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 180:sc= 0.839 USER MOD Set 1.2: A 163 SER OG : rot 72:sc= 0.982 USER MOD Set 2.1: A 107 CYS SG : rot -140:sc= 0.103 USER MOD Set 2.2: A 138 SER OG : rot 178:sc= 0.108 USER MOD Set 3.1: A 104 THR OG1 : rot -58:sc= 0.0648 USER MOD Set 3.2: A 118 SER OG : rot 180:sc= 0.0538 USER MOD Single : A 100 HIS : no HE2:sc= 0.0467 K(o=0.047,f=-0.81) USER MOD Single : A 101 MET CE :methyl -155:sc= -0.0309 (180deg=-0.218) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot -150:sc= -0.428 USER MOD Single : A 116 THR OG1 : rot 33:sc= 0.883 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 129 ASN : amide:sc= -0.508 K(o=-0.51,f=-1.3) USER MOD Single : A 134 CYS SG : rot -23:sc= -0.702 USER MOD Single : A 145 SER OG : rot 90:sc= 0.523 USER MOD Single : A 146 GLN : amide:sc= -0.0224 X(o=-0.022,f=-0.021) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0.0658 USER MOD Single : A 157 ASN : amide:sc= -0.463 X(o=-0.46,f=-0.61) 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= -0.374 USER MOD Single : A 167 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0395) USER MOD Single : A 176 GLN : amide:sc= -1.32 K(o=-1.3,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 61.804 8.844 -11.124 1.00 25.00 N ATOM 307 CA HIS A 100 62.447 10.117 -10.821 1.00 25.00 C ATOM 308 C HIS A 100 63.439 9.785 -9.725 1.00 25.00 C ATOM 309 O HIS A 100 63.449 8.657 -9.233 1.00 25.00 O ATOM 310 CB HIS A 100 61.409 11.138 -10.342 1.00 25.00 C ATOM 311 CG HIS A 100 60.714 10.737 -9.080 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.205 10.957 -7.814 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.529 10.104 -8.891 1.00 25.00 C ATOM 314 CE1 HIS A 100 60.338 10.464 -6.944 1.00 25.00 C ATOM 315 NE2 HIS A 100 59.297 9.924 -7.547 1.00 25.00 N ATOM 0 HA HIS A 100 62.933 10.563 -11.689 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.901 12.098 -10.187 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.666 11.283 -11.126 1.00 25.00 H new ATOM 0 HD1 HIS A 100 62.085 11.420 -7.585 1.00 25.00 H new ATOM 0 HD2 HIS A 100 58.864 9.787 -9.681 1.00 25.00 H new ATOM 0 HE1 HIS A 100 60.467 10.500 -5.872 1.00 25.00 H new ATOM 323 N MET A 101 64.248 10.751 -9.329 1.00 25.00 N ATOM 324 CA MET A 101 65.244 10.552 -8.284 1.00 25.00 C ATOM 325 C MET A 101 65.021 11.577 -7.174 1.00 25.00 C ATOM 326 O MET A 101 64.088 12.388 -7.246 1.00 25.00 O ATOM 327 CB MET A 101 66.652 10.668 -8.879 1.00 25.00 C ATOM 328 CG MET A 101 66.985 12.029 -9.454 1.00 25.00 C ATOM 329 SD MET A 101 68.612 12.022 -10.211 1.00 25.00 S ATOM 330 CE MET A 101 68.783 13.742 -10.660 1.00 25.00 C ATOM 0 H MET A 101 64.236 11.693 -9.719 1.00 25.00 H new ATOM 0 HA MET A 101 65.143 9.554 -7.857 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.380 10.428 -8.104 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.763 9.920 -9.664 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.236 12.309 -10.195 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.949 12.780 -8.665 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.480 13.833 -11.493 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.812 14.139 -10.955 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.161 14.305 -9.807 1.00 25.00 H new ATOM 340 N LEU A 102 65.858 11.517 -6.149 1.00 25.00 N ATOM 341 CA LEU A 102 65.746 12.398 -4.992 1.00 25.00 C ATOM 342 C LEU A 102 67.115 12.990 -4.690 1.00 25.00 C ATOM 343 O LEU A 102 68.099 12.257 -4.597 1.00 25.00 O ATOM 344 CB LEU A 102 65.252 11.580 -3.788 1.00 25.00 C ATOM 345 CG LEU A 102 64.911 12.367 -2.514 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.542 13.034 -2.636 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.914 11.413 -1.313 1.00 25.00 C ATOM 0 H LEU A 102 66.634 10.857 -6.094 1.00 25.00 H new ATOM 0 HA LEU A 102 65.040 13.203 -5.195 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.364 11.026 -4.094 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.017 10.844 -3.539 1.00 25.00 H new ATOM 0 HG LEU A 102 65.661 13.145 -2.373 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.323 13.585 -1.721 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.546 13.721 -3.482 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.779 12.272 -2.792 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.672 11.968 -0.407 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.171 10.630 -1.468 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.901 10.961 -1.210 1.00 25.00 H new ATOM 359 N LEU A 103 67.185 14.300 -4.522 1.00 25.00 N ATOM 360 CA LEU A 103 68.436 14.986 -4.174 1.00 25.00 C ATOM 361 C LEU A 103 68.225 15.756 -2.897 1.00 25.00 C ATOM 362 O LEU A 103 67.129 16.247 -2.651 1.00 25.00 O ATOM 363 CB LEU A 103 68.857 15.974 -5.265 1.00 25.00 C ATOM 364 CG LEU A 103 69.253 15.385 -6.625 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.593 16.534 -7.566 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.443 14.463 -6.515 1.00 25.00 C ATOM 0 H LEU A 103 66.384 14.924 -4.621 1.00 25.00 H new ATOM 0 HA LEU A 103 69.218 14.234 -4.063 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.035 16.672 -5.425 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.700 16.554 -4.889 1.00 25.00 H new ATOM 0 HG LEU A 103 68.416 14.799 -7.005 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.877 16.135 -8.540 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.723 17.181 -7.679 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.422 17.109 -7.153 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.690 14.068 -7.501 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.296 15.016 -6.122 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.204 13.639 -5.843 1.00 25.00 H new ATOM 378 N THR A 104 69.265 15.880 -2.093 1.00 25.00 N ATOM 379 CA THR A 104 69.184 16.610 -0.833 1.00 25.00 C ATOM 380 C THR A 104 69.779 18.002 -1.029 1.00 25.00 C ATOM 381 O THR A 104 70.724 18.183 -1.787 1.00 25.00 O ATOM 382 CB THR A 104 69.927 15.829 0.272 1.00 25.00 C ATOM 383 OG1 THR A 104 69.409 14.498 0.325 1.00 25.00 O ATOM 384 CG2 THR A 104 69.724 16.455 1.649 1.00 25.00 C ATOM 0 H THR A 104 70.184 15.483 -2.289 1.00 25.00 H new ATOM 0 HA THR A 104 68.144 16.716 -0.523 1.00 25.00 H new ATOM 0 HB THR A 104 70.989 15.846 0.029 1.00 25.00 H new ATOM 0 HG1 THR A 104 68.444 14.529 0.490 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.264 15.874 2.396 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.101 17.478 1.643 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.662 16.462 1.893 1.00 25.00 H new ATOM 392 N VAL A 105 69.207 18.996 -0.369 1.00 25.00 N ATOM 393 CA VAL A 105 69.679 20.373 -0.447 1.00 25.00 C ATOM 394 C VAL A 105 69.947 20.845 0.974 1.00 25.00 C ATOM 395 O VAL A 105 69.089 20.718 1.839 1.00 25.00 O ATOM 396 CB VAL A 105 68.602 21.283 -1.082 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.097 22.738 -1.202 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.161 20.746 -2.460 1.00 25.00 C ATOM 0 H VAL A 105 68.398 18.872 0.240 1.00 25.00 H new ATOM 0 HA VAL A 105 70.578 20.422 -1.062 1.00 25.00 H new ATOM 0 HB VAL A 105 67.736 21.274 -0.420 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.317 23.352 -1.652 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.336 23.124 -0.211 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.989 22.768 -1.828 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.403 21.406 -2.882 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.022 20.707 -3.128 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.746 19.745 -2.345 1.00 25.00 H new ATOM 408 N TYR A 106 71.127 21.400 1.210 1.00 25.00 N ATOM 409 CA TYR A 106 71.483 21.959 2.514 1.00 25.00 C ATOM 410 C TYR A 106 71.645 23.476 2.357 1.00 25.00 C ATOM 411 O TYR A 106 72.602 23.943 1.739 1.00 25.00 O ATOM 412 CB TYR A 106 72.769 21.313 3.031 1.00 25.00 C ATOM 413 CG TYR A 106 72.957 21.440 4.534 1.00 25.00 C ATOM 414 CD1 TYR A 106 73.139 22.693 5.142 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.960 20.291 5.357 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.327 22.803 6.554 1.00 25.00 C ATOM 417 CE2 TYR A 106 73.143 20.401 6.759 1.00 25.00 C ATOM 418 CZ TYR A 106 73.319 21.660 7.341 1.00 25.00 C ATOM 419 OH TYR A 106 73.504 21.771 8.695 1.00 25.00 O ATOM 0 H TYR A 106 71.864 21.477 0.509 1.00 25.00 H new ATOM 0 HA TYR A 106 70.700 21.754 3.244 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.768 20.257 2.762 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.622 21.769 2.528 1.00 25.00 H new ATOM 0 HD1 TYR A 106 73.137 23.585 4.534 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.821 19.317 4.912 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.475 23.772 7.007 1.00 25.00 H new ATOM 0 HE2 TYR A 106 73.146 19.514 7.376 1.00 25.00 H new ATOM 0 HH TYR A 106 73.470 20.881 9.104 1.00 25.00 H new ATOM 429 N CYS A 107 70.695 24.239 2.864 1.00 25.00 N ATOM 430 CA CYS A 107 70.704 25.693 2.722 1.00 25.00 C ATOM 431 C CYS A 107 71.315 26.294 3.979 1.00 25.00 C ATOM 432 O CYS A 107 70.911 25.962 5.080 1.00 25.00 O ATOM 433 CB CYS A 107 69.280 26.206 2.524 1.00 25.00 C ATOM 434 SG CYS A 107 69.191 27.960 2.066 1.00 25.00 S ATOM 0 H CYS A 107 69.896 23.876 3.384 1.00 25.00 H new ATOM 0 HA CYS A 107 71.293 25.983 1.852 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.794 25.613 1.749 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.717 26.051 3.444 1.00 25.00 H new ATOM 0 HG CYS A 107 68.197 28.521 2.688 1.00 25.00 H new ATOM 440 N VAL A 108 72.307 27.156 3.801 1.00 25.00 N ATOM 441 CA VAL A 108 73.064 27.736 4.914 1.00 25.00 C ATOM 442 