USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 475 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 Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -148:sc= 1.24 (180deg=0.262) USER MOD Single : A 91 TYR OH : rot 180:sc= -0.33 USER MOD Single : A 93 SER OG : rot 80:sc= 0.627 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.335 X(o=-0.33,f=-0.52) USER MOD Single : A 97 MET CE :methyl -122:sc= -3.12! (180deg=-6.8!) USER MOD Single : A 98 SER OG : rot 180:sc= -0.467 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -161:sc= -0.0237 (180deg=-0.376) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot -95:sc= -1.29 USER MOD Single : A 142 ASN : amide:sc= -1.52 K(o=-1.5,f=-3.5!) USER MOD Single : A 145 ASN : amide:sc=-0.00188 X(o=-0.0019,f=-0.46) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 170:sc=-0.000572 (180deg=-0.0226) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot -165:sc= -1.62 USER MOD Single : A 164 GLN : amide:sc= -2.47 K(o=-2.5,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.955 -7.864 5.205 1.00 0.00 N ATOM 32 CA ARG A 59 -0.317 -8.006 4.527 1.00 0.00 C ATOM 33 C ARG A 59 -1.004 -9.297 4.959 1.00 0.00 C ATOM 34 O ARG A 59 -0.379 -10.354 5.037 1.00 0.00 O ATOM 35 CB ARG A 59 -0.101 -8.019 3.013 1.00 0.00 C ATOM 36 CG ARG A 59 -1.454 -7.949 2.310 1.00 0.00 C ATOM 37 CD ARG A 59 -1.368 -8.677 0.973 1.00 0.00 C ATOM 38 NE ARG A 59 -0.631 -7.880 0.000 1.00 0.00 N ATOM 39 CZ ARG A 59 -0.498 -8.283 -1.264 1.00 0.00 C ATOM 40 NH1 ARG A 59 -1.030 -9.413 -1.662 1.00 0.00 N ATOM 41 NH2 ARG A 59 0.163 -7.545 -2.114 1.00 0.00 N ATOM 0 HA ARG A 59 -0.952 -7.161 4.793 1.00 0.00 H new ATOM 0 HB2 ARG A 59 0.520 -7.174 2.715 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.429 -8.924 2.717 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -2.224 -8.402 2.934 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -1.741 -6.909 2.153 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -0.877 -9.640 1.109 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.371 -8.881 0.599 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.209 -6.998 0.291 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.551 -9.992 -1.003 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.923 -9.714 -2.631 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.576 -6.663 -1.810 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.267 -7.850 -3.082 1.00 0.00 H new ATOM 55 N VAL A 60 -2.296 -9.197 5.235 1.00 0.00 N ATOM 56 CA VAL A 60 -3.079 -10.352 5.656 1.00 0.00 C ATOM 57 C VAL A 60 -4.295 -10.533 4.757 1.00 0.00 C ATOM 58 O VAL A 60 -5.015 -9.577 4.467 1.00 0.00 O ATOM 59 CB VAL A 60 -3.529 -10.191 7.100 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.386 -11.390 7.512 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.305 -10.112 8.003 1.00 0.00 C ATOM 0 H VAL A 60 -2.826 -8.327 5.175 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.447 -11.236 5.576 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.117 -9.278 7.195 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.706 -11.270 8.547 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.262 -11.450 6.866 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.801 -12.305 7.417 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.624 -9.997 9.039 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.720 -11.026 7.903 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.694 -9.257 7.714 1.00 0.00 H new ATOM 71 N VAL A 61 -4.522 -11.763 4.321 1.00 0.00 N ATOM 72 CA VAL A 61 -5.660 -12.059 3.454 1.00 0.00 C ATOM 73 C