 13.227 1.00 25.00 C ATOM 521 CG LEU A 112 74.309 30.021 13.518 1.00 25.00 C ATOM 522 CD1 LEU A 112 74.544 29.980 15.027 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.256 29.029 12.823 1.00 25.00 C ATOM 0 H LEU A 112 73.343 31.242 10.545 1.00 25.00 H new ATOM 0 HA LEU A 112 73.009 29.168 11.139 1.00 25.00 H new ATOM 0 HB2 LEU A 112 72.211 30.355 13.830 1.00 25.00 H new ATOM 0 HB3 LEU A 112 72.636 28.676 13.563 1.00 25.00 H new ATOM 0 HG LEU A 112 74.522 31.016 13.128 1.00 25.00 H new ATOM 0 HD11 LEU A 112 75.588 30.211 15.239 1.00 25.00 H new ATOM 0 HD12 LEU A 112 73.903 30.715 15.515 1.00 25.00 H new ATOM 0 HD13 LEU A 112 74.309 28.985 15.405 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.289 29.291 13.051 1.00 25.00 H new ATOM 0 HD22 LEU A 112 75.051 28.020 13.179 1.00 25.00 H new ATOM 0 HD23 LEU A 112 75.100 29.072 11.745 1.00 25.00 H new ATOM 535 N SER A 113 70.245 29.917 10.658 1.00 25.00 N ATOM 536 CA SER A 113 68.863 29.572 10.329 1.00 25.00 C ATOM 537 C SER A 113 68.839 28.498 9.255 1.00 25.00 C ATOM 538 O SER A 113 67.962 28.468 8.396 1.00 25.00 O ATOM 539 CB SER A 113 68.139 30.807 9.843 1.00 25.00 C ATOM 540 OG SER A 113 68.760 31.961 10.384 1.00 25.00 O ATOM 0 H SER A 113 70.622 30.669 10.081 1.00 25.00 H new ATOM 0 HA SER A 113 68.364 29.189 11.219 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.157 30.848 8.754 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.092 30.770 10.143 1.00 25.00 H new ATOM 0 HG SER A 113 68.111 32.460 10.922 1.00 25.00 H new ATOM 546 N GLU A 114 69.913 27.735 9.212 1.00 25.00 N ATOM 547 CA GLU A 114 70.136 26.763 8.159 1.00 25.00 C ATOM 548 C GLU A 114 69.202 25.565 8.313 1.00 25.00 C ATOM 549 O GLU A 114 68.760 25.232 9.413 1.00 25.00 O ATOM 550 CB GLU A 114 71.605 26.325 8.175 1.00 25.00 C ATOM 551 CG GLU A 114 72.082 25.671 9.464 1.00 25.00 C ATOM 552 CD GLU A 114 73.586 25.463 9.450 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.326 26.473 9.399 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.034 24.295 9.440 1.00 25.00 O1- ATOM 0 H GLU A 114 70.658 27.771 9.908 1.00 25.00 H new ATOM 0 HA GLU A 114 69.914 27.223 7.196 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.766 25.627 7.353 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.228 27.198 7.979 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.806 26.294 10.315 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.581 24.712 9.596 1.00 25.00 H new ATOM 561 N VAL A 115 68.852 24.970 7.183 1.00 25.00 N ATOM 562 CA VAL A 115 67.861 23.902 7.128 1.00 25.00 C ATOM 563 C VAL A 115 68.256 22.995 5.972 1.00 25.00 C ATOM 564 O VAL A 115 68.938 23.431 5.050 1.00 25.00 O ATOM 565 CB VAL A 115 66.414 24.507 6.914 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.283 25.193 5.535 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.317 23.443 7.088 1.00 25.00 C ATOM 0 H VAL A 115 69.247 25.214 6.275 1.00 25.00 H new ATOM 0 HA VAL A 115 67.834 23.338 8.060 1.00 25.00 H new ATOM 0 HB VAL A 115 66.275 25.263 7.687 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.277 25.596 5.423 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.009 26.003 5.461 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.471 24.464 4.747 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.339 23.900 6.933 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.465 22.646 6.360 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.368 23.029 8.095 1.00 25.00 H new ATOM 577 N THR A 116 67.823 21.748 5.996 1.00 25.00 N ATOM 578 CA THR A 116 68.061 20.850 4.880 1.00 25.00 C ATOM 579 C THR A 116 66.748 20.156 4.579 1.00 25.00 C ATOM 580 O THR A 116 65.911 19.983 5.468 1.00 25.00 O ATOM 581 CB THR A 116 69.214 19.851 5.171 1.00 25.00 C ATOM 582 OG1 THR A 116 69.516 19.101 3.990 1.00 25.00 O ATOM 583 CG2 THR A 116 68.870 18.877 6.289 1.00 25.00 C ATOM 0 H THR A 116 67.307 21.335 6.772 1.00 25.00 H new ATOM 0 HA THR A 116 68.394 21.408 4.005 1.00 25.00 H new ATOM 0 HB THR A 116 70.074 20.442 5.487 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.316 19.643 3.198 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.709 18.200 6.453 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.667 19.432 7.205 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.988 18.300 6.011 1.00 25.00 H new ATOM 591 N PHE A 117 66.543 19.831 3.316 1.00 25.00 N ATOM 592 CA PHE A 117 65.303 19.239 2.846 1.00 25.00 C ATOM 593 C PHE A 117 65.657 18.419 1.622 1.00 25.00 C ATOM 594 O PHE A 117 66.771 18.528 1.110 1.00 25.00 O ATOM 595 CB PHE A 117 64.284 20.337 2.504 1.00 25.00 C ATOM 596 CG PHE A 117 64.833 21.427 1.617 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.838 21.276 0.219 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.329 22.622 2.179 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.324 22.309 -0.621 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.824 23.663 1.349 1.00 25.00 C ATOM 601 CZ PHE A 117 65.818 23.506 -0.053 1.00 25.00 C ATOM 0 H PHE A 117 67.237 19.971 2.582 1.00 25.00 H new ATOM 0 HA PHE A 117 64.844 18.611 3.610 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.425 19.881 2.013 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.922 20.784 3.430 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.467 20.362 -0.220 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.332 22.747 3.252 1.00 25.00 H new ATOM 0 HE1 PHE A 117 65.317 22.182 -1.693 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.204 24.573 1.790 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.189 24.296 -0.689 1.00 25.00 H new ATOM 611 N SER A 118 64.734 17.597 1.156 1.00 25.00 N ATOM 612 CA SER A 118 64.979 16.760 -0.011 1.00 25.00 C ATOM 613 C SER A 118 64.052 17.176 -1.136 1.00 25.00 C ATOM 614 O SER A 118 62.920 17.575 -0.890 1.00 25.00 O ATOM 615 CB SER A 118 64.756 15.289 0.334 1.00 25.00 C ATOM 616 OG SER A 118 65.591 14.899 1.413 1.00 25.00 O ATOM 0 H SER A 118 63.806 17.489 1.566 1.00 25.00 H new ATOM 0 HA SER A 118 66.014 16.888 -0.329 1.00 25.00 H new ATOM 0 HB2 SER A 118 63.711 15.126 0.598 1.00 25.00 H new ATOM 0 HB3 SER A 118 64.965 14.669 -0.538 1.00 25.00 H new ATOM 0 HG SER A 118 65.435 13.955 1.623 1.00 25.00 H new ATOM 622 N LEU A 119 64.534 17.071 -2.363 1.00 25.00 N ATOM 623 CA LEU A 119 63.749 17.413 -3.543 1.00 25.00 C ATOM 624 C LEU A 119 63.678 16.219 -4.465 1.00 25.00 C ATOM 625 O LEU A 119 64.651 15.481 -4.628 1.00 25.00 O ATOM 626 CB LEU A 119 64.376 18.585 -4.302 1.00 25.00 C ATOM 627 CG LEU A 119 64.230 19.980 -3.682 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.975 20.964 -4.566 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.768 20.403 -3.569 1.00 25.00 C ATOM 0 H LEU A 119 65.478 16.747 -2.572 1.00 25.00 H new ATOM 0 HA LEU A 119 62.750 17.701 -3.214 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.439 18.379 -4.423 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.941 18.612 -5.301 1.00 25.00 H new ATOM 0 HG LEU A 119 64.641 19.963 -2.673 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.888 21.967 -4.148 1.00 25.00 H new ATOM 0 HD12 LEU A 119 66.027 20.683 -4.618 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.546 20.950 -5.568 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.710 21.397 -3.125 1.00 25.00 H new ATOM 0 HD22 LEU A 119 62.317 20.422 -4.561 1.00 25.00 H new ATOM 0 HD23 LEU A 119 62.231 19.693 -2.940 1.00 25.00 H new ATOM 641 N GLN A 120 62.523 16.053 -5.083 1.00 25.00 N ATOM 642 CA GLN A 120 62.292 14.975 -6.035 1.00 25.00 C ATOM 643 C GLN A 120 62.392 15.580 -7.430 1.00 25.00 C ATOM 644 O GLN A 120 61.785 16.613 -7.711 1.00 25.00 O ATOM 645 CB GLN A 120 60.922 14.316 -5.786 1.00 25.00 C ATOM 646 CG GLN A 120 59.729 15.286 -5.711 1.00 25.00 C ATOM 647 CD GLN A 120 58.448 14.599 -5.290 