USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=16 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 128 HIS : no HD1:sc= -0.519 X(o=-0.84,f=-0.94) USER MOD Set 1.2: A 157 ASN : amide:sc= -0.322 K(o=-0.84,f=-2.1!) USER MOD Set 2.1: A 100 HIS : no HE2:sc= -0.0402 K(o=-0.04,f=-4.1!) USER MOD Set 2.2: A 120 GLN : amide:sc= 0 K(o=-0.04,f=-2.6) USER MOD Single : A 101 MET CE :methyl -177:sc= -0.534 (180deg=-0.569) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot -140:sc= 0 USER MOD Single : A 113 SER OG : rot -130:sc= -0.145 USER MOD Single : A 116 THR OG1 : rot 32:sc= 0.912 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -0.0458 K(o=-0.046,f=-1.4) USER MOD Single : A 134 CYS SG : rot -28:sc= 0.598 USER MOD Single : A 138 SER OG : rot -97:sc= 1.22 USER MOD Single : A 145 SER OG : rot 95:sc= 1.19 USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 TYR OH : rot 26:sc= 1.28 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 170:sc= 0.519 USER MOD Single : A 164 TYR OH : rot 172:sc= -0.434 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= -0.214 K(o=-0.21,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 61.701 8.799 -11.155 1.00 25.00 N ATOM 307 CA HIS A 100 62.400 10.026 -10.761 1.00 25.00 C ATOM 308 C HIS A 100 63.351 9.702 -9.623 1.00 25.00 C ATOM 309 O HIS A 100 63.221 8.658 -8.992 1.00 25.00 O ATOM 310 CB HIS A 100 61.389 11.107 -10.353 1.00 25.00 C ATOM 311 CG HIS A 100 60.730 10.850 -9.034 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.357 11.065 -7.801 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.491 10.397 -8.717 1.00 25.00 C ATOM 314 CE1 HIS A 100 60.509 10.742 -6.834 1.00 25.00 C ATOM 315 NE2 HIS A 100 59.384 10.344 -7.363 1.00 25.00 N ATOM 0 HA HIS A 100 62.973 10.416 -11.602 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.897 12.070 -10.313 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.622 11.183 -11.123 1.00 25.00 H new ATOM 0 HD1 HIS A 100 62.307 11.412 -7.669 1.00 25.00 H new ATOM 0 HD2 HIS A 100 58.720 10.124 -9.422 1.00 25.00 H new ATOM 0 HE1 HIS A 100 60.716 10.799 -5.776 1.00 25.00 H new ATOM 323 N MET A 101 64.270 10.607 -9.346 1.00 25.00 N ATOM 324 CA MET A 101 65.249 10.439 -8.275 1.00 25.00 C ATOM 325 C MET A 101 64.978 11.442 -7.151 1.00 25.00 C ATOM 326 O MET A 101 64.003 12.208 -7.211 1.00 25.00 O ATOM 327 CB MET A 101 66.661 10.619 -8.845 1.00 25.00 C ATOM 328 CG MET A 101 66.944 12.000 -9.401 1.00 25.00 C ATOM 329 SD MET A 101 68.567 12.034 -10.160 1.00 25.00 S ATOM 330 CE MET A 101 68.753 13.800 -10.477 1.00 25.00 C ATOM 0 H MET A 101 64.364 11.485 -9.856 1.00 25.00 H new ATOM 0 HA MET A 101 65.166 9.436 -7.856 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.386 10.402 -8.061 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.816 9.884 -9.635 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.184 12.268 -10.135 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.891 12.740 -8.603 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.694 13.979 -10.998 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.925 14.148 -11.094 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.753 14.341 -9.531 1.00 25.00 H new ATOM 340 N LEU A 102 65.809 11.395 -6.116 1.00 25.00 N ATOM 341 CA LEU A 102 65.667 12.246 -4.937 1.00 25.00 C ATOM 342 C LEU A 102 67.037 12.824 -4.607 1.00 25.00 C ATOM 343 O LEU A 102 68.017 12.082 -4.581 1.00 25.00 O ATOM 344 CB LEU A 102 65.175 11.399 -3.755 1.00 25.00 C ATOM 345 CG LEU A 102 64.853 12.156 -2.451 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.474 12.803 -2.527 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.896 11.187 -1.278 1.00 25.00 C ATOM 0 H LEU A 102 66.607 10.761 -6.070 1.00 25.00 H new ATOM 0 HA LEU A 102 64.951 13.045 -5.127 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.279 10.864 -4.069 1.00 25.00 H new ATOM 0 HB3 LEU A 102 65.934 10.648 -3.535 1.00 25.00 H new ATOM 0 HG LEU A 102 65.597 12.940 -2.312 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.268 13.331 -1.596 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.448 13.508 -3.358 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.719 12.033 -2.681 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.668 11.722 -0.356 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.160 10.398 -1.431 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.891 10.747 -1.206 1.00 25.00 H new ATOM 359 N LEU A 103 67.103 14.120 -4.356 1.00 25.00 N ATOM 360 CA LEU A 103 68.361 14.787 -4.011 1.00 25.00 C ATOM 361 C LEU A 103 68.186 15.542 -2.711 1.00 25.00 C ATOM 362 O LEU A 103 67.084 15.969 -2.387 1.00 25.00 O ATOM 363 CB LEU A 103 68.774 15.786 -5.092 1.00 25.00 C ATOM 364 CG LEU A 103 69.080 15.225 -6.483 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.415 16.392 -7.402 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.231 14.244 -6.452 1.00 25.00 C ATOM 0 H LEU A 103 66.295 14.742 -4.383 1.00 25.00 H new ATOM 0 HA LEU A 103 69.133 14.023 -3.919 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.977 16.523 -5.193 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.658 16.318 -4.740 1.00 25.00 H new ATOM 0 HG LEU A 103 68.207 14.684 -6.847 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.637 16.016 -8.401 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.565 17.072 -7.451 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.283 16.924 -7.013 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.417 13.869 -7.458 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.125 14.744 -6.081 1.00 25.00 H new ATOM 0 HD23 LEU A 103 69.982 13.411 -5.795 1.00 25.00 H new ATOM 378 N THR A 104 69.279 15.738 -1.993 1.00 25.00 N ATOM 379 CA THR A 104 69.249 16.480 -0.737 1.00 25.00 C ATOM 380 C THR A 104 69.788 17.887 -0.982 1.00 25.00 C ATOM 381 O THR A 104 70.732 18.076 -1.742 1.00 25.00 O ATOM 382 CB THR A 104 70.106 15.779 0.324 1.00 25.00 C ATOM 383 OG1 THR A 104 69.897 14.366 0.236 1.00 25.00 O ATOM 384 CG2 THR A 104 69.752 16.232 1.736 1.00 25.00 C ATOM 0 H THR A 104 70.202 15.394 -2.257 1.00 25.00 H new ATOM 0 HA THR A 104 68.222 16.528 -0.374 1.00 25.00 H new ATOM 0 HB THR A 104 71.147 16.038 0.132 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.444 13.912 0.911 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.384 15.710 2.455 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.913 17.306 1.825 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.706 16.004 1.940 1.00 25.00 H new ATOM 392 N VAL A 105 69.174 18.873 -0.353 1.00 25.00 N ATOM 393 CA VAL A 105 69.581 20.265 -0.485 1.00 25.00 C ATOM 394 C VAL A 105 69.846 20.793 0.917 1.00 25.00 C ATOM 395 O VAL A 105 69.037 20.588 1.823 1.00 25.00 O ATOM 396 CB VAL A 105 68.448 21.104 -1.138 1.00 25.00 C ATOM 397 CG1 VAL A 105 68.858 22.581 -1.289 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.038 20.521 -2.503 1.00 25.00 C ATOM 0 H VAL A 105 68.376 18.733 0.267 1.00 25.00 H new ATOM 0 HA VAL A 105 70.468 20.338 -1.114 1.00 25.00 H new ATOM 0 HB VAL A 105 67.587 21.056 -0.472 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.043 23.140 -1.749 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.076 23.000 -0.307 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.745 22.650 -1.918 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.244 21.130 -2.935 1.00 25.00 H new ATOM 0 HG22 VAL A 105 68.899 20.520 -3.172 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.681 19.500 -2.370 1.00 25.00 H new ATOM 408 N TYR A 106 70.976 21.448 1.112 1.00 25.00 N ATOM 409 CA TYR A 106 71.341 21.996 2.413 1.00 25.00 C ATOM 410 C TYR A 106 71.530 23.509 2.286 1.00 25.00 C ATOM 411 O TYR A 106 72.484 23.967 1.670 1.00 25.00 O ATOM 412 CB TYR A 106 72.634 21.327 2.897 1.00 25.00 C ATOM 413 CG TYR A 106 72.780 21.299 4.402 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.731 22.484 5.166 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.975 20.076 5.080 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.859 22.446 6.584 1.00 25.00 C ATOM 417 CE2 TYR A 106 73.102 20.037 6.494 1.00 25.00 C ATOM 418 CZ TYR A 106 73.037 21.219 7.228 1.00 25.00 C ATOM 419 OH TYR A 106 73.159 21.178 8.591 1.00 25.00 O ATOM 0 H TYR A 106 71.666 21.616 0.380 1.00 25.00 H new ATOM 0 HA TYR A 106 70.552 21.801 3.140 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.667 20.305 2.519 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.487 21.853 2.468 1.00 25.00 H new ATOM 0 HD1 TYR A 106 72.595 23.433 4.669 1.00 25.00 H new ATOM 0 HD2 TYR A 106 73.028 19.157 4.515 1.00 25.00 H new ATOM 0 HE1 TYR A 106 72.819 23.360 7.158 1.00 25.00 H new ATOM 0 HE2 TYR A 106 73.249 19.094 6.999 1.00 25.00 H new ATOM 0 HH TYR A 106 73.276 20.249 8.881 1.00 25.00 H new ATOM 429 N CYS A 107 70.621 24.288 2.848 1.00 25.00 N ATOM 430 CA CYS A 107 70.715 25.740 2.784 1.00 25.00 C ATOM 431 C CYS A 107 71.421 26.221 4.040 1.00 25.00 C ATOM 432 O CYS A 107 71.122 25.749 5.120 1.00 25.00 O ATOM 433 CB CYS A 107 69.321 26.355 2.694 1.00 25.00 C ATOM 434 SG CYS A 107 68.404 25.808 1.234 1.00 25.00 S ATOM 0 H CYS A 107 69.807 23.940 3.355 1.00 25.00 H new ATOM 0 HA CYS A 107 71.274 26.042 1.899 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.756 26.096 3.590 1.00 25.00 H new ATOM 0 HB3 CYS A 107 69.409 27.441 2.676 1.00 25.00 H new ATOM 0 HG CYS A 107 67.746 26.811 0.734 1.00 25.00 H new ATOM 440 N VAL A 108 72.376 27.130 3.890 1.00 25.00 N ATOM 441 CA VAL A 108 73.179 27.610 5.019 1.00 25.00 C ATOM 442 C VAL A 108 73.232 29.136 5.078 1.00 25.00 C ATOM 443 O VAL A 108 73.568 29.806 4.087 1.00 25.00 O ATOM 444 CB VAL A 108 