C VAL A 108 72.923 29.252 4.958 1.00 25.00 C ATOM 443 O VAL A 108 73.143 29.956 3.957 1.00 25.00 O ATOM 444 CB VAL A 108 74.590 27.388 4.794 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.377 27.921 6.011 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.785 25.876 4.689 1.00 25.00 C ATOM 0 H VAL A 108 72.614 27.476 2.882 1.00 25.00 H new ATOM 0 HA VAL A 108 72.653 27.308 5.828 1.00 25.00 H new ATOM 0 HB VAL A 108 74.970 27.867 3.892 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.431 27.666 5.902 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.269 29.004 6.068 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.987 27.469 6.923 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.848 25.651 4.606 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.380 25.394 5.579 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.266 25.503 3.806 1.00 25.00 H new ATOM 456 N ARG A 109 72.623 29.765 6.148 1.00 25.00 N ATOM 457 CA ARG A 109 72.593 31.203 6.408 1.00 25.00 C ATOM 458 C ARG A 109 73.560 31.466 7.535 1.00 25.00 C ATOM 459 O ARG A 109 73.653 30.679 8.463 1.00 25.00 O ATOM 460 CB ARG A 109 71.186 31.640 6.830 1.00 25.00 C ATOM 461 CG ARG A 109 70.252 31.935 5.661 1.00 25.00 C ATOM 462 CD ARG A 109 69.707 33.364 5.757 1.00 25.00 C ATOM 463 NE ARG A 109 68.545 33.455 6.664 1.00 25.00 N ATOM 464 CZ ARG A 109 67.275 33.528 6.280 1.00 25.00 C ATOM 465 NH1 ARG A 109 66.908 33.542 5.021 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 66.341 33.595 7.193 1.00 25.00 N ATOM 0 H ARG A 109 72.393 29.195 6.962 1.00 25.00 H new ATOM 0 HA ARG A 109 72.865 31.760 5.511 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.743 30.858 7.447 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.265 32.531 7.453 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.786 31.806 4.720 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.426 31.224 5.659 1.00 25.00 H new ATOM 0 HD2 ARG A 109 70.495 34.029 6.110 1.00 25.00 H new ATOM 0 HD3 ARG A 109 69.419 33.709 4.764 1.00 25.00 H new ATOM 0 HE ARG A 109 68.733 33.462 7.667 1.00 25.00 H new ATOM 0 HH11 ARG A 109 67.612 33.496 4.284 1.00 25.00 H new ATOM 0 HH12 ARG A 109 65.919 33.599 4.779 1.00 25.00 H new ATOM 0 HH21 ARG A 109 66.593 33.591 8.181 1.00 25.00 H new ATOM 0 HH22 ARG A 109 65.361 33.652 6.917 1.00 25.00 H new ATOM 480 N ARG A 110 74.254 32.594 7.483 1.00 25.00 N ATOM 481 CA ARG A 110 75.237 32.952 8.524 1.00 25.00 C ATOM 482 C ARG A 110 74.578 33.218 9.882 1.00 25.00 C ATOM 483 O ARG A 110 75.256 33.312 10.892 1.00 25.00 O ATOM 484 CB ARG A 110 76.034 34.193 8.098 1.00 25.00 C ATOM 485 CG ARG A 110 75.257 35.509 8.234 1.00 25.00 C ATOM 486 CD ARG A 110 76.036 36.678 7.653 1.00 25.00 C ATOM 487 NE ARG A 110 75.380 37.948 8.027 1.00 25.00 N ATOM 488 CZ ARG A 110 75.730 39.152 7.587 1.00 25.00 C ATOM 489 NH1 ARG A 110 76.713 39.340 6.746 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 75.065 40.193 8.005 1.00 25.00 N ATOM 0 H ARG A 110 74.163 33.283 6.737 1.00 25.00 H new ATOM 0 HA ARG A 110 75.904 32.097 8.636 1.00 25.00 H new ATOM 0 HB2 ARG A 110 76.941 34.254 8.700 1.00 25.00 H new ATOM 0 HB3 ARG A 110 76.347 34.073 7.061 1.00 25.00 H new ATOM 0 HG2 ARG A 110 74.297 35.421 7.725 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.043 35.700 9.286 1.00 25.00 H new ATOM 0 HD2 ARG A 110 77.061 36.664 8.023 1.00 25.00 H new ATOM 0 HD3 ARG A 110 76.088 36.590 6.568 1.00 25.00 H new ATOM 0 HE ARG A 110 74.595 37.896 8.676 1.00 25.00 H new ATOM 0 HH11 ARG A 110 77.247 38.543 6.400 1.00 25.00 H new ATOM 0 HH12 ARG A 110 76.945 40.284 6.436 1.00 25.00 H new ATOM 0 HH21 ARG A 110 74.291 40.075 8.659 1.00 25.00 H new ATOM 0 HH22 ARG A 110 75.319 41.125 7.678 1.00 25.00 H new ATOM 504 N ASP A 111 73.261 33.354 9.865 1.00 25.00 N ATOM 505 CA ASP A 111 72.471 33.644 11.062 1.00 25.00 C ATOM 506 C ASP A 111 71.955 32.335 11.678 1.00 25.00 C ATOM 507 O ASP A 111 70.968 32.315 12.397 1.00 25.00 O ATOM 508 CB ASP A 111 71.306 34.551 10.653 1.00 25.00 C ATOM 509 CG ASP A 111 70.718 35.317 11.816 1.00 25.00 C ATOM 510 OD1 ASP A 111 71.485 35.761 12.697 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.507 35.619 11.759 1.00 25.00 O1- ATOM 0 H ASP A 111 72.702 33.266 9.016 1.00 25.00 H new ATOM 0 HA ASP A 111 73.081 34.147 11.812 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.650 35.257 9.897 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.526 33.945 10.192 1.00 25.00 H new ATOM 516 N LEU A 112 72.608 31.234 11.302 1.00 25.00 N ATOM 517 CA LEU A 112 72.262 29.863 11.732 1.00 25.00 C ATOM 518 C LEU A 112 70.803 29.511 11.441 1.00 25.00 C ATOM 519 O LEU A 112 70.211 28.657 12.076 1.00 25.00 O ATOM 520 CB LEU A 112 72.603 29.631 13.215 1.00 25.00 C ATOM 521 CG LEU A 112 74.083 29.850 13.587 1.00 25.00 C ATOM 522 CD1 LEU A 112 74.263 29.610 15.091 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.021 28.918 12.802 1.00 25.00 C ATOM 0 H LEU A 112 73.412 31.263 10.675 1.00 25.00 H new ATOM 0 HA LEU A 112 72.877 29.188 11.137 1.00 25.00 H new ATOM 0 HB2 LEU A 112 71.989 30.297 13.821 1.00 25.00 H new ATOM 0 HB3 LEU A 112 72.325 28.611 13.481 1.00 25.00 H new ATOM 0 HG LEU A 112 74.347 30.875 13.328 1.00 25.00 H new ATOM 0 HD11 LEU A 112 75.308 29.763 15.361 1.00 25.00 H new ATOM 0 HD12 LEU A 112 73.638 30.308 15.648 1.00 25.00 H new ATOM 0 HD13 LEU A 112 73.971 28.588 15.334 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.053 29.108 13.097 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.767 27.880 13.018 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.909 29.104 11.734 1.00 25.00 H new ATOM 535 N SER A 113 70.267 30.133 10.402 1.00 25.00 N ATOM 536 CA SER A 113 68.926 29.842 9.899 1.00 25.00 C ATOM 537 C SER A 113 68.999 28.701 8.889 1.00 25.00 C ATOM 538 O SER A 113 68.219 28.640 7.946 1.00 25.00 O ATOM 539 CB SER A 113 68.341 31.074 9.226 1.00 25.00 C ATOM 540 OG SER A 113 68.968 32.251 9.701 1.00 25.00 O ATOM 0 H SER A 113 70.752 30.861 9.877 1.00 25.00 H new ATOM 0 HA SER A 113 68.288 29.555 10.735 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.468 30.999 8.146 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.269 31.125 9.418 1.00 25.00 H new ATOM 0 HG SER A 113 68.334 32.997 9.664 1.00 25.00 H new ATOM 546 N GLU A 114 70.028 27.887 9.023 1.00 25.00 N ATOM 547 CA GLU A 114 70.301 26.831 8.060 1.00 25.00 C ATOM 548 C GLU A 114 69.276 25.707 8.197 1.00 25.00 C ATOM 549 O GLU A 114 68.722 25.473 9.268 1.00 25.00 O ATOM 550 CB GLU A 114 71.741 26.320 8.255 1.00 25.00 C ATOM 551 CG GLU A 114 72.075 25.758 9.646 1.00 25.00 C ATOM 552 CD GLU A 114 73.588 25.619 9.859 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.330 25.589 8.852 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.035 25.628 11.028 1.00 25.00 O1- ATOM 0 H GLU A 114 70.694 27.935 9.794 1.00 25.00 H new ATOM 0 HA GLU A 114 70.213 27.225 7.048 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.933 25.542 7.515 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.428 27.139 8.042 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.659 26.413 10.412 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.600 24.784 9.768 1.00 25.00 H new ATOM 561 N VAL A 115 68.974 25.071 7.075 1.00 25.00 N ATOM 562 CA VAL A 115 67.928 24.052 6.997 1.00 25.00 C ATOM 563 C VAL A 115 68.317 23.096 5.871 1.00 25.00 C ATOM 564 O VAL A 115 68.949 23.509 4.902 1.00 25.00 O ATOM 565 CB VAL A 115 66.518 24.721 6.711 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.523 25.535 5.393 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.386 23.672 6.687 1.00 25.00 C ATOM 0 H VAL A 115 69.447 25.245 6.188 1.00 25.00 H new ATOM 0 HA VAL A 115 67.839 23.514 7.941 1.00 25.00 H new ATOM 0 HB VAL A 115 66.328 25.411 7.533 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.539 25.976 5.234 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.270 26.326 5.457 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.764 24.876 4.559 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.435 24.167 6.489 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.585 22.940 5.904 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.338 23.167 7.652 1.00 25.00 H new ATOM 577 N THR A 116 67.939 21.835 5.978 1.00 25.00 N ATOM 578 CA THR A 116 68.196 20.872 4.917 1.00 25.00 C ATOM 579 C THR A 116 66.915 20.111 4.647 1.00 25.00 C ATOM 580 O THR A 116 66.095 19.901 5.552 1.00 25.00 O ATOM 581 CB THR A 116 69.392 19.938 5.248 1.00 25.00 C ATOM 582 OG1 THR A 116 69.693 19.109 4.118 1.00 25.00 O ATOM 583 CG2 THR A 116 69.110 19.046 6.438 1.00 25.00 C ATOM 0 H THR A 116 67.453 21.452 6.788 1.00 25.00 H new ATOM 0 HA THR A 116 68.496 21.397 4.010 1.00 25.00 H new ATOM 0 HB THR A 116 70.238 20.580 5.492 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.506 19.602 3.292 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.975 18.412 6.630 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.909 19.662 7.315 1.00 25.00 H new ATOM 0 HG23 THR A 116 68.242 18.421 6.227 1.00 25.00 H new ATOM 591 N PHE A 117 66.700 19.780 3.384 1.00 25.00 N ATOM 592 CA PHE A 117 65.467 19.153 2.914 1.00 25.00 C ATOM 593 C PHE A 117 65.840 18.405 1.648 1.00 25.00 C ATOM 594 O PHE A 117 66.974 18.516 1.189 1.00 25.00 O ATOM 595 CB PHE A 117 64.402 20.223 2.634 1.00 25.00 C ATOM 596 CG PHE A 117 64.857 21.308 1.691 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.668 21.175 0.298 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.456 22.486 2.193 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.068 22.216 -0.585 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.863 23.522 