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.320 13.393 -5.375 1.00 25.00 O ATOM 649 NE2 GLN A 120 57.500 15.368 -4.820 1.00 25.00 N ATOM 0 H GLN A 120 61.716 16.661 -4.941 1.00 25.00 H new ATOM 0 HA GLN A 120 63.034 14.184 -5.923 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.734 13.596 -6.582 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.972 13.754 -4.853 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.958 16.084 -5.005 1.00 25.00 H new ATOM 0 HG3 GLN A 120 59.583 15.754 -6.685 1.00 25.00 H new ATOM 0 HE21 GLN A 120 57.642 16.376 -4.763 1.00 25.00 H new ATOM 0 HE22 GLN A 120 56.618 14.959 -4.510 1.00 25.00 H new ATOM 658 N VAL A 121 63.221 14.983 -8.273 1.00 25.00 N ATOM 659 CA VAL A 121 63.496 15.524 -9.606 1.00 25.00 C ATOM 660 C VAL A 121 63.589 14.388 -10.611 1.00 25.00 C ATOM 661 O VAL A 121 63.825 13.247 -10.238 1.00 25.00 O ATOM 662 CB VAL A 121 64.850 16.315 -9.631 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.768 17.563 -8.756 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.021 15.434 -9.157 1.00 25.00 C ATOM 0 H VAL A 121 63.720 14.119 -8.061 1.00 25.00 H new ATOM 0 HA VAL A 121 62.682 16.201 -9.863 1.00 25.00 H new ATOM 0 HB VAL A 121 65.031 16.613 -10.664 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.719 18.094 -8.790 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.975 18.214 -9.124 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.551 17.273 -7.728 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.945 16.011 -9.186 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.834 15.099 -8.137 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.113 14.568 -9.812 1.00 25.00 H new ATOM 674 N ASP A 122 63.440 14.693 -11.888 1.00 25.00 N ATOM 675 CA ASP A 122 63.654 13.687 -12.927 1.00 25.00 C ATOM 676 C ASP A 122 65.161 13.539 -13.144 1.00 25.00 C ATOM 677 O ASP A 122 65.941 14.385 -12.708 1.00 25.00 O ATOM 678 CB ASP A 122 62.985 14.098 -14.240 1.00 25.00 C ATOM 679 CG ASP A 122 63.202 13.071 -15.333 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.991 11.871 -15.052 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 63.797 13.422 -16.366 1.00 25.00 O1- ATOM 0 H ASP A 122 63.175 15.616 -12.233 1.00 25.00 H new ATOM 0 HA ASP A 122 63.213 12.742 -12.609 1.00 25.00 H new ATOM 0 HB2 ASP A 122 61.916 14.232 -14.076 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.381 15.061 -14.563 1.00 25.00 H new ATOM 686 N ALA A 123 65.573 12.488 -13.837 1.00 25.00 N ATOM 687 CA ALA A 123 66.979 12.286 -14.146 1.00 25.00 C ATOM 688 C ALA A 123 67.506 13.426 -15.028 1.00 25.00 C ATOM 689 O ALA A 123 68.604 13.934 -14.810 1.00 25.00 O ATOM 690 CB ALA A 123 67.167 10.936 -14.847 1.00 25.00 C ATOM 0 H ALA A 123 64.953 11.762 -14.196 1.00 25.00 H new ATOM 0 HA ALA A 123 67.548 12.285 -13.216 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.222 10.789 -15.077 1.00 25.00 H new ATOM 0 HB2 ALA A 123 66.823 10.135 -14.192 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.589 10.922 -15.771 1.00 25.00 H new ATOM 696 N ASP A 124 66.720 13.824 -16.019 1.00 25.00 N ATOM 697 CA ASP A 124 67.161 14.831 -16.984 1.00 25.00 C ATOM 698 C ASP A 124 66.619 16.219 -16.634 1.00 25.00 C ATOM 699 O ASP A 124 66.563 17.117 -17.468 1.00 25.00 O ATOM 700 CB ASP A 124 66.748 14.419 -18.401 1.00 25.00 C ATOM 701 CG ASP A 124 67.782 14.820 -19.455 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.998 14.874 -19.124 1.00 25.00 O ATOM 703 OD2 ASP A 124 67.400 14.993 -20.630 1.00 25.00 O1- ATOM 0 H ASP A 124 65.777 13.469 -16.179 1.00 25.00 H new ATOM 0 HA ASP A 124 68.249 14.890 -16.941 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.602 13.339 -18.433 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.790 14.878 -18.644 1.00 25.00 H new ATOM 708 N PHE A 125 66.217 16.384 -15.383 1.00 25.00 N ATOM 709 CA PHE A 125 65.673 17.654 -14.902 1.00 25.00 C ATOM 710 C PHE A 125 66.707 18.775 -15.039 1.00 25.00 C ATOM 711 O PHE A 125 67.872 18.606 -14.676 1.00 25.00 O ATOM 712 CB PHE A 125 65.270 17.493 -13.442 1.00 25.00 C ATOM 713 CG PHE A 125 64.252 18.486 -12.971 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.909 18.370 -13.375 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.614 19.522 -12.092 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.931 19.279 -12.908 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.643 20.429 -11.613 1.00 25.00 C ATOM 718 CZ PHE A 125 62.299 20.306 -12.022 1.00 25.00 C ATOM 0 H PHE A 125 66.256 15.651 -14.675 1.00 25.00 H new ATOM 0 HA PHE A 125 64.804 17.923 -15.502 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.875 16.488 -13.295 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.161 17.580 -12.820 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.622 17.577 -14.050 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.643 19.625 -11.781 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.905 19.184 -13.231 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.930 21.217 -10.933 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.555 20.998 -11.656 1.00 25.00 H new ATOM 728 N GLU A 126 66.277 19.908 -15.575 1.00 25.00 N ATOM 729 CA GLU A 126 67.168 21.041 -15.836 1.00 25.00 C ATOM 730 C GLU A 126 67.701 21.665 -14.559 1.00 25.00 C ATOM 731 O GLU A 126 66.967 21.812 -13.574 1.00 25.00 O ATOM 732 CB GLU A 126 66.413 22.152 -16.563 1.00 25.00 C ATOM 733 CG GLU A 126 65.898 21.801 -17.936 1.00 25.00 C ATOM 734 CD GLU A 126 65.092 22.952 -18.516 1.00 25.00 C ATOM 735 OE1 GLU A 126 65.631 24.078 -18.597 1.00 25.00 O ATOM 736 OE2 GLU A 126 63.886 22.761 -18.778 1.00 25.00 O1- ATOM 0 H GLU A 126 65.306 20.073 -15.842 1.00 25.00 H new ATOM 0 HA GLU A 126 67.990 20.642 -16.430 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.568 22.457 -15.945 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.072 23.016 -16.652 1.00 25.00 H new ATOM 0 HG2 GLU A 126 66.734 21.567 -18.595 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.277 20.907 -17.880 1.00 25.00 H new ATOM 743 N LEU A 127 68.935 22.151 -14.606 1.00 25.00 N ATOM 744 CA LEU A 127 69.491 22.894 -13.482 1.00 25.00 C ATOM 745 C LEU A 127 68.661 24.149 -13.241 1.00 25.00 C ATOM 746 O LEU A 127 68.445 24.539 -12.102 1.00 25.00 O ATOM 747 CB LEU A 127 70.938 23.315 -13.757 1.00 25.00 C ATOM 748 CG LEU A 127 71.943 23.129 -12.607 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.254 23.776 -13.009 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.468 23.739 -11.281 1.00 25.00 C ATOM 0 H LEU A 127 69.565 22.046 -15.402 1.00 25.00 H new ATOM 0 HA LEU A 127 69.471 22.244 -12.607 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.298 22.752 -14.618 1.00 25.00 H new ATOM 0 HB3 LEU A 127 70.938 24.367 -14.042 1.00 25.00 H new ATOM 0 HG LEU A 127 72.054 22.058 -12.438 1.00 25.00 H new ATOM 0 HD11 LEU A 127 73.981 23.655 -12.206 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.631 23.301 -13.915 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.093 24.838 -13.196 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.223 23.572 -10.513 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.310 24.810 -11.409 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.533 23.268 -10.978 1.00 25.00 H new ATOM 762 N HIS A 128 68.183 24.779 -14.308 1.00 25.00 N ATOM 763 CA HIS A 128 67.391 26.001 -14.162 1.00 25.00 C ATOM 764 C HIS A 128 66.169 25.747 -13.286 1.00 25.00 C ATOM 765 O HIS A 128 65.896 26.489 -12.339 1.00 25.00 O ATOM 766 CB HIS A 128 66.938 26.521 -15.531 1.00 25.00 C ATOM 767 CG HIS A 128 66.502 27.954 -15.506 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.317 28.396 -14.974 1.00 25.00 N ATOM 769 CD2 HIS A 128 67.127 29.077 -15.956 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.269 29.719 -15.108 1.00 25.00 C ATOM 771 NE2 HIS A 128 66.351 30.188 -15.697 1.00 25.00 N ATOM 0 H HIS A 128 68.325 24.473 -15.270 1.00 25.00 H new ATOM 0 HA HIS A 128 68.022 26.753 -13.687 1.00 25.00 H new ATOM 0 HB2 HIS A 128 67.756 26.410 -16.243 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.115 25.904 -15.892 1.00 25.00 H new ATOM 0 HD2 HIS A 128 68.090 29.095 -16.445 1.00 25.00 H new ATOM 0 HE1 HIS A 128 64.445 30.333 -14.775 1.00 25.00 H new ATOM 0 HE2 HIS A 128 66.568 31.161 -15.914 1.00 25.00 H new ATOM 779 N ASN A 129 65.454 24.673 -13.580 1.00 25.00 N ATOM 780 CA ASN A 129 64.258 24.331 -12.824 1.00 25.00 C ATOM 781 C ASN A 129 64.616 23.823 -11.430 1.00 25.00 C ATOM 782 O ASN A 129 63.873 24.034 -10.487 1.00 25.00 O ATOM 783 CB ASN A 129 63.431 23.300 -13.590 1.00 25.00 C ATOM 784 CG ASN A 129 62.786 23.887 -14.818 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.254 24.984 -14.776 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.855 23.186 -15.911 1.00 25.00 N ATOM 0 H ASN A 129 65.679 24.024 -14.334 1.00 25.00 H new ATOM 0 HA ASN A 129 63.658 25.232 -12.699 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.071 22.467 -13.881 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.660 22.896 -12.934 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.455 23.550 -16.776 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.309 22.273 -15.903 1.00 25.00 H new ATOM 793 N PHE A 130 65.774 23.199 -11.278 1.00 25.00 N ATOM 794 CA PHE A 130 66.222 22.753 -9.957 1.00 25.00 C ATOM 795 C PHE A 130 66.451 23.938 -9.018 1.00 25.00 C ATOM 796 O PHE A 130 66.083 23.889 -7.844 1.00 25.00 O ATOM 797 CB PHE A 130 67.510 21.948 -10.082 1.00 25.00 C ATOM 798 CG PHE A 130 67.976 21.351 -8.783 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.175 20.420 -8.098 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.224 21.709 -8.238 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.616 19.834 -6.887 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.676 21.132 -7.028 1.00 25.00 C ATOM 803 CZ PHE A 130 68.873 20.188 -6.356 1.00 25.00 C ATOM 0 H PHE A 130 66.418 22.989 -12.040 1.00 25.00 H new ATOM 0 HA PHE A 130 65.437 22.125 -9.535 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.359 21.148 -10.807 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.295 22.593 -10.478 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.211 20.148 -8.501 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.843 22.432 -8.749 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.992 19.119 -6.372 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.635 21.414 -6.620 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.220 19.738 -5.438 1.00 25.00 H new ATOM 813 N ARG A 131 67.024 25.020 -9.535 1.00 25.00 N ATOM 814 CA ARG A 131 67.234 26.223 -8.718 1.00 25.00 C ATOM 815 C ARG A 131 65.900 26.790 -8.326 1.00 25.00 C ATOM 816 O ARG A 131 65.698 27.186 -7.193 1.00 25.00 O ATOM 817 CB ARG A 131 68.018 27.298 -9.464 1.00 25.00 C ATOM 818 CG ARG A 131 69.389 26.844 -9.817 1.00 25.00 C ATOM 819 CD ARG A 131 70.246 27.945 -10.442 1.00 25.00 C ATOM 820 NE ARG A 131 70.519 29.044 -9.494 1.00 25.00 N ATOM 821 CZ ARG A 131 71.511 29.924 -9.600 1.00 25.00 C ATOM 822 NH1 ARG A 131 72.386 29.881 -10.575 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 71.630 30.862 -8.698 1.00 25.00 N ATOM 0 H ARG A 131 67.349 25.095 -10.499 1.00 25.00 H new ATOM 0 HA ARG A 131 67.812 25.929 -7.842 1.00 25.00 H new ATOM 0 HB2 ARG A 131 67.482 27.573 -10.372 1.00 25.00 H new ATOM 0 HB3 ARG A 131 68.081 28.195 -8.847 1.00 25.00 H new ATOM 0 HG2 ARG A 131 69.884 26.473 -8.920 1.00 25.00 H new ATOM 0 HG3 ARG A 131 69.320 26.007 -10.512 1.00 25.00 H new ATOM 0 HD2 ARG A 131 71.189 27.519 -10.784 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.739 28.343 -11.321 1.00 25.00 H new ATOM 0 HE ARG A 131 69.896 29.136 -8.692 1.00 25.00 H new ATOM 0 HH11 ARG A 131 72.320 29.154 -11.288 1.00 25.00 H new ATOM 0 HH12 ARG A 131 73.133 30.574 -10.621 1.00 25.00 H new ATOM 0 HH21 ARG A 131 70.967 30.913 -7.925 1.00 25.00 H new ATOM 0 HH22 ARG A 131 72.386 31.543 -8.767 1.00 25.00 H new ATOM 837 N ALA A 132 64.987 26.795 -9.277 1.00 25.00 N ATOM 838 CA ALA A 132 63.631 27.286 -9.024 1.00 25.00 C ATOM 839 C ALA A 132 62.952 26.469 -7.905 1.00 25.00 C ATOM 840 O ALA A 132 62.334 27.035 -7.008 1.00 25.00 O ATOM 841 CB ALA A 132 62.798 27.248 -10.313 1.00 25.00 C ATOM 0 H ALA A 132 65.150 26.468 -10.229 1.00 25.00 H new ATOM 0 HA ALA A 132 63.697 28.321 -8.690 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.793 27.616 -10.108 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.268 27.878 -11.068 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.741 26.223 -10.679 1.00 25.00 H new ATOM 847 N LEU A 133 63.103 25.150 -7.934 1.00 25.00 N ATOM 848 CA LEU A 133 62.524 24.302 -6.887 1.00 25.00 C ATOM 849 C LEU A 133 63.141 24.600 -5.528 1.00 25.00 C ATOM 850 O LEU A 133 62.432 24.710 -4.541 1.00 25.00 O ATOM 851 CB LEU A 133 62.741 22.809 -7.178 1.00 25.00 C ATOM 852 CG LEU A 133 61.948 22.133 -8.306 1.00 25.00 C ATOM 853 CD1 LEU A 133 62.351 20.658 -8.347 1.00 25.00 C ATOM 854 CD2 LEU A 133 60.438 22.245 -8.102 1.00 25.00 C ATOM 0 H LEU A 133 63.613 24.645 -8.659 1.00 25.00 H new ATOM 0 HA LEU A 133 61.457 24.526 -6.875 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.800 22.670 -7.395 1.00 25.00 H new ATOM 0 HB3 LEU A 133 62.530 22.263 -6.258 1.00 25.00 H new ATOM 0 HG LEU A 133 62.181 22.636 -9.245 1.00 25.00 H new ATOM 0 HD11 LEU A 133 61.801 20.153 -9.141 1.00 25.00 H new ATOM 0 HD12 LEU A 133 63.421 20.578 -8.539 1.00 25.00 H new ATOM 0 HD13 LEU A 133 62.118 20.190 -7.390 1.00 25.00 H new ATOM 0 HD21 LEU A 133 59.922 21.752 -8.926 1.00 25.00 H new ATOM 0 HD22 LEU A 133 60.161 21.767 -7.162 1.00 25.00 H new ATOM 0 HD23 LEU A 133 60.152 23.296 -8.072 1.00 25.00 H new ATOM 866 N CYS A 134 64.460 24.711 -5.461 1.00 25.00 N ATOM 867 CA CYS A 134 65.112 24.932 -4.171 1.00 25.00 C ATOM 868 C CYS A 134 64.845 26.342 -3.644 1.00 25.00 C ATOM 869 O CYS A 134 64.859 26.560 -2.441 1.00 25.00 O ATOM 870 CB CYS A 134 66.616 24.628 -4.243 1.00 25.00 C ATOM 871 SG CYS A 134 67.618 25.838 -5.137 1.00 25.00 S ATOM 0 H CYS A 134 65.090 24.654 -6.261 1.00 25.00 H new ATOM 0 HA CYS A 134 64.675 24.233 -3.458 1.00 25.00 H new ATOM 0 HB2 CYS A 134 67.000 24.545 -3.226 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.749 23.654 -4.714 1.00 25.00 H new ATOM 0 HG CYS A 134 66.867 26.488 -5.976 1.00 25.00 H new ATOM 877 N GLU A 135 64.570 27.286 -4.537 1.00 25.00 N ATOM 878 CA GLU A 135 64.211 28.643 -4.128 1.00 25.00 C ATOM 879 C GLU A 135 62.849 28.595 -3.439 1.00 25.00 C ATOM 880 O GLU A 135 62.661 29.152 -2.357 1.00 25.00 O ATOM 881 CB GLU A 135 64.150 29.573 -5.355 1.00 25.00 C ATOM 882 CG GLU A 135 63.959 31.037 -4.994 1.00 25.00 C ATOM 883 CD GLU A 135 63.915 31.968 -6.203 1.00 25.00 C ATOM 884 OE1 GLU A 135 63.897 31.478 -7.352 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 63.997 33.208 -5.995 1.00 25.00 O1- ATOM 0 H GLU A 135 64.588 27.140 -5.546 1.00 25.00 H new ATOM 0 HA GLU A 135 64.963 29.033 -3.443 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.070 29.465 -5.929 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.332 29.256 -6.001 1.00 25.00 H new ATOM 0 HG2 GLU A 135 63.032 31.145 -4.430 1.00 25.00 H new ATOM 0 HG3 GLU A 135 64.771 31.348 -4.336 1.00 25.00 H new ATOM 892 N LEU A 136 61.913 27.892 -4.066 1.00 25.00 N ATOM 893 CA LEU A 136 60.552 27.767 -3.551 1.00 25.00 C ATOM 894 C LEU A 136 60.501 27.005 -2.229 1.00 25.00 C ATOM 895 O LEU A 136 59.819 27.417 -1.299 1.00 25.00 O ATOM 896 CB LEU A 136 59.689 27.038 -4.592 1.00 25.00 C ATOM 897 CG LEU A 136 58.198 26.852 -4.260 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.468 28.196 -4.155 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.546 