74.650 27.067 4.926 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.468 27.490 6.161 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.656 25.531 4.818 1.00 25.00 C ATOM 0 H VAL A 108 72.618 27.554 2.995 1.00 25.00 H new ATOM 0 HA VAL A 108 72.695 27.238 5.922 1.00 25.00 H new ATOM 0 HB VAL A 108 75.104 27.494 4.032 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.483 27.103 6.075 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.498 28.578 6.222 1.00 25.00 H new ATOM 0 HG13 VAL A 108 75.002 27.089 7.061 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.684 25.175 4.755 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.177 25.102 5.698 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.111 25.227 3.924 1.00 25.00 H new ATOM 456 N ARG A 109 72.967 29.680 6.264 1.00 25.00 N ATOM 457 CA ARG A 109 73.148 31.094 6.546 1.00 25.00 C ATOM 458 C ARG A 109 73.885 31.144 7.867 1.00 25.00 C ATOM 459 O ARG A 109 73.641 30.320 8.732 1.00 25.00 O ATOM 460 CB ARG A 109 71.805 31.792 6.688 1.00 25.00 C ATOM 461 CG ARG A 109 70.985 31.833 5.398 1.00 25.00 C ATOM 462 CD ARG A 109 69.823 32.830 5.480 1.00 25.00 C ATOM 463 NE ARG A 109 70.265 34.234 5.376 1.00 25.00 N ATOM 464 CZ ARG A 109 70.002 35.198 6.253 1.00 25.00 C ATOM 465 NH1 ARG A 109 69.328 34.988 7.361 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 70.434 36.400 6.005 1.00 25.00 N ATOM 0 H ARG A 109 72.618 29.144 7.059 1.00 25.00 H new ATOM 0 HA ARG A 109 73.690 31.594 5.743 1.00 25.00 H new ATOM 0 HB2 ARG A 109 71.224 31.286 7.459 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.972 32.813 7.032 1.00 25.00 H new ATOM 0 HG2 ARG A 109 71.635 32.103 4.565 1.00 25.00 H new ATOM 0 HG3 ARG A 109 70.593 30.838 5.187 1.00 25.00 H new ATOM 0 HD2 ARG A 109 69.111 32.618 4.682 1.00 25.00 H new ATOM 0 HD3 ARG A 109 69.295 32.689 6.423 1.00 25.00 H new ATOM 0 HE ARG A 109 70.821 34.487 4.559 1.00 25.00 H new ATOM 0 HH11 ARG A 109 68.982 34.053 7.578 1.00 25.00 H new ATOM 0 HH12 ARG A 109 69.151 35.760 8.004 1.00 25.00 H new ATOM 0 HH21 ARG A 109 70.962 36.586 5.152 1.00 25.00 H new ATOM 0 HH22 ARG A 109 70.245 37.156 6.663 1.00 25.00 H new ATOM 480 N ARG A 110 74.779 32.112 8.034 1.00 25.00 N ATOM 481 CA ARG A 110 75.559 32.227 9.277 1.00 25.00 C ATOM 482 C ARG A 110 74.703 32.654 10.461 1.00 25.00 C ATOM 483 O ARG A 110 75.145 32.604 11.592 1.00 25.00 O ATOM 484 CB ARG A 110 76.690 33.242 9.124 1.00 25.00 C ATOM 485 CG ARG A 110 77.817 32.786 8.220 1.00 25.00 C ATOM 486 CD ARG A 110 78.935 33.810 8.241 1.00 25.00 C ATOM 487 NE ARG A 110 80.109 33.363 7.473 1.00 25.00 N ATOM 488 CZ ARG A 110 81.229 34.059 7.316 1.00 25.00 C ATOM 489 NH1 ARG A 110 81.393 35.250 7.839 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 82.206 33.541 6.618 1.00 25.00 N ATOM 0 H ARG A 110 74.986 32.826 7.336 1.00 25.00 H new ATOM 0 HA ARG A 110 75.962 31.233 9.468 1.00 25.00 H new ATOM 0 HB2 ARG A 110 76.278 34.172 8.731 1.00 25.00 H new ATOM 0 HB3 ARG A 110 77.098 33.466 10.110 1.00 25.00 H new ATOM 0 HG2 ARG A 110 78.192 31.817 8.550 1.00 25.00 H new ATOM 0 HG3 ARG A 110 77.450 32.655 7.202 1.00 25.00 H new ATOM 0 HD2 ARG A 110 78.571 34.752 7.831 1.00 25.00 H new ATOM 0 HD3 ARG A 110 79.229 34.004 9.272 1.00 25.00 H new ATOM 0 HE ARG A 110 80.058 32.447 7.027 1.00 25.00 H new ATOM 0 HH11 ARG A 110 80.645 35.673 8.389 1.00 25.00 H new ATOM 0 HH12 ARG A 110 82.268 35.754 7.696 1.00 25.00 H new ATOM 0 HH21 ARG A 110 82.101 32.615 6.203 1.00 25.00 H new ATOM 0 HH22 ARG A 110 83.073 34.063 6.488 1.00 25.00 H new ATOM 504 N ASP A 111 73.484 33.068 10.175 1.00 25.00 N ATOM 505 CA ASP A 111 72.542 33.532 11.194 1.00 25.00 C ATOM 506 C ASP A 111 71.718 32.348 11.728 1.00 25.00 C ATOM 507 O ASP A 111 70.567 32.506 12.122 1.00 25.00 O ATOM 508 CB ASP A 111 71.632 34.591 10.553 1.00 25.00 C ATOM 509 CG ASP A 111 71.000 35.514 11.561 1.00 25.00 C ATOM 510 OD1 ASP A 111 71.594 35.755 12.628 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.964 36.119 11.207 1.00 25.00 O1- ATOM 0 H ASP A 111 73.110 33.095 9.226 1.00 25.00 H new ATOM 0 HA ASP A 111 73.075 33.970 12.038 1.00 25.00 H new ATOM 0 HB2 ASP A 111 72.214 35.180 9.844 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.848 34.091 9.984 1.00 25.00 H new ATOM 516 N LEU A 112 72.313 31.157 11.648 1.00 25.00 N ATOM 517 CA LEU A 112 71.701 29.878 12.077 1.00 25.00 C ATOM 518 C LEU A 112 70.326 29.627 11.456 1.00 25.00 C ATOM 519 O LEU A 112 69.484 28.960 12.028 1.00 25.00 O ATOM 520 CB LEU A 112 71.627 29.793 13.612 1.00 25.00 C ATOM 521 CG LEU A 112 72.962 29.869 14.375 1.00 25.00 C ATOM 522 CD1 LEU A 112 72.685 29.894 15.878 1.00 25.00 C ATOM 523 CD2 LEU A 112 73.864 28.675 14.045 1.00 25.00 C ATOM 0 H LEU A 112 73.256 31.042 11.276 1.00 25.00 H new ATOM 0 HA LEU A 112 72.355 29.089 11.707 1.00 25.00 H new ATOM 0 HB2 LEU A 112 70.986 30.600 13.967 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.136 28.857 13.877 1.00 25.00 H new ATOM 0 HG LEU A 112 73.477 30.780 14.070 1.00 25.00 H new ATOM 0 HD11 LEU A 112 73.629 29.948 16.421 1.00 25.00 H new ATOM 0 HD12 LEU A 112 72.076 30.765 16.121 1.00 25.00 H new ATOM 0 HD13 LEU A 112 72.152 28.987 16.165 1.00 25.00 H new ATOM 0 HD21 LEU A 112 74.798 28.760 14.600 1.00 25.00 H new ATOM 0 HD22 LEU A 112 73.359 27.750 14.323 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.077 28.665 12.976 1.00 25.00 H new ATOM 535 N SER A 113 70.129 30.157 10.259 1.00 25.00 N ATOM 536 CA SER A 113 68.882 29.974 9.519 1.00 25.00 C ATOM 537 C SER A 113 69.054 28.823 8.539 1.00 25.00 C ATOM 538 O SER A 113 68.393 28.746 7.513 1.00 25.00 O ATOM 539 CB SER A 113 68.531 31.256 8.769 1.00 25.00 C ATOM 540 OG SER A 113 69.370 32.323 9.191 1.00 25.00 O ATOM 0 H SER A 113 70.823 30.724 9.772 1.00 25.00 H new ATOM 0 HA SER A 113 68.072 29.744 10.211 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.643 31.099 7.696 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.487 31.514 8.946 1.00 25.00 H new ATOM 0 HG SER A 113 68.820 33.103 9.414 1.00 25.00 H new ATOM 546 N GLU A 114 70.027 27.977 8.827 1.00 25.00 N ATOM 547 CA GLU A 114 70.327 26.844 7.975 1.00 25.00 C ATOM 548 C GLU A 114 69.268 25.759 8.150 1.00 25.00 C ATOM 549 O GLU A 114 68.660 25.620 9.213 1.00 25.00 O ATOM 550 CB GLU A 114 71.735 26.322 8.281 1.00 25.00 C ATOM 551 CG GLU A 114 72.002 25.920 9.715 1.00 25.00 C ATOM 552 CD GLU A 114 73.488 25.735 9.962 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.239 26.728 9.785 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.920 24.614 10.295 1.00 25.00 O1- ATOM 0 H GLU A 114 70.625 28.056 9.650 1.00 25.00 H new ATOM 0 HA GLU A 114 70.306 27.156 6.931 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.927 25.460 7.642 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.454 27.092 8.002 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.610 26.682 10.389 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.474 24.993 9.941 1.00 25.00 H new ATOM 561 N VAL A 115 69.004 25.032 7.071 1.00 25.00 N ATOM 562 CA VAL A 115 67.967 24.007 7.038 1.00 25.00 C ATOM 563 C VAL A 115 68.343 23.053 5.915 1.00 25.00 C ATOM 564 O VAL A 115 69.011 23.452 4.964 1.00 25.00 O ATOM 565 CB VAL A 115 66.542 24.653 6.785 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.459 25.343 5.408 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.418 23.616 6.930 1.00 25.00 C ATOM 0 H VAL A 115 69.506 25.137 6.189 1.00 25.00 H new ATOM 0 HA VAL A 115 67.903 23.481 7.991 1.00 25.00 H new ATOM 0 HB VAL A 115 66.406 25.416 7.552 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.466 25.772 5.275 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.207 26.134 5.352 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.646 24.611 4.622 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.456 24.095 6.750 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.566 22.815 6.206 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.434 23.201 7.938 1.00 25.00 H new ATOM 577 N THR A 116 67.934 21.804 5.999 1.00 25.00 N ATOM 578 CA THR A 116 68.184 20.846 4.934 1.00 25.00 C ATOM 579 C THR A 116 66.902 20.073 4.685 1.00 25.00 C ATOM 580 O THR A 116 66.083 19.897 5.587 1.00 25.00 O ATOM 581 CB THR A 116 69.383 19.907 5.263 1.00 25.00 C ATOM 582 OG1 THR A 116 69.652 19.059 4.145 1.00 25.00 O ATOM 583 CG2 THR A 116 69.123 19.028 6.483 1.00 25.00 C ATOM 0 H THR A 116 67.424 21.424 6.797 1.00 25.00 H new ATOM 0 HA THR A 116 68.472 21.374 4.025 1.00 25.00 H new ATOM 0 HB THR A 116 70.235 20.550 5.483 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.439 19.534 3.315 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.991 18.394 6.666 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.943 19.658 7.354 1.00 25.00 H new ATOM 0 HG23 THR A 116 68.249 18.403 6.301 1.00 25.00 H new ATOM 591 N PHE A 117 66.696 19.687 3.435 1.00 25.00 N ATOM 592 CA PHE A 117 65.474 19.022 3.011 1.00 25.00 C ATOM 593 C PHE A 117 65.821 18.238 1.751 1.00 25.00 C ATOM 594 O PHE A 117 66.938 18.346 1.258 1.00 25.00 O ATOM 595 CB PHE A 117 64.365 20.056 2.733 1.00 25.00 C ATOM 596 CG PHE A 117 64.786 21.175 1.811 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.667 21.038 0.417 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.287 22.384 2.339 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.040 22.096 -0.449 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.664 23.447 1.484 1.00 25.00 C ATOM 601 CZ PHE A 117 65.541 23.303 0.087 1.00 25.00 C ATOM 0 H PHE A 117 67.373 19.826 2.685 1.00 25.00 H new ATOM 0 HA PHE A 117 65.096 18.357 3.787 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.506 