1.313 1.00 25.00 C ATOM 601 CZ PHE A 117 65.662 23.384 -0.075 1.00 25.00 C ATOM 0 H PHE A 117 67.383 19.940 2.644 1.00 25.00 H new ATOM 0 HA PHE A 117 65.044 18.477 3.657 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.518 19.741 2.217 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.102 20.678 3.578 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.217 20.278 -0.099 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.605 22.599 3.257 1.00 25.00 H new ATOM 0 HE1 PHE A 117 64.915 22.109 -1.649 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.326 24.415 1.706 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.964 24.174 -0.746 1.00 25.00 H new ATOM 611 N SER A 118 64.909 17.664 1.067 1.00 25.00 N ATOM 612 CA SER A 118 65.179 16.939 -0.176 1.00 25.00 C ATOM 613 C SER A 118 64.097 17.235 -1.196 1.00 25.00 C ATOM 614 O SER A 118 62.972 17.555 -0.834 1.00 25.00 O ATOM 615 CB SER A 118 65.243 15.430 0.088 1.00 25.00 C ATOM 616 OG SER A 118 66.310 15.113 0.976 1.00 25.00 O ATOM 0 H SER A 118 63.963 17.546 1.430 1.00 25.00 H new ATOM 0 HA SER A 118 66.141 17.269 -0.568 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.298 15.091 0.513 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.378 14.898 -0.854 1.00 25.00 H new ATOM 0 HG SER A 118 66.330 14.146 1.131 1.00 25.00 H new ATOM 622 N LEU A 119 64.442 17.109 -2.471 1.00 25.00 N ATOM 623 CA LEU A 119 63.504 17.355 -3.569 1.00 25.00 C ATOM 624 C LEU A 119 63.475 16.200 -4.545 1.00 25.00 C ATOM 625 O LEU A 119 64.507 15.590 -4.839 1.00 25.00 O ATOM 626 CB LEU A 119 63.928 18.606 -4.342 1.00 25.00 C ATOM 627 CG LEU A 119 63.675 19.967 -3.674 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.374 21.017 -4.498 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.177 20.269 -3.604 1.00 25.00 C ATOM 0 H LEU A 119 65.376 16.835 -2.777 1.00 25.00 H new ATOM 0 HA LEU A 119 62.515 17.481 -3.128 1.00 25.00 H new ATOM 0 HB2 LEU A 119 64.994 18.527 -4.553 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.412 18.600 -5.302 1.00 25.00 H new ATOM 0 HG LEU A 119 64.058 19.957 -2.653 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.214 21.998 -4.050 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.442 20.803 -4.530 1.00 25.00 H new ATOM 0 HD13 LEU A 119 63.972 21.011 -5.511 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.023 21.237 -3.127 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.763 20.291 -4.612 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.677 19.495 -3.023 1.00 25.00 H new ATOM 641 N GLN A 120 62.291 15.935 -5.070 1.00 25.00 N ATOM 642 CA GLN A 120 62.099 14.907 -6.085 1.00 25.00 C ATOM 643 C GLN A 120 62.262 15.589 -7.447 1.00 25.00 C ATOM 644 O GLN A 120 61.665 16.632 -7.710 1.00 25.00 O ATOM 645 CB GLN A 120 60.717 14.235 -5.952 1.00 25.00 C ATOM 646 CG GLN A 120 59.508 15.192 -5.961 1.00 25.00 C ATOM 647 CD GLN A 120 58.198 14.475 -5.733 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.150 13.267 -5.587 1.00 25.00 O ATOM 649 NE2 GLN A 120 57.127 15.225 -5.703 1.00 25.00 N ATOM 0 H GLN A 120 61.435 16.424 -4.807 1.00 25.00 H new ATOM 0 HA GLN A 120 62.833 14.110 -5.966 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.599 13.522 -6.768 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.698 13.663 -5.024 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.643 15.949 -5.189 1.00 25.00 H new ATOM 0 HG3 GLN A 120 59.470 15.715 -6.917 1.00 25.00 H new ATOM 0 HE21 GLN A 120 57.207 16.234 -5.829 1.00 25.00 H new ATOM 0 HE22 GLN A 120 56.211 14.801 -5.553 1.00 25.00 H new ATOM 658 N VAL A 121 63.136 15.034 -8.273 1.00 25.00 N ATOM 659 CA VAL A 121 63.489 15.637 -9.569 1.00 25.00 C ATOM 660 C VAL A 121 63.725 14.530 -10.582 1.00 25.00 C ATOM 661 O VAL A 121 63.969 13.392 -10.202 1.00 25.00 O ATOM 662 CB VAL A 121 64.799 16.484 -9.464 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.572 17.717 -8.610 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.948 15.651 -8.860 1.00 25.00 C ATOM 0 H VAL A 121 63.623 14.160 -8.075 1.00 25.00 H new ATOM 0 HA VAL A 121 62.669 16.287 -9.874 1.00 25.00 H new ATOM 0 HB VAL A 121 65.075 16.790 -10.473 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.496 18.293 -8.549 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.790 18.331 -9.058 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.267 17.415 -7.608 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.848 16.263 -8.798 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.668 15.315 -7.862 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.141 14.785 -9.493 1.00 25.00 H new ATOM 674 N ASP A 122 63.682 14.850 -11.867 1.00 25.00 N ATOM 675 CA ASP A 122 63.976 13.857 -12.906 1.00 25.00 C ATOM 676 C ASP A 122 65.472 13.897 -13.237 1.00 25.00 C ATOM 677 O ASP A 122 66.188 14.788 -12.767 1.00 25.00 O ATOM 678 CB ASP A 122 63.142 14.112 -14.164 1.00 25.00 C ATOM 679 CG ASP A 122 62.677 12.813 -14.808 1.00 25.00 C ATOM 680 OD1 ASP A 122 63.507 11.870 -14.893 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 61.473 12.698 -15.126 1.00 25.00 O1- ATOM 0 H ASP A 122 63.449 15.778 -12.219 1.00 25.00 H new ATOM 0 HA ASP A 122 63.713 12.868 -12.531 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.275 14.721 -13.908 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.732 14.682 -14.881 1.00 25.00 H new ATOM 686 N ALA A 123 65.948 12.949 -14.026 1.00 25.00 N ATOM 687 CA ALA A 123 67.363 12.890 -14.387 1.00 25.00 C ATOM 688 C ALA A 123 67.722 14.015 -15.366 1.00 25.00 C ATOM 689 O ALA A 123 68.802 14.612 -15.298 1.00 25.00 O ATOM 690 CB ALA A 123 67.665 11.521 -15.005 1.00 25.00 C ATOM 0 H ALA A 123 65.378 12.207 -14.432 1.00 25.00 H new ATOM 0 HA ALA A 123 67.969 13.025 -13.491 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.719 11.469 -15.277 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.438 10.737 -14.282 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.053 11.381 -15.896 1.00 25.00 H new ATOM 696 N ASP A 124 66.822 14.263 -16.304 1.00 25.00 N ATOM 697 CA ASP A 124 67.020 15.259 -17.362 1.00 25.00 C ATOM 698 C ASP A 124 66.564 16.640 -16.901 1.00 25.00 C ATOM 699 O ASP A 124 66.654 17.609 -17.645 1.00 25.00 O ATOM 700 CB ASP A 124 66.245 14.848 -18.604 1.00 25.00 C ATOM 701 CG ASP A 124 64.747 14.751 -18.346 1.00 25.00 C ATOM 702 OD1 ASP A 124 64.359 13.822 -17.609 1.00 25.00 O ATOM 703 OD2 ASP A 124 63.982 15.583 -18.858 1.00 25.00 O1- ATOM 0 H ASP A 124 65.926 13.779 -16.359 1.00 25.00 H new ATOM 0 HA ASP A 124 68.084 15.309 -17.595 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.428 15.571 -19.399 1.00 25.00 H new ATOM 0 HB3 ASP A 124 66.614 13.885 -18.957 1.00 25.00 H new ATOM 708 N PHE A 125 66.113 16.726 -15.658 1.00 25.00 N ATOM 709 CA PHE A 125 65.650 17.984 -15.078 1.00 25.00 C ATOM 710 C PHE A 125 66.762 19.020 -15.145 1.00 25.00 C ATOM 711 O PHE A 125 67.899 18.740 -14.768 1.00 25.00 O ATOM 712 CB PHE A 125 65.251 17.715 -13.635 1.00 25.00 C ATOM 713 CG PHE A 125 64.168 18.600 -13.106 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.822 18.323 -13.403 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.466 19.677 -12.258 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.783 19.116 -12.862 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.429 20.461 -11.691 1.00 25.00 C ATOM 718 CZ PHE A 125 62.088 20.185 -12.001 1.00 25.00 C ATOM 0 H PHE A 125 66.057 15.930 -15.023 1.00 25.00 H new ATOM 0 HA PHE A 125 64.795 18.373 -15.631 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.926 16.678 -13.550 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.132 17.826 -13.003 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.578 17.495 -14.052 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.496 19.912 -12.034 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.754 18.900 -13.111 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.671 21.272 -11.020 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.297 20.789 -11.582 1.00 25.00 H new ATOM 728 N GLU A 126 66.449 20.201 -15.650 1.00 25.00 N ATOM 729 CA GLU A 126 67.457 21.252 -15.805 1.00 25.00 C ATOM 730 C GLU A 126 67.857 21.825 -14.461 1.00 25.00 C ATOM 731 O GLU A 126 67.035 21.919 -13.550 1.00 25.00 O ATOM 732 CB GLU A 126 66.912 22.411 -16.637 1.00 25.00 C ATOM 733 CG GLU A 126 66.738 22.115 -18.101 1.00 25.00 C ATOM 734 CD GLU A 126 66.400 23.383 -18.878 1.00 25.00 C ATOM 735 OE1 GLU A 126 65.881 24.344 -18.259 1.00 25.00 O ATOM 736 OE2 GLU A 126 66.707 23.442 -20.085 1.00 25.00 O1- ATOM 0 H GLU A 126 65.513 20.461 -15.960 1.00 25.00 H new ATOM 0 HA GLU A 126 68.314 20.792 -16.297 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.949 22.713 -16.226 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.584 23.262 -16.531 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.652 21.674 -18.498 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.945 21.379 -18.235 1.00 25.00 H new ATOM 743 N LEU A 127 69.078 22.317 -14.370 1.00 25.00 N ATOM 744 CA LEU A 127 69.519 23.046 -13.191 1.00 25.00 C ATOM 745 C LEU A 127 68.693 24.311 -13.024 1.00 25.00 C ATOM 746 O LEU A 127 68.439 24.766 -11.907 1.00 25.00 O ATOM 747 CB LEU A 127 70.974 23.471 -13.334 1.00 25.00 C ATOM 748 CG LEU A 127 72.015 22.912 -12.366 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.343 23.599 -12.673 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.628 23.163 -10.908 1.00 25.00 C ATOM 0 H LEU A 127 69.785 22.226 -15.099 1.00 25.00 H new ATOM 0 HA LEU A 127 69.401 22.386 -12.332 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.293 23.212 -14.344 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.007 