25.992 -5.344 1.00 25.00 C ATOM 0 H LEU A 136 62.073 27.394 -4.942 1.00 25.00 H new ATOM 0 HA LEU A 136 60.171 28.771 -3.365 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.761 27.584 -5.533 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.123 26.053 -4.761 1.00 25.00 H new ATOM 0 HG LEU A 136 58.123 26.359 -3.291 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.418 28.022 -3.920 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.922 28.796 -3.367 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.544 28.726 -5.104 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.489 25.857 -5.114 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.647 26.486 -6.310 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.037 25.019 -5.381 1.00 25.00 H new ATOM 911 N GLU A 137 61.215 25.892 -2.161 1.00 25.00 N ATOM 912 CA GLU A 137 61.197 25.032 -0.975 1.00 25.00 C ATOM 913 C GLU A 137 61.872 25.704 0.227 1.00 25.00 C ATOM 914 O GLU A 137 61.495 25.483 1.372 1.00 25.00 O ATOM 915 CB GLU A 137 61.913 23.715 -1.301 1.00 25.00 C ATOM 916 CG GLU A 137 61.497 22.528 -0.429 1.00 25.00 C ATOM 917 CD GLU A 137 60.124 21.976 -0.811 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.938 21.593 -1.989 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 59.243 21.898 0.071 1.00 25.00 O1- ATOM 0 H GLU A 137 61.818 25.557 -2.913 1.00 25.00 H new ATOM 0 HA GLU A 137 60.158 24.844 -0.706 1.00 25.00 H new ATOM 0 HB2 GLU A 137 61.726 23.464 -2.345 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.987 23.866 -1.197 1.00 25.00 H new ATOM 0 HG2 GLU A 137 62.241 21.737 -0.519 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.483 22.836 0.616 1.00 25.00 H new ATOM 926 N SER A 138 62.879 26.524 -0.041 1.00 25.00 N ATOM 927 CA SER A 138 63.624 27.203 1.022 1.00 25.00 C ATOM 928 C SER A 138 62.984 28.547 1.404 1.00 25.00 C ATOM 929 O SER A 138 63.143 29.020 2.529 1.00 25.00 O ATOM 930 CB SER A 138 65.066 27.410 0.563 1.00 25.00 C ATOM 931 OG SER A 138 65.901 27.885 1.605 1.00 25.00 O ATOM 0 H SER A 138 63.202 26.738 -0.984 1.00 25.00 H new ATOM 0 HA SER A 138 63.602 26.576 1.914 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.463 26.468 0.184 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.083 28.119 -0.265 1.00 25.00 H new ATOM 0 HG SER A 138 66.831 27.640 1.417 1.00 25.00 H new ATOM 937 N GLY A 139 62.253 29.157 0.477 1.00 25.00 N ATOM 938 CA GLY A 139 61.556 30.404 0.771 1.00 25.00 C ATOM 939 C GLY A 139 62.464 31.618 0.864 1.00 25.00 C ATOM 940 O GLY A 139 62.206 32.538 1.643 1.00 25.00 O ATOM 0 H GLY A 139 62.128 28.813 -0.475 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.809 30.581 -0.003 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.018 30.293 1.713 1.00 25.00 H new ATOM 944 N ILE A 140 63.535 31.626 0.082 1.00 25.00 N ATOM 945 CA ILE A 140 64.516 32.721 0.099 1.00 25.00 C ATOM 946 C ILE A 140 64.756 33.226 -1.322 1.00 25.00 C ATOM 947 O ILE A 140 64.602 32.475 -2.269 1.00 25.00 O ATOM 948 CB ILE A 140 65.879 32.248 0.693 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.354 30.970 -0.031 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.738 32.013 2.221 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.755 30.534 0.303 1.00 25.00 C ATOM 0 H ILE A 140 63.754 30.882 -0.581 1.00 25.00 H new ATOM 0 HA ILE A 140 64.112 33.518 0.723 1.00 25.00 H new ATOM 0 HB ILE A 140 66.631 33.022 0.539 1.00 25.00 H new ATOM 0 HG12 ILE A 140 65.669 30.157 0.211 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.287 31.134 -1.107 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.694 31.683 2.628 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.438 32.942 2.706 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.983 31.249 2.403 1.00 25.00 H new ATOM 0 HD11 ILE A 140 67.997 29.629 -0.254 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.456 31.324 0.034 1.00 25.00 H new ATOM 0 HD13 ILE A 140 67.828 30.333 1.372 1.00 25.00 H new ATOM 963 N PRO A 141 65.123 34.511 -1.492 1.00 25.00 N ATOM 964 CA PRO A 141 65.365 34.955 -2.873 1.00 25.00 C ATOM 965 C PRO A 141 66.602 34.317 -3.511 1.00 25.00 C ATOM 966 O PRO A 141 67.691 34.321 -2.918 1.00 25.00 O ATOM 967 CB PRO A 141 65.594 36.470 -2.714 1.00 25.00 C ATOM 968 CG PRO A 141 65.018 36.811 -1.375 1.00 25.00 C ATOM 969 CD PRO A 141 65.324 35.615 -0.537 1.00 25.00 C ATOM 0 HA PRO A 141 64.538 34.678 -3.526 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.655 36.716 -2.761 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.101 37.029 -3.509 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.470 37.713 -0.964 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.945 36.992 -1.436 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.342 35.638 -0.149 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.658 35.538 0.322 1.00 25.00 H new ATOM 977 N ALA A 142 66.474 33.837 -4.742 1.00 25.00 N ATOM 978 CA ALA A 142 67.618 33.283 -5.470 1.00 25.00 C ATOM 979 C ALA A 142 68.670 34.360 -5.744 1.00 25.00 C ATOM 980 O ALA A 142 69.845 34.060 -5.906 1.00 25.00 O ATOM 981 CB ALA A 142 67.159 32.654 -6.790 1.00 25.00 C ATOM 0 H ALA A 142 65.595 33.818 -5.259 1.00 25.00 H new ATOM 0 HA ALA A 142 68.069 32.512 -4.846 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.021 32.247 -7.318 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.449 31.853 -6.584 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.680 33.414 -7.408 1.00 25.00 H new ATOM 987 N ALA A 143 68.241 35.616 -5.782 1.00 25.00 N ATOM 988 CA ALA A 143 69.145 36.740 -6.025 1.00 25.00 C ATOM 989 C ALA A 143 70.181 36.893 -4.901 1.00 25.00 C ATOM 990 O ALA A 143 71.265 37.425 -5.111 1.00 25.00 O ATOM 991 CB ALA A 143 68.326 38.031 -6.165 1.00 25.00 C ATOM 0 H ALA A 143 67.267 35.885 -5.647 1.00 25.00 H new ATOM 0 HA ALA A 143 69.691 36.543 -6.948 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.998 38.870 -6.346 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.633 37.934 -7.001 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.765 38.207 -5.247 1.00 25.00 H new ATOM 997 N GLU A 144 69.829 36.432 -3.710 1.00 25.00 N ATOM 998 CA GLU A 144 70.698 36.541 -2.535 1.00 25.00 C ATOM 999 C GLU A 144 71.395 35.211 -2.270 1.00 25.00 C ATOM 1000 O GLU A 144 71.981 34.998 -1.198 1.00 25.00 O ATOM 1001 CB GLU A 144 69.853 36.896 -1.312 1.00 25.00 C ATOM 1002 CG GLU A 144 69.110 38.219 -1.433 1.00 25.00 C ATOM 1003 CD GLU A 144 68.288 38.519 -0.191 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.940 37.564 0.541 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 67.980 39.703 0.050 1.00 25.00 O1- ATOM 0 H GLU A 144 68.937 35.972 -3.525 1.00 25.00 H new ATOM 0 HA GLU A 144 71.443 37.314 -2.721 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.129 36.099 -1.140 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.500 36.934 -0.435 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.826 39.024 -1.599 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.455 38.190 -2.304 1.00 25.00 H new ATOM 1012 N SER A 145 71.273 34.290 -3.215 1.00 25.00 N ATOM 1013 CA SER A 145 71.711 32.919 -3.002 1.00 25.00 C ATOM 1014 C SER A 145 72.636 32.371 -4.076 1.00 25.00 C ATOM 1015 O SER A 145 72.519 32.683 -5.254 1.00 25.00 O ATOM 1016 CB SER A 145 70.477 32.028 -2.925 1.00 25.00 C ATOM 1017 OG SER A 145 69.607 32.470 -1.896 1.00 25.00 O ATOM 0 H SER A 145 70.874 34.468 -4.137 1.00 25.00 H new ATOM 0 HA SER A 145 72.289 32.922 -2.078 1.00 25.00 H new ATOM 0 HB2 SER A 145 69.954 32.039 -3.881 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.777 30.997 -2.737 1.00 25.00 H new ATOM 0 HG SER A 145 68.949 33.093 -2.269 1.00 25.00 H new ATOM 1023 N GLN A 146 73.527 31.490 -3.654 1.00 25.00 N ATOM 1024 CA GLN A 146 74.421 30.785 -4.561 1.00 25.00 C ATOM 1025 C GLN