19.544 2.298 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.036 20.484 3.680 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.287 20.116 0.001 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.384 22.499 3.408 1.00 25.00 H new ATOM 0 HE1 PHE A 117 64.941 21.979 -1.518 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.045 24.367 1.901 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.828 24.111 -0.570 1.00 25.00 H new ATOM 611 N SER A 118 64.884 17.463 1.236 1.00 25.00 N ATOM 612 CA SER A 118 65.116 16.691 0.022 1.00 25.00 C ATOM 613 C SER A 118 64.033 16.983 -0.984 1.00 25.00 C ATOM 614 O SER A 118 62.888 17.236 -0.621 1.00 25.00 O ATOM 615 CB SER A 118 65.132 15.195 0.348 1.00 25.00 C ATOM 616 OG SER A 118 66.155 14.892 1.283 1.00 25.00 O ATOM 0 H SER A 118 63.953 17.349 1.638 1.00 25.00 H new ATOM 0 HA SER A 118 66.081 16.973 -0.399 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.165 14.896 0.752 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.287 14.621 -0.566 1.00 25.00 H new ATOM 0 HG SER A 118 66.146 13.932 1.478 1.00 25.00 H new ATOM 622 N LEU A 119 64.388 16.938 -2.259 1.00 25.00 N ATOM 623 CA LEU A 119 63.448 17.207 -3.344 1.00 25.00 C ATOM 624 C LEU A 119 63.452 16.057 -4.326 1.00 25.00 C ATOM 625 O LEU A 119 64.483 15.432 -4.556 1.00 25.00 O ATOM 626 CB LEU A 119 63.834 18.485 -4.094 1.00 25.00 C ATOM 627 CG LEU A 119 63.666 19.811 -3.344 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.285 20.915 -4.182 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.188 20.129 -3.080 1.00 25.00 C ATOM 0 H LEU A 119 65.332 16.715 -2.573 1.00 25.00 H new ATOM 0 HA LEU A 119 62.457 17.328 -2.907 1.00 25.00 H new ATOM 0 HB2 LEU A 119 64.877 18.397 -4.397 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.240 18.535 -5.006 1.00 25.00 H new ATOM 0 HG LEU A 119 64.162 19.734 -2.376 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.176 21.869 -3.665 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.343 20.705 -4.336 1.00 25.00 H new ATOM 0 HD13 LEU A 119 63.781 20.965 -5.147 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.109 21.076 -2.547 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.656 20.202 -4.029 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.747 19.335 -2.477 1.00 25.00 H new ATOM 641 N GLN A 120 62.300 15.803 -4.920 1.00 25.00 N ATOM 642 CA GLN A 120 62.187 14.770 -5.943 1.00 25.00 C ATOM 643 C GLN A 120 62.281 15.438 -7.303 1.00 25.00 C ATOM 644 O GLN A 120 61.596 16.416 -7.565 1.00 25.00 O ATOM 645 CB GLN A 120 60.884 13.976 -5.815 1.00 25.00 C ATOM 646 CG GLN A 120 59.617 14.791 -5.546 1.00 25.00 C ATOM 647 CD GLN A 120 58.360 13.944 -5.642 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.407 12.717 -5.578 1.00 25.00 O ATOM 649 NE2 GLN A 120 57.235 14.591 -5.796 1.00 25.00 N ATOM 0 H GLN A 120 61.430 16.294 -4.715 1.00 25.00 H new ATOM 0 HA GLN A 120 62.998 14.052 -5.817 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.737 13.409 -6.734 1.00 25.00 H new ATOM 0 HB3 GLN A 120 61.002 13.252 -5.009 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.678 15.237 -4.553 1.00 25.00 H new ATOM 0 HG3 GLN A 120 59.556 15.611 -6.261 1.00 25.00 H new ATOM 0 HE21 GLN A 120 57.235 15.610 -5.845 1.00 25.00 H new ATOM 0 HE22 GLN A 120 56.357 14.077 -5.867 1.00 25.00 H new ATOM 658 N VAL A 121 63.174 14.928 -8.141 1.00 25.00 N ATOM 659 CA VAL A 121 63.433 15.521 -9.456 1.00 25.00 C ATOM 660 C VAL A 121 63.688 14.414 -10.458 1.00 25.00 C ATOM 661 O VAL A 121 63.990 13.294 -10.074 1.00 25.00 O ATOM 662 CB VAL A 121 64.691 16.458 -9.437 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.422 17.708 -8.607 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.917 15.723 -8.872 1.00 25.00 C ATOM 0 H VAL A 121 63.736 14.102 -7.937 1.00 25.00 H new ATOM 0 HA VAL A 121 62.560 16.113 -9.729 1.00 25.00 H new ATOM 0 HB VAL A 121 64.898 16.750 -10.467 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.308 18.343 -8.608 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.583 18.256 -9.036 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.183 17.420 -7.583 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.775 16.395 -8.870 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.708 15.398 -7.853 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.138 14.854 -9.492 1.00 25.00 H new ATOM 674 N ASP A 122 63.575 14.715 -11.738 1.00 25.00 N ATOM 675 CA ASP A 122 63.907 13.743 -12.775 1.00 25.00 C ATOM 676 C ASP A 122 65.429 13.778 -12.965 1.00 25.00 C ATOM 677 O ASP A 122 66.086 14.691 -12.483 1.00 25.00 O ATOM 678 CB ASP A 122 63.198 14.084 -14.086 1.00 25.00 C ATOM 679 CG ASP A 122 63.176 12.907 -15.046 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.246 12.088 -14.958 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 64.161 12.731 -15.792 1.00 25.00 O1- ATOM 0 H ASP A 122 63.258 15.619 -12.088 1.00 25.00 H new ATOM 0 HA ASP A 122 63.578 12.747 -12.479 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.176 14.398 -13.874 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.699 14.928 -14.560 1.00 25.00 H new ATOM 686 N ALA A 123 65.986 12.818 -13.682 1.00 25.00 N ATOM 687 CA ALA A 123 67.410 12.832 -13.993 1.00 25.00 C ATOM 688 C ALA A 123 67.687 13.970 -14.986 1.00 25.00 C ATOM 689 O ALA A 123 68.726 14.633 -14.924 1.00 25.00 O ATOM 690 CB ALA A 123 67.820 11.488 -14.590 1.00 25.00 C ATOM 0 H ALA A 123 65.478 12.019 -14.061 1.00 25.00 H new ATOM 0 HA ALA A 123 67.991 12.996 -13.086 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.885 11.502 -14.821 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.615 10.693 -13.872 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.253 11.307 -15.503 1.00 25.00 H new ATOM 696 N ASP A 124 66.740 14.191 -15.892 1.00 25.00 N ATOM 697 CA ASP A 124 66.876 15.203 -16.938 1.00 25.00 C ATOM 698 C ASP A 124 66.406 16.582 -16.483 1.00 25.00 C ATOM 699 O ASP A 124 66.249 17.493 -17.284 1.00 25.00 O ATOM 700 CB ASP A 124 66.085 14.760 -18.179 1.00 25.00 C ATOM 701 CG ASP A 124 66.979 14.501 -19.393 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.226 14.403 -19.233 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.428 14.324 -20.506 1.00 25.00 O1- ATOM 0 H ASP A 124 65.860 13.677 -15.924 1.00 25.00 H new ATOM 0 HA ASP A 124 67.936 15.292 -17.177 1.00 25.00 H new ATOM 0 HB2 ASP A 124 65.528 13.853 -17.944 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.353 15.528 -18.430 1.00 25.00 H new ATOM 708 N PHE A 125 66.188 16.738 -15.187 1.00 25.00 N ATOM 709 CA PHE A 125 65.741 18.015 -14.635 1.00 25.00 C ATOM 710 C PHE A 125 66.799 19.083 -14.906 1.00 25.00 C ATOM 711 O PHE A 125 67.983 18.889 -14.628 1.00 25.00 O ATOM 712 CB PHE A 125 65.512 17.878 -13.129 1.00 25.00 C ATOM 713 CG PHE A 125 64.339 18.659 -12.609 1.00 25.00 C ATOM 714 CD1 PHE A 125 63.031 18.180 -12.812 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.522 19.845 -11.879 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.917 18.871 -12.282 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.414 20.542 -11.341 1.00 25.00 C ATOM 718 CZ PHE A 125 62.118 20.058 -11.540 1.00 25.00 C ATOM 0 H PHE A 125 66.312 15.999 -14.495 1.00 25.00 H new ATOM 0 HA PHE A 125 64.804 18.307 -15.109 1.00 25.00 H new ATOM 0 HB2 PHE A 125 65.367 16.825 -12.890 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.411 18.203 -12.605 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.877 17.274 -13.379 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.520 20.229 -11.727 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.918 18.494 -12.443 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.570 21.449 -10.776 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.272 20.589 -11.128 1.00 25.00 H new ATOM 728 N GLU A 126 66.358 20.203 -15.454 1.00 25.00 N ATOM 729 CA GLU A 126 67.256 21.305 -15.790 1.00 25.00 C ATOM 730 C GLU A 126 67.775 21.956 -14.525 1.00 25.00 C ATOM 731 O GLU A 126 67.035 22.082 -13.547 1.00 25.00 O ATOM 732 CB GLU A 126 66.504 22.374 -16.598 1.00 25.00 C ATOM 733 CG GLU A 126 66.174 21.967 -18.032 1.00 25.00 C ATOM 734 CD GLU A 126 67.387 22.027 -18.960 1.00 25.00 C ATOM 735 OE1 GLU A 126 68.517 22.288 -18.470 1.00 25.00 O ATOM 736 OE2 GLU A 126 67.202 21.867 -20.182 1.00 25.00 O1- ATOM 0 H GLU A 126 65.378 20.377 -15.678 1.00 25.00 H new ATOM 0 HA GLU A 126 68.082 20.902 -16.376 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.576 22.617 -16.080 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.104 23.283 -16.621 1.00 25.00 H new ATOM 0 HG2 GLU A 126 65.771 20.954 -18.034 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.393 22.621 -18.420 1.00 25.00 H new ATOM 743 N LEU A 127 69.000 22.466 -14.552 1.00 25.00 N ATOM 744 CA LEU A 127 69.519 23.223 -13.409 1.00 25.00 C ATOM 745 C LEU A 127 68.676 24.466 -13.203 1.00 25.00 C ATOM 746 O LEU A 127 68.417 24.877 -12.073 1.00 25.00 O ATOM 747 CB LEU A 127 70.961 23.671 -13.651 1.00 25.00 C ATOM 748 CG LEU A 127 72.034 23.092 -12.720 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.365 23.706 -13.120 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.748 23.397 -11.235 1.00 25.00 C ATOM 0 H LEU A 127 69.646 22.375 -15.336 1.00 25.00 H new ATOM 0 HA LEU A 127 69.483 22.573 -12.535 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.228 23.415 -14.676 1.00 25.00 H new ATOM 0 HB3 LEU A 127 70.996 24.758 -13.574 1.00 25.00 H new ATOM 0 HG LEU A 127 72.044 22.007 -12.822 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.154 23.316 -12.477 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.585 