USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 989 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 120 LYS NZ :NH3+ -120:sc= 0.982 (180deg=-0.0472) USER MOD Set 1.2: A 141 THR OG1 : rot -90:sc= 0.942 USER MOD Set 2.1: A 65 THR OG1 : rot -29:sc= 0.456 USER MOD Set 2.2: A 87 TYR OH : rot 150:sc= 0 USER MOD Set 3.1: A 57 HIS : no HD1:sc= -2.25 K(o=-2.8,f=0.64) USER MOD Set 3.2: A 58 SER OG : rot -150:sc= -0.558 USER MOD Set 4.1: A 23 ASN : amide:sc= 1.01 X(o=2.3,f=2.1) USER MOD Set 4.2: A 49 TYR OH : rot -154:sc= 1.33 USER MOD Single : A 28 TYR OH : rot -161:sc= 1.23 USER MOD Single : A 32 CYS SG : rot -24:sc= -0.447 USER MOD Single : A 33 SER OG : rot -73:sc= 1.4 USER MOD Single : A 37 THR OG1 : rot 122:sc= -0.31 USER MOD Single : A 51 SER OG : rot -120:sc= -0.0885 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 142:sc= -1.3 (180deg=-3.56!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 125:sc= 1.13 USER MOD Single : A 81 SER OG : rot -59:sc= 0.155 USER MOD Single : A 84 MET CE :methyl -165:sc= -1.04 (180deg=-1.98!) USER MOD Single : A 94 TYR OH : rot 27:sc= 1.15 USER MOD Single : A 95 SER OG : rot 100:sc= -1.46 USER MOD Single : A 103 HIS : no HD1:sc= -0.216 K(o=-0.22,f=-4.8!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl 160:sc= -0.462 (180deg=-0.852) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.00844 USER MOD Single : A 132 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0474) USER MOD Single : A 133 MET CE :methyl -121:sc= -0.113 (180deg=-0.694) USER MOD Single : A 134 LYS NZ :NH3+ -172:sc= 1.21 (180deg=0.995) USER MOD Single : A 137 ASN : amide:sc= -1.09 K(o=-1.1,f=0) USER MOD Single : A 138 TYR OH : rot 180:sc= 0.929 USER MOD Single : A 142 TYR OH : rot 180:sc=-0.00543 USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot -162:sc= 0.499 USER MOD ----------------------------------------------------------------- ATOM 305 N TRP A 22 -1.918 -13.679 -0.148 1.00 0.00 N ATOM 306 CA TRP A 22 -2.166 -12.248 -0.070 1.00 0.00 C ATOM 307 C TRP A 22 -2.880 -11.895 1.232 1.00 0.00 C ATOM 308 O TRP A 22 -2.815 -10.758 1.699 1.00 0.00 O ATOM 309 CB TRP A 22 -2.989 -11.782 -1.270 1.00 0.00 C ATOM 310 CG TRP A 22 -2.270 -11.939 -2.573 1.00 0.00 C ATOM 311 CD1 TRP A 22 -2.496 -12.895 -3.514 1.00 0.00 C ATOM 312 CD2 TRP A 22 -1.203 -11.124 -3.073 1.00 0.00 C ATOM 313 NE1 TRP A 22 -1.641 -12.727 -4.575 1.00 0.00 N ATOM 314 CE2 TRP A 22 -0.838 -11.643 -4.331 1.00 0.00 C ATOM 315 CE3 TRP A 22 -0.527 -10.001 -2.587 1.00 0.00 C ATOM 316 CZ2 TRP A 22 0.177 -11.084 -5.102 1.00 0.00 C ATOM 317 CZ3 TRP A 22 0.481 -9.448 -3.353 1.00 0.00 C ATOM 318 CH2 TRP A 22 0.822 -9.986 -4.600 1.00 0.00 C ATOM 0 HA TRP A 22 -1.205 -11.734 -0.086 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.920 -12.347 -1.306 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -3.257 -10.734 -1.134 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -3.240 -13.674 -3.438 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -1.609 -13.313 -5.409 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -0.788 -9.574 -1.630 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 0.446 -11.501 -6.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 1.016 -8.585 -2.983 1.00 0.00 H new ATOM 0 HH2 TRP A 22 1.610 -9.525 -5.177 1.00 0.00 H new ATOM 329 N ASN A 23 -3.548 -12.884 1.819 1.00 0.00 N ATOM 330 CA ASN A 23 -4.283 -12.686 3.065 1.00 0.00 C ATOM 331 C ASN A 23 -3.335 -12.373 4.213 1.00 0.00 C ATOM 332 O ASN A 23 -3.617 -11.505 5.038 1.00 0.00 O ATOM 333 CB ASN A 23 -5.120 -13.923 3.410 1.00 0.00 C ATOM 334 CG ASN A 23 -6.334 -14.078 2.517 1.00 0.00 C ATOM 335 OD1 ASN A 23 -6.257 -14.671 1.443 1.00 0.00 O ATOM 336 ND2 ASN A 23 -7.467 -13.557 2.961 1.00 0.00 N ATOM 0 H ASN A 23 -3.596 -13.834 1.450 1.00 0.00 H new ATOM 0 HA ASN A 23 -4.951 -11.837 2.920 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -4.496 -14.813 3.326 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -5.444 -13.858 4.449 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.319 -13.640 2.406 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -7.488 -13.072 3.858 1.00 0.00 H new ATOM 343 N ASP A 24 -2.206 -13.078 4.250 1.00 0.00 N ATOM 344 CA ASP A 24 -1.196 -12.861 5.287 1.00 0.00 C ATOM 345 C ASP A 24 -0.706 -11.420 5.245 1.00 0.00 C ATOM 346 O ASP A 24 -0.625 -10.745 6.273 1.00 0.00 O ATOM 347 CB ASP A 24 -0.004 -13.809 5.097 1.00 0.00 C ATOM 348 CG ASP A 24 -0.395 -15.273 5.115 1.00 0.00 C ATOM 349 OD1 ASP A 24 -0.670 -15.814 6.207 1.00 0.00 O ATOM 350 OD2 ASP A 24 -0.428 -15.898 4.034 1.00 0.00 O ATOM 0 H ASP A 24 -1.967 -13.804 3.575 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.656 -13.064 6.254 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.485 -13.582 4.149 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.727 -13.625 5.885 1.00 0.00 H new ATOM 355 N LEU A 25 -0.402 -10.957 4.039 1.00 0.00 N ATOM 356 CA LEU A 25 0.055 -9.590 3.825 1.00 0.00 C ATOM 357 C LEU A 25 -0.994 -8.591 4.301 1.00 0.00 C ATOM 358 O LEU A 25 -0.680 -7.647 5.028 1.00 0.00 O ATOM 359 CB LEU A 25 0.359 -9.367 2.340 1.00 0.00 C ATOM 360 CG LEU A 25 0.761 -7.940 1.963 1.00 0.00 C ATOM 361 CD1 LEU A 25 2.050 -7.545 2.667 1.00 0.00 C ATOM 362 CD2 LEU A 25 0.908 -7.813 0.455 1.00 0.00 C ATOM 0 H LEU A 25 -0.465 -11.514 3.187 1.00 0.00 H new ATOM 0 HA LEU A 25 0.966 -9.434 4.403 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.161 -10.043 2.045 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.521 -9.644 1.760 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.026 -7.259 2.289 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.320 -6.527 2.387 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.906 -7.598 3.746 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.848 -8.226 2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.194 -6.792 0.202 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.676 -8.503 0.105 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.041 -8.053 -0.025 1.00 0.00 H new ATOM 374 N ALA A 26 -2.237 -8.821 3.896 1.00 0.00 N ATOM 375 CA ALA A 26 -3.350 -7.948 4.257 1.00 0.00 C ATOM 376 C ALA A 26 -3.454 -7.772 5.768 1.00 0.00 C ATOM 377 O ALA A 26 -3.491 -6.647 6.259 1.00 0.00 O ATOM 378 CB ALA A 26 -4.651 -8.498 3.698 1.00 0.00 C ATOM 0 H ALA A 26 -2.502 -9.613 3.311 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.162 -6.967 3.821 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.473 -7.838 3.974 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.583 -8.559 2.612 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -4.831 -9.492 4.107 1.00 0.00 H new ATOM 384 N VAL A 27 -3.482 -8.886 6.496 1.00 0.00 N ATOM 385 CA VAL A 27 -3.586 -8.855 7.955 1.00 0.00 C ATOM 386 C VAL A 27 -2.462 -8.022 8.570 1.00 0.00 C ATOM 387 O VAL A 27 -2.693 -7.216 9.472 1.00 0.00 O ATOM 388 CB VAL A 27 -3.553 -10.280 8.557 1.00 0.00 C ATOM 389 CG1 VAL A 27 -3.607 -10.231 10.078 1.00 0.00 C ATOM 390 CG2 VAL A 27 -4.703 -11.112 8.012 1.00 0.00 C ATOM 0 H VAL A 27 -3.434 -9.824 6.099 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.545 -8.395 8.193 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.613 -10.749 8.266 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.582 -11.246 10.476 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.750 -9.673 10.455 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.527 -9.740 10.394 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.666 -12.112 8.445 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.650 -10.639 8.272 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.619 -11.183 6.928 1.00 0.00 H new ATOM 400 N TYR A 28 -1.252 -8.210 8.053 1.00 0.00 N ATOM 401 CA TYR A 28 -0.081 -7.478 8.521 1.00 0.00 C ATOM 402 C TYR A 28 -0.285 -5.971 8.350 1.00 0.00 C ATOM 403 O TYR A 28 -0.014 -5.186 9.261 1.00 0.00 O ATOM 404 CB TYR A 28 1.150 -7.945 7.736 1.00 0.00 C ATOM 405 CG TYR A 28 2.450 -7.304 8.158 1.00 0.00 C ATOM 406 CD1 TYR A 28 3.144 -7.767 9.267 1.00 0.00 C ATOM 407 CD2 TYR A 28 2.991 -6.245 7.440 1.00 0.00 C ATOM 408 CE1 TYR A 28 4.340 -7.195 9.649 1.00 0.00 C ATOM 409 CE2 TYR A 28 4.186 -5.665 7.817 1.00 0.00 C ATOM 410 CZ TYR A 28 4.855 -6.143 8.922 1.00 0.00 C ATOM 411 OH TYR A 28 6.052 -5.581 9.291 1.00 0.00 O ATOM 0 H TYR A 28 -1.056 -8.871 7.301 1.00 0.00 H new ATOM 0 HA TYR A 28 0.069 -7.678 9.582 1.00 0.00 H new ATOM 0 HB2 TYR A 28 1.243 -9.026 7.842 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.987 -7.741 6.678 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.741 -8.589 9.841 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.468 -5.869 6.573 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.870 -7.569 10.513 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.594 -4.842 7.249 1.00 0.00 H new ATOM 0 HH TYR A 28 6.132 -4.690 8.891 1.00 0.00 H new ATOM 421 N ILE A 29 -0.782 -5.587 7.182 1.00 0.00 N ATOM 422 CA ILE A 29 -1.050 -4.188 6.872 1.00 0.00 C ATOM 423 C ILE A 29 -2.158 -3.641 7.769 1.00 0.00 C ATOM 424 O ILE A 29 -2.064 -2.525 8.286 1.00 0.00 O ATOM 425 CB ILE A 29 -1.459 -4.026 5.393 1.00 0.00 C ATOM 426 CG1 ILE A 29 -0.348 -4.553 4.479 1.00 0.00 C ATOM 427 CG2 ILE A 29 -1.770 -2.569 5.075 1.00 0.00 C ATOM 428 CD1 ILE A 29 -0.748 -4.645 3.023 1.00 0.00 C ATOM 0 H ILE A 29 -1.010 -6.232 6.426 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.134 -3.625 7.052 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.363 -4.609 5.217 1.00 0.00 H new ATOM 0 HG12 ILE A 29 0.522 -3.902 4.567 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.043 -5.540 4.826 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.056 -2.478 4.027 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.590 -2.226 5.706 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.887 -1.959 5.264 1.00 0.00 H new ATOM 0 HD11 ILE A 29 0.090 -5.026 2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.598 -5.320 2.921 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.025 -3.656 2.658 1.00 0.00 H new ATOM 440 N ILE A 30 -3.195 -4.447 7.955 1.00 0.00 N ATOM 441 CA ILE A 30 -4.328 -4.094 8.806 1.00 0.00 C ATOM 442 C ILE A 30 -3.866 -3.764 10.223 1.00 0.00 C ATOM 443 O ILE A 30 -4.282 -2.764 10.806 1.00 0.00 O ATOM 444 CB ILE A 30 -5.348 -5.255 8.861 1.00 0.00 C ATOM 445 CG1 ILE A 30 -5.993 -5.462 7.488 1.00 0.00 C ATOM 446 CG2 ILE A 30 -6.409 -4.992 9.919 1.00 0.00 C ATOM 447 CD1 ILE A 30 -6.770 -6.756 7.362 1.00 0.00 C ATOM 0 H ILE A 30 -3.276 -5.366 7.520 1.00 0.00 H new ATOM 0 HA ILE A 30 -4.803 -3.213 8.374 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.817 -6.167 9.135 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.662 -4.627 7.283 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.215 -5.442 6.725 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.116 -5.822 9.940 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.934 -4.896 10.895 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.939 -4.070 9.681 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.196 -6.829 6.361 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.102 -7.600 7.534 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -7.572 -6.772 8.100 1.00 0.00 H new ATOM 459 N ARG A 31 -2.986 -4.601 10.757 1.00 0.00 N ATOM 460 CA ARG A 31 -2.490 -4.431 12.116 1.00 0.00 C ATOM 461 C ARG A 31 -1.678 -3.147 12.262 1.00 0.00 C ATOM 462 O ARG A 31 -1.616 -2.562 13.343 1.00 0.00 O ATOM 463 CB ARG A 31 -1.631 -5.625 12.524 1.00 0.00 C ATOM 464 CG ARG A 31 -2.391 -6.936 12.597 1.00 0.00 C ATOM 465 CD ARG A 31 -1.463 -8.087 12.947 1.00 0.00 C ATOM 466 NE ARG A 31 -0.851 -7.917 14.266 1.00 0.00 N ATOM 467 CZ ARG A 31 0.061 -8.743 14.779 1.00 0.00 C ATOM 468 NH1 ARG A 31 0.434 -9.826 14.111 1.00 0.00 N ATOM 469 NH2 ARG A 31 0.589 -8.491 15.972 1.00 0.00 N ATOM 0 H ARG A 31 -2.600 -5.408 10.267 1.00 0.00 H new ATOM 0 HA ARG A 31 -3.358 -4.365 12.772 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.812 -5.731 11.812 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.183 -5.422 13.497 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -3.181 -6.861 13.345 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.875 -7.133 11.641 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.022 -9.023 12.925 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.681 -8.165 12.192 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.141 -7.116 14.828 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.023 -10.030 13.200 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.132 -10.455 14.508 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.296 -7.666 16.495 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.287 -9.123 16.365 1.00 0.00 H new ATOM 483 N CYS A 32 -1.057 -2.710 11.176 1.00 0.00 N ATOM 484 CA CYS A 32 -0.209 -1.527 11.220 1.00 0.00 C ATOM 485 C CYS A 32 -1.022 -0.253 10.998 1.00 0.00 C ATOM 486 O CYS A 32 -0.628 0.829 11.438 1.00 0.00 O ATOM 487 CB CYS A 32 0.905 -1.629 10.177 1.00 0.00 C ATOM 488 SG CYS A 32 2.072 -0.247 10.209 1.00 0.00 S ATOM 0 H CYS A 32 -1.123 -3.153 10.260 1.00 0.00 H new ATOM 0 HA CYS A 32 0.238 -1.475 12.213 1.00 0.00 H new ATOM 0 HB2 CYS A 32 1.453 -2.558 10.336 1.00 0.00 H new ATOM 0 HB3 CYS A 32 0.456 -1.689 9.186 1.00 0.00 H new ATOM 0 HG CYS A 32 1.499 0.793 10.739 1.00 0.00 H new ATOM 494 N SER A 33 -2.160 -0.382 10.331 1.00 0.00 N ATOM 495 CA SER A 33 -2.983 0.774 10.000 1.00 0.00 C ATOM 496 C SER A 33 -4.133 0.944 10.994 1.00 0.00 C ATOM 497 O SER A 33 -4.074 1.793 11.888 1.00 0.00 O ATOM 498 CB SER A 33 -3.516 0.640 8.569 1.00 0.00 C ATOM 499 OG SER A 33 -4.044 -0.657 8.340 1.00 0.00 O ATOM 0 H SER A 33 -2.535 -1.274 10.008 1.00 0.00 H new ATOM 0 HA SER A 33 -2.362 1.668 10.066 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.290 1.387 8.395 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.714 0.840 7.859 1.00 0.00 H new ATOM 0 HG SER A 33 -3.309 -1.303 8.276 1.00 0.00 H new ATOM 505 N GLY A 34 -5.166 0.126 10.845 1.00 0.00 N ATOM 506 CA GLY A 34 -6.324 0.222 11.712 1.00 0.00 C ATOM 507 C GLY A 34 -7.383 1.160 11.158 1.00 0.00 C ATOM 508 O GLY A 34 -7.150 1.841 10.159 1.00 0.00 O ATOM 0 H GLY A 34 -5.223 -0.605 10.136 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.756 -0.769 11.849 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -6.011 0.572 12.696 1.00 0.00 H new ATOM 512 N PRO A 35 -8.567 1.214 11.783 1.00 0.00 N ATOM 513 CA PRO A 35 -9.653 2.093 11.341 1.00 0.00 C ATOM 514 C PRO A 35 -9.387 3.556 11.690 1.00 0.00 C ATOM 515 O PRO A 35 -8.660 3.855 12.642 1.00 0.00 O ATOM 516 CB PRO A 35 -10.863 1.569 12.115 1.00 0.00 C ATOM 517 CG PRO A 35 -10.289 0.971 13.354 1.00 0.00 C ATOM 518 CD PRO A 35 -8.942 0.422 12.970 1.00 0.00 C ATOM 0 HA PRO