A 146 74.295 29.304 -4.261 1.00 25.00 C ATOM 1026 O GLN A 146 74.044 28.916 -3.123 1.00 25.00 O ATOM 1027 CB GLN A 146 75.863 31.258 -4.377 1.00 25.00 C ATOM 1028 CG GLN A 146 76.247 32.391 -5.329 1.00 25.00 C ATOM 1029 CD GLN A 146 76.284 31.932 -6.777 1.00 25.00 C ATOM 1030 OE1 GLN A 146 75.437 32.280 -7.579 1.00 25.00 O ATOM 1031 NE2 GLN A 146 77.259 31.123 -7.107 1.00 25.00 N ATOM 0 H GLN A 146 73.652 31.242 -2.673 1.00 25.00 H new ATOM 0 HA GLN A 146 74.150 30.986 -5.597 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.001 31.592 -3.349 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.538 30.416 -4.532 1.00 25.00 H new ATOM 0 HG2 GLN A 146 75.533 33.208 -5.226 1.00 25.00 H new ATOM 0 HG3 GLN A 146 77.224 32.784 -5.049 1.00 25.00 H new ATOM 0 HE21 GLN A 146 77.953 30.850 -6.411 1.00 25.00 H new ATOM 0 HE22 GLN A 146 77.324 30.765 -8.060 1.00 25.00 H new ATOM 1040 N ILE A 147 74.435 28.489 -5.292 1.00 25.00 N ATOM 1041 CA ILE A 147 74.222 27.050 -5.193 1.00 25.00 C ATOM 1042 C ILE A 147 75.519 26.331 -5.608 1.00 25.00 C ATOM 1043 O ILE A 147 76.195 26.735 -6.563 1.00 25.00 O ATOM 1044 CB ILE A 147 72.976 26.651 -6.054 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.678 25.155 -5.886 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.165 27.090 -7.536 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.436 24.654 -6.656 1.00 25.00 C ATOM 0 H ILE A 147 74.700 28.804 -6.225 1.00 25.00 H new ATOM 0 HA ILE A 147 74.000 26.744 -4.171 1.00 25.00 H new ATOM 0 HB ILE A 147 72.095 27.185 -5.697 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.547 24.586 -6.216 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.542 24.942 -4.826 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.288 26.803 -8.115 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.292 28.172 -7.582 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.048 26.603 -7.950 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.304 23.587 -6.478 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.553 25.192 -6.311 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.574 24.830 -7.723 1.00 25.00 H new ATOM 1059 N VAL A 148 75.915 25.355 -4.805 1.00 25.00 N ATOM 1060 CA VAL A 148 77.225 24.701 -4.900 1.00 25.00 C ATOM 1061 C VAL A 148 77.081 23.177 -4.778 1.00 25.00 C ATOM 1062 O VAL A 148 76.380 22.682 -3.908 1.00 25.00 O ATOM 1063 CB VAL A 148 78.144 25.219 -3.733 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.516 24.556 -3.756 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.323 26.750 -3.823 1.00 25.00 C ATOM 0 H VAL A 148 75.331 24.985 -4.055 1.00 25.00 H new ATOM 0 HA VAL A 148 77.665 24.939 -5.869 1.00 25.00 H new ATOM 0 HB VAL A 148 77.648 24.958 -2.798 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.120 24.941 -2.934 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.401 23.478 -3.647 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.010 24.775 -4.703 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.962 27.090 -3.008 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.784 27.007 -4.777 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.350 27.235 -3.748 1.00 25.00 H new ATOM 1075 N TYR A 149 77.770 22.441 -5.635 1.00 25.00 N ATOM 1076 CA TYR A 149 77.768 20.975 -5.614 1.00 25.00 C ATOM 1077 C TYR A 149 79.203 20.535 -5.858 1.00 25.00 C ATOM 1078 O TYR A 149 79.905 21.165 -6.642 1.00 25.00 O ATOM 1079 CB TYR A 149 76.845 20.455 -6.710 1.00 25.00 C ATOM 1080 CG TYR A 149 77.212 19.092 -7.234 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.973 17.928 -6.477 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.800 18.956 -8.509 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.305 16.649 -6.993 1.00 25.00 C ATOM 1084 CE2 TYR A 149 78.129 17.683 -9.025 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.874 16.540 -8.267 1.00 25.00 C ATOM 1086 OH TYR A 149 78.180 15.316 -8.801 1.00 25.00 O ATOM 0 H TYR A 149 78.352 22.840 -6.372 1.00 25.00 H new ATOM 0 HA TYR A 149 77.407 20.582 -4.664 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.826 20.421 -6.325 1.00 25.00 H new ATOM 0 HB3 TYR A 149 76.849 21.163 -7.539 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.533 18.010 -5.494 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.001 19.838 -9.099 1.00 25.00 H new ATOM 0 HE1 TYR A 149 77.119 15.762 -6.405 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.577 17.595 -10.004 1.00 25.00 H new ATOM 0 HH TYR A 149 78.087 15.352 -9.776 1.00 25.00 H new ATOM 1096 N ALA A 150 79.653 19.513 -5.131 1.00 25.00 N ATOM 1097 CA ALA A 150 81.047 19.045 -5.187 1.00 25.00 C ATOM 1098 C ALA A 150 82.023 20.224 -4.981 1.00 25.00 C ATOM 1099 O ALA A 150 83.015 20.359 -5.693 1.00 25.00 O ATOM 1100 CB ALA A 150 81.317 18.318 -6.524 1.00 25.00 C ATOM 0 H ALA A 150 79.066 18.984 -4.486 1.00 25.00 H new ATOM 0 HA ALA A 150 81.211 18.333 -4.378 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.352 17.978 -6.551 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.651 17.460 -6.613 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.139 19.003 -7.353 1.00 25.00 H new ATOM 1106 N GLU A 151 81.670 21.088 -4.029 1.00 25.00 N ATOM 1107 CA GLU A 151 82.418 22.315 -3.682 1.00 25.00 C ATOM 1108 C GLU A 151 82.604 23.325 -4.835 1.00 25.00 C ATOM 1109 O GLU A 151 83.358 24.290 -4.707 1.00 25.00 O ATOM 1110 CB GLU A 151 83.779 21.978 -3.051 1.00 25.00 C ATOM 1111 CG GLU A 151 83.660 21.175 -1.763 1.00 25.00 C ATOM 1112 CD GLU A 151 84.955 21.183 -0.966 1.00 25.00 C ATOM 1113 OE1 GLU A 151 85.984 20.695 -1.477 1.00 25.00 O ATOM 1114 OE2 GLU A 151 84.944 21.711 0.169 1.00 25.00 O1- ATOM 0 H GLU A 151 80.835 20.958 -3.458 1.00 25.00 H new ATOM 0 HA GLU A 151 81.781 22.818 -2.954 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.376 21.415 -3.769 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.317 22.904 -2.846 1.00 25.00 H new ATOM 0 HG2 GLU A 151 82.856 21.586 -1.152 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.387 20.147 -2.000 1.00 25.00 H new ATOM 1121 N ARG A 152 81.881 23.148 -5.936 1.00 25.00 N ATOM 1122 CA ARG A 152 81.966 24.065 -7.075 1.00 25.00 C ATOM 1123 C ARG A 152 80.594 24.662 -7.395 1.00 25.00 C ATOM 1124 O ARG A 152 79.580 23.981 -7.281 1.00 25.00 O ATOM 1125 CB ARG A 152 82.504 23.312 -8.291 1.00 25.00 C ATOM 1126 CG ARG A 152 83.922 22.779 -8.078 1.00 25.00 C ATOM 1127 CD ARG A 152 84.403 21.970 -9.271 1.00 25.00 C ATOM 1128 NE ARG A 152 84.534 22.805 -10.480 1.00 25.00 N ATOM 1129 CZ ARG A 152 85.586 23.557 -10.785 1.00 25.00 C ATOM 1130 NH1 ARG A 152 86.646 23.633 -10.016 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 85.565 24.257 -11.885 1.00 25.00 N ATOM 0 H ARG A 152 81.227 22.376 -6.067 1.00 25.00 H new ATOM 0 HA ARG A 152 82.641 24.882 -6.820 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.839 22.480 -8.521 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.496 23.975 -9.156 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.602 23.613 -7.906 1.00 25.00 H new ATOM 0 HG3 ARG A 152 83.947 22.157 -7.183 1.00 25.00 H new ATOM 0 HD2 ARG A 152 85.365 21.514 -9.037 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.704 21.157 -9.465 1.00 25.00 H new ATOM 0 HE ARG A 152 83.753 22.805 -11.136 1.00 25.00 H new ATOM 0 HH11 ARG A 152 86.684 23.102 -9.146 1.00 25.00 H new ATOM 0 HH12 ARG A 152 87.432 24.223 -10.288 1.00 25.00 H new ATOM 0 HH21 ARG A 152 84.749 24.222 -12.496 1.00 25.00 H new ATOM 0 HH22 ARG A 152 86.364 24.840 -12.134 1.00 25.00 H new ATOM 1145 N PRO A 153 80.537 25.956 -7.763 1.00 25.00 N ATOM 1146 CA PRO A 153 79.203 26.498 -8.054 1.00 25.00 C ATOM 1147 C PRO A 153 78.525 25.837 -9.253 1.00 25.00 C ATOM 1148 O PRO A 153 79.185 25.463 -10.225 1.00 25.00 O ATOM 1149 CB PRO A 153 79.485 27.974 -8.362 1.00 25.00 C ATOM 1150 CG