23.454 -14.157 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.313 24.789 -13.013 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.536 22.966 -10.617 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.718 24.476 -11.084 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.788 22.964 -10.953 1.00 25.00 H new ATOM 762 N HIS A 128 68.219 25.049 -14.306 1.00 25.00 N ATOM 763 CA HIS A 128 67.346 26.223 -14.260 1.00 25.00 C ATOM 764 C HIS A 128 66.078 25.913 -13.460 1.00 25.00 C ATOM 765 O HIS A 128 65.591 26.742 -12.695 1.00 25.00 O ATOM 766 CB HIS A 128 66.969 26.630 -15.689 1.00 25.00 C ATOM 767 CG HIS A 128 66.201 27.917 -15.773 1.00 25.00 C ATOM 768 ND1 HIS A 128 64.907 28.087 -15.335 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.561 29.131 -16.270 1.00 25.00 C ATOM 770 CE1 HIS A 128 64.547 29.340 -15.563 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.519 30.027 -16.125 1.00 25.00 N ATOM 0 H HIS A 128 68.438 24.728 -15.249 1.00 25.00 H new ATOM 0 HA HIS A 128 67.875 27.041 -13.772 1.00 25.00 H new ATOM 0 HB2 HIS A 128 67.879 26.722 -16.282 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.375 25.834 -16.138 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.519 29.361 -16.712 1.00 25.00 H new ATOM 0 HE1 HIS A 128 63.577 29.748 -15.319 1.00 25.00 H new ATOM 0 HE2 HIS A 128 65.506 31.010 -16.396 1.00 25.00 H new ATOM 779 N ASN A 129 65.538 24.717 -13.643 1.00 25.00 N ATOM 780 CA ASN A 129 64.329 24.329 -12.931 1.00 25.00 C ATOM 781 C ASN A 129 64.664 23.938 -11.485 1.00 25.00 C ATOM 782 O ASN A 129 63.940 24.270 -10.564 1.00 25.00 O ATOM 783 CB ASN A 129 63.651 23.167 -13.665 1.00 25.00 C ATOM 784 CG ASN A 129 62.184 23.053 -13.341 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.662 23.776 -12.518 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.503 22.161 -14.016 1.00 25.00 N ATOM 0 H ASN A 129 65.912 24.006 -14.271 1.00 25.00 H new ATOM 0 HA ASN A 129 63.642 25.175 -12.902 1.00 25.00 H new ATOM 0 HB2 ASN A 129 63.772 23.301 -14.740 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.151 22.235 -13.402 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.501 22.057 -13.857 1.00 25.00 H new ATOM 0 HD22 ASN A 129 61.975 21.570 -14.700 1.00 25.00 H new ATOM 793 N PHE A 130 65.781 23.259 -11.290 1.00 25.00 N ATOM 794 CA PHE A 130 66.188 22.814 -9.959 1.00 25.00 C ATOM 795 C PHE A 130 66.438 23.972 -9.002 1.00 25.00 C ATOM 796 O PHE A 130 65.994 23.943 -7.852 1.00 25.00 O ATOM 797 CB PHE A 130 67.457 21.970 -10.060 1.00 25.00 C ATOM 798 CG PHE A 130 67.865 21.330 -8.759 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.952 20.539 -8.032 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.164 21.507 -8.255 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.338 19.921 -6.819 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.565 20.885 -7.050 1.00 25.00 C ATOM 803 CZ PHE A 130 68.647 20.091 -6.329 1.00 25.00 C ATOM 0 H PHE A 130 66.427 23.001 -12.036 1.00 25.00 H new ATOM 0 HA PHE A 130 65.364 22.224 -9.558 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.305 21.190 -10.806 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.273 22.598 -10.417 1.00 25.00 H new ATOM 0 HD1 PHE A 130 65.948 20.403 -8.405 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.865 22.126 -8.795 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.629 19.319 -6.269 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.572 21.017 -6.682 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.947 19.616 -5.406 1.00 25.00 H new ATOM 813 N ARG A 131 67.130 25.004 -9.465 1.00 25.00 N ATOM 814 CA ARG A 131 67.401 26.156 -8.605 1.00 25.00 C ATOM 815 C ARG A 131 66.101 26.876 -8.246 1.00 25.00 C ATOM 816 O ARG A 131 65.976 27.382 -7.149 1.00 25.00 O ATOM 817 CB ARG A 131 68.437 27.112 -9.231 1.00 25.00 C ATOM 818 CG ARG A 131 68.036 27.739 -10.571 1.00 25.00 C ATOM 819 CD ARG A 131 67.545 29.172 -10.434 1.00 25.00 C ATOM 820 NE ARG A 131 68.645 30.118 -10.158 1.00 25.00 N ATOM 821 CZ ARG A 131 68.509 31.432 -10.042 1.00 25.00 C ATOM 822 NH1 ARG A 131 67.353 32.035 -10.172 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 69.562 32.153 -9.779 1.00 25.00 N ATOM 0 H ARG A 131 67.508 25.072 -10.410 1.00 25.00 H new ATOM 0 HA ARG A 131 67.844 25.786 -7.680 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.640 27.914 -8.521 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.370 26.566 -9.371 1.00 25.00 H new ATOM 0 HG2 ARG A 131 68.891 27.717 -11.246 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.253 27.135 -11.029 1.00 25.00 H new ATOM 0 HD2 ARG A 131 67.036 29.468 -11.351 1.00 25.00 H new ATOM 0 HD3 ARG A 131 66.811 29.227 -9.630 1.00 25.00 H new ATOM 0 HE ARG A 131 69.582 29.731 -10.048 1.00 25.00 H new ATOM 0 HH11 ARG A 131 66.513 31.491 -10.370 1.00 25.00 H new ATOM 0 HH12 ARG A 131 67.293 33.049 -10.075 1.00 25.00 H new ATOM 0 HH21 ARG A 131 70.471 31.705 -9.666 1.00 25.00 H new ATOM 0 HH22 ARG A 131 69.477 33.165 -9.686 1.00 25.00 H new ATOM 837 N ALA A 132 65.119 26.862 -9.144 1.00 25.00 N ATOM 838 CA ALA A 132 63.819 27.472 -8.863 1.00 25.00 C ATOM 839 C ALA A 132 63.021 26.597 -7.886 1.00 25.00 C ATOM 840 O ALA A 132 62.325 27.098 -7.014 1.00 25.00 O ATOM 841 CB ALA A 132 63.038 27.665 -10.168 1.00 25.00 C ATOM 0 H ALA A 132 65.196 26.438 -10.068 1.00 25.00 H new ATOM 0 HA ALA A 132 63.978 28.447 -8.402 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.072 28.120 -9.950 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.602 28.315 -10.837 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.884 26.698 -10.646 1.00 25.00 H new ATOM 847 N LEU A 133 63.136 25.286 -8.021 1.00 25.00 N ATOM 848 CA LEU A 133 62.429 24.360 -7.145 1.00 25.00 C ATOM 849 C LEU A 133 62.937 24.474 -5.703 1.00 25.00 C ATOM 850 O LEU A 133 62.156 24.472 -4.764 1.00 25.00 O ATOM 851 CB LEU A 133 62.598 22.925 -7.662 1.00 25.00 C ATOM 852 CG LEU A 133 61.688 21.860 -7.022 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.217 22.079 -7.393 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.125 20.472 -7.491 1.00 25.00 C ATOM 0 H LEU A 133 63.714 24.836 -8.731 1.00 25.00 H new ATOM 0 HA LEU A 133 61.370 24.618 -7.148 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.421 22.925 -8.738 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.635 22.626 -7.510 1.00 25.00 H new ATOM 0 HG LEU A 133 61.781 21.942 -5.939 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.605 21.309 -6.924 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.896 23.060 -7.044 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.103 22.024 -8.476 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.482 19.716 -7.039 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.046 20.413 -8.577 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.158 20.295 -7.192 1.00 25.00 H new ATOM 866 N CYS A 134 64.247 24.599 -5.531 1.00 25.00 N ATOM 867 CA CYS A 134 64.808 24.723 -4.190 1.00 25.00 C ATOM 868 C CYS A 134 64.566 26.120 -3.615 1.00 25.00 C ATOM 869 O CYS A 134 64.476 26.285 -2.409 1.00 25.00 O ATOM 870 CB CYS A 134 66.302 24.373 -4.183 1.00 25.00 C ATOM 871 SG CYS A 134 67.392 25.616 -4.914 1.00 25.00 S ATOM 0 H CYS A 134 64.931 24.617 -6.288 1.00 25.00 H new ATOM 0 HA CYS A 134 64.294 24.008 -3.548 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.613 24.202 -3.152 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.440 23.433 -4.718 1.00 25.00 H new ATOM 0 HG CYS A 134 66.740 26.290 -5.814 1.00 25.00 H new ATOM 877 N GLU A 135 64.418 27.104 -4.489 1.00 25.00 N ATOM 878 CA GLU A 135 64.092 28.476 -4.091 1.00 25.00 C ATOM 879 C GLU A 135 62.680 28.487 -3.501 1.00 25.00 C ATOM 880 O GLU A 135 62.432 29.081 -2.453 1.00 25.00 O ATOM 881 CB GLU A 135 64.184 29.370 -5.341 1.00 25.00 C ATOM 882 CG GLU A 135 63.688 30.794 -5.228 1.00 25.00 C ATOM 883 CD GLU A 135 64.009 31.593 -6.492 1.00 25.00 C ATOM 884 OE1 GLU A 135 63.905 31.043 -7.613 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.474 32.746 -6.356 1.00 25.00 O1- ATOM 0 H GLU A 135 64.519 26.980 -5.496 1.00 25.00 H new ATOM 0 HA GLU A 135 64.784 28.852 -3.337 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.228 29.403 -5.653 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.627 28.884 -6.142 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.611 30.795 -5.058 1.00 25.00 H new ATOM 0 HG3 GLU A 135 64.147 31.275 -4.364 1.00 25.00 H new ATOM 892 N LEU A 136 61.774 27.781 -4.170 1.00 25.00 N ATOM 893 CA LEU A 136 60.384 27.689 -3.728 1.00 25.00 C ATOM 894 C LEU A 136 60.266 26.990 -2.374 1.00 25.00 C ATOM 895 O LEU A 136 59.531 27.440 -1.504 1.00 25.00 O ATOM 896 CB LEU A 136 59.573 26.916 -4.782 1.00 25.00 C ATOM 897 CG LEU A 136 58.066 26.750 -4.529 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.349 28.097 -4.554 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.476 25.834 -5.605 1.00 25.00 C ATOM 0 H LEU A 136 61.977 27.262 -5.024 1.00 25.00 H new ATOM 0 HA LEU A 136 59.993 28.700 -3.613 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.701 27.418 -5.741 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.010 25.922 -4.882 1.00 25.00 H new ATOM 0 HG LEU A 136 57.926 26.311 -3.541 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.285 27.946 -4.372 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.762 28.743 -3.779 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.488 28.565 -5.529 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.407 25.711 -5.432 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.636 26.277 -6.588 