24.558 -13.258 1.00 25.00 H new ATOM 0 HG LEU A 127 72.086 21.832 -12.497 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.112 23.223 -11.998 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.631 23.391 -13.703 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.236 24.675 -12.537 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.394 22.750 -10.252 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.541 24.236 -10.734 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.673 22.682 -10.697 1.00 25.00 H new ATOM 762 N HIS A 128 68.261 24.867 -14.145 1.00 25.00 N ATOM 763 CA HIS A 128 67.426 26.062 -14.147 1.00 25.00 C ATOM 764 C HIS A 128 66.122 25.805 -13.396 1.00 25.00 C ATOM 765 O HIS A 128 65.683 26.627 -12.604 1.00 25.00 O ATOM 766 CB HIS A 128 67.121 26.459 -15.594 1.00 25.00 C ATOM 767 CG HIS A 128 66.278 27.692 -15.713 1.00 25.00 C ATOM 768 ND1 HIS A 128 64.936 27.685 -16.005 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.605 29.003 -15.565 1.00 25.00 C ATOM 770 CE1 HIS A 128 64.509 28.939 -16.023 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.485 29.785 -15.765 1.00 25.00 N ATOM 0 H HIS A 128 68.477 24.507 -15.075 1.00 25.00 H new ATOM 0 HA HIS A 128 67.959 26.870 -13.646 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.060 26.619 -16.124 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.612 25.632 -16.089 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.590 29.376 -15.327 1.00 25.00 H new ATOM 0 HE1 HIS A 128 63.489 29.231 -16.224 1.00 25.00 H new ATOM 0 HE2 HIS A 128 65.426 30.802 -15.722 1.00 25.00 H new ATOM 779 N ASN A 129 65.537 24.641 -13.623 1.00 25.00 N ATOM 780 CA ASN A 129 64.298 24.261 -12.963 1.00 25.00 C ATOM 781 C ASN A 129 64.583 23.804 -11.522 1.00 25.00 C ATOM 782 O ASN A 129 63.830 24.076 -10.599 1.00 25.00 O ATOM 783 CB ASN A 129 63.633 23.143 -13.774 1.00 25.00 C ATOM 784 CG ASN A 129 62.144 23.049 -13.535 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.616 23.596 -12.586 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.464 22.373 -14.416 1.00 25.00 N ATOM 0 H ASN A 129 65.903 23.937 -14.264 1.00 25.00 H new ATOM 0 HA ASN A 129 63.624 25.116 -12.911 1.00 25.00 H new ATOM 0 HB2 ASN A 129 63.816 23.313 -14.835 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.098 22.190 -13.519 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.452 22.288 -14.323 1.00 25.00 H new ATOM 0 HD22 ASN A 129 61.944 21.928 -15.199 1.00 25.00 H new ATOM 793 N PHE A 130 65.721 23.149 -11.329 1.00 25.00 N ATOM 794 CA PHE A 130 66.113 22.673 -10.005 1.00 25.00 C ATOM 795 C PHE A 130 66.269 23.820 -9.010 1.00 25.00 C ATOM 796 O PHE A 130 65.766 23.752 -7.889 1.00 25.00 O ATOM 797 CB PHE A 130 67.423 21.906 -10.092 1.00 25.00 C ATOM 798 CG PHE A 130 67.859 21.315 -8.782 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.008 20.451 -8.077 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.131 21.606 -8.245 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.413 19.870 -6.845 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.548 21.031 -7.024 1.00 25.00 C ATOM 803 CZ PHE A 130 68.687 20.163 -6.318 1.00 25.00 C ATOM 0 H PHE A 130 66.389 22.935 -12.070 1.00 25.00 H new ATOM 0 HA PHE A 130 65.318 22.018 -9.648 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.319 21.107 -10.826 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.203 22.574 -10.458 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.031 20.224 -8.476 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.793 22.276 -8.773 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.747 19.206 -6.314 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.528 21.256 -6.630 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.002 19.727 -5.382 1.00 25.00 H new ATOM 813 N ARG A 131 66.930 24.897 -9.417 1.00 25.00 N ATOM 814 CA ARG A 131 67.092 26.038 -8.526 1.00 25.00 C ATOM 815 C ARG A 131 65.766 26.756 -8.264 1.00 25.00 C ATOM 816 O ARG A 131 65.609 27.381 -7.228 1.00 25.00 O ATOM 817 CB ARG A 131 68.166 27.017 -9.004 1.00 25.00 C ATOM 818 CG ARG A 131 67.873 27.744 -10.311 1.00 25.00 C ATOM 819 CD ARG A 131 68.130 29.256 -10.192 1.00 25.00 C ATOM 820 NE ARG A 131 69.472 29.574 -9.649 1.00 25.00 N ATOM 821 CZ ARG A 131 70.605 29.575 -10.338 1.00 25.00 C ATOM 822 NH1 ARG A 131 70.656 29.274 -11.609 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 71.715 29.886 -9.731 1.00 25.00 N ATOM 0 H ARG A 131 67.354 25.004 -10.338 1.00 25.00 H new ATOM 0 HA ARG A 131 67.439 25.628 -7.578 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.323 27.762 -8.224 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.103 26.471 -9.117 1.00 25.00 H new ATOM 0 HG2 ARG A 131 68.495 27.331 -11.105 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.835 27.573 -10.598 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.023 29.716 -11.175 1.00 25.00 H new ATOM 0 HD3 ARG A 131 67.370 29.699 -9.549 1.00 25.00 H new ATOM 0 HE ARG A 131 69.529 29.813 -8.659 1.00 25.00 H new ATOM 0 HH11 ARG A 131 69.802 29.026 -12.109 1.00 25.00 H new ATOM 0 HH12 ARG A 131 71.550 29.287 -12.101 1.00 25.00 H new ATOM 0 HH21 ARG A 131 71.704 30.124 -8.739 1.00 25.00 H new ATOM 0 HH22 ARG A 131 72.595 29.891 -10.247 1.00 25.00 H new ATOM 837 N ALA A 132 64.810 26.643 -9.177 1.00 25.00 N ATOM 838 CA ALA A 132 63.493 27.233 -8.951 1.00 25.00 C ATOM 839 C ALA A 132 62.774 26.413 -7.874 1.00 25.00 C ATOM 840 O ALA A 132 62.169 26.963 -6.966 1.00 25.00 O ATOM 841 CB ALA A 132 62.682 27.250 -10.251 1.00 25.00 C ATOM 0 H ALA A 132 64.916 26.157 -10.068 1.00 25.00 H new ATOM 0 HA ALA A 132 63.601 28.265 -8.617 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.704 27.693 -10.064 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.209 27.839 -11.001 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.555 26.230 -10.614 1.00 25.00 H new ATOM 847 N LEU A 133 62.883 25.093 -7.942 1.00 25.00 N ATOM 848 CA LEU A 133 62.279 24.246 -6.912 1.00 25.00 C ATOM 849 C LEU A 133 62.900 24.497 -5.543 1.00 25.00 C ATOM 850 O LEU A 133 62.190 24.588 -4.551 1.00 25.00 O ATOM 851 CB LEU A 133 62.438 22.760 -7.235 1.00 25.00 C ATOM 852 CG LEU A 133 61.672 22.159 -8.422 1.00 25.00 C ATOM 853 CD1 LEU A 133 61.994 20.669 -8.461 1.00 25.00 C ATOM 854 CD2 LEU A 133 60.157 22.359 -8.308 1.00 25.00 C ATOM 0 H LEU A 133 63.373 24.590 -8.682 1.00 25.00 H new ATOM 0 HA LEU A 133 61.221 24.508 -6.893 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.499 22.574 -7.403 1.00 25.00 H new ATOM 0 HB3 LEU A 133 62.153 22.200 -6.345 1.00 25.00 H new ATOM 0 HG LEU A 133 61.982 22.665 -9.336 1.00 25.00 H new ATOM 0 HD11 LEU A 133 61.466 20.204 -9.294 1.00 25.00 H new ATOM 0 HD12 LEU A 133 63.068 20.532 -8.590 1.00 25.00 H new ATOM 0 HD13 LEU A 133 61.678 20.204 -7.527 1.00 25.00 H new ATOM 0 HD21 LEU A 133 59.665 21.915 -9.173 1.00 25.00 H new ATOM 0 HD22 LEU A 133 59.794 21.880 -7.399 1.00 25.00 H new ATOM 0 HD23 LEU A 133 59.933 23.425 -8.271 1.00 25.00 H new ATOM 866 N CYS A 134 64.221 24.618 -5.470 1.00 25.00 N ATOM 867 CA CYS A 134 64.849 24.825 -4.162 1.00 25.00 C ATOM 868 C CYS A 134 64.556 26.223 -3.618 1.00 25.00 C ATOM 869 O CYS A 134 64.554 26.423 -2.407 1.00 25.00 O ATOM 870 CB CYS A 134 66.354 24.552 -4.195 1.00 25.00 C ATOM 871 SG CYS A 134 67.363 25.816 -4.993 1.00 25.00 S ATOM 0 H CYS A 134 64.860 24.579 -6.264 1.00 25.00 H new ATOM 0 HA CYS A 134 64.405 24.099 -3.481 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.704 24.428 -3.170 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.521 23.604 -4.706 1.00 25.00 H new ATOM 0 HG CYS A 134 66.631 26.493 -5.827 1.00 25.00 H new ATOM 877 N GLU A 135 64.292 27.182 -4.499 1.00 25.00 N ATOM 878 CA GLU A 135 63.895 28.529 -4.069 1.00 25.00 C ATOM 879 C GLU A 135 62.534 28.428 -3.397 1.00 25.00 C ATOM 880 O GLU A 135 62.345 28.907 -2.273 1.00 25.00 O ATOM 881 CB GLU A 135 63.806 29.461 -5.283 1.00 25.00 C ATOM 882 CG GLU A 135 63.387 30.884 -4.957 1.00 25.00 C ATOM 883 CD GLU A 135 62.539 31.499 -6.060 1.00 25.00 C ATOM 884 OE1 GLU A 135 61.334 31.170 -6.144 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 63.077 32.342 -6.817 1.00 25.00 O1- ATOM 0 H GLU A 135 64.344 27.059 -5.510 1.00 25.00 H new ATOM 0 HA GLU A 135 64.631 28.934 -3.375 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.777 29.486 -5.777 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.096 29.041 -5.996 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.826 30.891 -4.023 1.00 25.00 H new ATOM 0 HG3 GLU A 135 64.275 31.496 -4.800 1.00 25.00 H new ATOM 892 N LEU A 136 61.608 27.763 -4.078 1.00 25.00 N ATOM 893 CA LEU A 136 60.238 27.598 -3.597 1.00 25.00 C ATOM 894 C LEU A 136 60.187 26.875 -2.256 1.00 25.00 C ATOM 895 O LEU A 136 59.492 27.304 -1.336 1.00 25.00 O ATOM 896 CB LEU A 136 59.437 26.808 -4.644 1.00 25.00 C ATOM 897 CG LEU A 136 57.945 26.545 -4.364 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.138 27.849 -4.334 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.381 25.612 -5.446 1.00 25.00 C ATOM 0 H LEU A 136 61.784 27.322 -4.981 1.00 25.00 H new ATOM 0 HA LEU A 136 59.805 28.587 -3.449 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.510 27.340 -5.592 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.926 25.844 -4.781 1.00 25.00 H new ATOM 0 HG LEU A 136 57.860 26.077 -3.383 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.090 27.624 -4.134 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.526 28.499 -3.550 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.224 28.352 -5.297 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.325 