PRO A 153 80.797 28.252 -7.717 1.00 25.00 C ATOM 1151 CD PRO A 153 81.574 26.989 -7.924 1.00 25.00 C ATOM 0 HA PRO A 153 78.519 26.328 -7.223 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.526 28.153 -9.436 1.00 25.00 H new ATOM 0 HB3 PRO A 153 78.703 28.618 -7.961 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.294 29.107 -8.175 1.00 25.00 H new ATOM 0 HG3 PRO A 153 80.681 28.481 -6.658 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.036 26.952 -8.911 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.375 26.879 -7.193 1.00 25.00 H new ATOM 1159 N LEU A 154 77.206 25.737 -9.195 1.00 25.00 N ATOM 1160 CA LEU A 154 76.416 25.201 -10.303 1.00 25.00 C ATOM 1161 C LEU A 154 75.980 26.384 -11.168 1.00 0.00 C ATOM 1162 O LEU A 154 75.333 27.307 -10.672 1.00 25.00 O ATOM 1163 CB LEU A 154 75.194 24.449 -9.761 1.00 25.00 C ATOM 1164 CG LEU A 154 75.447 23.062 -9.149 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.173 22.516 -8.511 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.926 22.069 -10.197 1.00 25.00 C ATOM 0 H LEU A 154 76.652 26.022 -8.387 1.00 25.00 H new ATOM 0 HA LEU A 154 77.003 24.497 -10.893 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.720 25.073 -9.003 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.477 24.335 -10.574 1.00 25.00 H new ATOM 0 HG LEU A 154 76.222 23.184 -8.392 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.372 21.533 -8.083 1.00 25.00 H new ATOM 0 HD12 LEU A 154 73.841 23.193 -7.724 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.394 22.430 -9.269 1.00 25.00 H new ATOM 0 HD21 LEU A 154 76.095 21.099 -9.729 1.00 25.00 H new ATOM 0 HD22 LEU A 154 75.170 21.969 -10.976 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.857 22.426 -10.638 1.00 25.00 H new ATOM 1178 N THR A 155 76.405 26.399 -12.429 1.00 25.00 N ATOM 1179 CA THR A 155 76.208 27.575 -13.292 1.00 25.00 C ATOM 1180 C THR A 155 75.547 27.347 -14.656 1.00 25.00 C ATOM 1181 O THR A 155 74.989 28.281 -15.216 1.00 25.00 O ATOM 1182 CB THR A 155 77.573 28.244 -13.592 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.414 27.314 -14.284 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.286 28.659 -12.309 1.00 25.00 C ATOM 0 H THR A 155 76.885 25.620 -12.879 1.00 25.00 H new ATOM 0 HA THR A 155 75.520 28.184 -12.706 1.00 25.00 H new ATOM 0 HB THR A 155 77.383 29.131 -14.197 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.278 27.735 -14.477 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.240 29.125 -12.557 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.667 29.370 -11.762 1.00 25.00 H new ATOM 0 HG23 THR A 155 78.462 27.779 -11.690 1.00 25.00 H new ATOM 1192 N ASP A 156 75.639 26.149 -15.218 1.00 25.00 N ATOM 1193 CA ASP A 156 75.086 25.903 -16.559 1.00 25.00 C ATOM 1194 C ASP A 156 73.615 25.531 -16.461 1.00 25.00 C ATOM 1195 O ASP A 156 73.268 24.389 -16.197 1.00 25.00 O ATOM 1196 CB ASP A 156 75.852 24.787 -17.267 1.00 25.00 C ATOM 1197 CG ASP A 156 75.390 24.582 -18.701 1.00 25.00 C ATOM 1198 OD1 ASP A 156 74.474 25.300 -19.169 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 75.969 23.697 -19.368 1.00 25.00 O1- ATOM 0 H ASP A 156 76.082 25.340 -14.782 1.00 25.00 H new ATOM 0 HA ASP A 156 75.188 26.819 -17.140 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.916 25.022 -17.262 1.00 25.00 H new ATOM 0 HB3 ASP A 156 75.728 23.857 -16.712 1.00 25.00 H new ATOM 1204 N ASN A 157 72.753 26.512 -16.663 1.00 25.00 N ATOM 1205 CA ASN A 157 71.316 26.320 -16.513 1.00 25.00 C ATOM 1206 C ASN A 157 70.717 25.327 -17.509 1.00 25.00 C ATOM 1207 O ASN A 157 69.642 24.793 -17.260 1.00 25.00 O ATOM 1208 CB ASN A 157 70.605 27.668 -16.668 1.00 25.00 C ATOM 1209 CG ASN A 157 70.751 28.239 -18.056 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.796 28.766 -18.401 1.00 25.00 O ATOM 1211 ND2 ASN A 157 69.725 28.131 -18.853 1.00 25.00 N ATOM 0 H ASN A 157 73.023 27.458 -16.933 1.00 25.00 H new ATOM 0 HA ASN A 157 71.165 25.899 -15.519 1.00 25.00 H new ATOM 0 HB2 ASN A 157 69.547 27.546 -16.438 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.009 28.374 -15.943 1.00 25.00 H new ATOM 0 HD21 ASN A 157 69.778 28.494 -19.805 1.00 25.00 H new ATOM 0 HD22 ASN A 157 68.869 27.683 -18.525 1.00 25.00 H new ATOM 1218 N HIS A 158 71.395 25.102 -18.628 1.00 25.00 N ATOM 1219 CA HIS A 158 70.878 24.225 -19.680 1.00 25.00 C ATOM 1220 C HIS A 158 71.166 22.763 -19.392 1.00 25.00 C ATOM 1221 O HIS A 158 70.565 21.870 -19.977 1.00 25.00 O ATOM 1222 CB HIS A 158 71.532 24.574 -21.017 1.00 25.00 C ATOM 1223 CG HIS A 158 71.444 26.024 -21.367 1.00 25.00 C ATOM 1224 ND1 HIS A 158 72.443 26.933 -21.129 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.446 26.739 -21.954 1.00 25.00 C ATOM 1226 CE1 HIS A 158 72.032 28.124 -21.555 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.817 28.066 -22.064 1.00 25.00 N ATOM 0 H HIS A 158 72.305 25.514 -18.834 1.00 25.00 H new ATOM 0 HA HIS A 158 69.799 24.376 -19.718 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.581 24.280 -20.986 1.00 25.00 H new ATOM 0 HB3 HIS A 158 71.060 23.989 -21.806 1.00 25.00 H new ATOM 0 HD1 HIS A 158 73.346 26.731 -20.699 1.00 25.00 H new ATOM 0 HD2 HIS A 158 69.503 26.330 -22.285 1.00 25.00 H new ATOM 0 HE1 HIS A 158 72.621 29.027 -21.492 1.00 25.00 H new ATOM 1235 N ARG A 159 72.139 22.513 -18.531 1.00 25.00 N ATOM 1236 CA ARG A 159 72.534 21.145 -18.232 1.00 25.00 C ATOM 1237 C ARG A 159 71.520 20.503 -17.318 1.00 25.00 C ATOM 1238 O ARG A 159 70.990 21.146 -16.416 1.00 25.00 O ATOM 1239 CB ARG A 159 73.899 21.121 -17.557 1.00 25.00 C ATOM 1240 CG ARG A 159 74.981 20.584 -18.452 1.00 25.00 C ATOM 1241 CD ARG A 159 76.336 20.659 -17.772 1.00 25.00 C ATOM 1242 NE ARG A 159 77.361 19.945 -18.550 1.00 25.00 N ATOM 1243 CZ ARG A 159 77.988 20.422 -19.621 1.00 25.00 C ATOM 1244 NH1 ARG A 159 77.757 21.614 -20.115 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.875 19.671 -20.213 1.00 25.00 N ATOM 0 H ARG A 159 72.665 23.230 -18.031 1.00 25.00 H new ATOM 0 HA ARG A 159 72.587 20.591 -19.169 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.162 22.131 -17.242 1.00 25.00 H new ATOM 0 HB3 ARG A 159 73.843 20.511 -16.656 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.759 19.550 -18.716 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.005 21.153 -19.382 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.628 21.702 -17.651 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.269 20.229 -16.773 1.00 25.00 H new ATOM 0 HE ARG A 159 77.611 19.005 -18.242 1.00 25.00 H new ATOM 0 HH11 ARG A 159 77.068 22.224 -19.675 1.00 25.00 H new ATOM 0 HH12 ARG A 159 78.266 21.932 -20.940 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.075 18.738 -19.853 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.368 20.017 -21.036 1.00 25.00 H new ATOM 1259 N SER A 160 71.299 19.217 -17.505 1.00 25.00 N ATOM 1260 CA SER A 160 70.464 18.470 -16.591 1.00 25.00 C ATOM 1261 C SER A 160 71.305 18.078 -15.389 1.00 25.00 C ATOM 1262 O SER A 160 72.538 18.112 -15.437 1.00 25.00 O ATOM 1263 CB SER A 160 69.898 17.235 -17.269 1.00 25.00 C ATOM 1264 OG SER A 160 70.919 16.372 -17.741 1.00 25.00 O ATOM 0 H SER A 160 71.684 18.672 -18.277 1.00 25.00 H new ATOM 0 HA SER A 160 69.623 19.085 -16.273 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.263 16.695 -16.567 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.265 17.538 -18.103 1.00 25.00 H new ATOM 0 HG SER A 160 70.526 15.685 -18.319 1.00 25.00 H new ATOM 1270 N LEU A 161 70.653 17.698 -14.307 1.00 25.00 N ATOM 1271 CA LEU A 161 71.360 17.322 -13.085 1.00 25.00 C ATOM 1272 C LEU A 161 72.187 16.044 -13.289 1.00 25.00 C ATOM 1273 O LEU A 161 73.307 15.919 -12.768 1.00 25.00 O ATOM 1274 CB LEU A 161 70.338 17.139 -11.961 1.00 25.00 C ATOM 1275 