A 35 -9.782 2.077 10.259 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -11.561 2.372 12.350 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.413 0.828 11.535 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -10.194 1.720 14.140 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -10.935 0.183 13.741 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -8.217 0.540 13.775 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -8.994 -0.642 12.741 1.00 0.00 H new ATOM 526 N GLY A 36 -9.968 4.465 10.918 1.00 0.00 N ATOM 527 CA GLY A 36 -9.815 5.882 11.198 1.00 0.00 C ATOM 528 C GLY A 36 -8.520 6.459 10.656 1.00 0.00 C ATOM 529 O GLY A 36 -7.963 7.400 11.225 1.00 0.00 O ATOM 0 H GLY A 36 -10.542 4.248 10.103 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.656 6.425 10.767 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.853 6.040 12.276 1.00 0.00 H new ATOM 533 N THR A 37 -8.033 5.893 9.564 1.00 0.00 N ATOM 534 CA THR A 37 -6.844 6.406 8.902 1.00 0.00 C ATOM 535 C THR A 37 -6.934 6.112 7.408 1.00 0.00 C ATOM 536 O THR A 37 -7.944 5.583 6.948 1.00 0.00 O ATOM 537 CB THR A 37 -5.548 5.807 9.500 1.00 0.00 C ATOM 538 OG1 THR A 37 -4.401 6.497 8.987 1.00 0.00 O ATOM 539 CG2 THR A 37 -5.425 4.321 9.194 1.00 0.00 C ATOM 0 H THR A 37 -8.445 5.075 9.115 1.00 0.00 H new ATOM 0 HA THR A 37 -6.799 7.483 9.061 1.00 0.00 H new ATOM 0 HB THR A 37 -5.598 5.931 10.582 1.00 0.00 H new ATOM 0 HG1 THR A 37 -3.887 6.876 9.731 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.503 3.935 9.629 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.277 3.790 9.619 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.406 4.172 8.114 1.00 0.00 H new ATOM 547 N ARG A 38 -5.895 6.451 6.660 1.00 0.00 N ATOM 548 CA ARG A 38 -5.903 6.281 5.214 1.00 0.00 C ATOM 549 C ARG A 38 -4.828 5.300 4.764 1.00 0.00 C ATOM 550 O ARG A 38 -3.691 5.346 5.239 1.00 0.00 O ATOM 551 CB ARG A 38 -5.689 7.632 4.530 1.00 0.00 C ATOM 552 CG ARG A 38 -6.870 8.573 4.679 1.00 0.00 C ATOM 553 CD ARG A 38 -6.496 10.015 4.366 1.00 0.00 C ATOM 554 NE ARG A 38 -6.020 10.197 2.995 1.00 0.00 N ATOM 555 CZ ARG A 38 -6.382 11.217 2.216 1.00 0.00 C ATOM 556 NH1 ARG A 38 -7.288 12.093 2.640 1.00 0.00 N ATOM 557 NH2 ARG A 38 -5.850 11.359 1.009 1.00 0.00 N ATOM 0 H ARG A 38 -5.032 6.847 7.032 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.873 5.875 4.928 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -4.801 8.106 4.947 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.495 7.468 3.470 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -7.673 8.255 4.014 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -7.256 8.512 5.697 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.364 10.654 4.531 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.722 10.343 5.060 1.00 0.00 H new ATOM 0 HE ARG A 38 -5.375 9.505 2.613 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -7.708 11.986 3.563 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -7.563 12.872 2.042 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -5.161 10.686 0.673 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -6.130 12.141 0.417 1.00 0.00 H new ATOM 571 N VAL A 39 -5.200 4.406 3.862 1.00 0.00 N ATOM 572 CA VAL A 39 -4.246 3.507 3.228 1.00 0.00 C ATOM 573 C VAL A 39 -4.346 3.678 1.720 1.00 0.00 C ATOM 574 O VAL A 39 -5.436 3.585 1.155 1.00 0.00 O ATOM 575 CB VAL A 39 -4.499 2.023 3.593 1.00 0.00 C ATOM 576 CG1 VAL A 39 -3.350 1.148 3.116 1.00 0.00 C ATOM 577 CG2 VAL A 39 -4.717 1.855 5.088 1.00 0.00 C ATOM 0 H VAL A 39 -6.163 4.282 3.550 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.250 3.764 3.589 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.408 1.704 3.084 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.548 0.110 3.383 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.253 1.233 2.034 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.424 1.474 3.589 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.892 0.803 5.314 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.834 2.200 5.626 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.582 2.442 5.398 1.00 0.00 H new ATOM 587 N VAL A 40 -3.228 3.970 1.074 1.00 0.00 N ATOM 588 CA VAL A 40 -3.232 4.197 -0.361 1.00 0.00 C ATOM 589 C VAL A 40 -2.539 3.054 -1.085 1.00 0.00 C ATOM 590 O VAL A 40 -1.345 2.806 -0.893 1.00 0.00 O ATOM 591 CB VAL A 40 -2.563 5.534 -0.743 1.00 0.00 C ATOM 592 CG1 VAL A 40 -2.659 5.767 -2.244 1.00 0.00 C ATOM 593 CG2 VAL A 40 -3.195 6.691 0.018 1.00 0.00 C ATOM 0 H VAL A 40 -2.313 4.055 1.517 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.276 4.246 -0.670 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.510 5.480 -0.467 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.182 6.714 -2.496 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.156 4.956 -2.771 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.707 5.798 -2.541 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.708 7.623 -0.267 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -4.257 6.748 -0.223 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.074 6.531 1.089 1.00 0.00 H new ATOM 603 N GLU A 41 -3.301 2.368 -1.916 1.00 0.00 N ATOM 604 CA GLU A 41 -2.815 1.194 -2.618 1.00 0.00 C ATOM 605 C GLU A 41 -2.226 1.590 -3.963 1.00 0.00 C ATOM 606 O GLU A 41 -2.921 2.165 -4.810 1.00 0.00 O ATOM 607 CB GLU A 41 -3.957 0.209 -2.847 1.00 0.00 C ATOM 608 CG GLU A 41 -5.107 0.373 -1.870 1.00 0.00 C ATOM 609 CD GLU A 41 -4.782 -0.124 -0.483 1.00 0.00 C ATOM 610 OE1 GLU A 41 -3.901 0.458 0.172 1.00 0.00 O ATOM 611 OE2 GLU A 41 -5.412 -1.110 -0.054 1.00 0.00 O ATOM 0 H GLU A 41 -4.271 2.607 -2.123 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.044 0.725 -2.007 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.334 0.332 -3.862 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.570 -0.807 -2.772 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.383 1.426 -1.817 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.976 -0.165 -2.248 1.00 0.00 H new ATOM 618 N VAL A 42 -0.956 1.290 -4.161 1.00 0.00 N ATOM 619 CA VAL A 42 -0.313 1.543 -5.439 1.00 0.00 C ATOM 620 C VAL A 42 -0.370 0.290 -6.301 1.00 0.00 C ATOM 621 O VAL A 42 0.284 -0.713 -6.008 1.00 0.00 O ATOM 622 CB VAL A 42 1.151 1.989 -5.266 1.00 0.00 C ATOM 623 CG1 VAL A 42 1.789 2.268 -6.616 1.00 0.00 C ATOM 624 CG2 VAL A 42 1.236 3.215 -4.370 1.00 0.00 C ATOM 0 H VAL A 42 -0.349 0.872 -3.456 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.853 2.355 -5.927 1.00 0.00 H new ATOM 0 HB VAL A 42 1.701 1.178 -4.789 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.823 2.582 -6.472 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.766 1.363 -7.223 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.237 3.060 -7.123 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.278 3.514 -4.260 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.669 4.032 -4.816 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.821 2.979 -3.390 1.00 0.00 H new ATOM 634 N GLY A 43 -1.170 0.354 -7.353 1.00 0.00 N ATOM 635 CA GLY A 43 -1.387 -0.803 -8.192 1.00 0.00 C ATOM 636 C GLY A 43 -2.681 -1.495 -7.835 1.00 0.00 C ATOM 637 O GLY A 43 -2.737 -2.266 -6.878 1.00 0.00 O ATOM 0 H GLY A 43 -1.675 1.192 -7.641 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.410 -0.499 -9.238 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.555 -1.499 -8.080 1.00 0.00 H new ATOM 641 N ALA A 44 -3.729 -1.201 -8.589 1.00 0.00 N ATOM 642 CA ALA A 44 -5.043 -1.740 -8.295 1.00 0.00 C ATOM 643 C ALA A 44 -5.473 -2.734 -9.362 1.00 0.00 C ATOM 644 O ALA A 44 -5.820 -3.875 -9.054 1.00 0.00 O ATOM 645 CB ALA A 44 -6.059 -0.613 -8.173 1.00 0.00 C ATOM 0 H ALA A 44 -3.693 -0.593 -9.407 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.992 -2.269 -7.343 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.041 -1.031 -7.952 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.762 0.059 -7.368 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.103 -0.059 -9.111 1.00 0.00 H new ATOM 651 N GLY A 45 -5.423 -2.294 -10.617 1.00 0.00 N ATOM 652 CA GLY A 45 -5.876 -3.115 -11.722 1.00 0.00 C ATOM 653 C GLY A 45 -7.239 -3.722 -11.466 1.00 0.00 C ATOM 654 O GLY A 45 -8.218 -3.006 -11.241 1.00 0.00 O ATOM 0 H GLY A 45 -5.073 -1.375 -10.887 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.914 -2.511 -12.629 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.154 -3.912 -11.900 1.00 0.00 H new ATOM 658 N ARG A 46 -7.301 -5.042 -11.494 1.00 0.00 N ATOM 659 CA ARG A 46 -8.526 -5.755 -11.176 1.00 0.00 C ATOM 660 C ARG A 46 -8.318 -6.643 -9.953 1.00 0.00 C ATOM 661 O ARG A 46 -9.223 -7.368 -9.536 1.00 0.00 O ATOM 662 CB ARG A 46 -8.966 -6.605 -12.368 1.00 0.00 C ATOM 663 CG ARG A 46 -9.138 -5.812 -13.652 1.00 0.00 C ATOM 664 CD ARG A 46 -9.486 -6.713 -14.823 1.00 0.00 C ATOM 665 NE ARG A 46 -9.515 -5.979 -16.085 1.00 0.00 N ATOM 666 CZ ARG A 46 -9.439 -6.554 -17.285 1.00 0.00 C ATOM 667 NH1 ARG A 46 -9.356 -7.876 -17.392 1.00 0.00 N ATOM 668 NH2 ARG A 46 -9.447 -5.801 -18.379 1.00 0.00 N ATOM 0 H ARG A 46 -6.514 -5.644 -11.735 1.00 0.00 H new ATOM 0 HA ARG A 46 -9.305 -5.026 -10.954 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -8.230 -7.392 -12.533 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -9.909 -7.096 -12.125 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -9.924 -5.068 -13.518 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -8.219 -5.269 -13.871 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.757 -7.520 -14.889 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -10.458 -7.175 -14.649 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.599 -4.963 -16.046 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.350 -8.456 -16.553 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.298 -8.310 -18.313 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.511 -4.786 -18.299 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -9.389 -6.238 -19.299 1.00 0.00 H new ATOM 682 N PHE A 47 -7.129 -6.568 -9.368 1.00 0.00 N ATOM 683 CA PHE A 47 -6.769 -7.426 -8.246 1.00 0.00 C ATOM 684 C PHE A 47 -6.956 -6.700 -6.915 1.00 0.00 C ATOM 685 O PHE A 47 -6.011 -6.487 -6.159 1.00 0.00 O ATOM 686 CB PHE A 47 -5.329 -7.953 -8.395 1.00 0.00 C ATOM 687 CG PHE A 47 -4.318 -6.926 -8.838 1.00 0.00 C ATOM 688 CD1 PHE A 47 -3.638 -6.149 -7.913 1.00 0.00 C ATOM 689 CD2 PHE A 47 -4.039 -6.750 -10.184 1.00 0.00 C ATOM 690 CE1 PHE A 47 -2.702 -5.219 -8.322 1.00 0.00 C ATOM 691 CE2 PHE A 47 -3.105 -5.819 -10.600 1.00 0.00 C ATOM 692 CZ PHE A 47 -2.436 -5.053 -9.667 1.00 0.00 C ATOM 0 H PHE A 47 -6.395 -5.919 -9.653 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.441 -8.284 -8.252 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.009 -8.367 -7.439 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.331 -8.773 -9.113 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -3.843 -6.272 -6.860 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -4.558 -7.348 -10.918 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -2.178 -4.622 -7.590 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.900 -5.692 -11.653 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.706 -4.325 -9.988 1.00 0.00 H new ATOM 702 N LEU A 48 -8.200 -6.344 -6.624 1.00 0.00 N ATOM 703 CA LEU A 48 -8.531 -5.618 -5.399 1.00 0.00 C ATOM 704 C LEU A 48 -8.737 -6.585 -4.231 1.00 0.00 C ATOM 705 O LEU A 48 -9.385 -6.253 -3.242 1.00 0.00 O ATOM 706 CB LEU A 48 -9.800 -4.787 -5.616 1.00 0.00 C ATOM 707 CG LEU A 48 -9.772 -3.863 -6.838 1.00 0.00 C ATOM 708 CD1 LEU A 48 -11.073 -3.081 -6.944 1.00 0.00 C ATOM 709 CD2 LEU A 48 -8.583 -2.917 -6.771 1.00 0.00 C ATOM 0 H LEU A 48 -9.002 -6.546 -7.221 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.700 -4.956 -5.155 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.648 -5.465 -5.713 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.976 -4.182 -4.727 1.00 0.00 H new ATOM 0 HG LEU A 48 -9.666 -4.479 -7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.036 -2.430 -7.817 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -11.908 -3.775 -7.044 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -11.209 -2.477 -6.047 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.583 -2.270 -7.648 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.654 -2.307 -5.870 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.659 -3.495 -6.746 1.00 0.00 H new ATOM 721 N TYR A 49 -8.156 -7.773 -4.351 1.00 0.00 N ATOM 722 CA TYR A 49 -8.320 -8.830 -3.358 1.00 0.00 C ATOM 723 C TYR A 49 -7.743 -8.416 -2.005 1.00 0.00 C ATOM 724 O TYR A 49 -8.342 -8.672 -0.961 1.00 0.00 O ATOM 725 CB TYR A 49 -7.640 -10.108 -3.864 1.00 0.00 C ATOM 726 CG TYR A 49 -7.784 -11.307 -2.951 1.00 0.00 C ATOM 727 CD1 TYR A 49 -9.002 -11.957 -2.810 1.00 0.00 C ATOM 728 CD2 TYR A 49 -6.692 -11.798 -2.243 1.00 0.00 C ATOM 729 CE1 TYR A 49 -9.132 -13.062 -1.989 1.00 0.00 C ATOM 730 CE2 TYR A 49 -6.816 -12.900 -1.419 1.00 0.00 C ATOM 731 CZ TYR A 49 -8.036 -13.528 -1.295 1.00 0.00 C ATOM 732 OH TYR A 49 -8.160 -14.635 -0.484 1.00 0.00 O ATOM 0 H TYR A 49 -7.559 -8.031 -5.137 1.00 0.00 H new ATOM 0 HA TYR A 49 -9.385 -9.015 -3.216 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -8.053 -10.361 -4.840 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -6.579 -9.905 -4.010 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -9.863 -11.593 -3.351 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -5.733 -11.311 -2.339 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -10.087 -13.557 -1.892 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -5.959 -13.268 -0.874 1.00 0.00 H new ATOM 0 HH TYR A 49 -7.479 -14.603 0.220 1.00 0.00 H new ATOM 742 N VAL A 50 -6.586 -7.771 -2.031 1.00 0.00 N ATOM 743 CA VAL A 50 -5.926 -7.345 -0.802 1.00 0.00 C ATOM 744 C VAL A 50 -6.626 -6.124 -0.210 1.00 0.00 C ATOM 745 O VAL A 50 -6.999 -6.117 0.964 1.00 0.00 O ATOM 746 CB VAL A 50 -4.437 -7.009 -1.052 1.00 0.00 C ATOM 747 CG1 VAL A 50 -3.728 -6.666 0.249 1.00 0.00 C ATOM 748 CG2 VAL A 50 -3.736 -8.161 -1.756 1.00 0.00 C ATOM 0 H VAL A 50 -6.085 -7.531 -2.886 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.985 -8.174 -0.097 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.395 -6.133 -1.700 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.683 -6.434 0.044 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.208 -5.802 0.708 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.784 -7.516 0.929 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.690 -7.903 -1.922 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.795 -9.056 -1.137 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.220 -8.350 -2.714 