VAL A 61 -6.642 -12.995 4.161 1.00 0.00 C ATOM 74 O VAL A 61 -6.278 -14.095 4.572 1.00 0.00 O ATOM 75 CB VAL A 61 -5.174 -12.720 2.161 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.375 -13.044 1.271 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.242 -11.760 1.423 1.00 0.00 C ATOM 0 H VAL A 61 -3.940 -12.569 4.549 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.166 -11.123 3.219 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.640 -13.640 2.400 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.029 -13.514 0.351 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -7.045 -13.724 1.797 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.908 -12.124 1.030 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.894 -12.227 0.502 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.780 -10.843 1.184 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.387 -11.525 2.056 1.00 0.00 H new ATOM 87 N VAL A 62 -7.887 -12.550 4.288 1.00 0.00 N ATOM 88 CA VAL A 62 -8.913 -13.361 4.940 1.00 0.00 C ATOM 89 C VAL A 62 -9.884 -13.916 3.899 1.00 0.00 C ATOM 90 O VAL A 62 -10.697 -13.184 3.344 1.00 0.00 O ATOM 91 CB VAL A 62 -9.683 -12.510 5.957 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.762 -13.358 6.633 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.709 -11.979 7.015 1.00 0.00 C ATOM 0 H VAL A 62 -8.210 -11.642 3.953 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.429 -14.190 5.456 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.157 -11.674 5.443 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.305 -12.748 7.354 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.455 -13.733 5.880 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.295 -14.198 7.147 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.253 -11.373 7.740 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.234 -12.817 7.526 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.945 -11.369 6.533 1.00 0.00 H new ATOM 103 N TYR A 63 -9.810 -15.219 3.654 1.00 0.00 N ATOM 104 CA TYR A 63 -10.683 -15.870 2.696 1.00 0.00 C ATOM 105 C TYR A 63 -12.030 -16.157 3.332 1.00 0.00 C ATOM 106 O TYR A 63 -12.118 -16.451 4.519 1.00 0.00 O ATOM 107 CB TYR A 63 -10.048 -17.178 2.216 1.00 0.00 C ATOM 108 CG TYR A 63 -8.870 -16.867 1.324 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.599 -16.668 1.881 1.00 0.00 C ATOM 110 CD2 TYR A 63 -9.051 -16.784 -0.065 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.506 -16.386 1.052 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.957 -16.498 -0.892 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.687 -16.300 -0.336 1.00 0.00 C ATOM 114 OH TYR A 63 -5.612 -16.021 -1.154 1.00 0.00 O ATOM 0 H TYR A 63 -9.148 -15.846 4.111 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.826 -15.208 1.842 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.724 -17.773 3.070 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.782 -17.773 1.673 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.463 -16.732 2.950 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -10.030 -16.940 -0.495 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.526 -16.235 1.481 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -8.093 -16.430 -1.961 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.909 -15.998 -2.088 1.00 0.00 H new ATOM 124 N ILE A 64 -13.066 -16.065 2.524 1.00 0.00 N ATOM 125 CA ILE A 64 -14.430 -16.306 2.991 1.00 0.00 C ATOM 126 C ILE A 64 -14.998 -17.580 2.374 1.00 0.00 C ATOM 127 O ILE A 64 -14.543 -18.026 1.331 1.00 0.00 O ATOM 128 CB ILE A 64 -15.326 -15.120 2.617 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.767 -13.839 3.241 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.750 -15.346 3.151 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.492 -12.607 2.670 1.00 0.00 C ATOM 0 H ILE A 64 -12.996 -15.824 1.535 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.403 -16.422 4.075 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.352 -15.029 1.531 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.888 -13.871 4.324 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.698 -13.765 3.041 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.379 -14.498 2.880 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.162 -16.257 2.716 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.720 -15.444 4.236 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.085 -11.703 3.122 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.349 -12.569 1.590 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.557 -12.676 2.893 1.00 0.00 H new ATOM 143 N ARG A 65 -15.998 -18.155 3.026 1.00 0.00 N ATOM 144 CA ARG A 65 -16.638 -19.367 2.523 1.00 0.00 C ATOM 145 C ARG A 65 -17.027 -19.199 1.057 1.00 0.00 C ATOM 146 O ARG A 65 -16.881 -18.119 0.487 1.00 0.00 O ATOM 147 CB ARG A 65 -17.891 -19.672 3.341 1.00 0.00 C ATOM 148 CG ARG A 65 -17.500 -20.042 4.768 1.00 0.00 C ATOM 149 CD ARG A 65 -16.858 -21.430 4.776 1.00 0.00 C ATOM 150 NE ARG A 65 -16.589 -21.846 6.144 1.00 0.00 N ATOM 151 CZ ARG A 65 -17.549 -22.360 6.914 1.00 0.00 C ATOM 152 NH1 ARG A 65 -18.772 -22.493 6.460 1.00 0.00 N ATOM 153 NH2 ARG A 65 -17.271 -22.727 8.135 1.00 0.00 N ATOM 0 H ARG A 65 -16.385 -17.805 3.902 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.930 -20.191 2.613 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.551 -18.805 3.349 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.445 -20.491 2.882 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -16.804 -19.305 5.169 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -18.380 -20.032 5.412 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -17.520 -22.149 4.292 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -15.931 -21.414 4.203 1.00 0.00 H new ATOM 0 HE ARG A 65 -15.647 -21.742 6.522 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -18.997 -22.202 5.509 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -19.498 -22.887 7.058 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.323 -22.620 8.496 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -18.002 -23.121 8.728 1.00 0.00 H new ATOM 517 N LYS A 89 -20.680 -7.715 5.686 1.00 0.00 N ATOM 518 CA LYS A 89 -20.570 -7.905 7.120 1.00 0.00 C ATOM 519 C LYS A 89 -19.124 -8.124 7.516 1.00 0.00 C ATOM 520 O LYS A 89 -18.652 -7.606 8.530 1.00 0.00 O ATOM 521 CB LYS A 89 -21.441 -9.081 7.557 1.00 0.00 C ATOM 522 CG LYS A 89 -21.470 -9.152 9.082 1.00 0.00 C ATOM 523 CD LYS A 89 -22.485 -10.205 9.523 1.00 0.00 C ATOM 524 CE LYS A 89 -22.582 -10.208 11.047 1.00 0.00 C ATOM 525 NZ LYS A 89 -23.637 -11.175 11.477 1.00 0.00 N ATOM 0 HA LYS A 89 -20.923 -7.006 7.626 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -22.452 -8.963 7.168 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.048 -10.011 7.146 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -20.480 -9.403 9.464 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.735 -8.180 9.497 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -23.460 -9.992 9.086 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -22.184 -11.189 9.165 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.622 -10.484 11.483 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -22.821 -9.208 11.