25.424 -5.250 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.491 26.081 -6.424 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.926 24.668 -5.433 1.00 25.00 H new ATOM 911 N GLU A 137 60.921 25.778 -2.151 1.00 25.00 N ATOM 912 CA GLU A 137 60.912 24.960 -0.939 1.00 25.00 C ATOM 913 C GLU A 137 61.585 25.657 0.257 1.00 25.00 C ATOM 914 O GLU A 137 61.151 25.511 1.398 1.00 25.00 O ATOM 915 CB GLU A 137 61.630 23.631 -1.227 1.00 25.00 C ATOM 916 CG GLU A 137 61.323 22.511 -0.230 1.00 25.00 C ATOM 917 CD GLU A 137 59.929 21.920 -0.403 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.529 21.660 -1.559 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 59.245 21.677 0.617 1.00 25.00 O1- ATOM 0 H GLU A 137 61.533 25.430 -2.889 1.00 25.00 H new ATOM 0 HA GLU A 137 59.871 24.791 -0.665 1.00 25.00 H new ATOM 0 HB2 GLU A 137 61.356 23.295 -2.227 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.705 23.808 -1.234 1.00 25.00 H new ATOM 0 HG2 GLU A 137 62.063 21.719 -0.344 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.423 22.898 0.784 1.00 25.00 H new ATOM 926 N SER A 138 62.671 26.383 -0.002 1.00 25.00 N ATOM 927 CA SER A 138 63.436 27.024 1.078 1.00 25.00 C ATOM 928 C SER A 138 62.949 28.429 1.423 1.00 25.00 C ATOM 929 O SER A 138 63.306 28.967 2.474 1.00 25.00 O ATOM 930 CB SER A 138 64.915 27.096 0.697 1.00 25.00 C ATOM 931 OG SER A 138 65.701 27.555 1.787 1.00 25.00 O ATOM 0 H SER A 138 63.042 26.544 -0.938 1.00 25.00 H new ATOM 0 HA SER A 138 63.287 26.404 1.962 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.262 26.111 0.384 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.042 27.764 -0.154 1.00 25.00 H new ATOM 0 HG SER A 138 66.646 27.561 1.529 1.00 25.00 H new ATOM 937 N GLY A 139 62.159 29.031 0.544 1.00 25.00 N ATOM 938 CA GLY A 139 61.630 30.366 0.792 1.00 25.00 C ATOM 939 C GLY A 139 62.687 31.457 0.790 1.00 25.00 C ATOM 940 O GLY A 139 62.567 32.458 1.505 1.00 25.00 O ATOM 0 H GLY A 139 61.871 28.619 -0.343 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.882 30.597 0.033 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.119 30.371 1.755 1.00 25.00 H new ATOM 944 N ILE A 140 63.730 31.277 -0.012 1.00 25.00 N ATOM 945 CA ILE A 140 64.827 32.249 -0.099 1.00 25.00 C ATOM 946 C ILE A 140 65.036 32.695 -1.551 1.00 25.00 C ATOM 947 O ILE A 140 65.026 31.871 -2.455 1.00 25.00 O ATOM 948 CB ILE A 140 66.171 31.661 0.468 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.573 30.347 -0.241 1.00 25.00 C ATOM 950 CG2 ILE A 140 66.048 31.415 1.983 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.764 30.474 -1.167 1.00 25.00 C ATOM 0 H ILE A 140 63.844 30.464 -0.617 1.00 25.00 H new ATOM 0 HA ILE A 140 64.546 33.109 0.509 1.00 25.00 H new ATOM 0 HB ILE A 140 66.952 32.397 0.277 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.795 29.594 0.515 1.00 25.00 H new ATOM 0 HG13 ILE A 140 65.720 29.982 -0.814 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.985 31.008 2.363 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.830 32.356 2.488 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.242 30.707 2.172 1.00 25.00 H new ATOM 0 HD11 ILE A 140 67.976 29.506 -1.621 1.00 25.00 H new ATOM 0 HD12 ILE A 140 67.542 31.201 -1.948 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.633 30.806 -0.599 1.00 25.00 H new ATOM 963 N PRO A 141 65.207 34.010 -1.795 1.00 25.00 N ATOM 964 CA PRO A 141 65.383 34.407 -3.201 1.00 25.00 C ATOM 965 C PRO A 141 66.610 33.795 -3.878 1.00 25.00 C ATOM 966 O PRO A 141 67.738 33.889 -3.370 1.00 25.00 O ATOM 967 CB PRO A 141 65.528 35.931 -3.114 1.00 25.00 C ATOM 968 CG PRO A 141 64.859 36.303 -1.840 1.00 25.00 C ATOM 969 CD PRO A 141 65.207 35.190 -0.905 1.00 25.00 C ATOM 0 HA PRO A 141 64.550 34.060 -3.812 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.576 36.229 -3.112 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.058 36.423 -3.966 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.217 37.263 -1.468 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.780 36.393 -1.968 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.179 35.344 -0.436 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.477 35.092 -0.102 1.00 25.00 H new ATOM 977 N ALA A 142 66.397 33.207 -5.047 1.00 25.00 N ATOM 978 CA ALA A 142 67.463 32.597 -5.822 1.00 25.00 C ATOM 979 C ALA A 142 68.490 33.635 -6.291 1.00 25.00 C ATOM 980 O ALA A 142 69.658 33.319 -6.506 1.00 25.00 O ATOM 981 CB ALA A 142 66.855 31.872 -7.033 1.00 25.00 C ATOM 0 H ALA A 142 65.478 33.141 -5.484 1.00 25.00 H new ATOM 0 HA ALA A 142 67.987 31.885 -5.184 1.00 25.00 H new ATOM 0 HB1 ALA A 142 67.651 31.412 -7.619 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.167 31.101 -6.687 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.316 32.588 -7.653 1.00 25.00 H new ATOM 987 N ALA A 143 68.046 34.871 -6.456 1.00 25.00 N ATOM 988 CA ALA A 143 68.916 35.951 -6.927 1.00 25.00 C ATOM 989 C ALA A 143 69.967 36.351 -5.881 1.00 25.00 C ATOM 990 O ALA A 143 71.018 36.884 -6.218 1.00 25.00 O ATOM 991 CB ALA A 143 68.047 37.175 -7.284 1.00 25.00 C ATOM 0 H ALA A 143 67.085 35.158 -6.271 1.00 25.00 H new ATOM 0 HA ALA A 143 69.454 35.591 -7.804 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.686 37.985 -7.636 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.341 36.903 -8.068 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.500 37.503 -6.400 1.00 25.00 H new ATOM 997 N GLU A 144 69.660 36.117 -4.613 1.00 25.00 N ATOM 998 CA GLU A 144 70.518 36.557 -3.509 1.00 25.00 C ATOM 999 C GLU A 144 71.356 35.410 -2.943 1.00 25.00 C ATOM 1000 O GLU A 144 71.957 35.534 -1.876 1.00 25.00 O ATOM 1001 CB GLU A 144 69.638 37.107 -2.383 1.00 25.00 C ATOM 1002 CG GLU A 144 68.766 38.290 -2.797 1.00 25.00 C ATOM 1003 CD GLU A 144 67.937 38.818 -1.633 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.763 38.076 -0.637 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 67.446 39.958 -1.720 1.00 25.00 O1- ATOM 0 H GLU A 144 68.819 35.622 -4.317 1.00 25.00 H new ATOM 0 HA GLU A 144 71.193 37.319 -3.898 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.996 36.307 -2.014 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.276 37.412 -1.553 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.398 39.089 -3.185 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.103 37.987 -3.607 1.00 25.00 H new ATOM 1012 N SER A 145 71.344 34.273 -3.626 1.00 25.00 N ATOM 1013 CA SER A 145 71.983 33.078 -3.100 1.00 25.00 C ATOM 1014 C SER A 145 72.789 32.301 -4.136 1.00 25.00 C ATOM 1015 O SER A 145 72.501 32.343 -5.333 1.00 25.00 O ATOM 1016 CB SER A 145 70.905 32.181 -2.507 1.00 25.00 C ATOM 1017 OG SER A 145 70.009 32.927 -1.700 1.00 25.00 O ATOM 0 H SER A 145 70.902 34.155 -4.538 1.00 25.00 H new ATOM 0 HA SER A 145 72.701 33.398 -2.345 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.354 31.690 -3.309 1.00 25.00 H new ATOM 0 HB3 SER A 145 71.369 31.395 -1.911 1.00 25.00 H new ATOM 0 HG SER A 145 69.270 33.259 -2.252 1.00 25.00 H new ATOM 1023 N GLN A 146 73.802 31.589 -3.671 1.00 25.00 N ATOM 1024 CA GLN A 146 74.684 30.815 -4.541 1.00 25.00 C ATOM 1025 C GLN A 146 74.556 29.338 -4.219 1.00 25.00 C ATOM 1026 O GLN A 146 74.297 28.965 -3.086 1.00 25.00 O ATOM 1027 CB GLN A 146 76.141 31.253 -4.361 1.00 25.00 C ATOM 1028 CG GLN A 146 76.566 32.384 -5.286 1.00 25.00 C ATOM 1029 CD GLN A 146 75.843 33.681 -4.997 1.00 25.00 C ATOM 1030 OE1 GLN A 146 76.118 34.346 -4.014 1.00 25.00 O ATOM 1031 NE2 GLN A 146 74.922 34.041 -5.851 1.00 25.00 N ATOM 0 H GLN A 146 74.039 31.529 -2.681 1.00 25.00 H new ATOM 0 HA GLN A 146 74.390 30.991 -5.576 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.290 31.567 -3.328 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.791 30.395 -4.531 1.00 25.00 H new ATOM 0 HG2 GLN A 146 77.640 32.543 -5.189 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.379 32.092 -6.319 1.00 25.00 H new ATOM 0 HE21 GLN A 146 74.722 33.456 -6.662 1.00 25.00 H new ATOM 0 HE22 GLN A 146 74.403 34.907 -5.707 1.00 25.00 H new ATOM 1040 N ILE A 147 74.728 28.505 -5.235 1.00 25.00 N ATOM 1041 CA ILE A 147 74.556 27.059 -5.101 1.00 25.00 C ATOM 1042 C ILE A 147 75.816 26.306 -5.597 1.00 25.00 C ATOM 1043 O ILE A 147 76.439 26.683 -6.605 1.00 25.00 O ATOM 1044 CB ILE A 147 73.249 26.624 -5.850 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.986 25.128 -5.614 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.309 27.016 -7.359 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.628 24.616 -6.121 1.00 25.00 C ATOM 0 H ILE A 147 74.990 28.807 -6.173 1.00 25.00 H new ATOM 0 HA ILE A 147 74.441 26.793 -4.050 1.00 25.00 H new ATOM 0 HB ILE A 147 72.396 27.165 -5.441 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.777 24.555 -6.099 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.056 24.927 -4.545 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.390 26.702 -7.853 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.419 28.097 -7.450 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.160 26.524 -7.829 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.538 23.551 -5.908 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.825 25.156 -5.619 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.557 24.778 -7.197 1.00 25.00 H new ATOM 1059 N VAL A 148 76.225 25.300 -4.834 1.00 25.00 N ATOM 1060 CA VAL A 148 77.477 24.572 -5.076 1.00 25.00 C ATOM 1061 C VAL A 148 77.265 23.062 -4.786 1.00 25.00 C ATOM 1062 O VAL A 148 76.504 22.695 -3.897 1.00 25.00 O ATOM 1063 CB VAL A 148 78.623 25.202 -4.168 1.00 25.00 C ATOM 1064 CG1 VAL A 148 78.321 