1.00 0.00 H new ATOM 758 N SER A 51 -6.835 -5.121 -1.051 1.00 0.00 N ATOM 759 CA SER A 51 -7.378 -3.839 -0.620 1.00 0.00 C ATOM 760 C SER A 51 -8.786 -3.970 -0.045 1.00 0.00 C ATOM 761 O SER A 51 -9.089 -3.410 1.014 1.00 0.00 O ATOM 762 CB SER A 51 -7.372 -2.864 -1.797 1.00 0.00 C ATOM 763 OG SER A 51 -7.738 -3.517 -3.004 1.00 0.00 O ATOM 0 H SER A 51 -6.634 -5.172 -2.050 1.00 0.00 H new ATOM 0 HA SER A 51 -6.744 -3.458 0.181 1.00 0.00 H new ATOM 0 HB2 SER A 51 -8.064 -2.045 -1.599 1.00 0.00 H new ATOM 0 HB3 SER A 51 -6.380 -2.424 -1.904 1.00 0.00 H new ATOM 0 HG SER A 51 -7.007 -3.441 -3.652 1.00 0.00 H new ATOM 769 N ASP A 52 -9.650 -4.715 -0.728 1.00 0.00 N ATOM 770 CA ASP A 52 -11.035 -4.842 -0.286 1.00 0.00 C ATOM 771 C ASP A 52 -11.117 -5.663 0.994 1.00 0.00 C ATOM 772 O ASP A 52 -11.919 -5.370 1.874 1.00 0.00 O ATOM 773 CB ASP A 52 -11.920 -5.459 -1.372 1.00 0.00 C ATOM 774 CG ASP A 52 -13.396 -5.384 -1.021 1.00 0.00 C ATOM 775 OD1 ASP A 52 -13.919 -4.256 -0.862 1.00 0.00 O ATOM 776 OD2 ASP A 52 -14.051 -6.444 -0.932 1.00 0.00 O ATOM 0 H ASP A 52 -9.421 -5.233 -1.577 1.00 0.00 H new ATOM 0 HA ASP A 52 -11.407 -3.838 -0.084 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.746 -4.943 -2.316 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -11.636 -6.501 -1.521 1.00 0.00 H new ATOM 781 N TYR A 53 -10.257 -6.668 1.112 1.00 0.00 N ATOM 782 CA TYR A 53 -10.216 -7.496 2.312 1.00 0.00 C ATOM 783 C TYR A 53 -9.932 -6.635 3.540 1.00 0.00 C ATOM 784 O TYR A 53 -10.533 -6.825 4.601 1.00 0.00 O ATOM 785 CB TYR A 53 -9.149 -8.588 2.176 1.00 0.00 C ATOM 786 CG TYR A 53 -9.030 -9.479 3.393 1.00 0.00 C ATOM 787 CD1 TYR A 53 -9.989 -10.445 3.669 1.00 0.00 C ATOM 788 CD2 TYR A 53 -7.960 -9.349 4.267 1.00 0.00 C ATOM 789 CE1 TYR A 53 -9.885 -11.255 4.784 1.00 0.00 C ATOM 790 CE2 TYR A 53 -7.848 -10.155 5.383 1.00 0.00 C ATOM 791 CZ TYR A 53 -8.812 -11.106 5.636 1.00 0.00 C ATOM 792 OH TYR A 53 -8.705 -11.907 6.750 1.00 0.00 O ATOM 0 H TYR A 53 -9.581 -6.929 0.394 1.00 0.00 H new ATOM 0 HA TYR A 53 -11.188 -7.973 2.434 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -9.381 -9.204 1.307 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -8.184 -8.119 1.985 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -10.830 -10.565 3.002 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -7.202 -8.605 4.071 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -10.640 -12.000 4.986 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -7.009 -10.040 6.054 1.00 0.00 H new ATOM 0 HH TYR A 53 -7.891 -11.674 7.243 1.00 0.00 H new ATOM 802 N ILE A 54 -9.029 -5.676 3.384 1.00 0.00 N ATOM 803 CA ILE A 54 -8.661 -4.783 4.473 1.00 0.00 C ATOM 804 C ILE A 54 -9.835 -3.895 4.885 1.00 0.00 C ATOM 805 O ILE A 54 -10.170 -3.812 6.065 1.00 0.00 O ATOM 806 CB ILE A 54 -7.454 -3.902 4.085 1.00 0.00 C ATOM 807 CG1 ILE A 54 -6.241 -4.787 3.789 1.00 0.00 C ATOM 808 CG2 ILE A 54 -7.133 -2.900 5.191 1.00 0.00 C ATOM 809 CD1 ILE A 54 -5.028 -4.020 3.315 1.00 0.00 C ATOM 0 H ILE A 54 -8.536 -5.497 2.509 1.00 0.00 H new ATOM 0 HA ILE A 54 -8.383 -5.408 5.321 1.00 0.00 H new ATOM 0 HB ILE A 54 -7.707 -3.337 3.188 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -5.979 -5.342 4.690 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.515 -5.521 3.031 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.279 -2.291 4.894 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.996 -2.256 5.361 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.894 -3.436 6.110 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.209 -4.714 3.126 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.271 -3.487 2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -4.727 -3.305 4.081 1.00 0.00 H new ATOM 821 N ARG A 55 -10.474 -3.264 3.904 1.00 0.00 N ATOM 822 CA ARG A 55 -11.568 -2.326 4.173 1.00 0.00 C ATOM 823 C ARG A 55 -12.814 -3.048 4.698 1.00 0.00 C ATOM 824 O ARG A 55 -13.685 -2.432 5.314 1.00 0.00 O ATOM 825 CB ARG A 55 -11.905 -1.523 2.910 1.00 0.00 C ATOM 826 CG ARG A 55 -12.415 -2.375 1.761 1.00 0.00 C ATOM 827 CD ARG A 55 -12.400 -1.628 0.434 1.00 0.00 C ATOM 828 NE ARG A 55 -13.360 -0.524 0.386 1.00 0.00 N ATOM 829 CZ ARG A 55 -14.534 -0.593 -0.245 1.00 0.00 C ATOM 830 NH1 ARG A 55 -14.928 -1.737 -0.799 1.00 0.00 N ATOM 831 NH2 ARG A 55 -15.318 0.479 -0.318 1.00 0.00 N ATOM 0 H ARG A 55 -10.256 -3.383 2.915 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.233 -1.639 4.950 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.657 -0.774 3.157 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.015 -0.985 2.584 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -11.801 -3.272 1.677 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -13.431 -2.703 1.979 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -11.398 -1.238 0.254 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.619 -2.328 -0.373 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.118 0.346 0.861 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.332 -2.563 -0.742 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.826 -1.788 -1.281 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -15.023 1.357 0.109 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -16.215 0.423 -0.801 1.00 0.00 H new ATOM 845 N LYS A 56 -12.898 -4.353 4.454 1.00 0.00 N ATOM 846 CA LYS A 56 -14.016 -5.146 4.951 1.00 0.00 C ATOM 847 C LYS A 56 -13.800 -5.553 6.404 1.00 0.00 C ATOM 848 O LYS A 56 -14.747 -5.611 7.188 1.00 0.00 O ATOM 849 CB LYS A 56 -14.225 -6.397 4.093 1.00 0.00 C ATOM 850 CG LYS A 56 -14.682 -6.099 2.670 1.00 0.00 C ATOM 851 CD LYS A 56 -16.003 -5.341 2.630 1.00 0.00 C ATOM 852 CE LYS A 56 -17.204 -6.243 2.890 1.00 0.00 C ATOM 853 NZ LYS A 56 -17.283 -6.707 4.301 1.00 0.00 N ATOM 0 H LYS A 56 -12.209 -4.880 3.918 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.908 -4.522 4.891 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.292 -6.960 4.055 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -14.964 -7.037 4.575 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.916 -5.515 2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.787 -7.035 2.122 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.983 -4.545 3.374 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -16.115 -4.865 1.656 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -18.118 -5.705 2.638 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.152 -7.109 2.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -18.277 -6.726 4.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.880 -7.663 4.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.747 -6.057 4.911 1.00 0.00 H new ATOM 867 N HIS A 57 -12.554 -5.826 6.765 1.00 0.00 N ATOM 868 CA HIS A 57 -12.233 -6.272 8.102 1.00 0.00 C ATOM 869 C HIS A 57 -12.070 -5.065 9.031 1.00 0.00 C ATOM 870 O HIS A 57 -12.535 -5.074 10.171 1.00 0.00 O ATOM 871 CB HIS A 57 -10.970 -7.146 8.044 1.00 0.00 C ATOM 872 CG HIS A 57 -10.323 -7.396 9.366 1.00 0.00 C ATOM 873 ND1 HIS A 57 -10.460 -8.584 10.041 1.00 0.00 N ATOM 874 CD2 HIS A 57 -9.536 -6.571 10.075 1.00 0.00 C ATOM 875 CE1 HIS A 57 -9.751 -8.448 11.151 1.00 0.00 C ATOM 876 NE2 HIS A 57 -9.172 -7.242 11.213 1.00 0.00 N ATOM 0 H HIS A 57 -11.750 -5.744 6.143 1.00 0.00 H new ATOM 0 HA HIS A 57 -13.042 -6.877 8.510 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -11.228 -8.105 7.594 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -10.245 -6.669 7.384 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -9.245 -5.568 9.800 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -9.652 -9.211 11.909 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -8.576 -6.891 11.962 1.00 0.00 H new ATOM 884 N SER A 58 -11.421 -4.024 8.531 1.00 0.00 N ATOM 885 CA SER A 58 -11.261 -2.789 9.277 1.00 0.00 C ATOM 886 C SER A 58 -11.829 -1.623 8.494 1.00 0.00 C ATOM 887 O SER A 58 -11.574 -1.480 7.300 1.00 0.00 O ATOM 888 CB SER A 58 -9.789 -2.543 9.601 1.00 0.00 C ATOM 889 OG SER A 58 -9.292 -3.542 10.476 1.00 0.00 O ATOM 0 H SER A 58 -10.994 -4.013 7.605 1.00 0.00 H new ATOM 0 HA SER A 58 -11.809 -2.881 10.215 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.206 -2.537 8.680 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.672 -1.561 10.059 1.00 0.00 H new ATOM 0 HG SER A 58 -8.581 -3.164 11.034 1.00 0.00 H new ATOM 895 N LYS A 59 -12.606 -0.793 9.172 1.00 0.00 N ATOM 896 CA LYS A 59 -13.204 0.369 8.545 1.00 0.00 C ATOM 897 C LYS A 59 -12.174 1.479 8.413 1.00 0.00 C ATOM 898 O LYS A 59 -12.265 2.530 9.050 1.00 0.00 O ATOM 899 CB LYS A 59 -14.419 0.842 9.340 1.00 0.00 C ATOM 900 CG LYS A 59 -15.701 0.865 8.524 1.00 0.00 C ATOM 901 CD LYS A 59 -16.032 -0.504 7.940 1.00 0.00 C ATOM 902 CE LYS A 59 -16.231 -1.550 9.028 1.00 0.00 C ATOM 903 NZ LYS A 59 -16.668 -2.860 8.474 1.00 0.00 N ATOM 0 H LYS A 59 -12.836 -0.905 10.159 1.00 0.00 H new ATOM 0 HA LYS A 59 -13.544 0.094 7.546 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.557 0.189 10.202 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -14.225 1.843 9.726 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -16.525 1.199 9.154 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -15.603 1.590 7.716 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -16.936 -0.432 7.335 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.228 -0.820 7.275 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -15.299 -1.682 9.577 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -16.974 -1.193 9.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -16.791 -3.541 9.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -17.571 -2.741 7.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -15.948 -3.215 7.813 1.00 0.00 H new ATOM 917 N VAL A 60 -11.161 1.192 7.624 1.00 0.00 N ATOM 918 CA VAL A 60 -10.123 2.153 7.304 1.00 0.00 C ATOM 919 C VAL A 60 -10.454 2.857 5.984 1.00 0.00 C ATOM 920 O VAL A 60 -11.113 2.280 5.118 1.00 0.00 O ATOM 921 CB VAL A 60 -8.744 1.447 7.223 1.00 0.00 C ATOM 922 CG1 VAL A 60 -8.748 0.344 6.174 1.00 0.00 C ATOM 923 CG2 VAL A 60 -7.630 2.439 6.943 1.00 0.00 C ATOM 0 H VAL A 60 -11.032 0.281 7.183 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.074 2.903 8.094 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.557 0.992 8.196 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.768 -0.131 6.142 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.503 -0.399 6.430 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.976 0.771 5.198 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.677 1.912 6.893 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.819 2.939 5.993 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.593 3.179 7.742 1.00 0.00 H new ATOM 933 N ASP A 61 -10.025 4.109 5.847 1.00 0.00 N ATOM 934 CA ASP A 61 -10.247 4.864 4.615 1.00 0.00 C ATOM 935 C ASP A 61 -9.295 4.355 3.541 1.00 0.00 C ATOM 936 O ASP A 61 -8.123 4.738 3.489 1.00 0.00 O ATOM 937 CB ASP A 61 -10.049 6.367 4.856 1.00 0.00 C ATOM 938 CG ASP A 61 -10.331 7.221 3.631 1.00 0.00 C ATOM 939 OD1 ASP A 61 -10.934 6.717 2.664 1.00 0.00 O ATOM 940 OD2 ASP A 61 -9.960 8.419 3.644 1.00 0.00 O ATOM 0 H ASP A 61 -9.523 4.622 6.572 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.274 4.718 4.281 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.702 6.685 5.669 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -9.024 6.542 5.183 1.00 0.00 H new ATOM 945 N LEU A 62 -9.802 3.454 2.721 1.00 0.00 N ATOM 946 CA LEU A 62 -8.992 2.766 1.735 1.00 0.00 C ATOM 947 C LEU A 62 -9.046 3.503 0.399 1.00 0.00 C ATOM 948 O LEU A 62 -10.130 3.765 -0.130 1.00 0.00 O ATOM 949 CB LEU A 62 -9.502 1.325 1.600 1.00 0.00 C ATOM 950 CG LEU A 62 -8.480 0.298 1.112 1.00 0.00 C ATOM 951 CD1 LEU A 62 -8.218 0.457 -0.377 1.00 0.00 C ATOM 952 CD2 LEU A 62 -7.190 0.427 1.905 1.00 0.00 C ATOM 0 H LEU A 62 -10.784 3.179 2.720 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.950 2.745 2.053 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.879 1.001 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.348 1.322 0.912 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.889 -0.700 1.272 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.488 -0.285 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.148 0.314 -0.927 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -7.830 1.457 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.469 -0.309 1.549 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.781 1.429 1.774 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.394 0.254 2.962 1.00 0.00 H new ATOM 964 N VAL A 63 -7.878 3.835 -0.138 1.00 0.00 N ATOM 965 CA VAL A 63 -7.786 4.594 -1.378 1.00 0.00 C ATOM 966 C VAL A 63 -6.916 3.869 -2.401 1.00 0.00 C ATOM 967 O VAL A 63 -5.736 3.625 -2.165 1.00 0.00 O ATOM 968 CB VAL A 63 -7.197 6.003 -1.136 1.00 0.00 C ATOM 969 CG1 VAL A 63 -7.211 6.816 -2.420 1.00 0.00 C ATOM 970 CG2 VAL A 63 -7.954 6.725 -0.030 1.00 0.00 C ATOM 0 H VAL A 63 -6.976 3.588 0.270 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.801 4.691 -1.764 1.00 0.00 H new ATOM 0 HB VAL A 63 -6.162 5.889 -0.815 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.793 7.804 -2.229 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.614 6.309 -3.178 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -8.237 6.918 -2.775 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.521 7.714 0.122 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -9.002 6.827 -0.313 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.882 6.152 0.894 1.00 0.00 H new ATOM 980 N LEU A 64 -7.505 3.537 -3.536 1.00 0.00 N ATOM 981 CA LEU A 64 -6.782 2.869 -4.608 1.00 0.00 C ATOM 982 C LEU A 64 -6.308 3.892 -5.632 1.00 0.00 C ATOM 983 O LEU A 64 -6.956 4.916 -5.824 1.00 0.00 O ATOM 984 CB LEU A 64 -7.689 1.835 -5.279 1.00 0.00 C ATOM 985 CG LEU A 64 -8.084 0.649 -4.400 1.00 0.00 C ATOM 986 CD1 LEU A 64 -9.425 0.086 -4.832 1.00 0.00 C ATOM 987 CD2 LEU A 64 -7.021 -0.429 -4.472 1.00 0.00 C ATOM 0 H LEU A 64 -8.487 3.720 -3.741 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.913 2.361 -4.190 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -8.597 2.336 -5.616 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.185 1.456 -6.168 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.170 0.996 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.688 -0.758 -4.194 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.189 0.859 -4.745 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.363 -0.248 -5.868 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.312 -1.270 -3.842 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.915 -0.767 -5.503 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.070 -0.026 -4.123 