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.964 24.861 -5.562 1.00 25.00 H new ATOM 911 N GLU A 137 60.983 25.886 -2.209 1.00 25.00 N ATOM 912 CA GLU A 137 60.922 25.103 -0.969 1.00 25.00 C ATOM 913 C GLU A 137 61.591 25.820 0.206 1.00 25.00 C ATOM 914 O GLU A 137 61.078 25.815 1.320 1.00 25.00 O ATOM 915 CB GLU A 137 61.584 23.744 -1.199 1.00 25.00 C ATOM 916 CG GLU A 137 61.365 22.714 -0.073 1.00 25.00 C ATOM 917 CD GLU A 137 59.941 22.155 -0.029 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.332 21.961 -1.101 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 59.453 21.849 1.084 1.00 25.00 O1- ATOM 0 H GLU A 137 61.615 25.508 -2.915 1.00 25.00 H new ATOM 0 HA GLU A 137 59.872 24.973 -0.707 1.00 25.00 H new ATOM 0 HB2 GLU A 137 61.206 23.326 -2.132 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.656 23.896 -1.329 1.00 25.00 H new ATOM 0 HG2 GLU A 137 62.067 21.890 -0.203 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.594 23.180 0.885 1.00 25.00 H new ATOM 926 N SER A 138 62.747 26.418 -0.037 1.00 25.00 N ATOM 927 CA SER A 138 63.499 27.084 1.033 1.00 25.00 C ATOM 928 C SER A 138 62.948 28.476 1.361 1.00 25.00 C ATOM 929 O SER A 138 63.183 28.995 2.452 1.00 25.00 O ATOM 930 CB SER A 138 64.974 27.216 0.657 1.00 25.00 C ATOM 931 OG SER A 138 65.135 28.025 -0.495 1.00 25.00 O ATOM 0 H SER A 138 63.188 26.460 -0.956 1.00 25.00 H new ATOM 0 HA SER A 138 63.390 26.456 1.917 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.528 27.649 1.490 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.396 26.228 0.473 1.00 25.00 H new ATOM 0 HG SER A 138 65.223 27.454 -1.286 1.00 25.00 H new ATOM 937 N GLY A 139 62.236 29.083 0.422 1.00 25.00 N ATOM 938 CA GLY A 139 61.625 30.382 0.672 1.00 25.00 C ATOM 939 C GLY A 139 62.591 31.551 0.621 1.00 25.00 C ATOM 940 O GLY A 139 62.259 32.649 1.064 1.00 25.00 O ATOM 0 H GLY A 139 62.068 28.703 -0.510 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.837 30.546 -0.062 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.149 30.363 1.652 1.00 25.00 H new ATOM 944 N ILE A 140 63.784 31.335 0.086 1.00 25.00 N ATOM 945 CA ILE A 140 64.789 32.398 -0.021 1.00 25.00 C ATOM 946 C ILE A 140 65.240 32.526 -1.483 1.00 25.00 C ATOM 947 O ILE A 140 65.374 31.520 -2.182 1.00 25.00 O ATOM 948 CB ILE A 140 66.005 32.158 0.934 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.551 30.724 0.778 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.569 32.396 2.401 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.841 30.432 1.548 1.00 25.00 C ATOM 0 H ILE A 140 64.086 30.433 -0.283 1.00 25.00 H new ATOM 0 HA ILE A 140 64.334 33.336 0.296 1.00 25.00 H new ATOM 0 HB ILE A 140 66.797 32.858 0.669 1.00 25.00 H new ATOM 0 HG12 ILE A 140 65.784 30.022 1.106 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.727 30.532 -0.280 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.417 32.228 3.064 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.217 33.421 2.514 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.765 31.706 2.658 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.143 29.399 1.374 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.629 31.103 1.206 1.00 25.00 H new ATOM 0 HD13 ILE A 140 67.671 30.585 2.614 1.00 25.00 H new ATOM 963 N PRO A 141 65.409 33.768 -1.988 1.00 25.00 N ATOM 964 CA PRO A 141 65.676 33.887 -3.427 1.00 25.00 C ATOM 965 C PRO A 141 66.983 33.275 -3.902 1.00 25.00 C ATOM 966 O PRO A 141 68.048 33.508 -3.335 1.00 25.00 O ATOM 967 CB PRO A 141 65.697 35.403 -3.656 1.00 25.00 C ATOM 968 CG PRO A 141 64.909 35.963 -2.526 1.00 25.00 C ATOM 969 CD PRO A 141 65.291 35.104 -1.367 1.00 25.00 C ATOM 0 HA PRO A 141 64.922 33.337 -3.991 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.716 35.790 -3.659 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.254 35.665 -4.617 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.155 37.010 -2.347 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.838 35.916 -2.723 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.229 35.426 -0.914 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.535 35.122 -0.582 1.00 25.00 H new ATOM 977 N ALA A 142 66.903 32.540 -5.005 1.00 25.00 N ATOM 978 CA ALA A 142 68.071 31.946 -5.646 1.00 25.00 C ATOM 979 C ALA A 142 68.954 33.035 -6.255 1.00 25.00 C ATOM 980 O ALA A 142 70.138 32.831 -6.466 1.00 25.00 O ATOM 981 CB ALA A 142 67.630 30.951 -6.712 1.00 25.00 C ATOM 0 H ALA A 142 66.024 32.338 -5.482 1.00 25.00 H new ATOM 0 HA ALA A 142 68.655 31.414 -4.895 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.508 30.512 -7.186 1.00 25.00 H new ATOM 0 HB2 ALA A 142 67.035 30.163 -6.250 1.00 25.00 H new ATOM 0 HB3 ALA A 142 67.031 31.465 -7.464 1.00 25.00 H new ATOM 987 N ALA A 143 68.358 34.177 -6.556 1.00 25.00 N ATOM 988 CA ALA A 143 69.092 35.303 -7.136 1.00 25.00 C ATOM 989 C ALA A 143 70.033 35.937 -6.103 1.00 25.00 C ATOM 990 O ALA A 143 71.039 36.542 -6.460 1.00 25.00 O ATOM 991 CB ALA A 143 68.104 36.351 -7.659 1.00 25.00 C ATOM 0 H ALA A 143 67.364 34.355 -6.410 1.00 25.00 H new ATOM 0 HA ALA A 143 69.697 34.931 -7.963 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.655 37.187 -8.090 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.469 35.903 -8.423 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.485 36.710 -6.837 1.00 25.00 H new ATOM 997 N GLU A 144 69.693 35.790 -4.832 1.00 25.00 N ATOM 998 CA GLU A 144 70.467 36.366 -3.728 1.00 25.00 C ATOM 999 C GLU A 144 71.338 35.280 -3.105 1.00 25.00 C ATOM 1000 O GLU A 144 71.919 35.455 -2.036 1.00 25.00 O ATOM 1001 CB GLU A 144 69.513 36.922 -2.673 1.00 25.00 C ATOM 1002 CG GLU A 144 68.614 38.046 -3.205 1.00 25.00 C ATOM 1003 CD GLU A 144 67.599 38.517 -2.178 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.618 38.026 -1.025 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 66.757 39.369 -2.532 1.00 25.00 O1- ATOM 0 H GLU A 144 68.871 35.267 -4.529 1.00 25.00 H new ATOM 0 HA GLU A 144 71.099 37.171 -4.104 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.888 36.113 -2.295 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.093 37.297 -1.830 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.234 38.889 -3.510 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.090 37.697 -4.095 1.00 25.00 H new ATOM 1012 N SER A 145 71.395 34.138 -3.769 1.00 25.00 N ATOM 1013 CA SER A 145 72.084 32.966 -3.249 1.00 25.00 C ATOM 1014 C SER A 145 73.000 32.346 -4.288 1.00 25.00 C ATOM 1015 O SER A 145 72.914 32.636 -5.474 1.00 25.00 O ATOM 1016 CB SER A 145 71.062 31.916 -2.833 1.00 25.00 C ATOM 1017 OG SER A 145 70.147 32.430 -1.892 1.00 25.00 O ATOM 0 H SER A 145 70.966 33.996 -4.683 1.00 25.00 H new ATOM 0 HA SER A 145 72.683 33.290 -2.398 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.522 31.564 -3.712 1.00 25.00 H new ATOM 0 HB3 SER A 145 71.577 31.054 -2.408 1.00 25.00 H new ATOM 0 HG SER A 145 69.347 32.754 -2.357 1.00 25.00 H new ATOM 1023 N GLN A 146 73.840 31.422 -3.845 1.00 25.00 N ATOM 1024 CA GLN A 146 74.615 30.597 -4.761 1.00 25.00 C ATOM 1025 C GLN A 146 74.390 29.162 -4.353 1.00 25.00 C ATOM 1026 O GLN A 146 74.233 28.874 -3.169 1.00 25.00 O ATOM 1027 CB GLN A 146 76.105 30.933 -4.716 1.00 25.00 C ATOM 1028 CG GLN A 146 76.439 32.282 -5.319 1.00 25.00 C ATOM 1029 CD GLN A 146 77.766 32.260 -6.034 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.818 32.226 -5.417 1.00 25.00 O ATOM 1031 NE2 GLN A 146 77.720 32.243 -7.337 1.00 25.00 N ATOM 0 H GLN A 146 74.002 31.225 -2.858 1.00 25.00 H new ATOM 0 HA GLN A 146 74.291 30.779 -5.786 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.443 30.914 -3.680 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.660 30.159 -5.247 1.00 25.00 H new ATOM 0 HG2 GLN A 146 75.654 32.573 -6.017 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.462 33.037 -4.533 1.00 25.00 H new ATOM 0 HE21 GLN A 146 76.820 32.273 -7.816 1.00 25.00 H new ATOM 0 HE22 GLN A 146 78.584 32.200 -7.877 1.00 25.00 H new ATOM 1040 N ILE A 147 74.389 28.265 -5.327 1.00 25.00 N ATOM 1041 CA ILE A 147 74.181 26.838 -5.076 1.00 25.00 C ATOM 1042 C ILE A 147 75.425 26.108 -5.589 1.00 25.00 C ATOM 1043 O ILE A 147 76.005 26.477 -6.609 1.00 25.00 O ATOM 1044 CB ILE A 147 72.830 26.345 -5.696 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.520 24.908 -5.235 1.00 25.00 C ATOM 1046 CG2 ILE A 147 72.828 26.478 -7.238 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.224 24.319 -5.804 1.00 25.00 C ATOM 0 H ILE A 147 74.531 28.499 -6.310 1.00 25.00 H new ATOM 0 HA ILE A 147 74.073 26.622 -4.013 1.00 25.00 H new ATOM 0 HB ILE A 147 72.030 26.989 -5.331 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.352 24.263 -5.518 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.462 24.894 -4.147 1.00 25.00 H new ATOM 0 HG21 ILE A 147 71.875 26.126 -7.632 1.00 25.00 H new ATOM 0 HG22 ILE A 147 72.971 27.523 -7.513 1.00 25.00 H new ATOM 0 HG23 ILE A 147 73.637 25.879 -7.656 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.088 23.306 -5.426 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.379 24.937 -5.499 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.282 24.295 -6.892 1.00 25.00 H new ATOM 1059 N VAL A 148 75.911 25.188 -4.771 1.00 25.00 N ATOM 1060 CA VAL A 148 77.222 24.563 -4.923 1.00 25.00 C ATOM 1061 C VAL A 148 77.086 23.043 -4.874 1.00 25.00 C ATOM 1062 O VAL A 148 76.344 22.504 -4.058 1.00 25.00 O ATOM 1063 CB VAL A 148 78.148 25.035 -3.737 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.542 24.397 -3.805 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.294 26.569 -3.755 1.00 25.00 C