25.043 -2.676 1.00 25.00 C ATOM 1065 CG2 VAL A 148 79.996 24.632 -4.488 1.00 25.00 C ATOM 0 H VAL A 148 75.701 24.961 -4.027 1.00 25.00 H new ATOM 0 HA VAL A 148 77.782 24.664 -6.119 1.00 25.00 H new ATOM 0 HB VAL A 148 78.640 26.266 -4.404 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.128 25.486 -2.092 1.00 25.00 H new ATOM 0 HG12 VAL A 148 77.383 25.545 -2.439 1.00 25.00 H new ATOM 0 HG13 VAL A 148 78.237 23.984 -2.433 1.00 25.00 H new ATOM 0 HG21 VAL A 148 80.742 25.094 -3.841 1.00 25.00 H new ATOM 0 HG22 VAL A 148 79.990 23.555 -4.323 1.00 25.00 H new ATOM 0 HG23 VAL A 148 80.242 24.838 -5.530 1.00 25.00 H new ATOM 1075 N TYR A 149 77.922 22.198 -5.557 1.00 25.00 N ATOM 1076 CA TYR A 149 77.830 20.744 -5.380 1.00 25.00 C ATOM 1077 C TYR A 149 79.209 20.141 -5.652 1.00 25.00 C ATOM 1078 O TYR A 149 79.884 20.572 -6.576 1.00 25.00 O ATOM 1079 CB TYR A 149 76.829 20.157 -6.376 1.00 25.00 C ATOM 1080 CG TYR A 149 76.937 18.656 -6.516 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.736 17.817 -5.400 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.265 18.062 -7.754 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.869 16.419 -5.515 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.389 16.653 -7.876 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.195 15.846 -6.749 1.00 25.00 C ATOM 1086 OH TYR A 149 77.324 14.490 -6.832 1.00 25.00 O ATOM 0 H TYR A 149 78.533 22.482 -6.322 1.00 25.00 H new ATOM 0 HA TYR A 149 77.499 20.517 -4.366 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.818 20.414 -6.059 1.00 25.00 H new ATOM 0 HB3 TYR A 149 76.984 20.618 -7.351 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.477 18.251 -4.446 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.424 18.688 -8.620 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.719 15.790 -4.650 1.00 25.00 H new ATOM 0 HE2 TYR A 149 77.631 16.208 -8.830 1.00 25.00 H new ATOM 0 HH TYR A 149 77.552 14.239 -7.752 1.00 25.00 H new ATOM 1096 N ALA A 150 79.615 19.173 -4.837 1.00 25.00 N ATOM 1097 CA ALA A 150 80.935 18.529 -4.952 1.00 25.00 C ATOM 1098 C ALA A 150 82.065 19.570 -5.008 1.00 25.00 C ATOM 1099 O ALA A 150 83.003 19.461 -5.790 1.00 25.00 O ATOM 1100 CB ALA A 150 80.971 17.596 -6.186 1.00 25.00 C ATOM 0 H ALA A 150 79.044 18.807 -4.075 1.00 25.00 H new ATOM 0 HA ALA A 150 81.098 17.925 -4.059 1.00 25.00 H new ATOM 0 HB1 ALA A 150 81.952 17.127 -6.259 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.207 16.825 -6.082 1.00 25.00 H new ATOM 0 HB3 ALA A 150 80.779 18.178 -7.088 1.00 25.00 H new ATOM 1106 N GLU A 151 81.905 20.609 -4.190 1.00 25.00 N ATOM 1107 CA GLU A 151 82.838 21.748 -4.101 1.00 25.00 C ATOM 1108 C GLU A 151 83.058 22.483 -5.438 1.00 25.00 C ATOM 1109 O GLU A 151 84.016 23.242 -5.599 1.00 25.00 O ATOM 1110 CB GLU A 151 84.175 21.303 -3.472 1.00 25.00 C ATOM 1111 CG GLU A 151 83.986 20.658 -2.096 1.00 25.00 C ATOM 1112 CD GLU A 151 85.310 20.438 -1.376 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.139 19.642 -1.866 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.520 21.083 -0.329 1.00 25.00 O1- ATOM 0 H GLU A 151 81.111 20.691 -3.556 1.00 25.00 H new ATOM 0 HA GLU A 151 82.365 22.481 -3.448 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.669 20.595 -4.138 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.835 22.166 -3.378 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.343 21.292 -1.485 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.474 19.703 -2.212 1.00 25.00 H new ATOM 1121 N ARG A 152 82.120 22.322 -6.364 1.00 25.00 N ATOM 1122 CA ARG A 152 82.143 23.033 -7.650 1.00 25.00 C ATOM 1123 C ARG A 152 80.830 23.784 -7.845 1.00 25.00 C ATOM 1124 O ARG A 152 79.771 23.320 -7.417 1.00 25.00 O ATOM 1125 CB ARG A 152 82.335 22.037 -8.792 1.00 25.00 C ATOM 1126 CG ARG A 152 83.788 21.746 -9.065 1.00 25.00 C ATOM 1127 CD ARG A 152 83.944 20.603 -10.044 1.00 25.00 C ATOM 1128 NE ARG A 152 85.297 20.582 -10.636 1.00 25.00 N ATOM 1129 CZ ARG A 152 86.385 20.085 -10.051 1.00 25.00 C ATOM 1130 NH1 ARG A 152 86.368 19.570 -8.845 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 87.519 20.122 -10.701 1.00 25.00 N ATOM 0 H ARG A 152 81.321 21.698 -6.251 1.00 25.00 H new ATOM 0 HA ARG A 152 82.971 23.742 -7.649 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.821 21.107 -8.549 1.00 25.00 H new ATOM 0 HB3 ARG A 152 81.871 22.431 -9.696 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.271 22.638 -9.464 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.294 21.500 -8.131 1.00 25.00 H new ATOM 0 HD2 ARG A 152 83.753 19.658 -9.536 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.200 20.696 -10.835 1.00 25.00 H new ATOM 0 HE ARG A 152 85.407 20.980 -11.568 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.496 19.539 -8.316 1.00 25.00 H new ATOM 0 HH12 ARG A 152 87.226 19.201 -8.436 1.00 25.00 H new ATOM 0 HH21 ARG A 152 87.557 20.526 -11.637 1.00 25.00 H new ATOM 0 HH22 ARG A 152 88.365 19.747 -10.272 1.00 25.00 H new ATOM 1145 N PRO A 153 80.882 24.977 -8.451 1.00 25.00 N ATOM 1146 CA PRO A 153 79.621 25.718 -8.550 1.00 25.00 C ATOM 1147 C PRO A 153 78.647 25.105 -9.547 1.00 25.00 C ATOM 1148 O PRO A 153 79.046 24.575 -10.583 1.00 25.00 O ATOM 1149 CB PRO A 153 80.081 27.102 -9.008 1.00 25.00 C ATOM 1150 CG PRO A 153 81.306 26.835 -9.788 1.00 25.00 C ATOM 1151 CD PRO A 153 82.004 25.740 -9.022 1.00 25.00 C ATOM 0 HA PRO A 153 79.069 25.721 -7.610 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.321 27.594 -9.615 1.00 25.00 H new ATOM 0 HB3 PRO A 153 80.283 27.756 -8.160 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.070 26.521 -10.805 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.930 27.725 -9.866 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.624 25.123 -9.672 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.657 26.141 -8.247 1.00 25.00 H new ATOM 1159 N LEU A 154 77.366 25.211 -9.246 1.00 25.00 N ATOM 1160 CA LEU A 154 76.312 24.727 -10.139 1.00 25.00 C ATOM 1161 C LEU A 154 75.820 25.928 -10.964 1.00 0.00 C ATOM 1162 O LEU A 154 74.698 26.396 -10.809 1.00 25.00 O ATOM 1163 CB LEU A 154 75.176 24.085 -9.319 1.00 25.00 C ATOM 1164 CG LEU A 154 75.436 22.671 -8.761 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.315 22.276 -7.809 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.541 21.639 -9.870 1.00 25.00 C ATOM 0 H LEU A 154 77.021 25.631 -8.383 1.00 25.00 H new ATOM 0 HA LEU A 154 76.686 23.955 -10.812 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.947 24.744 -8.482 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.285 24.045 -9.946 1.00 25.00 H new ATOM 0 HG LEU A 154 76.387 22.696 -8.229 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.505 21.276 -7.418 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.272 22.986 -6.983 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.365 22.283 -8.343 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.724 20.656 -9.436 1.00 25.00 H new ATOM 0 HD22 LEU A 154 74.610 21.618 -10.437 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.364 21.902 -10.535 1.00 25.00 H new ATOM 1178 N THR A 155 76.721 26.467 -11.780 1.00 25.00 N ATOM 1179 CA THR A 155 76.444 27.698 -12.529 1.00 25.00 C ATOM 1180 C THR A 155 75.970 27.502 -13.963 1.00 25.00 C ATOM 1181 O THR A 155 75.332 28.385 -14.513 1.00 25.00 O ATOM 1182 CB THR A 155 77.709 28.556 -12.606 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.846 27.695 -12.755 1.00 25.00 O ATOM 1184 CG2 THR A 155 77.881 29.382 -11.334 1.00 25.00 C ATOM 0 H THR A 155 77.649 26.075 -11.942 1.00 25.00 H new ATOM 0 HA THR A 155 75.632 28.167 -11.974 1.00 25.00 H new ATOM 0 HB THR A 155 77.623 29.232 -13.457 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.661 28.236 -12.807 1.00 25.00 H new ATOM 0 HG21 THR A 155 78.786 29.984 -11.411 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.019 30.037 -11.206 1.00 25.00 H new ATOM 0 HG23 THR A 155 77.960 28.715 -10.475 1.00 25.00 H new ATOM 1192 N ASP A 156 76.267 26.359 -14.569 1.00 25.00 N ATOM 1193 CA ASP A 156 75.885 26.123 -15.972 1.00 25.00 C ATOM 1194 C ASP A 156 74.447 25.611 -15.967 1.00 25.00 C ATOM 1195 O ASP A 156 74.199 24.412 -16.096 1.00 25.00 O ATOM 1196 CB ASP A 156 76.809 25.114 -16.683 1.00 25.00 C ATOM 1197 CG ASP A 156 78.256 25.603 -16.798 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.564 26.736 -16.384 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 79.081 24.807 -17.292 1.00 25.00 O1- ATOM 0 H ASP A 156 76.764 25.586 -14.126 1.00 25.00 H new ATOM 0 HA ASP A 156 75.979 27.056 -16.528 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.793 24.170 -16.139 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.419 24.914 -17.681 1.00 25.00 H new ATOM 1204 N ASN A 157 73.512 26.518 -15.759 1.00 25.00 N ATOM 1205 CA ASN A 157 72.103 26.169 -15.539 1.00 25.00 C ATOM 1206 C ASN A 157 71.416 25.478 -16.711 1.00 25.00 C ATOM 1207 O ASN A 157 70.318 24.964 -16.563 1.00 25.00 O ATOM 1208 CB ASN A 157 71.297 27.419 -15.180 1.00 25.00 C ATOM 1209 CG ASN A 157 71.254 28.415 -16.309 1.00 25.00 C ATOM 1210 OD1 ASN A 157 72.197 29.157 -16.518 1.00 25.00 O ATOM 1211 ND2 ASN A 157 70.176 28.430 -17.045 1.00 25.00 N ATOM 0 H ASN A 157 73.698 27.521 -15.736 1.00 25.00 H new ATOM 0 HA ASN A 157 72.124 25.450 -14.720 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.280 27.129 -14.915 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.734 27.890 -14.299 1.00 25.00 H new ATOM 0 HD21 ASN A 157 70.102 29.080 -17.828 1.00 25.00 H new ATOM 0 HD22 ASN A 157 69.408 27.792 -16.837 1.00 25.00 H new ATOM 1218 N HIS A 158 