1.00 0.00 H new ATOM 999 N THR A 65 -5.179 3.626 -6.277 1.00 0.00 N ATOM 1000 CA THR A 65 -4.673 4.506 -7.326 1.00 0.00 C ATOM 1001 C THR A 65 -4.223 3.692 -8.539 1.00 0.00 C ATOM 1002 O THR A 65 -3.448 2.741 -8.397 1.00 0.00 O ATOM 1003 CB THR A 65 -3.500 5.386 -6.825 1.00 0.00 C ATOM 1004 OG1 THR A 65 -2.549 4.599 -6.090 1.00 0.00 O ATOM 1005 CG2 THR A 65 -4.006 6.521 -5.946 1.00 0.00 C ATOM 0 H THR A 65 -4.596 2.809 -6.093 1.00 0.00 H new ATOM 0 HA THR A 65 -5.492 5.165 -7.615 1.00 0.00 H new ATOM 0 HB THR A 65 -3.011 5.810 -7.702 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.008 3.847 -5.662 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.163 7.123 -5.608 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.692 7.146 -6.518 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.526 6.108 -5.082 1.00 0.00 H new ATOM 1013 N ASP A 66 -4.721 4.050 -9.725 1.00 0.00 N ATOM 1014 CA ASP A 66 -4.380 3.320 -10.947 1.00 0.00 C ATOM 1015 C ASP A 66 -4.734 4.158 -12.174 1.00 0.00 C ATOM 1016 O ASP A 66 -5.317 5.237 -12.051 1.00 0.00 O ATOM 1017 CB ASP A 66 -5.124 1.976 -11.001 1.00 0.00 C ATOM 1018 CG ASP A 66 -4.364 0.908 -11.771 1.00 0.00 C ATOM 1019 OD1 ASP A 66 -4.237 1.027 -13.010 1.00 0.00 O ATOM 1020 OD2 ASP A 66 -3.888 -0.056 -11.135 1.00 0.00 O ATOM 0 H ASP A 66 -5.357 4.835 -9.864 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.308 3.124 -10.943 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -5.304 1.625 -9.985 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -6.100 2.125 -11.464 1.00 0.00 H new ATOM 1025 N ILE A 67 -4.396 3.657 -13.354 1.00 0.00 N ATOM 1026 CA ILE A 67 -4.652 4.373 -14.597 1.00 0.00 C ATOM 1027 C ILE A 67 -6.039 4.033 -15.130 1.00 0.00 C ATOM 1028 O ILE A 67 -6.265 2.925 -15.619 1.00 0.00 O ATOM 1029 CB ILE A 67 -3.594 4.037 -15.670 1.00 0.00 C ATOM 1030 CG1 ILE A 67 -2.188 4.347 -15.145 1.00 0.00 C ATOM 1031 CG2 ILE A 67 -3.868 4.809 -16.957 1.00 0.00 C ATOM 1032 CD1 ILE A 67 -1.976 5.807 -14.795 1.00 0.00 C ATOM 0 H ILE A 67 -3.941 2.752 -13.477 1.00 0.00 H new ATOM 0 HA ILE A 67 -4.596 5.439 -14.378 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.654 2.972 -15.893 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -1.998 3.739 -14.260 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.456 4.053 -15.897 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -3.111 4.558 -17.700 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -4.854 4.542 -17.338 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -3.835 5.879 -16.753 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.959 5.950 -14.431 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -2.133 6.420 -15.682 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -2.684 6.102 -14.020 1.00 0.00 H new ATOM 1044 N LYS A 68 -6.954 4.996 -15.028 1.00 0.00 N ATOM 1045 CA LYS A 68 -8.345 4.816 -15.453 1.00 0.00 C ATOM 1046 C LYS A 68 -9.016 3.681 -14.677 1.00 0.00 C ATOM 1047 O LYS A 68 -8.975 2.517 -15.082 1.00 0.00 O ATOM 1048 CB LYS A 68 -8.434 4.575 -16.964 1.00 0.00 C ATOM 1049 CG LYS A 68 -8.001 5.775 -17.792 1.00 0.00 C ATOM 1050 CD LYS A 68 -8.041 5.478 -19.281 1.00 0.00 C ATOM 1051 CE LYS A 68 -7.050 4.391 -19.660 1.00 0.00 C ATOM 1052 NZ LYS A 68 -7.048 4.128 -21.122 1.00 0.00 N ATOM 0 H LYS A 68 -6.754 5.922 -14.649 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.882 5.738 -15.229 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -7.812 3.719 -17.225 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -9.460 4.315 -17.223 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.652 6.622 -17.573 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.990 6.068 -17.507 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -9.047 5.169 -19.564 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.817 6.386 -19.840 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.050 4.685 -19.343 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.296 3.473 -19.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.359 3.380 -21.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -7.996 3.822 -21.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.788 4.997 -21.631 1.00 0.00 H new ATOM 1066 N PRO A 69 -9.634 4.021 -13.539 1.00 0.00 N ATOM 1067 CA PRO A 69 -10.277 3.045 -12.654 1.00 0.00 C ATOM 1068 C PRO A 69 -11.493 2.373 -13.284 1.00 0.00 C ATOM 1069 O PRO A 69 -12.271 3.008 -14.000 1.00 0.00 O ATOM 1070 CB PRO A 69 -10.712 3.883 -11.451 1.00 0.00 C ATOM 1071 CG PRO A 69 -10.785 5.282 -11.951 1.00 0.00 C ATOM 1072 CD PRO A 69 -9.746 5.394 -13.024 1.00 0.00 C ATOM 0 HA PRO A 69 -9.598 2.228 -12.411 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -11.678 3.551 -11.069 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -9.998 3.795 -10.632 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -11.777 5.504 -12.344 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -10.594 5.994 -11.148 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -10.049 6.092 -13.805 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -8.796 5.752 -12.627 1.00 0.00 H new ATOM 1122 N ILE A 74 -11.211 3.877 -7.004 1.00 0.00 N ATOM 1123 CA ILE A 74 -9.839 4.048 -7.439 1.00 0.00 C ATOM 1124 C ILE A 74 -9.639 5.459 -7.978 1.00 0.00 C ATOM 1125 O ILE A 74 -10.470 5.958 -8.737 1.00 0.00 O ATOM 1126 CB ILE A 74 -9.486 3.033 -8.547 1.00 0.00 C ATOM 1127 CG1 ILE A 74 -9.875 1.618 -8.116 1.00 0.00 C ATOM 1128 CG2 ILE A 74 -8.005 3.099 -8.885 1.00 0.00 C ATOM 1129 CD1 ILE A 74 -9.809 0.606 -9.236 1.00 0.00 C ATOM 0 HA ILE A 74 -9.187 3.881 -6.582 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.052 3.291 -9.442 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.215 1.298 -7.309 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -10.887 1.635 -7.712 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.778 2.376 -9.668 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.756 4.101 -9.234 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -7.418 2.868 -7.996 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.098 -0.375 -8.858 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -10.490 0.902 -10.034 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.792 0.560 -9.625 1.00 0.00 H new ATOM 1141 N VAL A 75 -8.556 6.105 -7.576 1.00 0.00 N ATOM 1142 CA VAL A 75 -8.232 7.429 -8.077 1.00 0.00 C ATOM 1143 C VAL A 75 -7.627 7.324 -9.470 1.00 0.00 C ATOM 1144 O VAL A 75 -6.716 6.528 -9.705 1.00 0.00 O ATOM 1145 CB VAL A 75 -7.259 8.177 -7.139 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -6.975 9.577 -7.661 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.818 8.237 -5.725 1.00 0.00 C ATOM 0 H VAL A 75 -7.886 5.732 -6.903 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.159 8.001 -8.120 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.319 7.625 -7.114 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.288 10.085 -6.985 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.527 9.512 -8.652 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.907 10.139 -7.721 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.118 8.768 -5.079 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.773 8.762 -5.733 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.963 7.225 -5.348 1.00 0.00 H new ATOM 1157 N ARG A 76 -8.145 8.130 -10.385 1.00 0.00 N ATOM 1158 CA ARG A 76 -7.742 8.096 -11.786 1.00 0.00 C ATOM 1159 C ARG A 76 -6.466 8.901 -12.033 1.00 0.00 C ATOM 1160 O ARG A 76 -6.263 9.430 -13.129 1.00 0.00 O ATOM 1161 CB ARG A 76 -8.870 8.669 -12.643 1.00 0.00 C ATOM 1162 CG ARG A 76 -9.228 10.098 -12.270 1.00 0.00 C ATOM 1163 CD ARG A 76 -10.353 10.650 -13.127 1.00 0.00 C ATOM 1164 NE ARG A 76 -10.682 12.022 -12.753 1.00 0.00 N ATOM 1165 CZ ARG A 76 -11.757 12.682 -13.166 1.00 0.00 C ATOM 1166 NH1 ARG A 76 -12.613 12.114 -14.008 1.00 0.00 N ATOM 1167 NH2 ARG A 76 -11.963 13.921 -12.739 1.00 0.00 N ATOM 0 H ARG A 76 -8.859 8.829 -10.178 1.00 0.00 H new ATOM 0 HA ARG A 76 -7.540 7.059 -12.053 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -8.576 8.635 -13.692 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -9.754 8.039 -12.540 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -9.521 10.135 -11.221 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -8.347 10.731 -12.378 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -10.063 10.617 -14.177 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.236 10.020 -13.021 1.00 0.00 H new ATOM 0 HE ARG A 76 -10.039 12.509 -12.129 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -12.446 11.165 -14.341 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -13.437 12.627 -14.321 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.299 14.357 -12.100 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -12.786 14.437 -13.050 1.00 0.00 H new ATOM 1181 N ASP A 77 -5.607 8.988 -11.034 1.00 0.00 N ATOM 1182 CA ASP A 77 -4.374 9.752 -11.166 1.00 0.00 C ATOM 1183 C ASP A 77 -3.298 8.897 -11.829 1.00 0.00 C ATOM 1184 O ASP A 77 -3.400 7.669 -11.859 1.00 0.00 O ATOM 1185 CB ASP A 77 -3.908 10.257 -9.796 1.00 0.00 C ATOM 1186 CG ASP A 77 -2.714 11.192 -9.884 1.00 0.00 C ATOM 1187 OD1 ASP A 77 -2.596 11.925 -10.894 1.00 0.00 O ATOM 1188 OD2 ASP A 77 -1.895 11.200 -8.944 1.00 0.00 O ATOM 0 H ASP A 77 -5.737 8.543 -10.126 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.561 10.620 -11.798 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -4.733 10.774 -9.306 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -3.649 9.404 -9.169 1.00 0.00 H new ATOM 1193 N ASP A 78 -2.281 9.544 -12.373 1.00 0.00 N ATOM 1194 CA ASP A 78 -1.221 8.840 -13.077 1.00 0.00 C ATOM 1195 C ASP A 78 -0.237 8.242 -12.085 1.00 0.00 C ATOM 1196 O ASP A 78 0.585 8.946 -11.515 1.00 0.00 O ATOM 1197 CB ASP A 78 -0.498 9.774 -14.054 1.00 0.00 C ATOM 1198 CG ASP A 78 -1.363 10.159 -15.240 1.00 0.00 C ATOM 1199 OD1 ASP A 78 -2.161 11.113 -15.120 1.00 0.00 O ATOM 1200 OD2 ASP A 78 -1.242 9.515 -16.306 1.00 0.00 O ATOM 0 H ASP A 78 -2.166 10.557 -12.341 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.671 8.032 -13.654 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.188 10.676 -13.527 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.409 9.287 -14.413 1.00 0.00 H new ATOM 1205 N ILE A 79 -0.335 6.933 -11.896 1.00 0.00 N ATOM 1206 CA ILE A 79 0.479 6.206 -10.922 1.00 0.00 C ATOM 1207 C ILE A 79 1.987 6.379 -11.170 1.00 0.00 C ATOM 1208 O ILE A 79 2.796 6.238 -10.255 1.00 0.00 O ATOM 1209 CB ILE A 79 0.110 4.712 -10.932 1.00 0.00 C ATOM 1210 CG1 ILE A 79 0.851 3.963 -9.838 1.00 0.00 C ATOM 1211 CG2 ILE A 79 0.394 4.087 -12.290 1.00 0.00 C ATOM 1212 CD1 ILE A 79 0.155 2.689 -9.453 1.00 0.00 C ATOM 0 H ILE A 79 -0.983 6.340 -12.414 1.00 0.00 H new ATOM 0 HA ILE A 79 0.262 6.631 -9.942 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.960 4.634 -10.738 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.862 3.735 -10.176 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.945 4.603 -8.961 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.124 3.031 -12.268 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -0.193 4.596 -13.055 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.455 4.185 -12.521 1.00 0.00 H new ATOM 0 HD11 ILE A 79 0.721 2.188 -8.668 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -0.847 2.917 -9.089 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.084 2.036 -10.323 1.00 0.00 H new ATOM 1224 N THR A 80 2.361 6.705 -12.401 1.00 0.00 N ATOM 1225 CA THR A 80 3.767 6.853 -12.753 1.00 0.00 C ATOM 1226 C THR A 80 4.251 8.289 -12.485 1.00 0.00 C ATOM 1227 O THR A 80 5.442 8.590 -12.588 1.00 0.00 O ATOM 1228 CB THR A 80 4.005 6.465 -14.230 1.00 0.00 C ATOM 1229 OG1 THR A 80 5.395 6.213 -14.468 1.00 0.00 O ATOM 1230 CG2 THR A 80 3.514 7.556 -15.170 1.00 0.00 C ATOM 0 H THR A 80 1.712 6.871 -13.170 1.00 0.00 H new ATOM 0 HA THR A 80 4.346 6.177 -12.124 1.00 0.00 H new ATOM 0 HB THR A 80 3.438 5.555 -14.427 1.00 0.00 H new ATOM 0 HG1 THR A 80 5.504 5.320 -14.857 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.694 7.255 -16.202 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.446 7.713 -15.019 1.00 0.00 H new ATOM 0 HG23 THR A 80 4.049 8.483 -14.963 1.00 0.00 H new ATOM 1238 N SER A 81 3.315 9.160 -12.125 1.00 0.00 N ATOM 1239 CA SER A 81 3.614 10.549 -11.798 1.00 0.00 C ATOM 1240 C SER A 81 2.526 11.078 -10.859 1.00 0.00 C ATOM 1241 O SER A 81 1.835 12.051 -11.170 1.00 0.00 O ATOM 1242 CB SER A 81 3.683 11.393 -13.082 1.00 0.00 C ATOM 1243 OG SER A 81 4.061 12.735 -12.810 1.00 0.00 O ATOM 0 H SER A 81 2.326 8.922 -12.052 1.00 0.00 H new ATOM 0 HA SER A 81 4.582 10.614 -11.302 1.00 0.00 H new ATOM 0 HB2 SER A 81 4.398 10.947 -13.773 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.712 11.382 -13.577 1.00 0.00 H new ATOM 0 HG SER A 81 3.412 13.140 -12.198 1.00 0.00 H new ATOM 1249 N PRO A 82 2.375 10.446 -9.684 1.00 0.00 N ATOM 1250 CA PRO A 82 1.206 10.639 -8.829 1.00 0.00 C ATOM 1251 C PRO A 82 1.252 11.922 -8.004 1.00 0.00 C ATOM 1252 O PRO A 82 2.323 12.468 -7.725 1.00 0.00 O ATOM 1253 CB PRO A 82 1.248 9.414 -7.924 1.00 0.00 C ATOM 1254 CG PRO A 82 2.698 9.103 -7.783 1.00 0.00 C ATOM 1255 CD PRO A 82 3.346 9.510 -9.081 1.00 0.00 C ATOM 0 HA PRO A 82 0.292 10.741 -9.414 1.00 0.00 H new ATOM 0 HB2 PRO A 82 0.790 9.620 -6.956 1.00 0.00 H new ATOM 0 HB3 PRO A 82 0.704 8.578 -8.363 1.00 0.00 H new ATOM 0 HG2 PRO A 82 3.133 9.647 -6.944 1.00 0.00 H new ATOM 0 HG3 PRO A 82 2.851 8.041 -7.588 1.00 0.00 H new ATOM 0 HD2 PRO A 82 4.311 9.988 -8.913 1.00 0.00 H new ATOM 0 HD3 PRO A 82 3.525 8.649 -9.726 1.00 0.00 H new ATOM 1263 N ARG A 83 0.072 12.394 -7.633 1.00 0.00 N ATOM 1264 CA ARG A 83 -0.067 13.582 -6.806 1.00 0.00 C ATOM 1265 C ARG A 83 0.258 13.276 -5.356 1.00 0.00 C ATOM 1266 O ARG A 83 -0.249 12.308 -4.785 1.00 0.00 O ATOM 1267 CB ARG A 83 -1.494 14.109 -6.867 1.00 0.00 C ATOM 1268 CG ARG A 83 -1.957 14.539 -8.240 1.00 0.00 C ATOM 1269 CD ARG A 83 -3.401 14.996 -8.186 1.00 0.00 C ATOM 1270 NE ARG A 83 -3.931 15.361 -9.495 1.00 0.00 N ATOM 1271 CZ ARG A 83 -5.043 16.078 -9.659 1.00 0.00 C ATOM 1272 NH1 ARG A 83 -5.667 16.594 -8.605 1.00 0.00 N ATOM 1273 NH2 ARG A 83 -5.523 16.302 -10.873 1.00 0.00 N ATOM 0 H ARG A 83 -0.815 11.965 -7.896 1.00 0.00 H new ATOM 0 HA ARG A 83 0.629 14.328 -7.191 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.167 13.335 -6.499 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -1.582 14.957 -6.188 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.326 15.348 -8.608 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.856 13.711 -8.942 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.013 14.200 -7.761 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.481 