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -24.086 -10.833 12.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -24.355 -11.261 10.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -23.205 -12.105 11.651 1.00 0.00 H new ATOM 539 N VAL A 90 -18.426 -8.890 6.697 1.00 0.00 N ATOM 540 CA VAL A 90 -17.023 -9.189 6.947 1.00 0.00 C ATOM 541 C VAL A 90 -16.178 -7.935 6.758 1.00 0.00 C ATOM 542 O VAL A 90 -15.224 -7.696 7.495 1.00 0.00 O ATOM 543 CB VAL A 90 -16.538 -10.302 6.020 1.00 0.00 C ATOM 544 CG1 VAL A 90 -15.038 -10.518 6.230 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.289 -11.597 6.341 1.00 0.00 C ATOM 0 H VAL A 90 -18.806 -9.318 5.852 1.00 0.00 H new ATOM 0 HA VAL A 90 -16.919 -9.531 7.977 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.725 -10.021 4.984 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.689 -11.312 5.570 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.502 -9.596 6.004 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.853 -10.800 7.266 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -16.943 -12.392 5.680 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.101 -11.879 7.377 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.358 -11.443 6.195 1.00 0.00 H new ATOM 555 N TYR A 91 -16.531 -7.149 5.747 1.00 0.00 N ATOM 556 CA TYR A 91 -15.806 -5.921 5.449 1.00 0.00 C ATOM 557 C TYR A 91 -15.877 -4.966 6.625 1.00 0.00 C ATOM 558 O TYR A 91 -14.892 -4.319 6.976 1.00 0.00 O ATOM 559 CB TYR A 91 -16.378 -5.247 4.195 1.00 0.00 C ATOM 560 CG TYR A 91 -15.605 -3.990 3.896 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.214 -4.042 3.744 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.279 -2.772 3.754 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.498 -2.874 3.458 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.562 -1.604 3.469 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.172 -1.654 3.322 1.00 0.00 C ATOM 566 OH TYR A 91 -13.464 -0.503 3.045 1.00 0.00 O ATOM 0 H TYR A 91 -17.313 -7.340 5.121 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.763 -6.178 5.264 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.323 -5.929 3.347 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.431 -5.010 4.346 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -13.694 -4.983 3.847 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.353 -2.733 3.864 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.425 -2.914 3.342 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.082 -0.664 3.363 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.083 0.254 2.982 1.00 0.00 H new ATOM 576 N ASP A 92 -17.054 -4.877 7.221 1.00 0.00 N ATOM 577 CA ASP A 92 -17.249 -3.976 8.355 1.00 0.00 C ATOM 578 C ASP A 92 -16.514 -4.499 9.581 1.00 0.00 C ATOM 579 O ASP A 92 -15.957 -3.728 10.361 1.00 0.00 O ATOM 580 CB ASP A 92 -18.741 -3.835 8.669 1.00 0.00 C ATOM 581 CG ASP A 92 -19.049 -4.462 10.025 1.00 0.00 C ATOM 582 OD1 ASP A 92 -19.339 -5.647 10.057 1.00 0.00 O ATOM 583 OD2 ASP A 92 -18.990 -3.748 11.013 1.00 0.00 O ATOM 0 H ASP A 92 -17.881 -5.407 6.947 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.846 -2.998 8.091 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.022 -2.782 8.673 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -19.332 -4.320 7.892 1.00 0.00 H new ATOM 588 N SER A 93 -16.507 -5.816 9.738 1.00 0.00 N ATOM 589 CA SER A 93 -15.829 -6.435 10.871 1.00 0.00 C ATOM 590 C SER A 93 -14.324 -6.235 10.761 1.00 0.00 C ATOM 591 O SER A 