72.070 25.474 -17.861 1.00 25.00 N ATOM 1219 CA HIS A 158 71.541 24.837 -19.063 1.00 25.00 C ATOM 1220 C HIS A 158 71.734 23.326 -19.054 1.00 25.00 C ATOM 1221 O HIS A 158 71.281 22.633 -19.953 1.00 25.00 O ATOM 1222 CB HIS A 158 72.251 25.418 -20.283 1.00 25.00 C ATOM 1223 CG HIS A 158 72.251 26.912 -20.319 1.00 25.00 C ATOM 1224 ND1 HIS A 158 73.379 27.693 -20.280 1.00 25.00 N ATOM 1225 CD2 HIS A 158 71.213 27.789 -20.389 1.00 25.00 C ATOM 1226 CE1 HIS A 158 73.002 28.964 -20.316 1.00 25.00 C ATOM 1227 NE2 HIS A 158 71.688 29.084 -20.383 1.00 25.00 N ATOM 0 H HIS A 158 72.982 25.911 -17.991 1.00 25.00 H new ATOM 0 HA HIS A 158 70.469 25.033 -19.097 1.00 25.00 H new ATOM 0 HB2 HIS A 158 73.281 25.062 -20.297 1.00 25.00 H new ATOM 0 HB3 HIS A 158 71.771 25.041 -21.186 1.00 25.00 H new ATOM 0 HD2 HIS A 158 70.170 27.512 -20.442 1.00 25.00 H new ATOM 0 HE1 HIS A 158 73.686 29.799 -20.293 1.00 25.00 H new ATOM 0 HE2 HIS A 158 71.144 29.946 -20.422 1.00 25.00 H new ATOM 1235 N ARG A 159 72.462 22.813 -18.071 1.00 25.00 N ATOM 1236 CA ARG A 159 72.722 21.374 -18.000 1.00 25.00 C ATOM 1237 C ARG A 159 71.714 20.675 -17.105 1.00 25.00 C ATOM 1238 O ARG A 159 71.194 21.266 -16.163 1.00 25.00 O ATOM 1239 CB ARG A 159 74.124 21.122 -17.460 1.00 25.00 C ATOM 1240 CG ARG A 159 75.212 21.646 -18.360 1.00 25.00 C ATOM 1241 CD ARG A 159 76.542 21.057 -17.951 1.00 25.00 C ATOM 1242 NE ARG A 159 77.627 21.543 -18.813 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.850 21.042 -18.860 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.222 20.022 -18.124 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 79.727 21.581 -19.670 1.00 25.00 N ATOM 0 H ARG A 159 72.880 23.360 -17.319 1.00 25.00 H new ATOM 0 HA ARG A 159 72.633 20.972 -19.009 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.217 21.588 -16.479 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.264 20.050 -17.318 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.994 21.390 -19.397 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.252 22.734 -18.302 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.754 21.317 -16.914 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.492 19.969 -18.003 1.00 25.00 H new ATOM 0 HE ARG A 159 77.420 22.332 -19.426 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.558 19.585 -17.485 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.176 19.666 -18.191 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.462 22.375 -20.253 1.00 25.00 H new ATOM 0 HH22 ARG A 159 80.675 21.206 -19.718 1.00 25.00 H new ATOM 1259 N SER A 160 71.483 19.406 -17.381 1.00 25.00 N ATOM 1260 CA SER A 160 70.630 18.582 -16.551 1.00 25.00 C ATOM 1261 C SER A 160 71.418 18.120 -15.333 1.00 25.00 C ATOM 1262 O SER A 160 72.652 18.141 -15.331 1.00 25.00 O ATOM 1263 CB SER A 160 70.146 17.369 -17.334 1.00 25.00 C ATOM 1264 OG SER A 160 71.241 16.570 -17.770 1.00 25.00 O ATOM 0 H SER A 160 71.881 18.920 -18.185 1.00 25.00 H new ATOM 0 HA SER A 160 69.764 19.164 -16.235 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.481 16.771 -16.710 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.565 17.697 -18.196 1.00 25.00 H new ATOM 0 HG SER A 160 70.904 15.797 -18.269 1.00 25.00 H new ATOM 1270 N LEU A 161 70.721 17.686 -14.301 1.00 25.00 N ATOM 1271 CA LEU A 161 71.363 17.233 -13.061 1.00 25.00 C ATOM 1272 C LEU A 161 72.203 15.966 -13.306 1.00 25.00 C ATOM 1273 O LEU A 161 73.318 15.820 -12.772 1.00 25.00 O ATOM 1274 CB LEU A 161 70.277 16.991 -12.003 1.00 25.00 C ATOM 1275 CG LEU A 161 69.409 18.240 -11.697 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.194 17.844 -10.893 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.198 19.320 -10.946 1.00 25.00 C ATOM 0 H LEU A 161 69.702 17.634 -14.288 1.00 25.00 H new ATOM 0 HA LEU A 161 72.048 18.001 -12.701 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.628 16.183 -12.341 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.750 16.655 -11.081 1.00 25.00 H new ATOM 0 HG LEU A 161 69.097 18.661 -12.653 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.592 18.728 -10.684 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.601 17.127 -11.460 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.511 17.391 -9.954 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.551 20.176 -10.753 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.557 18.916 -10.000 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.047 19.637 -11.551 1.00 25.00 H new ATOM 1289 N ALA A 162 71.730 15.110 -14.201 1.00 25.00 N ATOM 1290 CA ALA A 162 72.483 13.923 -14.598 1.00 25.00 C ATOM 1291 C ALA A 162 73.838 14.302 -15.229 1.00 25.00 C ATOM 1292 O ALA A 162 74.802 13.555 -15.123 1.00 25.00 O ATOM 1293 CB ALA A 162 71.662 13.090 -15.576 1.00 25.00 C ATOM 0 H ALA A 162 70.829 15.213 -14.667 1.00 25.00 H new ATOM 0 HA ALA A 162 72.684 13.335 -13.703 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.230 12.207 -15.868 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.731 12.782 -15.100 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.437 13.685 -16.461 1.00 25.00 H new ATOM 1299 N SER A 163 73.917 15.473 -15.849 1.00 25.00 N ATOM 1300 CA SER A 163 75.169 15.930 -16.473 1.00 25.00 C ATOM 1301 C SER A 163 76.235 16.289 -15.437 1.00 25.00 C ATOM 1302 O SER A 163 77.419 16.383 -15.764 1.00 25.00 O ATOM 1303 CB SER A 163 74.922 17.156 -17.357 1.00 25.00 C ATOM 1304 OG SER A 163 73.962 16.882 -18.364 1.00 25.00 O ATOM 0 H SER A 163 73.138 16.126 -15.937 1.00 25.00 H new ATOM 0 HA SER A 163 75.531 15.097 -17.076 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.579 17.987 -16.741 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.858 17.468 -17.820 1.00 25.00 H new ATOM 0 HG SER A 163 73.074 16.807 -17.957 1.00 25.00 H new ATOM 1310 N TYR A 164 75.822 16.479 -14.192 1.00 25.00 N ATOM 1311 CA TYR A 164 76.760 16.750 -13.095 1.00 25.00 C ATOM 1312 C TYR A 164 77.030 15.474 -12.314 1.00 25.00 C ATOM 1313 O TYR A 164 77.808 15.467 -11.369 1.00 25.00 O ATOM 1314 CB TYR A 164 76.168 17.783 -12.146 1.00 25.00 C ATOM 1315 CG TYR A 164 76.261 19.182 -12.669 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.425 19.949 -12.451 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.196 19.762 -13.386 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.513 21.277 -12.918 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.289 21.095 -13.851 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.444 21.836 -13.605 1.00 25.00 C ATOM 1321 OH TYR A 164 76.554 23.130 -14.027 1.00 25.00 O ATOM 0 H TYR A 164 74.842 16.452 -13.909 1.00 25.00 H new ATOM 0 HA TYR A 164 77.689 17.128 -13.521 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.122 17.540 -11.960 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.684 17.725 -11.187 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.259 19.514 -11.920 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.304 19.186 -13.582 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.408 21.856 -12.742 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.468 21.537 -14.395 1.00 25.00 H new ATOM 0 HH TYR A 164 77.495 23.336 -14.210 1.00 25.00 H new ATOM 1331 N GLY A 165 76.345 14.409 -12.693 1.00 25.00 N ATOM 1332 CA GLY A 165 76.442 13.171 -11.955 1.00 25.00 C ATOM 1333 C GLY A 165 75.648 13.257 -10.667 1.00 25.00 C ATOM 1334 O GLY A 165 75.955 12.564 -9.703 1.00 25.00 O ATOM 0 H GLY A 165 75.722 14.380 -13.500 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.070 12.347 -12.564 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.487 12.955 -11.731 1.00 25.00 H new ATOM 1338 N LEU A 166 74.632 14.113 -10.631 1.00 25.00 N ATOM 1339 CA LEU A 166 73.823 14.236 -9.425 1.00 25.00 C ATOM 1340 C LEU A 166 72.892 13.043 -9.344 1.00 25.00 C ATOM 1341 O LEU A 166 71.770 13.065 -9.837 1.00 25.00 O ATOM 1342 CB LEU A 166 73.037 15.548 -9.427 1.00 25.00 C ATOM 1343 CG LEU A 166 73.832 16.743 -8.904 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.273 18.056 -9.416 1.00 25.00 C ATOM 1345 CD2 LEU A 166 73.812 16.733 -7.378 1.00 25.00 C ATOM 0 H LEU A 166 74.354 14.718 -11.403 1.00 25.00 H new ATOM 0 HA LEU A 166 74.471 14.252 -8.549 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.705 15.761 -10.443 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.141 15.425 -8.819 1.00 25.00 H new ATOM 0 HG LEU A 166 74.856 16.655 -9.267 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.865 18.882 -9.022 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.313 18.068 -10.505 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.239 18.163 -9.089 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.379 17.585 -7.001 1.00 25.00 H new ATOM 0 HD22 LEU A 166 72.782 16.798 -7.027 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.261 15.809 -7.014 1.00 25.00 H new ATOM 1357 N LYS A 167 73.402 11.971 -8.765 1.00 25.00 N ATOM 1358 CA LYS A 167 72.652 10.733 -8.576 1.00 25.00 C ATOM 1359 C LYS A 167 71.762 10.831 -7.343 1.00 25.00 C ATOM 1360 O LYS A 167 71.925 11.715 -6.505 1.00 25.00 O ATOM 1361 CB LYS A 167 73.620 9.561 -8.392 1.00 25.00 C ATOM 1362 CG LYS A 167 74.542 9.289 -9.603 1.00 25.00 C ATOM 1363 CD LYS A 167 73.779 8.974 -10.912 1.00 25.00 C ATOM 1364 CE LYS A 167 72.881 7.729 -10.788 1.00 25.00 C ATOM 1365 NZ LYS A 167 73.648 6.503 -10.362 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.357 11.930 -8.408 1.00 25.00 H new ATOM 0 HA LYS A 167 72.032 10.571 -9.458 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.240 9.754 -7.516 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.043 8.660 -8.182 