15.852 -7.516 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.426 15.053 -10.326 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.295 16.442 -7.667 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -6.518 17.142 -8.734 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.041 15.925 -11.689 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.374 16.851 -10.992 1.00 0.00 H new ATOM 1287 N MET A 84 1.065 14.126 -4.748 1.00 0.00 N ATOM 1288 CA MET A 84 1.393 13.974 -3.338 1.00 0.00 C ATOM 1289 C MET A 84 0.178 14.306 -2.478 1.00 0.00 C ATOM 1290 O MET A 84 0.064 13.848 -1.341 1.00 0.00 O ATOM 1291 CB MET A 84 2.574 14.868 -2.955 1.00 0.00 C ATOM 1292 CG MET A 84 3.852 14.553 -3.716 1.00 0.00 C ATOM 1293 SD MET A 84 4.334 12.823 -3.580 1.00 0.00 S ATOM 1294 CE MET A 84 4.467 12.646 -1.802 1.00 0.00 C ATOM 0 H MET A 84 1.505 14.926 -5.204 1.00 0.00 H new ATOM 0 HA MET A 84 1.679 12.937 -3.161 1.00 0.00 H new ATOM 0 HB2 MET A 84 2.303 15.909 -3.133 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.764 14.766 -1.886 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.716 14.806 -4.767 1.00 0.00 H new ATOM 0 HG3 MET A 84 4.659 15.181 -3.339 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.007 11.729 -1.567 1.00 0.00 H new ATOM 0 HE2 MET A 84 5.006 13.499 -1.391 1.00 0.00 H new ATOM 0 HE3 MET A 84 3.469 12.602 -1.365 1.00 0.00 H new ATOM 1304 N GLU A 85 -0.741 15.082 -3.051 1.00 0.00 N ATOM 1305 CA GLU A 85 -1.968 15.492 -2.365 1.00 0.00 C ATOM 1306 C GLU A 85 -2.889 14.300 -2.084 1.00 0.00 C ATOM 1307 O GLU A 85 -3.836 14.408 -1.306 1.00 0.00 O ATOM 1308 CB GLU A 85 -2.707 16.538 -3.212 1.00 0.00 C ATOM 1309 CG GLU A 85 -2.964 16.083 -4.641 1.00 0.00 C ATOM 1310 CD GLU A 85 -3.658 17.129 -5.494 1.00 0.00 C ATOM 1311 OE1 GLU A 85 -3.038 18.171 -5.790 1.00 0.00 O ATOM 1312 OE2 GLU A 85 -4.814 16.898 -5.901 1.00 0.00 O ATOM 0 H GLU A 85 -0.658 15.444 -4.001 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.687 15.924 -1.405 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.659 16.774 -2.736 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -2.123 17.458 -3.231 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.014 15.818 -5.106 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -3.573 15.179 -4.622 1.00 0.00 H new ATOM 1319 N ILE A 86 -2.616 13.170 -2.721 1.00 0.00 N ATOM 1320 CA ILE A 86 -3.434 11.978 -2.540 1.00 0.00 C ATOM 1321 C ILE A 86 -2.858 11.085 -1.443 1.00 0.00 C ATOM 1322 O ILE A 86 -3.594 10.525 -0.626 1.00 0.00 O ATOM 1323 CB ILE A 86 -3.543 11.173 -3.854 1.00 0.00 C ATOM 1324 CG1 ILE A 86 -4.105 12.058 -4.969 1.00 0.00 C ATOM 1325 CG2 ILE A 86 -4.417 9.941 -3.656 1.00 0.00 C ATOM 1326 CD1 ILE A 86 -4.153 11.375 -6.316 1.00 0.00 C ATOM 0 H ILE A 86 -1.835 13.053 -3.367 1.00 0.00 H new ATOM 0 HA ILE A 86 -4.430 12.308 -2.246 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.546 10.840 -4.143 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -5.111 12.377 -4.696 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.496 12.958 -5.049 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.482 9.387 -4.592 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.980 9.304 -2.887 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.416 10.249 -3.347 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -4.562 12.061 -7.058 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.146 11.080 -6.611 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -4.786 10.490 -6.253 1.00 0.00 H new ATOM 1338 N TYR A 87 -1.538 10.973 -1.421 1.00 0.00 N ATOM 1339 CA TYR A 87 -0.860 10.101 -0.471 1.00 0.00 C ATOM 1340 C TYR A 87 -0.745 10.757 0.898 1.00 0.00 C ATOM 1341 O TYR A 87 -0.702 10.074 1.919 1.00 0.00 O ATOM 1342 CB TYR A 87 0.533 9.731 -0.985 1.00 0.00 C ATOM 1343 CG TYR A 87 0.517 8.954 -2.281 1.00 0.00 C ATOM 1344 CD1 TYR A 87 0.380 7.573 -2.285 1.00 0.00 C ATOM 1345 CD2 TYR A 87 0.634 9.603 -3.501 1.00 0.00 C ATOM 1346 CE1 TYR A 87 0.359 6.861 -3.467 1.00 0.00 C ATOM 1347 CE2 TYR A 87 0.610 8.899 -4.686 1.00 0.00 C ATOM 1348 CZ TYR A 87 0.474 7.527 -4.665 1.00 0.00 C ATOM 1349 OH TYR A 87 0.448 6.820 -5.844 1.00 0.00 O ATOM 0 H TYR A 87 -0.913 11.476 -2.051 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.458 9.196 -0.369 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.112 10.643 -1.126 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.046 9.142 -0.225 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.288 7.046 -1.347 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.746 10.677 -3.523 1.00 0.00 H new ATOM 0 HE1 TYR A 87 0.253 5.786 -3.451 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.697 9.420 -5.628 1.00 0.00 H new ATOM 0 HH TYR A 87 0.067 7.380 -6.553 1.00 0.00 H new ATOM 1359 N ARG A 88 -0.687 12.082 0.919 1.00 0.00 N ATOM 1360 CA ARG A 88 -0.585 12.811 2.172 1.00 0.00 C ATOM 1361 C ARG A 88 -1.797 12.560 3.055 1.00 0.00 C ATOM 1362 O ARG A 88 -2.933 12.826 2.664 1.00 0.00 O ATOM 1363 CB ARG A 88 -0.405 14.305 1.919 1.00 0.00 C ATOM 1364 CG ARG A 88 1.032 14.684 1.612 1.00 0.00 C ATOM 1365 CD ARG A 88 1.172 16.163 1.315 1.00 0.00 C ATOM 1366 NE ARG A 88 2.542 16.627 1.517 1.00 0.00 N ATOM 1367 CZ ARG A 88 2.901 17.453 2.502 1.00 0.00 C ATOM 1368 NH1 ARG A 88 1.983 17.927 3.336 1.00 0.00 N ATOM 1369 NH2 ARG A 88 4.172 17.798 2.660 1.00 0.00 N ATOM 0 H ARG A 88 -0.709 12.670 0.086 1.00 0.00 H new ATOM 0 HA ARG A 88 0.296 12.444 2.698 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -1.041 14.606 1.086 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.742 14.860 2.795 1.00 0.00 H new ATOM 0 HG2 ARG A 88 1.666 14.422 2.459 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.386 14.107 0.758 1.00 0.00 H new ATOM 0 HD2 ARG A 88 0.870 16.358 0.286 1.00 0.00 H new ATOM 0 HD3 ARG A 88 0.498 16.729 1.958 1.00 0.00 H new ATOM 0 HE ARG A 88 3.262 16.303 0.872 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.005 17.660 3.223 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.256 18.558 4.089 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.882 17.432 2.026 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.439 18.430 3.415 1.00 0.00 H new ATOM 1383 N GLY A 89 -1.541 12.032 4.241 1.00 0.00 N ATOM 1384 CA GLY A 89 -2.611 11.703 5.157 1.00 0.00 C ATOM 1385 C GLY A 89 -2.791 10.206 5.300 1.00 0.00 C ATOM 1386 O GLY A 89 -3.634 9.745 6.070 1.00 0.00 O ATOM 0 H GLY A 89 -0.604 11.824 4.587 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.400 12.138 6.134 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.541 12.149 4.804 1.00 0.00 H new ATOM 1390 N ALA A 90 -2.002 9.447 4.550 1.00 0.00 N ATOM 1391 CA ALA A 90 -2.046 7.996 4.621 1.00 0.00 C ATOM 1392 C ALA A 90 -1.064 7.482 5.659 1.00 0.00 C ATOM 1393 O ALA A 90 0.027 8.029 5.818 1.00 0.00 O ATOM 1394 CB ALA A 90 -1.745 7.384 3.261 1.00 0.00 C ATOM 0 H ALA A 90 -1.323 9.816 3.884 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.052 7.700 4.919 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.783 6.297 3.335 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.485 7.724 2.537 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.751 7.691 2.936 1.00 0.00 H new ATOM 1400 N ALA A 91 -1.456 6.431 6.362 1.00 0.00 N ATOM 1401 CA ALA A 91 -0.617 5.844 7.396 1.00 0.00 C ATOM 1402 C ALA A 91 0.303 4.789 6.804 1.00 0.00 C ATOM 1403 O ALA A 91 1.395 4.538 7.316 1.00 0.00 O ATOM 1404 CB ALA A 91 -1.475 5.226 8.488 1.00 0.00 C ATOM 0 H ALA A 91 -2.354 5.965 6.235 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.008 6.637 7.830 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.832 4.791 9.254 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -2.104 5.996 8.936 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -2.105 4.447 8.059 1.00 0.00 H new ATOM 1410 N LEU A 92 -0.142 4.173 5.719 1.00 0.00 N ATOM 1411 CA LEU A 92 0.613 3.103 5.097 1.00 0.00 C ATOM 1412 C LEU A 92 0.354 3.085 3.597 1.00 0.00 C ATOM 1413 O LEU A 92 -0.756 3.375 3.147 1.00 0.00 O ATOM 1414 CB LEU A 92 0.234 1.761 5.738 1.00 0.00 C ATOM 1415 CG LEU A 92 1.202 0.607 5.483 1.00 0.00 C ATOM 1416 CD1 LEU A 92 1.131 -0.388 6.630 1.00 0.00 C ATOM 1417 CD2 LEU A 92 0.884 -0.094 4.170 1.00 0.00 C ATOM 0 H LEU A 92 -1.021 4.398 5.254 1.00 0.00 H new ATOM 0 HA LEU A 92 1.678 3.271 5.255 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.146 1.906 6.815 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.752 1.471 5.374 1.00 0.00 H new ATOM 0 HG LEU A 92 2.211 1.015 5.416 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.823 -1.209 6.443 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.402 0.110 7.561 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.117 -0.780 6.710 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.588 -0.911 4.014 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.130 -0.491 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.966 0.618 3.348 1.00 0.00 H new ATOM 1429 N ILE A 93 1.393 2.779 2.831 1.00 0.00 N ATOM 1430 CA ILE A 93 1.290 2.688 1.383 1.00 0.00 C ATOM 1431 C ILE A 93 1.972 1.414 0.906 1.00 0.00 C ATOM 1432 O ILE A 93 3.167 1.225 1.132 1.00 0.00 O ATOM 1433 CB ILE A 93 1.954 3.902 0.688 1.00 0.00 C ATOM 1434 CG1 ILE A 93 1.333 5.216 1.174 1.00 0.00 C ATOM 1435 CG2 ILE A 93 1.838 3.784 -0.825 1.00 0.00 C ATOM 1436 CD1 ILE A 93 1.999 6.451 0.604 1.00 0.00 C ATOM 0 H ILE A 93 2.326 2.588 3.195 1.00 0.00 H new ATOM 0 HA ILE A 93 0.232 2.678 1.123 1.00 0.00 H new ATOM 0 HB ILE A 93 3.011 3.907 0.953 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.276 5.228 0.908 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.388 5.253 2.262 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.311 4.647 -1.295 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.334 2.872 -1.158 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.786 3.748 -1.108 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.506 7.342 0.992 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.050 6.463 0.892 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.921 6.438 -0.483 1.00 0.00 H new ATOM 1448 N TYR A 94 1.227 0.531 0.266 1.00 0.00 N ATOM 1449 CA TYR A 94 1.822 -0.686 -0.255 1.00 0.00 C ATOM 1450 C TYR A 94 1.550 -0.826 -1.742 1.00 0.00 C ATOM 1451 O TYR A 94 0.629 -0.213 -2.279 1.00 0.00 O ATOM 1452 CB TYR A 94 1.347 -1.923 0.515 1.00 0.00 C ATOM 1453 CG TYR A 94 -0.122 -2.249 0.399 1.00 0.00 C ATOM 1454 CD1 TYR A 94 -1.054 -1.640 1.225 1.00 0.00 C ATOM 1455 CD2 TYR A 94 -0.571 -3.201 -0.510 1.00 0.00 C ATOM 1456 CE1 TYR A 94 -2.392 -1.967 1.147 1.00 0.00 C ATOM 1457 CE2 TYR A 94 -1.904 -3.536 -0.587 1.00 0.00 C ATOM 1458 CZ TYR A 94 -2.810 -2.919 0.241 1.00 0.00 C ATOM 1459 OH TYR A 94 -4.137 -3.263 0.172 1.00 0.00 O ATOM 0 H TYR A 94 0.226 0.630 0.096 1.00 0.00 H new ATOM 0 HA TYR A 94 2.900 -0.613 -0.113 1.00 0.00 H new ATOM 0 HB2 TYR A 94 1.919 -2.784 0.169 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.586 -1.785 1.569 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -0.728 -0.899 1.940 1.00 0.00 H new ATOM 0 HD2 TYR A 94 0.137 -3.685 -1.166 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.108 -1.480 1.792 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -2.236 -4.281 -1.295 1.00 0.00 H new ATOM 0 HH TYR A 94 -4.686 -2.508 0.470 1.00 0.00 H new ATOM 1469 N SER A 95 2.374 -1.617 -2.405 1.00 0.00 N ATOM 1470 CA SER A 95 2.272 -1.789 -3.842 1.00 0.00 C ATOM 1471 C SER A 95 2.177 -3.264 -4.202 1.00 0.00 C ATOM 1472 O SER A 95 3.018 -4.074 -3.798 1.00 0.00 O ATOM 1473 CB SER A 95 3.482 -1.153 -4.523 1.00 0.00 C ATOM 1474 OG SER A 95 3.673 0.171 -4.060 1.00 0.00 O ATOM 0 H SER A 95 3.124 -2.152 -1.968 1.00 0.00 H new ATOM 0 HA SER A 95 1.365 -1.296 -4.191 1.00 0.00 H new ATOM 0 HB2 SER A 95 4.374 -1.747 -4.322 1.00 0.00 H new ATOM 0 HB3 SER A 95 3.338 -1.149 -5.603 1.00 0.00 H new ATOM 0 HG SER A 95 4.381 0.182 -3.383 1.00 0.00 H new ATOM 1480 N ILE A 96 1.147 -3.612 -4.953 1.00 0.00 N ATOM 1481 CA ILE A 96 0.938 -4.989 -5.360 1.00 0.00 C ATOM 1482 C ILE A 96 1.547 -5.226 -6.734 1.00 0.00 C ATOM 1483 O ILE A 96 0.941 -4.902 -7.755 1.00 0.00 O ATOM 1484 CB ILE A 96 -0.560 -5.350 -5.384 1.00 0.00 C ATOM 1485 CG1 ILE A 96 -1.208 -4.999 -4.040 1.00 0.00 C ATOM 1486 CG2 ILE A 96 -0.745 -6.830 -5.699 1.00 0.00 C ATOM 1487 CD1 ILE A 96 -2.709 -5.193 -4.010 1.00 0.00 C ATOM 0 H ILE A 96 0.442 -2.958 -5.293 1.00 0.00 H new ATOM 0 HA ILE A 96 1.429 -5.630 -4.628 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.049 -4.770 -6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -0.757 -5.612 -3.260 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -0.981 -3.960 -3.799 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -1.808 -7.069 -5.712 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.311 -7.051 -6.674 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.248 -7.429 -4.936 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.091 -4.923 -3.025 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -3.173 -4.559 -4.765 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.945 -6.237 -4.217 1.00 0.00 H new ATOM 1499 N ARG A 97 2.764 -5.765 -6.736 1.00 0.00 N ATOM 1500 CA ARG A 97 3.507 -6.042 -7.965 1.00 0.00 C ATOM 1501 C ARG A 97 3.740 -4.755 -8.764 1.00 0.00 C ATOM 1502 O ARG A 97 3.094 -4.519 -9.788 1.00 0.00 O ATOM 1503 CB ARG A 97 2.765 -7.073 -8.821 1.00 0.00 C ATOM 1504 CG ARG A 97 3.616 -7.699 -9.914 1.00 0.00 C ATOM 1505 CD ARG A 97 2.785 -8.588 -10.827 1.00 0.00 C ATOM 1506 NE ARG A 97 1.864 -9.443 -10.077 1.00 0.00 N ATOM 1507 CZ ARG A 97 1.708 -10.748 -10.294 1.00 0.00 C ATOM 1508 NH1 ARG A 97 2.465 -11.376 -11.184 1.00 0.00 N ATOM 1509 NH2 ARG A 97 0.794 -11.423 -9.612 1.00 0.00 N ATOM 0 H ARG A 97 3.264 -6.023 -5.885 1.00 0.00 H new ATOM 0 HA ARG A 97 4.478 -6.453 -7.688 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.387 -7.863 -8.173 1.00 0.00 H new ATOM 0 HB3 ARG A 97 1.899 -6.594 -9.279 1.00 0.00 H new ATOM 0 HG2 ARG A 97 4.090 -6.913 -10.502 1.00 0.00 H new ATOM 0 HG3 ARG A 97 4.416 -8.286 -9.463 1.00 0.00 H new ATOM 0 HD2 ARG A 97 2.218 -7.966 -11.520 1.00 0.00 H new ATOM 0 HD3 ARG A 97 3.448 -9.210 -11.428 1.00 0.00 H new ATOM 0 HE ARG A 97 1.305 -9.012 -9.340 1.00 0.00 H new ATOM 0 HH11 ARG A 97 3.172 -10.859 -11.707 1.00 0.00 H new ATOM 0 HH12 ARG A 97 2.340 -12.375 -11.345 1.00 0.00 H new ATOM 0 HH21 ARG A 97 0.213 -10.943 -8.924 1.00 0.00 H new ATOM 0 HH22 ARG A 97 0.671 -12.422 -9.775 1.00 0.00 H new ATOM 1523 N PRO A 98 4.653 -3.890 -8.292 1.00 0.00 N ATOM 1524 CA PRO A 98 4.952 -2.626 -8.955 1.00 0.00 C ATOM 1525 C PRO A 98 5.998 -2.771 -10.063 1.00 0.00 C ATOM 1526 O PRO A 98 6.987 -3.491 -9.906 1.00 0.00 O ATOM 1527 CB PRO A 98 5.492 -1.773 -7.809 1.00 0.00 C ATOM 1528 CG PRO A 98 6.161 -2.744 -6.894 1.00 0.00 C ATOM 1529 CD PRO A 98 5.454 -4.067 -7.064 1.00 0.00 C ATOM 0 HA PRO A 98 4.082 -2.205 -9.458 1.00 0.00 H new ATOM 0 HB2 PRO A 98 6.194 -1.022 -8.171 1.00 0.00 H new ATOM 0 HB3 PRO A 98 4.689 -1.239 -7.301 1.00 0.00 H new ATOM 0 HG2 PRO A 98 7.219 -2.838 -7.138 1.00 0.00 H new ATOM 0 HG3 PRO A 98 6.101 -2.404 -5.860 1.00 0.00 H new ATOM 0 HD2 PRO A 98 6.163 -4.888 -7.165 1.00 0.00 H new ATOM 0 HD3 PRO A 98 4.823 -4.295 -6.205 1.00 0.00 H new ATOM 1537 N PRO A 99 5.776 -2.106 -11.205 1.00 0.00 N ATOM 1538 CA PRO A 99 6.743 -2.080 -12.307 1.00 0.00 C ATOM 1539 C PRO A 99 8.014 -1.321 -11.940 1.00 0.00 C ATOM 1540 O PRO A 99 8.029 -0.525 -10.997 1.00 0.00 O ATOM 1541 CB PRO A 99 6.003 -1.345 -13.428 1.00 0.00 C ATOM 1542 CG PRO A 99 4.940 -0.557 -12.742 1.00 0.00 C ATOM 1543 CD PRO A 99 4.553 -1.347 -11.524 1.00 0.00 C ATOM 0 HA PRO A 99 7.067 -3.085 -12.579 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.678 -0.695 -13.985 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.574 -2.047 -14.143 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.306 0.432 -12.465 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.082 -0.407 -13.398 1.00 0.00 H new ATOM 0 HD2 PRO A 99 4.258 -0.697 -10.701 1.00 0.00 H new ATOM 0 HD3 PRO A 99 3.711 -2.009 -11.725 1.00 0.00 H new ATOM 1551 N ALA A 100 9.064 -1.534 -12.717 1.00 0.00 N ATOM 1552 CA ALA A 100 10.353 -0.910 -12.459 1.00 0.00 C ATOM 1553 C ALA A 100 10.421 0.482 -13.084 1.00 0.00 C ATOM 1554 O ALA A 100 11.467 0.902 -13.581 1.00 0.00 O ATOM 1555 CB ALA A 100 11.478 -1.787 -12.988 1.00 0.00 C ATOM 0 H ALA A 100 9.048 -2.139 -13.538 1.00 0.00 H new ATOM 0 HA ALA A 100 10.471 -0.802 -11.381 1.00 0.00 H new ATOM 0 HB1 ALA A 100 12.437 -1.309 -12.789 1.00 0.00 H new ATOM 0 HB2 ALA A 100 11.447 -2.757 -12.492 1.00 0.00 H new ATOM 0 HB3 ALA A 100 11.358 -1.924 -14.063 1.00 0.00 H new ATOM 1561 N GLU A 101 9.298 1.187 -13.062 1.00 0.00 N ATOM 1562 CA GLU A 101 9.249 2.564 -13.536 1.00 0.00 C ATOM 1563 C GLU A 101 8.865 3.508 -12.397 1.00 0.00 C ATOM 1564 O GLU A 101 8.956 4.731 -12.524 1.00 0.00 O ATOM 1565 CB GLU A 101 8.248 2.696 -14.684 1.00 0.00 C ATOM 1566 CG GLU A 101 6.822 2.345 -14.295 1.00 0.00 C ATOM 1567 CD GLU A 101 5.850 2.553 -15.434 1.00 0.00 C ATOM 1568 OE1 GLU A 101 5.654 1.612 -16.230 1.00 0.00 O ATOM 1569 OE2 GLU A 101 5.287 3.662 -15.545 1.00 0.00 O ATOM 0 H GLU A 101 8.407 0.827 -12.720 1.00 0.00 H new ATOM 0 HA GLU A 101 10.240 2.838 -13.899 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.271 3.719 -15.059 1.00 0.00 H new ATOM 0 HB3 GLU A 101 8.561 2.049 -15.503 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.781 1.305 -13.971 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.519 2.956 -13.445 1.00 0.00 H new ATOM 1576 N ILE A 102 8.432 2.929 -11.284 1.00 0.00 N ATOM 1577 CA ILE A 102 7.995 3.708 -10.132 1.00 0.00 C ATOM 1578 C ILE A 102 8.676 3.227 -8.860 1.00 0.00 C ATOM 1579 O ILE A 102 8.341 3.659 -7.766 1.00 0.00 O ATOM 1580 CB ILE A 102 6.473 3.624 -9.933 1.00 0.00 C ATOM 1581 CG1 ILE A 102 6.011 2.163 -9.921 1.00 0.00 C ATOM 1582 CG2 ILE A 102 5.745 4.415 -11.012 1.00 0.00 C ATOM 1583 CD1 ILE A 102 4.530 1.999 -9.663 1.00 0.00 C ATOM 0 H ILE A 102 8.374 1.919 -11.155 1.00 0.00 H new ATOM 0 HA ILE A 102 8.272 4.743 -10.333 1.00 0.00 H new ATOM 0 HB ILE A 102 6.228 4.066 -8.967 1.00 0.00 H new ATOM 0 HG12 ILE A 102 6.257 1.705 -10.879 1.00 0.00 H new ATOM 0 HG13 ILE A 102 6.567 1.621 -9.156 1.00 0.00 H new ATOM 0 HG21 ILE A 102 4.669 4.343 -10.853 1.00 0.00 H new ATOM 0 HG22 ILE A 102 6.049 5.461 -10.964 1.00 0.00 H new ATOM 0 HG23 ILE A 102 5.995 4.009 -11.992 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.275 0.939 -9.669 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.280 2.427 -8.692 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.966 2.512 -10.442 1.00 0.00 H new ATOM 1595 N HIS A 103 9.648 2.356 -9.032 1.00 0.00 N ATOM 1596 CA HIS A 103 10.341 1.706 -7.921 1.00 0.00 C ATOM 1597 C HIS A 103 10.934 2.717 -6.934 1.00 0.00 C ATOM 1598 O HIS A 103 10.629 2.682 -5.742 1.00 0.00 O ATOM 1599 CB HIS A 103 11.431 0.769 -8.466 1.00 0.00 C ATOM 1600 CG HIS A 103 12.359 1.406 -9.466 1.00 0.00 C ATOM 1601 ND1 HIS A 103 11.884 1.988 -10.617 1.00 0.00 N ATOM 1602 CD2 HIS A 103 13.708 1.526 -9.440 1.00 0.00 C ATOM 1603 CE1 HIS A 103 12.943 2.444 -11.260 1.00 0.00 C ATOM 1604 NE2 HIS A 103 14.071 2.190 -10.586 1.00 0.00 N ATOM 0 H HIS A 103 9.988 2.072 -9.951 1.00 0.00 H new ATOM 0 HA HIS A 103 9.607 1.122 -7.366 1.00 0.00 H new ATOM 0 HB2 HIS A 103 12.021 0.393 -7.630 1.00 0.00 H new ATOM 0 HB3 HIS A 103 10.952 -0.093 -8.931 1.00 0.00 H new ATOM 0 HD2 HIS A 103 14.371 1.168 -8.666 1.00 0.00 H new ATOM 0 HE1 HIS A 103 12.904 2.957 -12.210 1.00 0.00 H new ATOM 0 HE2 HIS A 103 15.018 2.441 -10.869 1.00 0.00 H new ATOM 1612 N SER A 104 11.772 3.616 -7.425 1.00 0.00 N ATOM 1613 CA SER A 104 12.376 4.633 -6.574 1.00 0.00 C ATOM 1614 C SER A 104 11.356 5.725 -6.261 1.00 0.00 C ATOM 1615 O SER A 104 11.423 6.380 -5.217 1.00 0.00 O ATOM 1616 CB SER A 104 13.613 5.225 -7.262 1.00 0.00 C ATOM 1617 OG SER A 104 14.290 6.145 -6.419 1.00 0.00 O ATOM 0 H SER A 104 12.050 3.664 -8.405 1.00 0.00 H new ATOM 0 HA SER A 104 12.689 4.176 -5.636 1.00 0.00 H new ATOM 0 HB2 SER A 104 14.293 4.421 -7.544 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.313 5.727 -8.182 1.00 0.00 H new ATOM 0 HG SER A 104 15.073 6.502 -6.887 1.00 0.00 H new ATOM 1623 N SER A 105 10.392 5.884 -7.159 1.00 0.00 N ATOM 1624 CA SER A 105 9.367 6.905 -7.018 1.00 0.00 C ATOM 1625 C SER A 105 8.483 6.601 -5.813 1.00 0.00 C ATOM 1626 O SER A 105 8.161 7.483 -5.027 1.00 0.00 O ATOM 1627 CB SER A 105 8.527 6.966 -8.294 1.00 0.00 C ATOM 1628 OG SER A 105 9.364 6.979 -9.440 1.00 0.00 O ATOM 0 H SER A 105 10.300 5.312 -7.999 1.00 0.00 H new ATOM 0 HA SER A 105 9.843 7.873 -6.859 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.856 6.108 -8.336 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.902 7.859 -8.283 1.00 0.00 H new ATOM 0 HG SER A 105 8.811 7.016 -10.248 1.00 0.00 H new ATOM 1634 N LEU A 106 8.125 5.336 -5.665 1.00 0.00 N ATOM 1635 CA LEU A 106 7.299 4.892 -4.556 1.00 0.00 C ATOM 1636 C LEU A 106 7.982 5.151 -3.221 1.00 0.00 C ATOM 1637 O LEU A 106 7.348 5.596 -2.262 1.00 0.00 O ATOM 1638 CB LEU A 106 6.992 3.404 -4.710 1.00 0.00 C ATOM 1639 CG LEU A 106 6.111 3.057 -5.908 1.00 0.00 C ATOM 1640 CD1 LEU A 106 5.874 1.560 -5.975 1.00 0.00 C ATOM 1641 CD2 LEU A 106 4.794 3.814 -5.838 1.00 0.00 C ATOM 0 H LEU A 106 8.398 4.592 -6.307 1.00 0.00 H new ATOM 0 HA LEU A 106 6.369 5.460 -4.571 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.932 2.860 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.503 3.052 -3.802 1.00 0.00 H new ATOM 0 HG LEU A 106 6.627 3.360 -6.819 1.00 0.00 H new ATOM 0 HD11 LEU A 106 5.244 1.329 -6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.829 1.045 -6.076 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.378 1.229 -5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.179 3.554 -6.700 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.268 3.545 -4.922 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.990 4.886 -5.842 1.00 0.00 H new ATOM 1653 N MET A 107 9.280 4.890 -3.169 1.00 0.00 N ATOM 1654 CA MET A 107 10.042 5.074 -1.944 1.00 0.00 C ATOM 1655 C MET A 107 10.098 6.545 -1.544 1.00 0.00 C ATOM 1656 O MET A 107 9.938 6.880 -0.370 1.00 0.00 O ATOM 1657 CB MET A 107 11.460 4.518 -2.089 1.00 0.00 C ATOM 1658 CG MET A 107 11.505 3.017 -2.322 1.00 0.00 C ATOM 1659 SD MET A 107 13.100 2.299 -1.892 1.00 0.00 S ATOM 1660 CE MET A 107 13.112 2.545 -0.116 1.00 0.00 C ATOM 0 H MET A 107 9.827 4.550 -3.960 1.00 0.00 H new ATOM 0 HA MET A 107 9.529 4.521 -1.157 1.00 0.00 H new ATOM 0 HB2 MET A 107 11.955 5.021 -2.920 1.00 0.00 H new ATOM 0 HB3 MET A 107 12.028 4.755 -1.189 1.00 0.00 H new ATOM 0 HG2 MET A 107 10.724 2.538 -1.732 1.00 0.00 H new ATOM 0 HG3 MET A 107 11.287 2.809 -3.369 1.00 0.00 H new ATOM 0 HE1 MET A 107 13.831 1.865 0.341 1.00 0.00 H new ATOM 0 HE2 MET A 107 13.394 3.574 0.107 1.00 0.00 H new ATOM 0 HE3 MET A 107 12.118 2.346 0.286 1.00 0.00 H new ATOM 1670 N ARG A 108 10.301 7.427 -2.521 1.00 0.00 N ATOM 1671 CA ARG A 108 10.394 8.856 -2.236 1.00 0.00 C ATOM 1672 C ARG A 108 9.027 9.449 -1.900 1.00 0.00 C ATOM 1673 O ARG A 108 8.941 10.487 -1.247 1.00 0.00 O ATOM 1674 CB ARG A 108 11.037 9.624 -3.394 1.00 0.00 C ATOM 1675 CG ARG A 108 10.291 9.519 -4.709 1.00 0.00 C ATOM 1676 CD ARG A 108 10.900 10.434 -5.751 1.00 0.00 C ATOM 1677 NE ARG A 108 10.702 11.841 -5.413 1.00 0.00 N ATOM 1678 CZ ARG A 108 11.322 12.852 -6.019 1.00 0.00 C ATOM 1679 NH1 ARG A 108 12.182 12.621 -7.002 1.00 0.00 N ATOM 1680 NH2 ARG A 108 11.082 14.095 -5.631 1.00 0.00 N ATOM 0 H ARG A 108 10.403 7.181 -3.506 1.00 0.00 H new ATOM 0 HA ARG A 108 11.037 8.962 -1.362 1.00 0.00 H new ATOM 0 HB2 ARG A 108 11.114 10.676 -3.118 1.00 0.00 H new ATOM 0 HB3 ARG A 108 12.053 9.257 -3.537 1.00 0.00 H new ATOM 0 HG2 ARG A 108 10.316 8.489 -5.065 1.00 0.00 H new ATOM 0 HG3 ARG A 108 9.243 9.779 -4.559 1.00 0.00 H new ATOM 0 HD2 ARG A 108 11.967 10.227 -5.839 1.00 0.00 H new ATOM 0 HD3 ARG A 108 10.454 10.227 -6.724 1.00 0.00 H new ATOM 0 HE ARG A 108 10.046 12.064 -4.664 1.00 0.00 H new ATOM 0 HH11 ARG A 108 12.372 11.664 -7.299 1.00 0.00 H new ATOM 0 HH12 ARG A 108 12.653 13.401 -7.461 1.00 0.00 H new ATOM 0 HH21 ARG A 108 10.425 14.274 -4.872 1.00 0.00 H new ATOM 0 HH22 ARG A 108 11.554 14.873 -6.092 1.00 0.00 H new ATOM 1694 N VAL A 109 7.958 8.797 -2.348 1.00 0.00 N ATOM 1695 CA VAL A 109 6.607 9.230 -1.999 1.00 0.00 C ATOM 1696 C VAL A 109 6.278 8.827 -0.568 1.00 0.00 C ATOM 1697 O VAL A 109 5.768 9.635 0.211 1.00 0.00 O ATOM 1698 CB VAL A 109 5.540 8.648 -2.953 1.00 0.00 C ATOM 1699 CG1 VAL A 109 4.139 8.995 -2.474 1.00 0.00 C ATOM 1700 CG2 VAL A 109 5.748 9.162 -4.371 1.00 0.00 C ATOM 0 H VAL A 109 7.999 7.974 -2.949 1.00 0.00 H new ATOM 0 HA VAL A 109 6.586 10.316 -2.096 1.00 0.00 H new ATOM 0 HB VAL A 109 5.648 7.563 -2.954 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.405 8.575 -3.161 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.982 8.581 -1.478 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.024 10.078 -2.439 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.986 8.740 -5.026 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.672 10.249 -4.379 1.00 0.00 H new ATOM 0 HG23 VAL A 109 6.735 8.865 -4.724 1.00 0.00 H new ATOM 1710 N ALA A 110 6.581 7.578 -0.226 1.00 0.00 N ATOM 1711 CA ALA A 110 6.386 7.095 1.134 1.00 0.00 C ATOM 1712 C ALA A 110 7.158 7.963 2.109 1.00 0.00 C ATOM 1713 O ALA A 110 6.606 8.447 3.095 1.00 0.00 O ATOM 1714 CB ALA A 110 6.835 5.648 1.264 1.00 0.00 C ATOM 0 H ALA A 110 6.961 6.885 -0.871 1.00 0.00 H new ATOM 0 HA ALA A 110 5.323 7.149 1.367 1.00 0.00 H new ATOM 0 HB1 ALA A 110 6.680 5.309 2.288 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.255 5.024 0.584 1.00 0.00 H new ATOM 0 HB3 ALA A 110 7.893 5.571 1.013 1.00 0.00 H new ATOM 1720 N ASP A 111 8.434 8.171 1.802 1.00 0.00 N ATOM 1721 CA ASP A 111 9.329 8.957 2.647 1.00 0.00 C ATOM 1722 C ASP A 111 8.811 10.384 2.816 1.00 0.00 C ATOM 1723 O ASP A 111 8.960 10.990 3.875 1.00 0.00 O ATOM 1724 CB ASP A 111 10.729 8.975 2.029 1.00 0.00 C ATOM 1725 CG ASP A 111 11.782 9.557 2.951 1.00 0.00 C ATOM 1726 OD1 ASP A 111 12.397 8.785 3.714 1.00 0.00 O ATOM 1727 OD2 ASP A 111 12.019 10.781 2.892 1.00 0.00 O ATOM 0 H ASP A 111 8.878 7.800 0.962 1.00 0.00 H new ATOM 0 HA ASP A 111 9.371 8.496 3.634 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.013 7.958 1.760 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.704 9.554 1.106 1.00 0.00 H new ATOM 1732 N ALA A 112 8.182 10.904 1.770 1.00 0.00 N ATOM 1733 CA ALA A 112 7.662 12.265 1.785 1.00 0.00 C ATOM 1734 C ALA A 112 6.452 12.400 2.704 1.00 0.00 C ATOM 1735 O ALA A 112 6.368 13.339 3.501 1.00 0.00 O ATOM 1736 CB ALA A 112 7.300 12.701 0.376 1.00 0.00 C ATOM 0 H ALA A 112 8.019 10.402 0.897 1.00 0.00 H new ATOM 0 HA ALA A 112 8.446 12.914 2.175 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.912 13.720 0.399 1.00 0.00 H new ATOM 0 HB2 ALA A 112 8.188 12.664 -0.256 1.00 0.00 H new ATOM 0 HB3 ALA A 112 6.540 12.032 -0.028 1.00 0.00 H new ATOM 1742 N VAL A 113 5.511 11.467 2.595 1.00 0.00 N ATOM 1743 CA VAL A 113 4.275 11.551 3.369 1.00 0.00 C ATOM 1744 C VAL A 113 4.446 10.963 4.768 1.00 0.00 C ATOM 1745 O VAL A 113 3.768 11.382 5.706 1.00 0.00 O ATOM 1746 CB VAL A 113 3.089 10.861 2.657 1.00 0.00 C ATOM 1747 CG1 VAL A 113 2.824 11.520 1.313 1.00 0.00 C ATOM 1748 CG2 VAL A 113 3.332 9.368 2.483 1.00 0.00 C ATOM 0 H VAL A 113 5.578 10.652 1.985 1.00 0.00 H new ATOM 0 HA VAL A 113 4.047 12.613 3.458 1.00 0.00 H new ATOM 0 HB VAL A 113 2.207 10.979 3.287 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.986 11.024 0.823 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.584 12.572 1.465 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.712 11.437 0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.477 8.917 1.979 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.230 9.213 1.885 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.463 8.904 3.461 1.00 0.00 H new ATOM 1758 N GLY A 114 5.359 10.013 4.904 1.00 0.00 N ATOM 1759 CA GLY A 114 5.602 9.400 6.194 1.00 0.00 C ATOM 1760 C GLY A 114 4.791 8.138 6.397 1.00 0.00 C ATOM 1761 O GLY A 114 4.312 7.868 7.498 1.00 0.00 O ATOM 0 H GLY A 114 5.937 9.655 4.143 1.00 0.00 H new ATOM 0 HA2 GLY A 114 6.662 9.166 6.288 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.362 10.113 6.983 1.00 0.00 H new ATOM 1765 N ALA A 115 4.638 7.354 5.342 1.00 0.00 N ATOM 1766 CA ALA A 115 3.861 6.131 5.426 1.00 0.00 C ATOM 1767 C ALA A 115 4.742 4.909 5.230 1.00 0.00 C ATOM 1768 O ALA A 115 5.753 4.961 4.529 1.00 0.00 O ATOM 1769 CB ALA A 115 2.740 6.140 4.406 1.00 0.00 C ATOM 0 H ALA A 115 5.039 7.542 4.423 1.00 0.00 H new ATOM 0 HA ALA A 115 3.425 6.080 6.424 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.169 5.215 4.485 1.00 0.00 H new ATOM 0 HB2 ALA A 115 2.083 6.989 4.595 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.161 6.223 3.404 1.00 0.00 H new ATOM 1775 N ARG A 116 4.354 3.816 5.860 1.00 0.00 N ATOM 1776 CA ARG A 116 5.087 2.567 5.756 1.00 0.00 C ATOM 1777 C ARG A 116 4.898 1.972 4.367 1.00 0.00 C ATOM 1778 O ARG A 116 3.782 1.635 3.974 1.00 0.00 O ATOM 1779 CB ARG A 116 4.588 1.601 6.829 1.00 0.00 C ATOM 1780 CG ARG A 116 5.475 0.412 7.098 1.00 0.00 C ATOM 1781 CD ARG A 116 4.930 -0.322 8.304 1.00 0.00 C ATOM 1782 NE ARG A 116 5.823 -1.352 8.770 1.00 0.00 N ATOM 1783 