93 -13.650 -5.948 11.747 1.00 0.00 O ATOM 592 CB SER A 93 -16.152 -7.929 10.919 1.00 0.00 C ATOM 593 OG SER A 93 -17.537 -8.098 11.188 1.00 0.00 O ATOM 0 H SER A 93 -16.959 -6.472 9.101 1.00 0.00 H new ATOM 0 HA SER A 93 -16.180 -5.963 11.789 1.00 0.00 H new ATOM 0 HB2 SER A 93 -15.893 -8.400 9.971 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.557 -8.418 11.691 1.00 0.00 H new ATOM 0 HG SER A 93 -18.048 -7.973 10.361 1.00 0.00 H new ATOM 599 N LEU A 94 -13.807 -6.397 9.550 1.00 0.00 N ATOM 600 CA LEU A 94 -12.374 -6.232 9.312 1.00 0.00 C ATOM 601 C LEU A 94 -11.973 -4.767 9.397 1.00 0.00 C ATOM 602 O LEU A 94 -10.920 -4.431 9.923 1.00 0.00 O ATOM 603 CB LEU A 94 -11.994 -6.797 7.946 1.00 0.00 C ATOM 604 CG LEU A 94 -12.108 -8.325 7.970 1.00 0.00 C ATOM 605 CD1 LEU A 94 -11.997 -8.864 6.544 1.00 0.00 C ATOM 606 CD2 LEU A 94 -10.977 -8.912 8.826 1.00 0.00 C ATOM 0 H LEU A 94 -14.351 -6.640 8.722 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.839 -6.782 10.086 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.648 -6.386 7.177 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.976 -6.502 7.690 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.070 -8.610 8.396 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.078 -9.951 6.559 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.800 -8.449 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.034 -8.577 6.121 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.059 -9.999 8.842 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.014 -8.627 8.402 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.053 -8.527 9.843 1.00 0.00 H new ATOM 618 N LYS A 95 -12.827 -3.902 8.865 1.00 0.00 N ATOM 619 CA LYS A 95 -12.561 -2.469 8.874 1.00 0.00 C ATOM 620 C LYS A 95 -12.586 -1.912 10.289 1.00 0.00 C ATOM 621 O LYS A 95 -11.864 -0.964 10.604 1.00 0.00 O ATOM 622 CB LYS A 95 -13.606 -1.738 8.029 1.00 0.00 C ATOM 623 CG LYS A 95 -13.110 -1.630 6.589 1.00 0.00 C ATOM 624 CD LYS A 95 -12.446 -0.266 6.371 1.00 0.00 C ATOM 625 CE LYS A 95 -11.319 -0.399 5.345 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.910 0.954 4.877 1.00 0.00 N ATOM 0 H LYS A 95 -13.707 -4.166 8.423 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.567 -2.312 8.455 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.554 -2.275 8.059 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -13.789 -0.744 8.437 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.399 -2.429 6.378 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -13.943 -1.754 5.897 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.184 0.457 6.023 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.050 0.111 7.314 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.467 -0.914 5.789 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -11.651 -1.002 4.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.144 0.863 4.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.724 1.430 4.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.576 1.515 5.687 1.00 0.00 H new ATOM 640 N ASN A 96 -13.411 -2.509 11.141 1.00 0.00 N ATOM 641 CA ASN A 96 -13.517 -2.062 12.521 1.00 0.00 C ATOM 642 C ASN A 96 -12.401 -2.660 13.373 1.00 0.00 C ATOM 643 O ASN A 96 -12.379 -2.490 14.593 1.00 0.00 O ATOM 644 CB ASN A 96 -14.874 -2.468 13.095 1.00 0.00 C ATOM 645 CG ASN A 96 -15.101 -1.785 14.440 1.00 0.00 C ATOM 646 OD1 ASN A 96 -15.005 -2.423 15.486 1.00 0.00 O ATOM 647 ND2 ASN A 96 -15.391 -0.511 14.472 1.00 0.00 N ATOM 0 H ASN A 96 -14.011 -3.298 10.901 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.423 -0.976 12.538 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.668 -2.193 12.401 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -14.917 -3.550 13.216 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -15.538 -0.044 15.367 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -15.470 0.016 13.602 1.00 0.00 H new ATOM 654 N MET A 97 -11.478 -3.376 12.732 1.00 0.00 N ATOM 655 CA MET A 97 -10.381 -3.999 13.446 1.00 0.00 C ATOM 656 C MET A 97 -9.610 -2.977 14.244 1.00 0.00 C ATOM 657 O MET A 97 -8.963 -3.332 15.229 1.00 0.00 O ATOM 658 CB MET A 97 -9.434 -4.671 12.453 1.00 0.00 C ATOM 659 CG MET A 97 -9.976 -6.051 12.083 1.00 0.00 C ATOM 660 SD MET A 97 -9.611 -7.221 13.415 1.00 0.00 S ATOM 661 CE MET A 97 -9.227 -8.651 12.372 1.00 0.00 C ATOM 0 H MET A 97 -11.474 -3.535 11.724 1.00 0.00 H new ATOM 0 HA MET A 97 -10.797 -4.741 14.128 1.00 0.00 H new ATOM 0 HB2 MET A 97 -9.333 -4.057 11.558 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.440 -4.765 12.889 1.00 0.00 H new ATOM 0 HG2 MET A 97 -11.052 -5.998 11.916 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.525 -6.392 11.151 1.00 0.00 H new ATOM 0 HE1 MET A 97 -9.892 -9.476 12.627 1.00 0.00 H new ATOM 0 HE2 MET A 97 -9.365 -8.384 11.324 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.193 -8.954 12.536 1.00 0.00 H new ATOM 671 N SER A 98 -9.670 -1.704 13.819 1.00 0.00 N ATOM 672 CA SER A 98 -8.965 -0.625 14.509 1.00 0.00 C ATOM 673 C SER A 98 -7.477 -0.666 14.182 1.00 0.00 C ATOM 674 O SER A 98 -6.910 0.310 13.686 1.00 0.00 O ATOM 675 CB SER A 98 -9.176 -0.723 16.018 1.00 0.00 C ATOM 676 OG SER A 98 -10.471 -1.251 16.271 1.00 0.00 O ATOM 0 H SER A 98 -10.200 -1.403 13.001 1.00 0.00 H new ATOM 0 HA SER A 98 -9.373 0.325 14.163 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.415 -1.363 16.464 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.074 0.260 16.477 1.00 0.00 H new ATOM 0 HG SER A 98 -10.613 -1.319 17.238 1.00 0.00 H new ATOM 682 N THR A 99 -6.854 -1.807 14.445 1.00 0.00 N ATOM 683 CA THR A 99 -5.436 -1.983 14.162 1.00 0.00 C ATOM 684 C THR A 99 -5.198 -2.065 12.652 1.00 0.00 C ATOM 685 O THR A 99 -4.054 -2.022 12.180 1.00 0.00 O ATOM 686 CB THR A 99 -4.922 -3.257 14.843 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.069 -3.129 16.249 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.448 -3.467 14.496 1.00 0.00 C ATOM 0 H THR A 99 -7.308 -2.624 14.854 1.00 0.00 H new ATOM 0 HA THR A 99 -4.892 -1.123 14.554 1.00 0.00 H new ATOM 0 HB THR A 99 -5.497 -4.115 14.493 1.00 0.00 H new ATOM 0 HG1 THR A 99 -4.743 -3.943 16.687 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.085 -4.373 14.981 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.339 -3.565 13.416 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.867 -2.612 14.843 1.00 0.00 H new ATOM 696 N VAL A 100 -6.280 -2.194 11.888 1.00 0.00 N ATOM 697 CA VAL A 100 -6.168 -2.289 10.441 1.00 0.00 C ATOM 698 C VAL A 100 -6.082 -0.901 9.807 1.00 0.00 C ATOM 699 O VAL A 100 -6.803 0.018 10.197 1.00 0.00 O ATOM 700 CB VAL A 100 -7.387 -3.023 9.877 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.617 -2.118 9.968 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.129 -3.382 8.413 1.00 0.00 C ATOM 0 H VAL A 100 -7.234 -2.235 12.246 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.257 -2.840 10.205 1.00 0.00 H new ATOM 0 HB VAL A 100 -7.562 -3.932 10.452 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.484 -2.642 9.566 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.801 -1.858 11.010 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.443 -1.209 9.392 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -7.996 -3.905 8.008 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -6.955 -2.471 7.840 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -6.252 -4.026 8.345 1.00 0.00 H new ATOM 712 N LYS A 101 -5.199 -0.765 8.827 1.00 0.00 N ATOM 713 CA LYS A 101 -5.034 0.505 8.132 1.00 0.00 C ATOM 714 C LYS A 101 -6.031 0.618 6.981 1.00 0.00 C ATOM 715 O LYS A 101 -6.637 1.670 6.768 1.00 0.00 O ATOM 716 CB LYS A 101 -3.608 0.633 7.599 1.00 0.00 C ATOM 717 CG LYS A 101 -3.461 1.962 6.854 1.00 0.00 C ATOM 718 CD LYS A 101 -2.015 2.125 6.383 1.00 0.00 C ATOM 719 CE LYS A 101 -1.870 3.438 5.612 1.00 0.00 C ATOM 720 NZ LYS A 101 -2.627 3.347 4.332 1.00 0.00 N ATOM 0 H LYS A 101 -4.589 -1.513 8.497 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.223 1.312 8.840 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.895 0.584 8.422 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.382 -0.198 6.931 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.138 1.989 6.000 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.738 2.790 7.507 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.340 2.118 7.239 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.732 1.286 5.748 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.246 4.268 6.211 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.818 3.640 5.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.284 4.075 3.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.486 2.406 3.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -3.640 3.496 4.516 1.00 0.00 H new ATOM 734 N SER A 102 -6.188 -0.470 6.234 1.00 0.00 N ATOM 735 CA SER A 102 -7.102 -0.489 5.098 1.00 0.00 C ATOM 736 C SER A 102 -7.537 -1.914 4.790 1.00 0.00 C ATOM 737 O SER A 102 -6.796 -2.857 5.042 1.00 0.00 O ATOM 738 CB SER A 102 -6.426 0.123 3.871 1.00 0.00 C ATOM 739 OG SER A 102 -7.328 0.084 2.773 1.00 0.00 O ATOM 0 H SER A 102 -5.695 -1.348 6.395 1.00 0.00 H new ATOM 0 HA SER A 102 -7.983 0.100 5.352 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.131 1.152 4.078 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.516 -0.427 3.630 1.00 0.00 H new ATOM 0 HG SER A 102 -6.900 0.477 1.984 1.00 0.00 H new ATOM 745 N VAL A 103 -8.734 -2.052 4.240 1.00 0.00 N ATOM 746 CA VAL A 103 -9.264 -3.367 3.888 1.00 0.00 C ATOM 747 C VAL A 103 -9.790 -3.379 2.452 1.00 0.00 C ATOM 748 O VAL A 103 -10.580 -2.521 2.064 1.00 0.00 O ATOM 749 CB VAL A 103 -10.390 -3.756 4.843 1.00 0.00 C ATOM 750 CG1 VAL A 103 -10.994 -5.100 4.417 1.00 0.00 C ATOM 751 CG2 VAL A 103 -9.835 -3.868 6.268 1.00 0.00 C ATOM 0 H VAL A 103 -9.358 -1.274 4.027 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.451 -4.088 3.970 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.167 -2.992 4.814 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.797 -5.372 5.102 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.393 -5.016 3.406 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.222 -5.869 4.439 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.638 -4.146 6.951 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.056 -4.629 6.296 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.416 -2.909 6.572 1.00 0.00 H new ATOM 761 N THR A 104 -9.345 -4.358 1.670 1.00 0.00 N ATOM 762 CA THR A 104 -9.773 -4.476 0.283 1.00 0.00 C ATOM 763 C THR A 104 -10.489 -5.799 0.055 1.00 0.00 C ATOM 764 O THR A 104 -10.000 -6.854 0.433 1.00 0.00 O ATOM 765 CB THR A 104 -8.566 -4.380 -0.653 1.00 0.00 C ATOM 766 OG1 THR A 104 -7.941 -3.113 -0.494 