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.179 10.159 -9.765 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.199 8.452 -9.366 1.00 25.00 H new ATOM 0 HD2 LYS A 167 73.167 9.833 -11.187 1.00 25.00 H new ATOM 0 HD3 LYS A 167 74.496 8.822 -11.719 1.00 25.00 H new ATOM 0 HE2 LYS A 167 72.089 7.927 -10.066 1.00 25.00 H new ATOM 0 HE3 LYS A 167 72.398 7.537 -11.746 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 73.021 5.674 -10.392 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 74.450 6.354 -11.007 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 74.002 6.635 -9.393 1.00 25.00 H new ATOM 1379 N ASP A 168 70.845 9.893 -7.221 1.00 25.00 N ATOM 1380 CA ASP A 168 69.949 9.833 -6.088 1.00 25.00 C ATOM 1381 C ASP A 168 70.733 9.755 -4.785 1.00 25.00 C ATOM 1382 O ASP A 168 71.631 8.928 -4.629 1.00 25.00 O ATOM 1383 CB ASP A 168 69.003 8.624 -6.203 1.00 25.00 C ATOM 1384 CG ASP A 168 69.746 7.298 -6.421 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.400 7.142 -7.493 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.580 6.384 -5.589 1.00 25.00 O1- ATOM 0 H ASP A 168 70.701 9.151 -7.906 1.00 25.00 H new ATOM 0 HA ASP A 168 69.352 10.745 -6.085 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.402 8.552 -5.296 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.313 8.787 -7.031 1.00 25.00 H new ATOM 1391 N GLY A 169 70.399 10.651 -3.868 1.00 25.00 N ATOM 1392 CA GLY A 169 71.052 10.694 -2.570 1.00 25.00 C ATOM 1393 C GLY A 169 72.146 11.737 -2.491 1.00 25.00 C ATOM 1394 O GLY A 169 72.588 12.077 -1.395 1.00 25.00 O ATOM 0 H GLY A 169 69.677 11.360 -4.000 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.307 10.899 -1.801 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.476 9.714 -2.350 1.00 25.00 H new ATOM 1398 N ASP A 170 72.588 12.263 -3.624 1.00 25.00 N ATOM 1399 CA ASP A 170 73.614 13.303 -3.597 1.00 25.00 C ATOM 1400 C ASP A 170 73.034 14.572 -2.971 1.00 25.00 C ATOM 1401 O ASP A 170 71.829 14.851 -3.072 1.00 25.00 O ATOM 1402 CB ASP A 170 74.140 13.609 -5.003 1.00 25.00 C ATOM 1403 CG ASP A 170 75.169 12.580 -5.481 1.00 25.00 C ATOM 1404 OD1 ASP A 170 75.934 12.059 -4.648 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.265 12.361 -6.711 1.00 25.00 O1- ATOM 0 H ASP A 170 72.264 11.997 -4.554 1.00 25.00 H new ATOM 0 HA ASP A 170 74.451 12.943 -2.999 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.304 13.634 -5.702 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.592 14.601 -5.010 1.00 25.00 H new ATOM 1410 N VAL A 171 73.893 15.323 -2.305 1.00 25.00 N ATOM 1411 CA VAL A 171 73.481 16.514 -1.569 1.00 25.00 C ATOM 1412 C VAL A 171 74.189 17.759 -2.108 1.00 25.00 C ATOM 1413 O VAL A 171 75.406 17.746 -2.354 1.00 25.00 O ATOM 1414 CB VAL A 171 73.726 16.326 -0.021 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.158 15.855 0.267 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.410 17.616 0.763 1.00 25.00 C ATOM 0 H VAL A 171 74.893 15.129 -2.257 1.00 25.00 H new ATOM 0 HA VAL A 171 72.411 16.659 -1.717 1.00 25.00 H new ATOM 0 HB VAL A 171 73.041 15.550 0.320 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.292 15.736 1.342 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.334 14.900 -0.229 1.00 25.00 H new ATOM 0 HG13 VAL A 171 75.866 16.594 -0.107 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.590 17.450 1.825 1.00 25.00 H new ATOM 0 HG22 VAL A 171 74.051 18.423 0.409 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.366 17.888 0.610 1.00 25.00 H new ATOM 1426 N VAL A 172 73.436 18.839 -2.300 1.00 25.00 N ATOM 1427 CA VAL A 172 74.004 20.096 -2.785 1.00 25.00 C ATOM 1428 C VAL A 172 73.955 21.094 -1.642 1.00 25.00 C ATOM 1429 O VAL A 172 73.190 20.930 -0.691 1.00 25.00 O ATOM 1430 CB VAL A 172 73.240 20.650 -4.027 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.168 19.587 -5.118 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.819 21.085 -3.669 1.00 25.00 C ATOM 0 H VAL A 172 72.431 18.870 -2.127 1.00 25.00 H new ATOM 0 HA VAL A 172 75.030 19.924 -3.110 1.00 25.00 H new ATOM 0 HB VAL A 172 73.792 21.520 -4.384 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.632 19.986 -5.980 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.177 19.304 -5.417 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.643 18.711 -4.738 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.319 21.465 -4.560 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.265 20.232 -3.278 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.858 21.869 -2.913 1.00 25.00 H new ATOM 1442 N ILE A 173 74.782 22.128 -1.714 1.00 25.00 N ATOM 1443 CA ILE A 173 74.846 23.142 -0.658 1.00 25.00 C ATOM 1444 C ILE A 173 74.456 24.482 -1.259 1.00 25.00 C ATOM 1445 O ILE A 173 74.946 24.881 -2.317 1.00 25.00 O ATOM 1446 CB ILE A 173 76.270 23.199 -0.015 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.601 21.845 0.645 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.355 24.337 1.033 1.00 25.00 C ATOM 1449 CD1 ILE A 173 78.065 21.690 1.124 1.00 25.00 C ATOM 0 H ILE A 173 75.421 22.291 -2.492 1.00 25.00 H new ATOM 0 HA ILE A 173 74.153 22.885 0.143 1.00 25.00 H new ATOM 0 HB ILE A 173 76.997 23.403 -0.801 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.938 21.703 1.499 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.381 21.048 -0.066 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.355 24.358 1.467 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.149 25.292 0.550 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.621 24.163 1.820 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.199 20.706 1.573 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.739 21.795 0.274 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.290 22.460 1.862 1.00 25.00 H new ATOM 1461 N LEU A 174 73.563 25.175 -0.578 1.00 25.00 N ATOM 1462 CA LEU A 174 73.057 26.473 -1.003 1.00 25.00 C ATOM 1463 C LEU A 174 73.482 27.466 0.074 1.00 25.00 C ATOM 1464 O LEU A 174 73.376 27.169 1.255 1.00 25.00 O ATOM 1465 CB LEU A 174 71.531 26.385 -1.114 1.00 25.00 C ATOM 1466 CG LEU A 174 70.843 27.222 -2.198 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.371 26.826 -2.261 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.956 28.715 -1.931 1.00 25.00 C ATOM 0 H LEU A 174 73.160 24.849 0.301 1.00 25.00 H new ATOM 0 HA LEU A 174 73.444 26.785 -1.973 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.267 25.340 -1.280 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.108 26.672 -0.151 1.00 25.00 H new ATOM 0 HG LEU A 174 71.341 27.024 -3.147 1.00 25.00 H new ATOM 0 HD11 LEU A 174 68.869 27.414 -3.029 1.00 25.00 H new ATOM 0 HD12 LEU A 174 69.289 25.767 -2.504 1.00 25.00 H new ATOM 0 HD13 LEU A 174 68.902 27.014 -1.295 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.454 29.266 -2.726 1.00 25.00 H new ATOM 0 HD22 LEU A 174 70.488 28.950 -0.975 1.00 25.00 H new ATOM 0 HD23 LEU A 174 72.007 29.001 -1.900 1.00 25.00 H new ATOM 1480 N ARG A 175 74.039 28.599 -0.318 1.00 25.00 N ATOM 1481 CA ARG A 175 74.544 29.581 0.640 1.00 25.00 C ATOM 1482 C ARG A 175 73.955 30.944 0.352 1.00 25.00 C ATOM 1483 O ARG A 175 74.072 31.457 -0.763 1.00 25.00 O ATOM 1484 CB ARG A 175 76.069 29.654 0.560 1.00 25.00 C ATOM 1485 CG ARG A 175 76.752 28.358 0.974 1.00 25.00 C ATOM 1486 CD ARG A 175 78.235 28.382 0.681 1.00 25.00 C ATOM 1487 NE ARG A 175 78.865 27.120 1.086 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.103 26.742 0.774 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.896 27.486 0.042 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.549 25.593 1.199 1.00 25.00 N ATOM 0 H ARG A 175 74.155 28.867 -1.295 1.00 25.00 H new ATOM 0 HA ARG A 175 74.251 29.271 1.643 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.362 29.902 -0.460 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.422 30.464 1.199 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.595 28.190 2.039 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.292 27.521 0.448 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.398 28.550 -0.384 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.702 29.213 1.210 1.00 25.00 H new ATOM 0 HE ARG A 175 78.309 26.480 1.653 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.570 28.387 -0.308 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.839 27.164 -0.177 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.951 24.992 1.766 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.496 25.295 0.965 1.00 25.00 H new ATOM 1504 N GLN A 176 73.331 31.552 1.366 1.00 25.00 N ATOM 1505 CA GLN A 176 72.762 32.904 1.255 1.00 25.00 C ATOM 1506 C GLN A 176 73.554 33.902 2.094 1.00 25.00 C ATOM 1507 O GLN A 176 73.780 33.769 3.284 1.00 25.00 O ATOM 1508 CB GLN A 176 71.260 32.919 1.622 1.00 25.00 C ATOM 1509 CG GLN A 176 70.651 34.298 1.307 1.00 25.00 C ATOM 1510 CD GLN A 176 69.169 34.313 1.576 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.657 33.854 2.576 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.425 34.896 0.660 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.961 34.845 1.473 1.00 25.00 O ATOM 0 H GLN A 176 73.205 31.125 2.284 1.00 25.00 H new ATOM 0 HA GLN A 176 72.841 33.212 0.213 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.734 32.145 1.064 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.134 32.691 2.680 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.141 35.061 1.911 1.00 25.00 H new ATOM 0 HG3 GLN A 176 70.836 34.551 0.263 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.858 35.281 -0.180 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.415 34.963 0.790 1.00 25.00 H new