CZ ARG A 116 6.126 -1.546 10.053 1.00 0.00 C ATOM 1784 NH1 ARG A 116 5.632 -0.739 10.985 1.00 0.00 N ATOM 1785 NH2 ARG A 116 6.921 -2.545 10.400 1.00 0.00 N ATOM 0 H ARG A 116 3.527 3.768 6.455 1.00 0.00 H new ATOM 0 HA ARG A 116 6.151 2.748 5.910 1.00 0.00 H new ATOM 0 HB2 ARG A 116 4.460 2.154 7.759 1.00 0.00 H new ATOM 0 HB3 ARG A 116 3.603 1.238 6.536 1.00 0.00 H new ATOM 0 HG2 ARG A 116 5.500 -0.248 6.231 1.00 0.00 H new ATOM 0 HG3 ARG A 116 6.500 0.736 7.281 1.00 0.00 H new ATOM 0 HD2 ARG A 116 4.750 0.391 9.109 1.00 0.00 H new ATOM 0 HD3 ARG A 116 3.967 -0.767 8.051 1.00 0.00 H new ATOM 0 HE ARG A 116 6.248 -1.969 8.078 1.00 0.00 H new ATOM 0 HH11 ARG A 116 5.019 0.032 10.719 1.00 0.00 H new ATOM 0 HH12 ARG A 116 5.866 -0.890 11.966 1.00 0.00 H new ATOM 0 HH21 ARG A 116 7.301 -3.166 9.686 1.00 0.00 H new ATOM 0 HH22 ARG A 116 7.154 -2.694 11.382 1.00 0.00 H new ATOM 1799 N LEU A 117 5.987 1.872 3.626 1.00 0.00 N ATOM 1800 CA LEU A 117 5.954 1.333 2.277 1.00 0.00 C ATOM 1801 C LEU A 117 6.138 -0.174 2.316 1.00 0.00 C ATOM 1802 O LEU A 117 7.142 -0.665 2.817 1.00 0.00 O ATOM 1803 CB LEU A 117 7.055 1.969 1.425 1.00 0.00 C ATOM 1804 CG LEU A 117 7.142 1.463 -0.018 1.00 0.00 C ATOM 1805 CD1 LEU A 117 5.882 1.824 -0.793 1.00 0.00 C ATOM 1806 CD2 LEU A 117 8.371 2.034 -0.703 1.00 0.00 C ATOM 0 H LEU A 117 6.914 2.160 3.939 1.00 0.00 H new ATOM 0 HA LEU A 117 4.986 1.564 1.832 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.899 3.048 1.405 1.00 0.00 H new ATOM 0 HB3 LEU A 117 8.014 1.795 1.912 1.00 0.00 H new ATOM 0 HG LEU A 117 7.228 0.377 0.003 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.965 1.455 -1.815 1.00 0.00 H new ATOM 0 HD12 LEU A 117 5.016 1.369 -0.312 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.761 2.907 -0.807 1.00 0.00 H new ATOM 0 HD21 LEU A 117 8.420 1.666 -1.728 1.00 0.00 H new ATOM 0 HD22 LEU A 117 8.311 3.122 -0.711 1.00 0.00 H new ATOM 0 HD23 LEU A 117 9.266 1.724 -0.163 1.00 0.00 H new ATOM 1818 N ILE A 118 5.167 -0.907 1.811 1.00 0.00 N ATOM 1819 CA ILE A 118 5.259 -2.355 1.788 1.00 0.00 C ATOM 1820 C ILE A 118 5.153 -2.870 0.359 1.00 0.00 C ATOM 1821 O ILE A 118 4.126 -2.714 -0.299 1.00 0.00 O ATOM 1822 CB ILE A 118 4.172 -3.006 2.672 1.00 0.00 C ATOM 1823 CG1 ILE A 118 4.314 -2.522 4.120 1.00 0.00 C ATOM 1824 CG2 ILE A 118 4.270 -4.522 2.602 1.00 0.00 C ATOM 1825 CD1 ILE A 118 3.247 -3.052 5.055 1.00 0.00 C ATOM 0 H ILE A 118 4.308 -0.528 1.412 1.00 0.00 H new ATOM 0 HA ILE A 118 6.231 -2.632 2.195 1.00 0.00 H new ATOM 0 HB ILE A 118 3.191 -2.710 2.300 1.00 0.00 H new ATOM 0 HG12 ILE A 118 5.293 -2.819 4.497 1.00 0.00 H new ATOM 0 HG13 ILE A 118 4.285 -1.432 4.132 1.00 0.00 H new ATOM 0 HG21 ILE A 118 3.498 -4.966 3.230 1.00 0.00 H new ATOM 0 HG22 ILE A 118 4.132 -4.848 1.571 1.00 0.00 H new ATOM 0 HG23 ILE A 118 5.251 -4.840 2.954 1.00 0.00 H new ATOM 0 HD11 ILE A 118 3.418 -2.664 6.059 1.00 0.00 H new ATOM 0 HD12 ILE A 118 2.265 -2.733 4.705 1.00 0.00 H new ATOM 0 HD13 ILE A 118 3.289 -4.141 5.075 1.00 0.00 H new ATOM 1837 N ILE A 119 6.224 -3.466 -0.127 1.00 0.00 N ATOM 1838 CA ILE A 119 6.251 -3.986 -1.478 1.00 0.00 C ATOM 1839 C ILE A 119 6.334 -5.503 -1.464 1.00 0.00 C ATOM 1840 O ILE A 119 7.262 -6.083 -0.894 1.00 0.00 O ATOM 1841 CB ILE A 119 7.440 -3.421 -2.289 1.00 0.00 C ATOM 1842 CG1 ILE A 119 7.312 -1.901 -2.438 1.00 0.00 C ATOM 1843 CG2 ILE A 119 7.523 -4.086 -3.657 1.00 0.00 C ATOM 1844 CD1 ILE A 119 8.403 -1.277 -3.283 1.00 0.00 C ATOM 0 H ILE A 119 7.089 -3.602 0.396 1.00 0.00 H new ATOM 0 HA ILE A 119 5.325 -3.671 -1.959 1.00 0.00 H new ATOM 0 HB ILE A 119 8.360 -3.640 -1.746 1.00 0.00 H new ATOM 0 HG12 ILE A 119 6.344 -1.669 -2.882 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.326 -1.445 -1.448 1.00 0.00 H new ATOM 0 HG21 ILE A 119 8.366 -3.674 -4.211 1.00 0.00 H new ATOM 0 HG22 ILE A 119 7.661 -5.160 -3.532 1.00 0.00 H new ATOM 0 HG23 ILE A 119 6.601 -3.901 -4.208 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.246 -0.200 -3.343 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.374 -1.477 -2.830 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.376 -1.704 -4.286 1.00 0.00 H new ATOM 1856 N LYS A 120 5.350 -6.140 -2.075 1.00 0.00 N ATOM 1857 CA LYS A 120 5.380 -7.578 -2.255 1.00 0.00 C ATOM 1858 C LYS A 120 5.587 -7.881 -3.734 1.00 0.00 C ATOM 1859 O LYS A 120 4.637 -7.864 -4.522 1.00 0.00 O ATOM 1860 CB LYS A 120 4.087 -8.224 -1.725 1.00 0.00 C ATOM 1861 CG LYS A 120 4.185 -9.731 -1.483 1.00 0.00 C ATOM 1862 CD LYS A 120 4.164 -10.526 -2.780 1.00 0.00 C ATOM 1863 CE LYS A 120 4.437 -12.004 -2.546 1.00 0.00 C ATOM 1864 NZ LYS A 120 3.417 -12.635 -1.665 1.00 0.00 N ATOM 0 H LYS A 120 4.521 -5.683 -2.454 1.00 0.00 H new ATOM 0 HA LYS A 120 6.205 -8.003 -1.683 1.00 0.00 H new ATOM 0 HB2 LYS A 120 3.808 -7.736 -0.791 1.00 0.00 H new ATOM 0 HB3 LYS A 120 3.283 -8.034 -2.436 1.00 0.00 H new ATOM 0 HG2 LYS A 120 5.104 -9.951 -0.940 1.00 0.00 H new ATOM 0 HG3 LYS A 120 3.357 -10.050 -0.850 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.193 -10.408 -3.262 1.00 0.00 H new ATOM 0 HD3 LYS A 120 4.911 -10.123 -3.464 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.457 -12.523 -3.504 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.424 -12.122 -2.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.880 -13.017 -0.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 2.713 -11.923 -1.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.944 -13.406 -2.178 1.00 0.00 H new ATOM 1878 N PRO A 121 6.843 -8.106 -4.136 1.00 0.00 N ATOM 1879 CA PRO A 121 7.191 -8.407 -5.515 1.00 0.00 C ATOM 1880 C PRO A 121 7.142 -9.905 -5.810 1.00 0.00 C ATOM 1881 O PRO A 121 6.530 -10.677 -5.070 1.00 0.00 O ATOM 1882 CB PRO A 121 8.619 -7.874 -5.618 1.00 0.00 C ATOM 1883 CG PRO A 121 9.196 -8.021 -4.245 1.00 0.00 C ATOM 1884 CD PRO A 121 8.038 -8.075 -3.274 1.00 0.00 C ATOM 0 HA PRO A 121 6.500 -7.964 -6.232 1.00 0.00 H new ATOM 0 HB2 PRO A 121 9.197 -8.438 -6.350 1.00 0.00 H new ATOM 0 HB3 PRO A 121 8.628 -6.832 -5.939 1.00 0.00 H new ATOM 0 HG2 PRO A 121 9.798 -8.927 -4.176 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.854 -7.183 -4.013 1.00 0.00 H new ATOM 0 HD2 PRO A 121 8.093 -8.958 -2.638 1.00 0.00 H new ATOM 0 HD3 PRO A 121 8.031 -7.207 -2.615 1.00 0.00 H new ATOM 1892 N LEU A 122 7.786 -10.304 -6.897 1.00 0.00 N ATOM 1893 CA LEU A 122 7.829 -11.704 -7.295 1.00 0.00 C ATOM 1894 C LEU A 122 8.936 -12.435 -6.546 1.00 0.00 C ATOM 1895 O LEU A 122 9.788 -11.806 -5.916 1.00 0.00 O ATOM 1896 CB LEU A 122 8.046 -11.830 -8.809 1.00 0.00 C ATOM 1897 CG LEU A 122 6.807 -11.604 -9.686 1.00 0.00 C ATOM 1898 CD1 LEU A 122 6.303 -10.172 -9.576 1.00 0.00 C ATOM 1899 CD2 LEU A 122 7.120 -11.944 -11.130 1.00 0.00 C ATOM 0 H LEU A 122 8.289 -9.674 -7.522 1.00 0.00 H new ATOM 0 HA LEU A 122 6.872 -12.160 -7.042 1.00 0.00 H new ATOM 0 HB2 LEU A 122 8.813 -11.115 -9.107 1.00 0.00 H new ATOM 0 HB3 LEU A 122 8.439 -12.825 -9.018 1.00 0.00 H new ATOM 0 HG LEU A 122 6.016 -12.263 -9.328 1.00 0.00 H new ATOM 0 HD11 LEU A 122 5.425 -10.046 -10.209 1.00 0.00 H new ATOM 0 HD12 LEU A 122 6.037 -9.958 -8.541 1.00 0.00 H new ATOM 0 HD13 LEU A 122 7.085 -9.485 -9.899 1.00 0.00 H new ATOM 0 HD21 LEU A 122 6.234 -11.780 -11.743 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.930 -11.308 -11.486 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.421 -12.989 -11.201 1.00 0.00 H new ATOM 1911 N THR A 123 8.926 -13.760 -6.632 1.00 0.00 N ATOM 1912 CA THR A 123 9.882 -14.592 -5.914 1.00 0.00 C ATOM 1913 C THR A 123 11.325 -14.271 -6.321 1.00 0.00 C ATOM 1914 O THR A 123 12.243 -14.369 -5.511 1.00 0.00 O ATOM 1915 CB THR A 123 9.589 -16.083 -6.165 1.00 0.00 C ATOM 1916 OG1 THR A 123 8.171 -16.310 -6.124 1.00 0.00 O ATOM 1917 CG2 THR A 123 10.268 -16.958 -5.124 1.00 0.00 C ATOM 0 H THR A 123 8.259 -14.285 -7.198 1.00 0.00 H new ATOM 0 HA THR A 123 9.773 -14.376 -4.851 1.00 0.00 H new ATOM 0 HB THR A 123 9.981 -16.346 -7.147 1.00 0.00 H new ATOM 0 HG1 THR A 123 7.987 -17.259 -6.286 1.00 0.00 H new ATOM 0 HG21 THR A 123 10.043 -18.005 -5.326 1.00 0.00 H new ATOM 0 HG22 THR A 123 11.346 -16.803 -5.166 1.00 0.00 H new ATOM 0 HG23 THR A 123 9.902 -16.694 -4.132 1.00 0.00 H new ATOM 1925 N GLY A 124 11.517 -13.877 -7.576 1.00 0.00 N ATOM 1926 CA GLY A 124 12.841 -13.504 -8.042 1.00 0.00 C ATOM 1927 C GLY A 124 12.854 -12.117 -8.652 1.00 0.00 C ATOM 1928 O GLY A 124 13.531 -11.871 -9.652 1.00 0.00 O ATOM 0 H GLY A 124 10.780 -13.809 -8.278 1.00 0.00 H new ATOM 0 HA2 GLY A 124 13.543 -13.541 -7.209 1.00 0.00 H new ATOM 0 HA3 GLY A 124 13.184 -14.229 -8.780 1.00 0.00 H new ATOM 1932 N GLU A 125 12.106 -11.207 -8.048 1.00 0.00 N ATOM 1933 CA GLU A 125 11.963 -9.862 -8.577 1.00 0.00 C ATOM 1934 C GLU A 125 12.668 -8.861 -7.671 1.00 0.00 C ATOM 1935 O GLU A 125 12.320 -8.721 -6.498 1.00 0.00 O ATOM 1936 CB GLU A 125 10.478 -9.512 -8.702 1.00 0.00 C ATOM 1937 CG GLU A 125 10.201 -8.205 -9.421 1.00 0.00 C ATOM 1938 CD GLU A 125 10.604 -8.241 -10.880 1.00 0.00 C ATOM 1939 OE1 GLU A 125 11.817 -8.302 -11.165 1.00 0.00 O ATOM 1940 OE2 GLU A 125 9.709 -8.217 -11.751 1.00 0.00 O ATOM 0 H GLU A 125 11.587 -11.378 -7.187 1.00 0.00 H new ATOM 0 HA GLU A 125 12.423 -9.817 -9.564 1.00 0.00 H new ATOM 0 HB2 GLU A 125 9.970 -10.318 -9.231 1.00 0.00 H new ATOM 0 HB3 GLU A 125 10.043 -9.463 -7.704 1.00 0.00 H new ATOM 0 HG2 GLU A 125 9.138 -7.974 -9.348 1.00 0.00 H new ATOM 0 HG3 GLU A 125 10.738 -7.399 -8.920 1.00 0.00 H new ATOM 1947 N ASP A 126 13.669 -8.184 -8.215 1.00 0.00 N ATOM 1948 CA ASP A 126 14.413 -7.180 -7.462 1.00 0.00 C ATOM 1949 C ASP A 126 13.709 -5.833 -7.506 1.00 0.00 C ATOM 1950 O ASP A 126 12.791 -5.619 -8.301 1.00 0.00 O ATOM 1951 CB ASP A 126 15.838 -7.026 -7.999 1.00 0.00 C ATOM 1952 CG ASP A 126 16.734 -8.182 -7.617 1.00 0.00 C ATOM 1953 OD1 ASP A 126 17.282 -8.170 -6.495 1.00 0.00 O ATOM 1954 OD2 ASP A 126 16.903 -9.109 -8.438 1.00 0.00 O ATOM 0 H ASP A 126 13.986 -8.311 -9.176 1.00 0.00 H new ATOM 0 HA ASP A 126 14.461 -7.524 -6.429 1.00 0.00 H new ATOM 0 HB2 ASP A 126 15.805 -6.941 -9.085 1.00 0.00 H new ATOM 0 HB3 ASP A 126 16.267 -6.099 -7.619 1.00 0.00 H new ATOM 1959 N ILE A 127 14.160 -4.923 -6.655 1.00 0.00 N ATOM 1960 CA ILE A 127 13.569 -3.598 -6.552 1.00 0.00 C ATOM 1961 C ILE A 127 14.292 -2.616 -7.470 1.00 0.00 C ATOM 1962 O ILE A 127 13.707 -1.624 -7.912 1.00 0.00 O ATOM 1963 CB ILE A 127 13.606 -3.106 -5.085 1.00 0.00 C ATOM 1964 CG1 ILE A 127 12.791 -4.070 -4.213 1.00 0.00 C ATOM 1965 CG2 ILE A 127 13.077 -1.677 -4.955 1.00 0.00 C ATOM 1966 CD1 ILE A 127 12.854 -3.775 -2.733 1.00 0.00 C ATOM 0 H ILE A 127 14.942 -5.082 -6.020 1.00 0.00 H new ATOM 0 HA ILE A 127 12.528 -3.656 -6.869 1.00 0.00 H new ATOM 0 HB ILE A 127 14.642 -3.092 -4.746 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.750 -4.039 -4.534 1.00 0.00 H new ATOM 0 HG13 ILE A 127 13.147 -5.086 -4.384 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.119 -1.367 -3.911 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.689 -1.006 -5.557 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.045 -1.638 -5.304 1.00 0.00 H new ATOM 0 HD11 ILE A 127 12.251 -4.503 -2.191 1.00 0.00 H new ATOM 0 HD12 ILE A 127 13.888 -3.836 -2.394 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.469 -2.773 -2.545 1.00 0.00 H new ATOM 2047 N LYS A 132 17.483 1.316 1.235 1.00 0.00 N ATOM 2048 CA LYS A 132 17.201 0.687 2.528 1.00 0.00 C ATOM 2049 C LYS A 132 15.756 0.224 2.634 1.00 0.00 C ATOM 2050 O LYS A 132 14.827 1.031 2.625 1.00 0.00 O ATOM 2051 CB LYS A 132 17.466 1.627 3.697 1.00 0.00 C ATOM 2052 CG LYS A 132 18.891 2.153 3.809 1.00 0.00 C ATOM 2053 CD LYS A 132 19.115 3.391 2.953 1.00 0.00 C ATOM 2054 CE LYS A 132 18.110 4.489 3.275 1.00 0.00 C ATOM 2055 NZ LYS A 132 18.165 4.914 4.699 1.00 0.00 N ATOM 0 HA LYS A 132 17.874 -0.169 2.580 1.00 0.00 H new ATOM 0 HB2 LYS A 132 16.789 2.478 3.617 1.00 0.00 H new ATOM 0 HB3 LYS A 132 17.216 1.107 4.622 1.00 0.00 H new ATOM 0 HG2 LYS A 132 19.109 2.389 4.851 1.00 0.00 H new ATOM 0 HG3 LYS A 132 19.589 1.373 3.506 1.00 0.00 H new ATOM 0 HD2 LYS A 132 20.126 3.765 3.112 1.00 0.00 H new ATOM 0 HD3 LYS A 132 19.037 3.124 1.899 1.00 0.00 H new ATOM 0 HE2 LYS A 132 18.301 5.350 2.635 1.00 0.00 H new ATOM 0 HE3 LYS A 132 17.105 4.136 3.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 17.549 5.740 4.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 17.842 4.134 5.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 19.143 5.165 4.949 1.00 0.00 H new ATOM 2069 N MET A 133 15.599 -1.077 2.733 1.00 0.00 N ATOM 2070 CA MET A 133 14.314 -1.716 2.986 1.00 0.00 C ATOM 2071 C MET A 133 14.569 -2.983 3.780 1.00 0.00 C ATOM 2072 O MET A 133 15.702 -3.466 3.829 1.00 0.00 O ATOM 2073 CB MET A 133 13.563 -2.044 1.682 1.00 0.00 C ATOM 2074 CG MET A 133 13.140 -0.815 0.890 1.00 0.00 C ATOM 2075 SD MET A 133 12.057 -1.194 -0.504 1.00 0.00 S ATOM 2076 CE MET A 133 10.556 -1.673 0.348 1.00 0.00 C ATOM 0 H MET A 133 16.370 -1.738 2.639 1.00 0.00 H new ATOM 0 HA MET A 133 13.680 -1.029 3.546 1.00 0.00 H new ATOM 0 HB2 MET A 133 14.200 -2.668 1.054 1.00 0.00 H new ATOM 0 HB3 MET A 133 12.677 -2.632 1.922 1.00 0.00 H new ATOM 0 HG2 MET A 133 12.630 -0.120 1.557 1.00 0.00 H new ATOM 0 HG3 MET A 133 14.030 -0.307 0.520 1.00 0.00 H new ATOM 0 HE1 MET A 133 10.289 -2.693 0.070 1.00 0.00 H new ATOM 0 HE2 MET A 133 10.716 -1.621 1.425 1.00 0.00 H new ATOM 0 HE3 MET A 133 9.748 -0.997 0.069 1.00 0.00 H new ATOM 2086 N LYS A 134 13.545 -3.514 4.415 1.00 0.00 N ATOM 2087 CA LYS A 134 13.720 -4.691 5.253 1.00 0.00 C ATOM 2088 C LYS A 134 12.755 -5.800 4.854 1.00 0.00 C ATOM 2089 O LYS A 134 11.564 -5.561 4.652 1.00 0.00 O ATOM 2090 CB LYS A 134 13.559 -4.316 6.730 1.00 0.00 C ATOM 2091 CG LYS A 134 12.264 -3.585 7.039 1.00 0.00 C ATOM 2092 CD LYS A 134 12.272 -2.963 8.431 1.00 0.00 C ATOM 2093 CE LYS A 134 12.407 -4.004 9.532 1.00 0.00 C ATOM 2094 NZ LYS A 134 11.332 -5.026 9.471 1.00 0.00 N ATOM 0 H LYS A 134 12.591 -3.157 4.371 1.00 0.00 H new ATOM 0 HA LYS A 134 14.730 -5.074 5.105 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.606 -5.223 7.333 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.399 -3.690 7.030 1.00 0.00 H new ATOM 0 HG2 LYS A 134 12.103 -2.805 6.295 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.428 -4.280 6.958 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.096 -2.253 8.504 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.351 -2.399 8.579 1.00 0.00 H new ATOM 0 HE2 LYS A 134 13.377 -4.494 9.450 1.00 0.00 H new ATOM 0 HE3 LYS A 134 12.381 -3.509 10.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.382 -5.633 10.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.406 -4.554 9.