CG LEU A 161 69.573 18.423 -11.592 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.400 18.079 -10.697 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.489 19.439 -10.895 1.00 25.00 C ATOM 0 H LEU A 161 69.637 17.640 -14.243 1.00 25.00 H new ATOM 0 HA LEU A 161 72.060 18.114 -12.817 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.621 16.374 -12.258 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.852 16.767 -11.074 1.00 25.00 H new ATOM 0 HG LEU A 161 69.208 18.879 -12.512 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.861 18.990 -10.438 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.730 17.397 -11.221 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.764 17.602 -9.787 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.918 20.334 -10.648 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.890 19.000 -9.981 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.310 19.705 -11.560 1.00 25.00 H new ATOM 1289 N ALA A 162 71.684 15.134 -14.115 1.00 25.00 N ATOM 1290 CA ALA A 162 72.421 13.914 -14.453 1.00 25.00 C ATOM 1291 C ALA A 162 73.721 14.253 -15.186 1.00 25.00 C ATOM 1292 O ALA A 162 74.718 13.552 -15.046 1.00 25.00 O ATOM 1293 CB ALA A 162 71.558 12.992 -15.314 1.00 25.00 C ATOM 0 H ALA A 162 70.772 15.214 -14.564 1.00 25.00 H new ATOM 0 HA ALA A 162 72.670 13.398 -13.526 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.120 12.090 -15.557 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.656 12.721 -14.766 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.282 13.507 -16.235 1.00 25.00 H new ATOM 1299 N SER A 163 73.722 15.353 -15.927 1.00 25.00 N ATOM 1300 CA SER A 163 74.920 15.799 -16.645 1.00 25.00 C ATOM 1301 C SER A 163 76.007 16.294 -15.688 1.00 25.00 C ATOM 1302 O SER A 163 77.171 16.403 -16.071 1.00 25.00 O ATOM 1303 CB SER A 163 74.576 16.908 -17.638 1.00 25.00 C ATOM 1304 OG SER A 163 73.616 16.475 -18.587 1.00 25.00 O ATOM 0 H SER A 163 72.909 15.957 -16.050 1.00 25.00 H new ATOM 0 HA SER A 163 75.305 14.934 -17.185 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.192 17.774 -17.099 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.481 17.229 -18.154 1.00 25.00 H new ATOM 0 HG SER A 163 72.726 16.480 -18.178 1.00 25.00 H new ATOM 1310 N TYR A 164 75.636 16.577 -14.443 1.00 25.00 N ATOM 1311 CA TYR A 164 76.607 16.954 -13.412 1.00 25.00 C ATOM 1312 C TYR A 164 76.919 15.751 -12.527 1.00 25.00 C ATOM 1313 O TYR A 164 77.810 15.801 -11.680 1.00 25.00 O ATOM 1314 CB TYR A 164 76.045 18.063 -12.532 1.00 25.00 C ATOM 1315 CG TYR A 164 76.238 19.444 -13.081 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.452 20.128 -12.878 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.207 20.093 -13.784 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.634 21.445 -13.357 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.382 21.413 -14.266 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.598 22.081 -14.040 1.00 25.00 C ATOM 1321 OH TYR A 164 76.810 23.366 -14.466 1.00 25.00 O ATOM 0 H TYR A 164 74.669 16.553 -14.120 1.00 25.00 H new ATOM 0 HA TYR A 164 77.512 17.302 -13.909 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.979 17.889 -12.385 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.516 18.006 -11.551 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.256 19.639 -12.348 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.273 19.580 -13.958 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.571 21.957 -13.195 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.585 21.904 -14.805 1.00 25.00 H new ATOM 0 HH TYR A 164 77.335 23.354 -15.293 1.00 25.00 H new ATOM 1331 N GLY A 165 76.170 14.676 -12.721 1.00 25.00 N ATOM 1332 CA GLY A 165 76.344 13.481 -11.919 1.00 25.00 C ATOM 1333 C GLY A 165 75.557 13.497 -10.623 1.00 25.00 C ATOM 1334 O GLY A 165 75.872 12.719 -9.722 1.00 25.00 O ATOM 0 H GLY A 165 75.437 14.610 -13.427 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.043 12.613 -12.506 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.403 13.359 -11.690 1.00 25.00 H new ATOM 1338 N LEU A 166 74.530 14.337 -10.518 1.00 25.00 N ATOM 1339 CA LEU A 166 73.704 14.366 -9.307 1.00 25.00 C ATOM 1340 C LEU A 166 72.821 13.125 -9.257 1.00 25.00 C ATOM 1341 O LEU A 166 71.671 13.142 -9.681 1.00 25.00 O ATOM 1342 CB LEU A 166 72.807 15.611 -9.261 1.00 25.00 C ATOM 1343 CG LEU A 166 73.323 16.920 -8.650 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.739 16.719 -7.204 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.456 17.518 -9.438 1.00 25.00 C ATOM 0 H LEU A 166 74.250 14.998 -11.243 1.00 25.00 H new ATOM 0 HA LEU A 166 74.378 14.392 -8.451 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.508 15.830 -10.286 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.903 15.336 -8.717 1.00 25.00 H new ATOM 0 HG LEU A 166 72.493 17.626 -8.686 1.00 25.00 H new ATOM 0 HD11 LEU A 166 74.101 17.662 -6.795 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.883 16.376 -6.623 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.533 15.974 -7.154 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.783 18.442 -8.962 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.287 16.814 -9.472 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.120 17.732 -10.453 1.00 25.00 H new ATOM 1357 N LYS A 167 73.387 12.040 -8.767 1.00 25.00 N ATOM 1358 CA LYS A 167 72.661 10.781 -8.617 1.00 25.00 C ATOM 1359 C LYS A 167 71.768 10.858 -7.393 1.00 25.00 C ATOM 1360 O LYS A 167 71.985 11.679 -6.508 1.00 25.00 O ATOM 1361 CB LYS A 167 73.644 9.628 -8.455 1.00 25.00 C ATOM 1362 CG LYS A 167 74.510 9.420 -9.677 1.00 25.00 C ATOM 1363 CD LYS A 167 75.532 8.345 -9.435 1.00 25.00 C ATOM 1364 CE LYS A 167 76.463 8.244 -10.623 1.00 25.00 C ATOM 1365 NZ LYS A 167 77.515 7.213 -10.379 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.359 11.999 -8.461 1.00 25.00 H new ATOM 0 HA LYS A 167 72.054 10.610 -9.506 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.282 9.819 -7.592 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.091 8.712 -8.247 1.00 25.00 H new ATOM 0 HG2 LYS A 167 73.885 9.148 -10.528 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.012 10.353 -9.935 1.00 25.00 H new ATOM 0 HD2 LYS A 167 76.102 8.569 -8.533 1.00 25.00 H new ATOM 0 HD3 LYS A 167 75.035 7.389 -9.269 1.00 25.00 H new ATOM 0 HE2 LYS A 167 75.894 7.987 -11.517 1.00 25.00 H new ATOM 0 HE3 LYS A 167 76.930 9.211 -10.809 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 78.145 7.157 -11.205 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 78.069 7.474 -9.538 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 77.065 6.288 -10.224 1.00 25.00 H new ATOM 1379 N ASP A 168 70.792 9.972 -7.323 1.00 25.00 N ATOM 1380 CA ASP A 168 69.916 9.902 -6.167 1.00 25.00 C ATOM 1381 C ASP A 168 70.762 9.677 -4.912 1.00 25.00 C ATOM 1382 O ASP A 168 71.657 8.833 -4.883 1.00 25.00 O ATOM 1383 CB ASP A 168 68.861 8.794 -6.338 1.00 25.00 C ATOM 1384 CG ASP A 168 69.469 7.435 -6.714 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.070 7.324 -7.816 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.238 6.457 -5.973 1.00 25.00 O1- ATOM 0 H ASP A 168 70.585 9.290 -8.053 1.00 25.00 H new ATOM 0 HA ASP A 168 69.375 10.843 -6.067 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.299 8.689 -5.410 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.151 9.093 -7.109 1.00 25.00 H new ATOM 1391 N GLY A 169 70.508 10.499 -3.902 1.00 25.00 N ATOM 1392 CA GLY A 169 71.270 10.454 -2.664 1.00 25.00 C ATOM 1393 C GLY A 169 72.355 11.513 -2.553 1.00 25.00 C ATOM 1394 O GLY A 169 72.899 11.708 -1.466 1.00 25.00 O ATOM 0 H GLY A 169 69.775 11.208 -3.918 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.583 10.566 -1.825 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.729 