ATOM 0 H VAL A 148 75.394 24.844 -3.962 1.00 25.00 H new ATOM 0 HA VAL A 148 77.653 24.852 -5.881 1.00 25.00 H new ATOM 0 HB VAL A 148 77.671 24.714 -2.811 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.145 24.751 -2.969 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.449 23.312 -3.752 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.024 24.674 -4.743 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.935 26.883 -2.932 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.738 26.881 -4.700 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.312 27.029 -3.646 1.00 25.00 H new ATOM 1075 N TYR A 149 77.831 22.359 -5.734 1.00 25.00 N ATOM 1076 CA TYR A 149 77.885 20.905 -5.759 1.00 25.00 C ATOM 1077 C TYR A 149 79.332 20.496 -5.956 1.00 25.00 C ATOM 1078 O TYR A 149 80.036 21.143 -6.727 1.00 25.00 O ATOM 1079 CB TYR A 149 77.063 20.373 -6.926 1.00 25.00 C ATOM 1080 CG TYR A 149 77.262 18.899 -7.140 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.814 17.967 -6.191 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.934 18.419 -8.289 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.019 16.584 -6.381 1.00 25.00 C ATOM 1084 CE2 TYR A 149 78.137 17.027 -8.485 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.669 16.122 -7.529 1.00 25.00 C ATOM 1086 OH TYR A 149 77.857 14.780 -7.720 1.00 25.00 O ATOM 0 H TYR A 149 78.419 22.803 -6.439 1.00 25.00 H new ATOM 0 HA TYR A 149 77.485 20.502 -4.828 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.007 20.572 -6.744 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.336 20.910 -7.834 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.305 18.313 -5.303 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.297 19.120 -9.026 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.673 15.881 -5.638 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.649 16.671 -9.366 1.00 25.00 H new ATOM 0 HH TYR A 149 77.171 14.281 -7.230 1.00 25.00 H new ATOM 1096 N ALA A 150 79.780 19.458 -5.251 1.00 25.00 N ATOM 1097 CA ALA A 150 81.169 18.980 -5.333 1.00 25.00 C ATOM 1098 C ALA A 150 82.161 20.145 -5.152 1.00 25.00 C ATOM 1099 O ALA A 150 83.135 20.274 -5.893 1.00 25.00 O ATOM 1100 CB ALA A 150 81.404 18.250 -6.672 1.00 25.00 C ATOM 0 H ALA A 150 79.197 18.923 -4.608 1.00 25.00 H new ATOM 0 HA ALA A 150 81.342 18.271 -4.523 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.436 17.901 -6.720 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.729 17.397 -6.745 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.214 18.935 -7.498 1.00 25.00 H new ATOM 1106 N GLU A 151 81.845 21.002 -4.182 1.00 25.00 N ATOM 1107 CA GLU A 151 82.626 22.209 -3.844 1.00 25.00 C ATOM 1108 C GLU A 151 82.802 23.234 -4.987 1.00 25.00 C ATOM 1109 O GLU A 151 83.559 24.200 -4.850 1.00 25.00 O ATOM 1110 CB GLU A 151 83.995 21.810 -3.246 1.00 25.00 C ATOM 1111 CG GLU A 151 83.858 20.993 -1.968 1.00 25.00 C ATOM 1112 CD GLU A 151 85.165 20.869 -1.207 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.102 20.203 -1.702 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.260 21.454 -0.101 1.00 25.00 O1- ATOM 0 H GLU A 151 81.022 20.881 -3.592 1.00 25.00 H new ATOM 0 HA GLU A 151 82.026 22.735 -3.102 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.556 21.235 -3.983 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.573 22.710 -3.038 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.110 21.456 -1.324 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.491 19.997 -2.216 1.00 25.00 H new ATOM 1121 N ARG A 152 82.043 23.092 -6.068 1.00 25.00 N ATOM 1122 CA ARG A 152 82.064 24.063 -7.171 1.00 25.00 C ATOM 1123 C ARG A 152 80.682 24.682 -7.376 1.00 25.00 C ATOM 1124 O ARG A 152 79.667 24.001 -7.236 1.00 25.00 O ATOM 1125 CB ARG A 152 82.500 23.380 -8.470 1.00 25.00 C ATOM 1126 CG ARG A 152 83.955 22.914 -8.455 1.00 25.00 C ATOM 1127 CD ARG A 152 84.386 22.450 -9.838 1.00 25.00 C ATOM 1128 NE ARG A 152 84.367 23.556 -10.801 1.00 25.00 N ATOM 1129 CZ ARG A 152 84.622 23.447 -12.097 1.00 25.00 C ATOM 1130 NH1 ARG A 152 84.937 22.308 -12.654 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 84.557 24.509 -12.851 1.00 25.00 N ATOM 0 H ARG A 152 81.401 22.312 -6.210 1.00 25.00 H new ATOM 0 HA ARG A 152 82.774 24.849 -6.911 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.854 22.522 -8.655 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.357 24.071 -9.300 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.599 23.728 -8.122 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.074 22.100 -7.740 1.00 25.00 H new ATOM 0 HD2 ARG A 152 85.389 22.028 -9.786 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.723 21.655 -10.180 1.00 25.00 H new ATOM 0 HE ARG A 152 84.139 24.484 -10.445 1.00 25.00 H new ATOM 0 HH11 ARG A 152 84.994 21.462 -12.088 1.00 25.00 H new ATOM 0 HH12 ARG A 152 85.126 22.265 -13.655 1.00 25.00 H new ATOM 0 HH21 ARG A 152 84.312 25.411 -12.442 1.00 25.00 H new ATOM 0 HH22 ARG A 152 84.751 24.438 -13.850 1.00 25.00 H new ATOM 1145 N PRO A 153 80.617 25.982 -7.705 1.00 25.00 N ATOM 1146 CA PRO A 153 79.277 26.540 -7.911 1.00 25.00 C ATOM 1147 C PRO A 153 78.624 26.029 -9.194 1.00 25.00 C ATOM 1148 O PRO A 153 79.292 25.777 -10.197 1.00 25.00 O ATOM 1149 CB PRO A 153 79.542 28.048 -7.977 1.00 25.00 C ATOM 1150 CG PRO A 153 80.903 28.145 -8.547 1.00 25.00 C ATOM 1151 CD PRO A 153 81.660 27.008 -7.905 1.00 25.00 C ATOM 0 HA PRO A 153 78.578 26.255 -7.124 1.00 25.00 H new ATOM 0 HB2 PRO A 153 78.809 28.555 -8.604 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.489 28.507 -6.990 1.00 25.00 H new ATOM 0 HG2 PRO A 153 80.887 28.049 -9.633 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.362 29.107 -8.319 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.464 26.646 -8.546 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.116 27.309 -6.962 1.00 25.00 H new ATOM 1159 N LEU A 154 77.316 25.862 -9.145 1.00 25.00 N ATOM 1160 CA LEU A 154 76.546 25.381 -10.289 1.00 25.00 C ATOM 1161 C LEU A 154 76.099 26.584 -11.120 1.00 0.00 C ATOM 1162 O LEU A 154 75.099 27.225 -10.806 1.00 25.00 O ATOM 1163 CB LEU A 154 75.320 24.608 -9.792 1.00 25.00 C ATOM 1164 CG LEU A 154 75.591 23.262 -9.095 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.485 22.960 -8.078 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.660 22.126 -10.121 1.00 25.00 C ATOM 0 H LEU A 154 76.753 26.054 -8.316 1.00 25.00 H new ATOM 0 HA LEU A 154 77.159 24.718 -10.900 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.772 25.247 -9.099 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.664 24.425 -10.643 1.00 25.00 H new ATOM 0 HG LEU A 154 76.549 23.334 -8.580 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.688 22.006 -7.592 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.455 23.750 -7.328 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.524 22.909 -8.590 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.852 21.184 -9.608 1.00 25.00 H new ATOM 0 HD22 LEU A 154 74.713 22.061 -10.656 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.464 22.324 -10.830 1.00 25.00 H new ATOM 1178 N THR A 155 76.876 26.929 -12.134 1.00 25.00 N ATOM 1179 CA THR A 155 76.615 28.137 -12.930 1.00 25.00 C ATOM 1180 C THR A 155 76.103 27.901 -14.352 1.00 25.00 C ATOM 1181 O THR A 155 75.444 28.769 -14.917 1.00 25.00 O ATOM 1182 CB THR A 155 77.895 28.979 -13.052 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.938 28.169 -13.602 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.366 29.454 -11.682 1.00 25.00 C ATOM 0 H THR A 155 77.693 26.397 -12.432 1.00 25.00 H new ATOM 0 HA THR A 155 75.820 28.641 -12.380 1.00 25.00 H new ATOM 0 HB THR A 155 77.675 29.837 -13.687 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.757 28.701 -13.684 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.273 30.048 -11.795 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.589 30.063 -11.221 1.00 25.00 H new ATOM 0 HG23 THR A 155 78.573 28.591 -11.049 1.00 25.00 H new ATOM 1192 N ASP A 156 76.384 26.741 -14.933 1.00 25.00 N ATOM 1193 CA ASP A 156 75.941 26.455 -16.305 1.00 25.00 C ATOM 1194 C ASP A 156 74.515 25.905 -16.238 1.00 25.00 C ATOM 1195 O ASP A 156 74.290 24.703 -16.280 1.00 25.00 O ATOM 1196 CB ASP A 156 76.868 25.451 -17.002 1.00 25.00 C ATOM 1197 CG ASP A 156 78.291 25.941 -17.098 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.512 27.071 -17.572 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 79.195 25.195 -16.657 1.00 25.00 O1- ATOM 0 H ASP A 156 76.909 25.988 -14.488 1.00 25.00 H new ATOM 0 HA ASP A 156 75.971 27.374 -16.891 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.849 24.507 -16.457 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.490 25.249 -18.004 1.00 25.00 H new ATOM 1204 N ASN A 157 73.556 26.804 -16.083 1.00 25.00 N ATOM 1205 CA ASN A 157 72.154 26.438 -15.851 1.00 25.00 C ATOM 1206 C ASN A 157 71.474 25.750 -17.037 1.00 25.00 C ATOM 1207 O ASN A 157 70.312 25.357 -16.933 1.00 25.00 O ATOM 1208 CB ASN A 157 71.349 27.688 -15.469 1.00 25.00 C ATOM 1209 CG ASN A 157 71.118 28.607 -16.644 1.00 25.00 C ATOM 1210 OD1 ASN A 157 72.026 28.925 -17.383 1.00 25.00 O ATOM 1211 ND2 ASN A 157 69.902 29.044 -16.808 1.00 25.00 N ATOM 0 H ASN A 157 73.720 27.810 -16.113 1.00 25.00 H new ATOM 0 HA ASN A 157 72.170 25.710 -15.040 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.388 27.385 -15.054 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.877 28.231 -14.685 1.00 25.00 H new ATOM 0 HD21 ASN A 157 69.687 29.676 -17.579 1.00 25.00 H new ATOM 0 HD22 ASN A 157 69.165 28.754 -16.165 1.00 25.00 H new ATOM 1218 N HIS A 158 72.195 25.616 -18.140 1.00 25.00 N ATOM 1219 CA HIS A 158 71.701 24.950 -19.350 1.00 25.00 C ATOM 1220 C HIS A 158 71.971 23.442 -19.337 1.00 25.00 C ATOM 1221 O HIS A 158 71.882 22.785 -20.367 1.00 25.00 O ATOM 1222 CB HIS A 158 72.407 25.544 -20.574 1.00 25.00 C ATOM 1223 CG HIS A 158 72.209 27.017 -20.732 1.00 25.00 C ATOM 1224 ND1 HIS A 158 71.015 27.605 -21.074 1.00 25.00 N ATOM 1225 CD2 HIS A 158 73.091 28.052 -20.611 1.00 25.00 C ATOM 1226 CE1 HIS A 158 71.205 28.921 -21.143 1.00 25.00 C ATOM 1227 NE2 HIS A 158 72.453 29.248 -20.866 1.00 25.00 N ATOM 0 H HIS A 158 73.149 25.967 -18.228 1.00 25.00 H new ATOM 0 HA HIS A 158 70.623 25.108 -19.389 1.00 25.00 H new ATOM 0 HB2 HIS A 158 73.475 25.337 -20.502 1.00 25.00 H new ATOM 0 HB3 HIS A 158 72.045 25.040 -21.470 1.00 25.00 H new ATOM 0 HD2 HIS A 158 74.135 27.949 -20.353 1.00 25.00 H new ATOM 0 HE1 HIS A 158 70.433 29.633 -21.395 1.00 25.00 H new ATOM 0 HE2 HIS A 158 72.859 30.184 -20.845 1.00 25.00 H new ATOM 1235 N ARG A 159 72.394 22.910 -18.195 1.00 25.00 N ATOM 1236 CA ARG A 159 72.724 21.492 -18.088 1.00 25.00 C ATOM 1237 C ARG A 159 71.823 20.799 -17.085 1.00 25.00 C ATOM 1238 O ARG A 159 71.471 21.369 -16.051 1.00 25.00 O ATOM 1239 CB ARG A 159 74.188 21.318 -17.673 1.00 25.00 C ATOM 1240 CG ARG A 159 75.185 21.817 -18.712 1.00 25.00 C ATOM 1241 CD ARG A 159 76.625 21.576 -18.287 1.00 25.00 C ATOM 1242 NE ARG A 159 76.955 20.143 -18.216 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.181 19.636 -18.292 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.244 20.383 -18.459 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.337 18.349 -18.201 1.00 25.00 N ATOM 0 H ARG A 159 72.517 23.438 -17.331 1.00 25.00 H new ATOM 0 HA ARG A 159 72.570 21.036 -19.066 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.356 21.850 -16.737 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.378 20.262 -17.478 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.999 21.315 -19.662 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.031 22.883 -18.879 1.00 25.00 H new ATOM 0 HD2 ARG A 159 77.296 22.067 -18.992 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.795 22.034 -17.313 1.00 25.00 H new ATOM 0 HE ARG A 159 76.182 19.488 -18.099 1.00 25.00 H new ATOM 0 HH11 ARG A 159 79.149 21.396 -18.536 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.167 19.952 -18.512 1.00 25.00 H new ATOM 0 HH21 ARG A 159 77.525 17.745 -18.073 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.271 17.943 -18.257 1.00 25.00 H new ATOM 1259 N SER A 160 71.474 19.558 -17.382 1.00 25.00 N ATOM 1260 CA SER A 160 70.647 18.757 -16.490 1.00 25.00 C ATOM 1261 C SER A 160 71.479 18.263 -15.316 1.00 25.00 C ATOM 1262 O SER A 160 72.709 18.236 -15.376 1.00 25.00 O ATOM 1263 CB SER A 160 70.039 17.572 -17.247 1.00 25.00 C ATOM 1264 OG SER A 160 71.056 16.725 -17.774 1.00 25.00 O ATOM 0 H SER A 160 71.752 19.080 -18.239 1.00 25.00 H new ATOM 0 HA SER A 160 69.835 19.377 -16.111 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.396 17.000 -16.578 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.410 17.939 -18.058 1.00 25.00 H new ATOM 0 HG SER A 160 70.643 15.975 -18.251 1.00 25.00 H new ATOM 1270 N LEU A 161 70.815 17.876 -14.238 1.00 25.00 N ATOM 1271 CA LEU A 161 71.499 17.428 -13.021 1.00 25.00 C ATOM 1272 C LEU A 161 72.295 16.136 -13.235 1.00 25.00 C ATOM 1273 O LEU A 161 73.405 15.958 -12.695 1.00 25.00 O ATOM 1274 CB LEU A 161 70.459 17.239 -11.913 1.00 25.00 C ATOM 1275 CG LEU A 161 69.667 18.512 -11.556 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.537 18.167 -10.607 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.575 19.582 -10.935 1.00 25.00 C ATOM 0 H LEU A 161 69.797 17.861 -14.175 1.00 25.00 H new ATOM 0 HA LEU A 161 72.223 18.192 -12.737 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.757 16.464 -12.220 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.963 16.877 -11.017 1.00 25.00 H new ATOM 0 HG LEU A 161 69.252 18.923 -12.477 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.981 19.071 -10.359 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.869 17.449 -11.083 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.947 17.732 -9.696 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.984 20.466 -10.695 1.00 25.00 H new ATOM 0 HD22 LEU A 161 71.028 19.191 -10.024 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.358 19.850 -11.644 1.00 25.00 H new ATOM 1289 N ALA A 162 71.776 15.257 -14.088 1.00 25.00 N ATOM 1290 CA ALA A 162 72.477 14.023 -14.435 1.00 25.00 C ATOM 1291 C ALA A 162 73.804 14.341 -15.137 1.00 25.00 C ATOM 1292 O ALA A 162 74.763 13.583 -15.039 1.00 25.00 O ATOM 1293 CB ALA A 162 71.598 13.154 -15.338 1.00 25.00 C ATOM 0 H ALA A 162 70.875 15.375 -14.551 1.00 25.00 H new ATOM 0 HA ALA A 162 72.691 13.475 -13.518 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.130 12.237 -15.590 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.674 12.905 -14.816 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.363 13.700 -16.252 1.00 25.00 H new ATOM 1299 N SER A 163 73.863 15.479 -15.816 1.00 25.00 N ATOM 1300 CA SER A 163 75.075 15.898 -16.523 1.00 25.00 C ATOM 1301 C SER A 163 76.203 16.269 -15.552 1.00 25.00 C ATOM 1302 O SER A 163 77.368 16.334 -15.946 1.00 25.00 O ATOM 1303 CB SER A 163 74.759 17.089 -17.430 1.00 25.00 C ATOM 1304 OG SER A 163 75.677 17.174 -18.510 1.00 25.00 O ATOM 0 H SER A 163 73.085 16.133 -15.895 1.00 25.00 H new ATOM 0 HA SER A 163 75.418 15.055 -17.123 1.00 25.00 H new ATOM 0 HB2 SER A 163 73.745 16.994 -17.819 1.00 25.00 H new ATOM 0 HB3 SER A 163 74.792 18.010 -16.849 1.00 25.00 H new ATOM 0 HG SER A 163 75.360 17.838 -19.157 1.00 25.00 H new ATOM 1310 N TYR A 164 75.864 16.503 -14.290 1.00 25.00 N ATOM 1311 CA TYR A 164 76.864 16.782 -13.255 1.00 25.00 C ATOM 1312 C TYR A 164 77.098 15.544 -12.407 1.00 25.00 C ATOM 1313 O TYR A 164 77.955 15.538 -11.533 1.00 25.00 O ATOM 1314 CB TYR A 164 76.384 17.896 -12.342 1.00 25.00 C ATOM 1315 CG TYR A 164 76.357 19.229 -13.007 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.515 20.028 -13.053 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.173 19.721 -13.588 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.494 21.291 -13.669 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.147 20.981 -14.201 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.306 21.756 -14.232 1.00 25.00 C ATOM 1321 OH TYR A 164 76.278 22.984 -14.812 1.00 25.00 O ATOM 0 H TYR A 164 74.901 16.506 -13.953 1.00 25.00 H new ATOM 0 HA TYR A 164 77.788 17.079 -13.751 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.383 17.656 -11.982 1.00 25.00 H new ATOM 0 HB3 TYR A 164 77.034 17.946 -11.468 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.431 19.666 -12.609 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.275 19.121 -13.561 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.389 21.895 -13.706 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.235 21.350 -14.647 1.00 25.00 H new ATOM 0 HH TYR A 164 75.418 23.113 -15.264 1.00 25.00 H new ATOM 1331 N GLY A 165 76.305 14.514 -12.647 1.00 25.00 N ATOM 1332 CA GLY A 165 76.388 13.308 -11.854 1.00 25.00 C ATOM 1333 C GLY A 165 75.576 13.359 -10.575 1.00 25.00 C ATOM 1334 O GLY A 165 75.838 12.568 -9.666 1.00 25.00 O ATOM 0 H GLY A 165 75.599 14.492 -13.383 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.048 12.465 -12.455 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.432 13.120 -11.603 1.00 25.00 H new ATOM 1338 N LEU A 166 74.578 14.244 -10.487 1.00 25.00 N ATOM 1339 CA LEU A 166 73.732 14.290 -9.290 1.00 25.00 C ATOM 1340 C LEU A 166 72.838 13.055 -9.249 1.00 25.00 C ATOM 1341 O LEU A 166 71.716 13.061 -9.742 1.00 25.00 O ATOM 1342 CB LEU A 166 72.839 15.542 -9.271 1.00 25.00 C ATOM 1343 CG LEU A 166 73.322 16.822 -8.573 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.598 16.574 -7.098 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.525 17.424 -9.242 1.00 25.00 C ATOM 0 H LEU A 166 74.340 14.922 -11.210 1.00 25.00 H new ATOM 0 HA LEU A 166 74.391 14.320 -8.422 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.622 15.801 -10.307 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.894 15.258 -8.809 1.00 25.00 H new ATOM 0 HG LEU A 166 72.511 17.545 -8.658 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.938 17.498 -6.631 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.685 16.235 -6.609 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.369 15.810 -6.995 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.825 18.326 -8.709 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.345 16.706 -9.230 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.279 17.677 -10.273 1.00 25.00 H new ATOM 1357 N LYS A 167 73.362 11.978 -8.697 1.00 25.00 N ATOM 1358 CA LYS A 167 72.599 10.736 -8.574 1.00 25.00 C ATOM 1359 C LYS A 167 71.696 10.775 -7.357 1.00 25.00 C ATOM 1360 O LYS A 167 71.834 11.625 -6.492 1.00 25.00 O ATOM 1361 CB LYS A 167 73.530 9.539 -8.475 1.00 25.00 C ATOM 1362 CG LYS A 167 74.319 9.282 -9.755 1.00 25.00 C ATOM 1363 CD LYS A 167 74.962 7.900 -9.738 1.00 25.00 C ATOM 1364 CE LYS A 167 73.913 6.813 -9.997 1.00 25.00 C ATOM 1365 NZ LYS A 167 74.512 5.451 -9.866 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.311 11.931 -8.325 1.00 25.00 H new ATOM 0 HA LYS A 167 71.984 10.637 -9.469 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.227 9.697 -7.652 1.00 25.00 H new ATOM 0 HB3 LYS A 167 72.945 8.652 -8.232 1.00 25.00 H new ATOM 0 HG2 