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.454 -5.607 8.617 1.00 0.00 H new ATOM 2108 N LEU A 135 13.284 -7.011 4.728 1.00 0.00 N ATOM 2109 CA LEU A 135 12.486 -8.163 4.346 1.00 0.00 C ATOM 2110 C LEU A 135 11.810 -8.758 5.572 1.00 0.00 C ATOM 2111 O LEU A 135 12.476 -9.146 6.533 1.00 0.00 O ATOM 2112 CB LEU A 135 13.365 -9.216 3.668 1.00 0.00 C ATOM 2113 CG LEU A 135 12.621 -10.447 3.156 1.00 0.00 C ATOM 2114 CD1 LEU A 135 11.635 -10.051 2.070 1.00 0.00 C ATOM 2115 CD2 LEU A 135 13.603 -11.483 2.636 1.00 0.00 C ATOM 0 H LEU A 135 14.270 -7.218 4.887 1.00 0.00 H new ATOM 0 HA LEU A 135 11.720 -7.840 3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 135 13.884 -8.749 2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 135 14.128 -9.540 4.375 1.00 0.00 H new ATOM 0 HG LEU A 135 12.065 -10.888 3.983 1.00 0.00 H new ATOM 0 HD11 LEU A 135 11.111 -10.938 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 135 10.913 -9.341 2.475 1.00 0.00 H new ATOM 0 HD13 LEU A 135 12.172 -9.589 1.242 1.00 0.00 H new ATOM 0 HD21 LEU A 135 13.056 -12.354 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 135 14.184 -11.055 1.819 1.00 0.00 H new ATOM 0 HD23 LEU A 135 14.274 -11.784 3.440 1.00 0.00 H new ATOM 2127 N VAL A 136 10.490 -8.812 5.541 1.00 0.00 N ATOM 2128 CA VAL A 136 9.717 -9.304 6.669 1.00 0.00 C ATOM 2129 C VAL A 136 8.950 -10.559 6.285 1.00 0.00 C ATOM 2130 O VAL A 136 8.575 -10.740 5.124 1.00 0.00 O ATOM 2131 CB VAL A 136 8.713 -8.251 7.187 1.00 0.00 C ATOM 2132 CG1 VAL A 136 8.968 -7.951 8.655 1.00 0.00 C ATOM 2133 CG2 VAL A 136 8.774 -6.976 6.359 1.00 0.00 C ATOM 0 H VAL A 136 9.928 -8.519 4.742 1.00 0.00 H new ATOM 0 HA VAL A 136 10.430 -9.527 7.463 1.00 0.00 H new ATOM 0 HB VAL A 136 7.710 -8.665 7.086 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.252 -7.207 9.004 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.855 -8.865 9.238 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.980 -7.565 8.777 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.056 -6.255 6.748 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.778 -6.554 6.414 1.00 0.00 H new ATOM 0 HG23 VAL A 136 8.532 -7.204 5.321 1.00 0.00 H new ATOM 2143 N ASN A 137 8.729 -11.426 7.262 1.00 0.00 N ATOM 2144 CA ASN A 137 7.963 -12.645 7.048 1.00 0.00 C ATOM 2145 C ASN A 137 6.702 -12.605 7.890 1.00 0.00 C ATOM 2146 O ASN A 137 6.774 -12.397 9.100 1.00 0.00 O ATOM 2147 CB ASN A 137 8.770 -13.892 7.431 1.00 0.00 C ATOM 2148 CG ASN A 137 10.087 -14.021 6.693 1.00 0.00 C ATOM 2149 OD1 ASN A 137 11.032 -14.622 7.200 1.00 0.00 O ATOM 2150 ND2 ASN A 137 10.164 -13.466 5.499 1.00 0.00 N ATOM 0 H ASN A 137 9.071 -11.307 8.215 1.00 0.00 H new ATOM 0 HA ASN A 137 7.717 -12.702 5.988 1.00 0.00 H new ATOM 0 HB2 ASN A 137 8.966 -13.871 8.503 1.00 0.00 H new ATOM 0 HB3 ASN A 137 8.166 -14.778 7.235 1.00 0.00 H new ATOM 0 HD21 ASN A 137 11.030 -13.527 4.963 1.00 0.00 H new ATOM 0 HD22 ASN A 137 9.358 -12.975 5.112 1.00 0.00 H new ATOM 2157 N TYR A 138 5.555 -12.788 7.262 1.00 0.00 N ATOM 2158 CA TYR A 138 4.301 -12.848 7.991 1.00 0.00 C ATOM 2159 C TYR A 138 3.433 -13.960 7.421 1.00 0.00 C ATOM 2160 O TYR A 138 3.260 -14.063 6.203 1.00 0.00 O ATOM 2161 CB TYR A 138 3.570 -11.502 7.933 1.00 0.00 C ATOM 2162 CG TYR A 138 2.466 -11.366 8.959 1.00 0.00 C ATOM 2163 CD1 TYR A 138 2.755 -10.985 10.263 1.00 0.00 C ATOM 2164 CD2 TYR A 138 1.141 -11.617 8.628 1.00 0.00 C ATOM 2165 CE1 TYR A 138 1.757 -10.858 11.208 1.00 0.00 C ATOM 2166 CE2 TYR A 138 0.135 -11.491 9.570 1.00 0.00 C ATOM 2167 CZ TYR A 138 0.448 -11.111 10.857 1.00 0.00 C ATOM 2168 OH TYR A 138 -0.549 -10.983 11.798 1.00 0.00 O ATOM 0 H TYR A 138 5.465 -12.897 6.252 1.00 0.00 H new ATOM 0 HA TYR A 138 4.511 -13.064 9.038 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.292 -10.699 8.081 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.147 -11.371 6.937 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.779 -10.785 10.543 1.00 0.00 H new ATOM 0 HD2 TYR A 138 0.892 -11.915 7.620 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.000 -10.562 12.218 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -0.891 -11.690 9.298 1.00 0.00 H new ATOM 0 HH TYR A 138 -1.414 -11.196 11.389 1.00 0.00 H new ATOM 2178 N GLY A 139 2.911 -14.802 8.303 1.00 0.00 N ATOM 2179 CA GLY A 139 2.169 -15.966 7.881 1.00 0.00 C ATOM 2180 C GLY A 139 3.095 -17.005 7.294 1.00 0.00 C ATOM 2181 O GLY A 139 3.591 -17.881 8.003 1.00 0.00 O ATOM 0 H GLY A 139 2.992 -14.694 9.314 1.00 0.00 H new ATOM 0 HA2 GLY A 139 1.632 -16.389 8.730 1.00 0.00 H new ATOM 0 HA3 GLY A 139 1.421 -15.679 7.142 1.00 0.00 H new ATOM 2185 N ARG A 140 3.336 -16.884 6.002 1.00 0.00 N ATOM 2186 CA ARG A 140 4.299 -17.726 5.299 1.00 0.00 C ATOM 2187 C ARG A 140 4.796 -17.038 4.037 1.00 0.00 C ATOM 2188 O ARG A 140 5.414 -17.667 3.177 1.00 0.00 O ATOM 2189 CB ARG A 140 3.710 -19.099 4.951 1.00 0.00 C ATOM 2190 CG ARG A 140 3.898 -20.153 6.035 1.00 0.00 C ATOM 2191 CD ARG A 140 5.372 -20.408 6.334 1.00 0.00 C ATOM 2192 NE ARG A 140 6.004 -19.299 7.058 1.00 0.00 N ATOM 2193 CZ ARG A 140 7.301 -18.988 6.973 1.00 0.00 C ATOM 2194 NH1 ARG A 140 8.110 -19.702 6.198 1.00 0.00 N ATOM 2195 NH2 ARG A 140 7.780 -17.959 7.660 1.00 0.00 N ATOM 0 H ARG A 140 2.871 -16.200 5.405 1.00 0.00 H new ATOM 0 HA ARG A 140 5.140 -17.883 5.974 1.00 0.00 H new ATOM 0 HB2 ARG A 140 2.644 -18.985 4.752 1.00 0.00 H new ATOM 0 HB3 ARG A 140 4.170 -19.456 4.029 1.00 0.00 H new ATOM 0 HG2 ARG A 140 3.394 -19.830 6.946 1.00 0.00 H new ATOM 0 HG3 ARG A 140 3.425 -21.084 5.722 1.00 0.00 H new ATOM 0 HD2 ARG A 140 5.466 -21.321 6.922 1.00 0.00 H new ATOM 0 HD3 ARG A 140 5.905 -20.575 5.398 1.00 0.00 H new ATOM 0 HE ARG A 140 5.415 -18.729 7.665 1.00 0.00 H new ATOM 0 HH11 ARG A 140 7.742 -20.490 5.666 1.00 0.00 H new ATOM 0 HH12 ARG A 140 9.099 -19.462 6.135 1.00 0.00 H new ATOM 0 HH21 ARG A 140 7.159 -17.407 8.252 1.00 0.00 H new ATOM 0 HH22 ARG A 140 8.770 -17.720 7.597 1.00 0.00 H new ATOM 2209 N THR A 141 4.543 -15.743 3.936 1.00 0.00 N ATOM 2210 CA THR A 141 4.986 -14.979 2.789 1.00 0.00 C ATOM 2211 C THR A 141 6.033 -13.956 3.218 1.00 0.00 C ATOM 2212 O THR A 141 6.078 -13.550 4.384 1.00 0.00 O ATOM 2213 CB THR A 141 3.804 -14.273 2.078 1.00 0.00 C ATOM 2214 OG1 THR A 141 4.222 -13.763 0.804 1.00 0.00 O ATOM 2215 CG2 THR A 141 3.245 -13.133 2.921 1.00 0.00 C ATOM 0 H THR A 141 4.034 -15.203 4.635 1.00 0.00 H new ATOM 0 HA THR A 141 5.430 -15.673 2.076 1.00 0.00 H new ATOM 0 HB THR A 141 3.018 -15.014 1.936 1.00 0.00 H new ATOM 0 HG1 THR A 141 4.554 -12.847 0.911 1.00 0.00 H new ATOM 0 HG21 THR A 141 2.418 -12.661 2.391 1.00 0.00 H new ATOM 0 HG22 THR A 141 2.889 -13.525 3.874 1.00 0.00 H new ATOM 0 HG23 THR A 141 4.028 -12.396 3.102 1.00 0.00 H new ATOM 2223 N TYR A 142 6.883 -13.555 2.286 1.00 0.00 N ATOM 2224 CA TYR A 142 7.920 -12.588 2.584 1.00 0.00 C ATOM 2225 C TYR A 142 7.800 -11.383 1.664 1.00 0.00 C ATOM 2226 O TYR A 142 7.528 -11.520 0.468 1.00 0.00 O ATOM 2227 CB TYR A 142 9.315 -13.224 2.490 1.00 0.00 C ATOM 2228 CG TYR A 142 9.764 -13.621 1.097 1.00 0.00 C ATOM 2229 CD1 TYR A 142 9.204 -14.709 0.438 1.00 0.00 C ATOM 2230 CD2 TYR A 142 10.771 -12.914 0.453 1.00 0.00 C ATOM 2231 CE1 TYR A 142 9.636 -15.078 -0.822 1.00 0.00 C ATOM 2232 CE2 TYR A 142 11.205 -13.272 -0.805 1.00 0.00 C ATOM 2233 CZ TYR A 142 10.637 -14.355 -1.438 1.00 0.00 C ATOM 2234 OH TYR A 142 11.078 -14.720 -2.690 1.00 0.00 O ATOM 0 H TYR A 142 6.873 -13.885 1.321 1.00 0.00 H new ATOM 0 HA TYR A 142 7.786 -12.247 3.611 1.00 0.00 H new ATOM 0 HB2 TYR A 142 10.042 -12.523 2.900 1.00 0.00 H new ATOM 0 HB3 TYR A 142 9.334 -14.110 3.124 1.00 0.00 H new ATOM 0 HD1 TYR A 142 8.419 -15.275 0.918 1.00 0.00 H new ATOM 0 HD2 TYR A 142 11.223 -12.067 0.948 1.00 0.00 H new ATOM 0 HE1 TYR A 142 9.193 -15.927 -1.321 1.00 0.00 H new ATOM 0 HE2 TYR A 142 11.986 -12.707 -1.292 1.00 0.00 H new ATOM 0 HH TYR A 142 11.785 -14.106 -2.980 1.00 0.00 H new ATOM 2244 N PHE A 143 7.977 -10.209 2.238 1.00 0.00 N ATOM 2245 CA PHE A 143 7.836 -8.963 1.505 1.00 0.00 C ATOM 2246 C PHE A 143 8.805 -7.924 2.047 1.00 0.00 C ATOM 2247 O PHE A 143 9.329 -8.071 3.152 1.00 0.00 O ATOM 2248 CB PHE A 143 6.393 -8.452 1.597 1.00 0.00 C ATOM 2249 CG PHE A 143 5.802 -8.554 2.979 1.00 0.00 C ATOM 2250 CD1 PHE A 143 6.007 -7.552 3.914 1.00 0.00 C ATOM 2251 CD2 PHE A 143 5.044 -9.658 3.341 1.00 0.00 C ATOM 2252 CE1 PHE A 143 5.466 -7.649 5.183 1.00 0.00 C ATOM 2253 CE2 PHE A 143 4.502 -9.760 4.609 1.00 0.00 C ATOM 2254 CZ PHE A 143 4.713 -8.754 5.529 1.00 0.00 C ATOM 0 H PHE A 143 8.222 -10.090 3.221 1.00 0.00 H new ATOM 0 HA PHE A 143 8.071 -9.144 0.456 1.00 0.00 H new ATOM 0 HB2 PHE A 143 6.364 -7.411 1.275 1.00 0.00 H new ATOM 0 HB3 PHE A 143 5.772 -9.018 0.903 1.00 0.00 H new ATOM 0 HD1 PHE A 143 6.596 -6.686 3.649 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.875 -10.448 2.624 1.00 0.00 H new ATOM 0 HE1 PHE A 143 5.632 -6.861 5.903 1.00 0.00 H new ATOM 0 HE2 PHE A 143 3.915 -10.625 4.879 1.00 0.00 H new ATOM 0 HZ PHE A 143 4.290 -8.830 6.520 1.00 0.00 H new ATOM 2264 N TYR A 144 9.048 -6.886 1.270 1.00 0.00 N ATOM 2265 CA TYR A 144 9.965 -5.836 1.676 1.00 0.00 C ATOM 2266 C TYR A 144 9.194 -4.631 2.184 1.00 0.00 C ATOM 2267 O TYR A 144 8.361 -4.074 1.468 1.00 0.00 O ATOM 2268 CB TYR A 144 10.861 -5.415 0.509 1.00 0.00 C ATOM 2269 CG TYR A 144 11.800 -6.495 0.027 1.00 0.00 C ATOM 2270 CD1 TYR A 144 12.992 -6.749 0.692 1.00 0.00 C ATOM 2271 CD2 TYR A 144 11.499 -7.255 -1.096 1.00 0.00 C ATOM 2272 CE1 TYR A 144 13.858 -7.733 0.252 1.00 0.00 C ATOM 2273 CE2 TYR A 144 12.359 -8.238 -1.543 1.00 0.00 C ATOM 2274 CZ TYR A 144 13.538 -8.474 -0.865 1.00 0.00 C ATOM 2275 OH TYR A 144 14.396 -9.456 -1.304 1.00 0.00 O ATOM 0 H TYR A 144 8.623 -6.746 0.353 1.00 0.00 H new ATOM 0 HA TYR A 144 10.592 -6.227 2.477 1.00 0.00 H new ATOM 0 HB2 TYR A 144 10.231 -5.100 -0.323 1.00 0.00 H new ATOM 0 HB3 TYR A 144 11.448 -4.547 0.811 1.00 0.00 H new ATOM 0 HD1 TYR A 144 13.247 -6.169 1.567 1.00 0.00 H new ATOM 0 HD2 TYR A 144 10.577 -7.074 -1.628 1.00 0.00 H new ATOM 0 HE1 TYR A 144 14.781 -7.920 0.781 1.00 0.00 H new ATOM 0 HE2 TYR A 144 12.111 -8.819 -2.419 1.00 0.00 H new ATOM 0 HH TYR A 144 14.022 -9.885 -2.102 1.00 0.00 H new ATOM 2285 N GLU A 145 9.459 -4.230 3.415 1.00 0.00 N ATOM 2286 CA GLU A 145 8.811 -3.055 3.968 1.00 0.00 C ATOM 2287 C GLU A 145 9.836 -1.954 4.198 1.00 0.00 C ATOM 2288 O GLU A 145 11.034 -2.216 4.325 1.00 0.00 O ATOM 2289 CB GLU A 145 8.083 -3.379 5.279 1.00 0.00 C ATOM 2290 CG GLU A 145 8.986 -3.374 6.504 1.00 0.00 C ATOM 2291 CD GLU A 145 8.262 -3.745 7.781 1.00 0.00 C ATOM 2292 OE1 GLU A 145 7.032 -3.561 7.847 1.00 0.00 O ATOM 2293 OE2 GLU A 145 8.927 -4.198 8.742 1.00 0.00 O ATOM 0 H GLU A 145 10.112 -4.696 4.045 1.00 0.00 H new ATOM 0 HA GLU A 145 8.067 -2.713 3.248 1.00 0.00 H new ATOM 0 HB2 GLU A 145 7.282 -2.654 5.427 1.00 0.00 H new ATOM 0 HB3 GLU A 145 7.614 -4.359 5.190 1.00 0.00 H new ATOM 0 HG2 GLU A 145 9.808 -4.072 6.344 1.00 0.00 H new ATOM 0 HG3 GLU A 145 9.427 -2.384 6.618 1.00 0.00 H new ATOM 2300 N TYR A 146 9.355 -0.732 4.233 1.00 0.00 N ATOM 2301 CA TYR A 146 10.184 0.422 4.509 1.00 0.00 C ATOM 2302 C TYR A 146 9.417 1.407 5.365 1.00 0.00 C ATOM 2303 O TYR A 146 8.322 1.837 5.005 1.00 0.00 O ATOM 2304 CB TYR A 146 10.640 1.084 3.205 1.00 0.00 C ATOM 2305 CG TYR A 146 11.339 2.412 3.408 1.00 0.00 C ATOM 2306 CD1 TYR A 146 12.528 2.490 4.121 1.00 0.00 C ATOM 2307 CD2 TYR A 146 10.812 3.589 2.883 1.00 0.00 C ATOM 2308 CE1 TYR A 146 13.173 3.696 4.304 1.00 0.00 C ATOM 2309 CE2 TYR A 146 11.451 4.801 3.064 1.00 0.00 C ATOM 2310 CZ TYR A 146 12.632 4.851 3.775 1.00 0.00 C ATOM 2311 OH TYR A 146 13.284 6.053 3.946 1.00 0.00 O ATOM 0 H TYR A 146 8.373 -0.508 4.070 1.00 0.00 H new ATOM 0 HA TYR A 146 11.073 0.097 5.050 1.00 0.00 H new ATOM 0 HB2 TYR A 146 11.313 0.406 2.680 1.00 0.00 H new ATOM 0 HB3 TYR A 146 9.773 1.234 2.562 1.00 0.00 H new ATOM 0 HD1 TYR A 146 12.955 1.591 4.540 1.00 0.00 H new ATOM 0 HD2 TYR A 146 9.888 3.554 2.325 1.00 0.00 H new ATOM 0 HE1 TYR A 146 14.098 3.736 4.859 1.00 0.00 H new ATOM 0 HE2 TYR A 146 11.028 5.705 2.651 1.00 0.00 H new ATOM 0 HH TYR A 146 12.660 6.790 3.781 1.00 0.00 H new ATOM 2321 N ILE A 147 9.986 1.762 6.497 1.00 0.00 N ATOM 2322 CA ILE A 147 9.313 2.658 7.410 1.00 0.00 C ATOM 2323 C ILE A 147 9.735 4.083 7.126 1.00 0.00 C ATOM 2324 O ILE A 147 10.840 4.496 7.482 1.00 0.00 O ATOM 2325 CB ILE A 147 9.585 2.321 8.899 1.00 0.00 C ATOM 2326 CG1 ILE A 147 9.002 0.955 9.275 1.00 0.00 C ATOM 2327 CG2 ILE A 147 9.003 3.398 9.807 1.00 0.00 C ATOM 2328 CD1 ILE A 147 9.821 -0.227 8.797 1.00 0.00 C ATOM 0 H ILE A 147 10.906 1.446 6.805 1.00 0.00 H new ATOM 0 HA ILE A 147 8.242 2.536 7.246 1.00 0.00 H new ATOM 0 HB ILE A 147 10.666 2.284 9.036 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.906 0.900 10.359 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.997 0.876 8.861 1.00 0.00 H new ATOM 0 HG21 ILE A 147 9.204 3.144 10.848 1.00 0.00 H new ATOM 0 HG22 ILE A 147 9.462 4.358 9.573 1.00 0.00 H new ATOM 0 HG23 ILE A 147 7.926 3.463 9.651 1.00 0.00 H new ATOM 0 HD11 ILE A 147 9.337 -1.154 9.106 1.00 0.00 H new ATOM 0 HD12 ILE A 147 9.896 -0.202 7.710 1.00 0.00 H new ATOM 0 HD13 ILE A 147 10.820 -0.177 9.231 1.00 0.00 H new ATOM 2340 N ALA A 148 8.876 4.811 6.434 1.00 0.00 N ATOM 2341 CA ALA A 148 9.089 6.228 6.231 1.00 0.00 C ATOM 2342 C ALA A 148 8.892 6.941 7.556 1.00 0.00 C ATOM 2343 O ALA A 148 7.771 7.023 8.063 1.00 0.00 O ATOM 2344 CB ALA A 148 8.150 6.771 5.176 1.00 0.00 C ATOM 0 H ALA A 148 8.027 4.443 6.005 1.00 0.00 H new ATOM 0 HA ALA A 148 10.104 6.398 5.873 1.00 0.00 H new ATOM 0 HB1 ALA A 148 8.330 7.838 5.043 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.324 6.253 4.233 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.119 6.614 5.492 1.00 0.00 H new ATOM 2350 N GLU A 149 9.984 7.414 8.129 1.00 0.00 N ATOM 2351 CA GLU A 149 9.966 7.939 9.483 1.00 0.00 C ATOM 2352 C GLU A 149 9.108 9.178 9.610 1.00 0.00 C ATOM 2353 O GLU A 149 9.166 10.099 8.795 1.00 0.00 O ATOM 2354 CB GLU A 149 11.380 8.209 9.975 1.00 0.00 C ATOM 2355 CG GLU A 149 12.129 6.929 10.281 1.00 0.00 C ATOM 2356 CD GLU A 149 13.577 7.161 10.643 1.00 0.00 C ATOM 2357 OE1 GLU A 149 14.422 7.227 9.729 1.00 0.00 O ATOM 2358 OE2 GLU A 149 13.879 7.270 11.852 1.00 0.00 O ATOM 0 H GLU A 149 10.897 7.445 7.676 1.00 0.00 H new ATOM 0 HA GLU A 149 9.515 7.174 10.115 1.00 0.00 H new ATOM 0 HB2 GLU A 149 11.924 8.776 9.220 1.00 0.00 H new ATOM 0 HB3 GLU A 149 11.340 8.828 10.871 1.00 0.00 H new ATOM 0 HG2 GLU A 149 11.633 6.413 11.103 1.00 0.00 H new ATOM 0 HG3 GLU A 149 12.079 6.270 9.414 1.00 0.00 H new