9.470 -2.570 1.00 25.00 H new ATOM 1398 N ASP A 170 72.680 12.207 -3.639 1.00 25.00 N ATOM 1399 CA ASP A 170 73.711 13.255 -3.584 1.00 25.00 C ATOM 1400 C ASP A 170 73.199 14.505 -2.843 1.00 25.00 C ATOM 1401 O ASP A 170 71.981 14.684 -2.653 1.00 25.00 O ATOM 1402 CB ASP A 170 74.183 13.625 -4.991 1.00 25.00 C ATOM 1403 CG ASP A 170 75.675 13.910 -5.049 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.204 14.588 -4.138 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.326 13.437 -6.001 1.00 25.00 O1- ATOM 0 H ASP A 170 72.256 12.072 -4.557 1.00 25.00 H new ATOM 0 HA ASP A 170 74.559 12.856 -3.027 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.945 12.811 -5.676 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.635 14.502 -5.335 1.00 25.00 H new ATOM 1410 N VAL A 171 74.127 15.349 -2.405 1.00 25.00 N ATOM 1411 CA VAL A 171 73.808 16.521 -1.583 1.00 25.00 C ATOM 1412 C VAL A 171 74.308 17.819 -2.228 1.00 25.00 C ATOM 1413 O VAL A 171 75.469 17.932 -2.628 1.00 25.00 O ATOM 1414 CB VAL A 171 74.436 16.389 -0.156 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.977 17.546 0.760 1.00 25.00 C ATOM 1416 CG2 VAL A 171 74.049 15.038 0.487 1.00 25.00 C ATOM 0 H VAL A 171 75.121 15.244 -2.607 1.00 25.00 H new ATOM 0 HA VAL A 171 72.722 16.563 -1.504 1.00 25.00 H new ATOM 0 HB VAL A 171 75.519 16.436 -0.266 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.428 17.430 1.746 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.288 18.497 0.328 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.891 17.527 0.853 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.496 14.966 1.479 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.964 14.973 0.572 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.414 14.221 -0.136 1.00 25.00 H new ATOM 1426 N VAL A 172 73.429 18.807 -2.300 1.00 25.00 N ATOM 1427 CA VAL A 172 73.752 20.116 -2.862 1.00 25.00 C ATOM 1428 C VAL A 172 73.742 21.138 -1.730 1.00 25.00 C ATOM 1429 O VAL A 172 72.872 21.101 -0.869 1.00 25.00 O ATOM 1430 CB VAL A 172 72.710 20.518 -3.943 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.110 21.825 -4.623 1.00 25.00 C ATOM 1432 CG2 VAL A 172 72.591 19.412 -4.995 1.00 25.00 C ATOM 0 H VAL A 172 72.467 18.726 -1.970 1.00 25.00 H new ATOM 0 HA VAL A 172 74.734 20.080 -3.334 1.00 25.00 H new ATOM 0 HB VAL A 172 71.748 20.659 -3.451 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.366 22.086 -5.376 1.00 25.00 H new ATOM 0 HG12 VAL A 172 73.168 22.619 -3.879 1.00 25.00 H new ATOM 0 HG13 VAL A 172 74.082 21.704 -5.101 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.859 19.703 -5.748 1.00 25.00 H new ATOM 0 HG22 VAL A 172 73.559 19.257 -5.471 1.00 25.00 H new ATOM 0 HG23 VAL A 172 72.270 18.487 -4.516 1.00 25.00 H new ATOM 1442 N ILE A 173 74.707 22.043 -1.717 1.00 25.00 N ATOM 1443 CA ILE A 173 74.801 23.061 -0.674 1.00 25.00 C ATOM 1444 C ILE A 173 74.362 24.396 -1.267 1.00 25.00 C ATOM 1445 O ILE A 173 74.872 24.833 -2.292 1.00 25.00 O ATOM 1446 CB ILE A 173 76.253 23.174 -0.117 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.733 21.797 0.400 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.311 24.228 1.031 1.00 25.00 C ATOM 1449 CD1 ILE A 173 78.226 21.738 0.776 1.00 25.00 C ATOM 0 H ILE A 173 75.443 22.096 -2.421 1.00 25.00 H new ATOM 0 HA ILE A 173 74.155 22.781 0.158 1.00 25.00 H new ATOM 0 HB ILE A 173 76.912 23.498 -0.922 1.00 25.00 H new ATOM 0 HG12 ILE A 173 76.141 21.525 1.274 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.535 21.047 -0.366 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.330 24.297 1.411 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.000 25.200 0.648 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.643 23.925 1.837 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.473 20.736 1.128 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.831 21.975 -0.099 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.431 22.461 1.566 1.00 25.00 H new ATOM 1461 N LEU A 174 73.422 25.052 -0.615 1.00 25.00 N ATOM 1462 CA LEU A 174 72.918 26.349 -1.044 1.00 25.00 C ATOM 1463 C LEU A 174 73.327 27.326 0.050 1.00 25.00 C ATOM 1464 O LEU A 174 73.200 27.020 1.223 1.00 25.00 O ATOM 1465 CB LEU A 174 71.393 26.265 -1.201 1.00 25.00 C ATOM 1466 CG LEU A 174 70.635 27.390 -1.930 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.187 26.943 -2.102 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.660 28.723 -1.189 1.00 25.00 C ATOM 0 H LEU A 174 72.981 24.700 0.235 1.00 25.00 H new ATOM 0 HA LEU A 174 73.318 26.670 -2.006 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.171 25.333 -1.721 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.967 26.181 -0.201 1.00 25.00 H new ATOM 0 HG LEU A 174 71.132 27.559 -2.885 1.00 25.00 H new ATOM 0 HD11 LEU A 174 68.624 27.722 -2.617 1.00 25.00 H new ATOM 0 HD12 LEU A 174 69.157 26.025 -2.689 1.00 25.00 H new ATOM 0 HD13 LEU A 174 68.743 26.762 -1.123 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.107 29.468 -1.761 1.00 25.00 H new ATOM 0 HD22 LEU A 174 70.199 28.603 -0.208 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.692 29.052 -1.067 1.00 25.00 H new ATOM 1480 N ARG A 175 73.865 28.477 -0.319 1.00 25.00 N ATOM 1481 CA ARG A 175 74.299 29.476 0.660 1.00 25.00 C ATOM 1482 C ARG A 175 73.669 30.818 0.340 1.00 25.00 C ATOM 1483 O ARG A 175 73.851 31.356 -0.749 1.00 25.00 O ATOM 1484 CB ARG A 175 75.824 29.586 0.656 1.00 25.00 C ATOM 1485 CG ARG A 175 76.510 28.336 1.212 1.00 25.00 C ATOM 1486 CD ARG A 175 78.012 28.363 1.003 1.00 25.00 C ATOM 1487 NE ARG A 175 78.645 29.503 1.690 1.00 25.00 N ATOM 1488 CZ ARG A 175 79.951 29.738 1.734 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.826 28.939 1.171 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.386 30.796 2.357 1.00 25.00 N ATOM 0 H ARG A 175 74.014 28.749 -1.291 1.00 25.00 H new ATOM 0 HA ARG A 175 73.977 29.166 1.654 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.168 29.761 -0.363 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.123 30.452 1.247 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.295 28.250 2.277 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.094 27.451 0.730 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.446 27.433 1.370 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.229 28.417 -0.064 1.00 25.00 H new ATOM 0 HE ARG A 175 78.032 30.163 2.169 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.511 28.104 0.678 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.822 29.153 1.226 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.726 31.432 2.804 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.387 30.988 2.398 1.00 25.00 H new ATOM 1504 N GLN A 176 72.915 31.343 1.303 1.00 25.00 N ATOM 1505 CA GLN A 176 72.225 32.638 1.190 1.00 25.00 C ATOM 1506 C GLN A 176 72.995 33.733 1.940 1.00 25.00 C ATOM 1507 O GLN A 176 73.567 33.555 3.006 1.00 25.00 O ATOM 1508 CB GLN A 176 70.768 32.482 1.684 1.00 25.00 C ATOM 1509 CG GLN A 176 69.886 33.733 1.412 1.00 25.00 C ATOM 1510 CD GLN A 176 69.845 34.683 2.590 1.00 25.00 C ATOM 1511 OE1 GLN A 176 70.437 34.503 3.629 1.00 25.00 O ATOM 1512 NE2 GLN A 176 69.085 35.752 2.457 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.083 34.770 1.343 1.00 25.00 O ATOM 0 H GLN A 176 72.760 30.879 2.198 1.00 25.00 H new ATOM 0 HA GLN A 176 72.191 32.953 0.147 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.318 31.617 1.197 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.775 32.278 2.755 1.00 25.00 H new ATOM 0 HG2 GLN A 176 70.269 34.260 0.538 1.00 25.00 H new ATOM 0 HG3 GLN A 176 68.872 33.413 1.172 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.581 35.914 1.585 1.00 25.00 H new ATOM 0 HE22 GLN A 176 69.001 36.417 3.226 1.00 25.00 H new