LYS A 167 73.657 9.367 -10.617 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.090 10.044 -9.869 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.743 7.847 -10.496 1.00 25.00 H new ATOM 0 HD3 LYS A 167 75.441 7.728 -8.774 1.00 25.00 H new ATOM 0 HE2 LYS A 167 73.089 6.922 -9.291 1.00 25.00 H new ATOM 0 HE3 LYS A 167 73.495 6.936 -10.996 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 73.782 4.732 -10.046 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 75.282 5.343 -10.556 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 74.889 5.329 -8.905 1.00 25.00 H new ATOM 1379 N ASP A 168 70.786 9.825 -7.283 1.00 25.00 N ATOM 1380 CA ASP A 168 69.882 9.696 -6.153 1.00 25.00 C ATOM 1381 C ASP A 168 70.664 9.597 -4.846 1.00 25.00 C ATOM 1382 O ASP A 168 71.570 8.781 -4.710 1.00 25.00 O ATOM 1383 CB ASP A 168 68.960 8.468 -6.334 1.00 25.00 C ATOM 1384 CG ASP A 168 69.726 7.178 -6.690 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.396 7.129 -7.768 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.530 6.168 -5.979 1.00 25.00 O1- ATOM 0 H ASP A 168 70.650 9.118 -8.005 1.00 25.00 H new ATOM 0 HA ASP A 168 69.258 10.589 -6.108 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.397 8.306 -5.415 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.234 8.680 -7.119 1.00 25.00 H new ATOM 1391 N GLY A 169 70.323 10.470 -3.906 1.00 25.00 N ATOM 1392 CA GLY A 169 70.982 10.506 -2.610 1.00 25.00 C ATOM 1393 C GLY A 169 72.090 11.538 -2.495 1.00 25.00 C ATOM 1394 O GLY A 169 72.577 11.797 -1.392 1.00 25.00 O ATOM 0 H GLY A 169 69.587 11.167 -4.021 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.235 10.707 -1.842 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.398 9.520 -2.400 1.00 25.00 H new ATOM 1398 N ASP A 170 72.490 12.143 -3.604 1.00 25.00 N ATOM 1399 CA ASP A 170 73.551 13.153 -3.575 1.00 25.00 C ATOM 1400 C ASP A 170 73.047 14.473 -2.965 1.00 25.00 C ATOM 1401 O ASP A 170 71.829 14.675 -2.811 1.00 25.00 O ATOM 1402 CB ASP A 170 74.091 13.368 -4.984 1.00 25.00 C ATOM 1403 CG ASP A 170 75.570 13.699 -4.998 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.106 14.184 -3.974 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.207 13.478 -6.051 1.00 25.00 O1- ATOM 0 H ASP A 170 72.103 11.958 -4.530 1.00 25.00 H new ATOM 0 HA ASP A 170 74.360 12.794 -2.939 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.918 12.469 -5.576 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.537 14.176 -5.462 1.00 25.00 H new ATOM 1410 N VAL A 171 73.970 15.343 -2.568 1.00 25.00 N ATOM 1411 CA VAL A 171 73.652 16.555 -1.801 1.00 25.00 C ATOM 1412 C VAL A 171 74.187 17.830 -2.466 1.00 25.00 C ATOM 1413 O VAL A 171 75.333 17.865 -2.920 1.00 25.00 O ATOM 1414 CB VAL A 171 74.283 16.464 -0.367 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.778 17.601 0.540 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.977 15.096 0.286 1.00 25.00 C ATOM 0 H VAL A 171 74.964 15.232 -2.767 1.00 25.00 H new ATOM 0 HA VAL A 171 72.565 16.613 -1.754 1.00 25.00 H new ATOM 0 HB VAL A 171 75.362 16.567 -0.481 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.234 17.510 1.526 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.048 18.562 0.103 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.694 17.537 0.634 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.425 15.058 1.279 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.898 14.966 0.370 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.392 14.298 -0.330 1.00 25.00 H new ATOM 1426 N VAL A 172 73.399 18.906 -2.452 1.00 25.00 N ATOM 1427 CA VAL A 172 73.891 20.219 -2.897 1.00 25.00 C ATOM 1428 C VAL A 172 73.810 21.188 -1.720 1.00 25.00 C ATOM 1429 O VAL A 172 73.039 20.972 -0.785 1.00 25.00 O ATOM 1430 CB VAL A 172 73.086 20.789 -4.099 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.224 19.871 -5.311 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.606 20.938 -3.738 1.00 25.00 C ATOM 0 H VAL A 172 72.427 18.900 -2.142 1.00 25.00 H new ATOM 0 HA VAL A 172 74.919 20.096 -3.238 1.00 25.00 H new ATOM 0 HB VAL A 172 73.491 21.771 -4.342 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.655 20.282 -6.145 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.275 19.793 -5.591 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.841 18.881 -5.063 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.061 21.338 -4.593 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.197 19.964 -3.471 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.504 21.618 -2.892 1.00 25.00 H new ATOM 1442 N ILE A 173 74.614 22.238 -1.750 1.00 25.00 N ATOM 1443 CA ILE A 173 74.660 23.223 -0.663 1.00 25.00 C ATOM 1444 C ILE A 173 74.328 24.597 -1.230 1.00 25.00 C ATOM 1445 O ILE A 173 74.917 25.021 -2.209 1.00 25.00 O ATOM 1446 CB ILE A 173 76.070 23.259 0.027 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.418 21.858 0.575 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.083 24.305 1.185 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.854 21.716 1.098 1.00 25.00 C ATOM 0 H ILE A 173 75.252 22.438 -2.520 1.00 25.00 H new ATOM 0 HA ILE A 173 73.930 22.937 0.095 1.00 25.00 H new ATOM 0 HB ILE A 173 76.816 23.551 -0.712 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.726 21.615 1.381 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.258 21.123 -0.214 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.067 24.318 1.653 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.859 25.294 0.785 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.332 24.035 1.927 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.010 20.701 1.463 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.557 21.923 0.291 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.016 22.423 1.912 1.00 25.00 H new ATOM 1461 N LEU A 174 73.385 25.288 -0.614 1.00 25.00 N ATOM 1462 CA LEU A 174 72.977 26.624 -1.036 1.00 25.00 C ATOM 1463 C LEU A 174 73.376 27.620 0.049 1.00 25.00 C ATOM 1464 O LEU A 174 73.152 27.379 1.225 1.00 25.00 O ATOM 1465 CB LEU A 174 71.458 26.636 -1.282 1.00 25.00 C ATOM 1466 CG LEU A 174 70.844 27.960 -1.786 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.650 27.667 -2.689 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.383 28.848 -0.626 1.00 25.00 C ATOM 0 H LEU A 174 72.876 24.939 0.198 1.00 25.00 H new ATOM 0 HA LEU A 174 73.471 26.906 -1.966 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.225 25.856 -2.007 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.961 26.364 -0.351 1.00 25.00 H new ATOM 0 HG LEU A 174 71.618 28.490 -2.341 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.221 28.605 -3.041 1.00 25.00 H new ATOM 0 HD12 LEU A 174 69.977 27.074 -3.543 1.00 25.00 H new ATOM 0 HD13 LEU A 174 68.898 27.112 -2.129 1.00 25.00 H new ATOM 0 HD21 LEU A 174 69.957 29.770 -1.021 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.629 28.321 -0.042 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.235 29.086 0.011 1.00 25.00 H new ATOM 1480 N ARG A 175 73.972 28.737 -0.336 1.00 25.00 N ATOM 1481 CA ARG A 175 74.374 29.775 0.620 1.00 25.00 C ATOM 1482 C ARG A 175 73.712 31.094 0.271 1.00 25.00 C ATOM 1483 O ARG A 175 73.819 31.562 -0.854 1.00 25.00 O ATOM 1484 CB ARG A 175 75.889 29.972 0.599 1.00 25.00 C ATOM 1485 CG ARG A 175 76.675 28.821 1.192 1.00 25.00 C ATOM 1486 CD ARG A 175 78.152 29.180 1.232 1.00 25.00 C ATOM 1487 NE ARG A 175 78.960 28.125 1.870 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.278 28.179 2.054 1.00 25.00 C ATOM 1489 NH1 ARG A 175 81.000 29.210 1.671 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.881 27.180 2.641 1.00 25.00 N ATOM 0 H ARG A 175 74.192 28.956 -1.308 1.00 25.00 H new ATOM 0 HA ARG A 175 74.062 29.452 1.613 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.210 30.123 -0.432 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.133 30.883 1.145 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.316 28.602 2.198 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.525 27.920 0.597 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.512 29.348 0.217 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.283 30.116 1.776 1.00 25.00 H new ATOM 0 HE ARG A 175 78.473 27.290 2.195 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.552 30.005 1.215 1.00 25.00 H new ATOM 0 HH12 ARG A 175 82.008 29.214 1.830 1.00 25.00 H new ATOM 0 HH21 ARG A 175 80.343 26.371 2.952 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.890 27.209 2.788 1.00 25.00 H new ATOM 1504 N GLN A 176 73.060 31.702 1.267 1.00 25.00 N ATOM 1505 CA GLN A 176 72.426 33.043 1.139 1.00 25.00 C ATOM 1506 C GLN A 176 73.029 34.034 2.137 1.00 25.00 C ATOM 1507 O GLN A 176 73.102 33.721 3.313 1.00 25.00 O ATOM 1508 CB GLN A 176 70.888 32.958 1.290 1.00 25.00 C ATOM 1509 CG GLN A 176 70.172 34.253 0.836 1.00 25.00 C ATOM 1510 CD GLN A 176 69.808 35.152 1.990 1.00 25.00 C ATOM 1511 OE1 GLN A 176 70.728 35.776 2.714 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.536 35.341 2.333 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.378 35.111 1.740 1.00 25.00 O ATOM 0 H GLN A 176 72.950 31.287 2.192 1.00 25.00 H new ATOM 0 HA GLN A 176 72.635 33.413 0.135 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.515 32.117 0.705 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.640 32.756 2.332 1.00 25.00 H new ATOM 0 HG2 GLN A 176 70.817 34.797 0.146 1.00 25.00 H new ATOM 0 HG3 GLN A 176 69.268 33.990 0.287 1.00 25.00 H new ATOM 0 HE21 GLN A 176 67.792 34.883 1.807 1.00 25.00 H new ATOM 0 HE22 GLN A 176 68.305 35.944 3.122 1.00 25.00 H new