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.019 -4.557 -2.103 1.00 0.00 C ATOM 0 H THR A 104 -8.690 -5.079 1.974 1.00 0.00 H new ATOM 0 HA THR A 104 -10.462 -3.659 0.068 1.00 0.00 H new ATOM 0 HB THR A 104 -7.854 -5.167 -0.405 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.167 -3.053 -1.092 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.156 -4.488 -2.765 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.489 -5.533 -2.221 1.00 0.00 H new ATOM 0 HG23 THR A 104 -9.735 -3.776 -2.358 1.00 0.00 H new ATOM 775 N PHE A 105 -11.657 -5.734 -0.562 1.00 0.00 N ATOM 776 CA PHE A 105 -12.431 -6.941 -0.826 1.00 0.00 C ATOM 777 C PHE A 105 -12.074 -7.521 -2.188 1.00 0.00 C ATOM 778 O PHE A 105 -12.348 -6.919 -3.227 1.00 0.00 O ATOM 779 CB PHE A 105 -13.925 -6.611 -0.794 1.00 0.00 C ATOM 780 CG PHE A 105 -14.723 -7.855 -1.111 1.00 0.00 C ATOM 781 CD1 PHE A 105 -14.643 -8.970 -0.274 1.00 0.00 C ATOM 782 CD2 PHE A 105 -15.557 -7.885 -2.236 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.389 -10.112 -0.558 1.00 0.00 C ATOM 784 CE2 PHE A 105 -16.302 -9.033 -2.522 1.00 0.00 C ATOM 785 CZ PHE A 105 -16.219 -10.146 -1.683 1.00 0.00 C ATOM 0 H PHE A 105 -12.089 -4.869 -0.888 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.197 -7.677 -0.057 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.203 -6.228 0.188 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.151 -5.827 -1.517 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -14.002 -8.947 0.595 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.624 -7.022 -2.882 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.326 -10.972 0.092 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -16.942 -9.059 -3.392 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.795 -11.033 -1.903 1.00 0.00 H new ATOM 795 N SER A 106 -11.468 -8.701 -2.176 1.00 0.00 N ATOM 796 CA SER A 106 -11.082 -9.365 -3.414 1.00 0.00 C ATOM 797 C SER A 106 -12.175 -10.332 -3.851 1.00 0.00 C ATOM 798 O SER A 106 -12.367 -11.384 -3.239 1.00 0.00 O ATOM 799 CB SER A 106 -9.772 -10.133 -3.214 1.00 0.00 C ATOM 800 OG SER A 106 -9.372 -10.707 -4.451 1.00 0.00 O ATOM 0 H SER A 106 -11.234 -9.216 -1.327 1.00 0.00 H new ATOM 0 HA SER A 106 -10.941 -8.608 -4.185 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.997 -9.463 -2.843 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.905 -10.913 -2.464 1.00 0.00 H new ATOM 0 HG SER A 106 -8.533 -11.198 -4.328 1.00 0.00 H new ATOM 806 N SER A 107 -12.895 -9.967 -4.905 1.00 0.00 N ATOM 807 CA SER A 107 -13.977 -10.804 -5.408 1.00 0.00 C ATOM 808 C SER A 107 -13.462 -12.198 -5.776 1.00 0.00 C ATOM 809 O SER A 107 -12.348 -12.357 -6.290 1.00 0.00 O ATOM 810 CB SER A 107 -14.612 -10.152 -6.639 1.00 0.00 C ATOM 811 OG SER A 107 -15.681 -10.969 -7.104 1.00 0.00 O ATOM 0 H SER A 107 -12.750 -9.102 -5.425 1.00 0.00 H new ATOM 0 HA SER A 107 -14.724 -10.905 -4.621 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.981 -9.157 -6.389 1.00 0.00 H new ATOM 0 HB3 SER A 107 -13.866 -10.027 -7.424 1.00 0.00 H new ATOM 0 HG SER A 107 -16.091 -10.554 -7.891 1.00 0.00 H new ATOM 817 N LYS A 108 -14.275 -13.210 -5.502 1.00 0.00 N ATOM 818 CA LYS A 108 -13.900 -14.583 -5.798 1.00 0.00 C ATOM 819 C LYS A 108 -13.608 -14.735 -7.288 1.00 0.00 C ATOM 820 O LYS A 108 -12.761 -15.536 -7.686 1.00 0.00 O ATOM 821 CB LYS A 108 -15.035 -15.529 -5.385 1.00 0.00 C ATOM 822 CG LYS A 108 -16.282 -15.235 -6.222 1.00 0.00 C ATOM 823 CD LYS A 108 -17.530 -15.689 -5.460 1.00 0.00 C ATOM 824 CE LYS A 108 -17.530 -17.214 -5.341 1.00 0.00 C ATOM 825 NZ LYS A 108 -18.842 -17.669 -4.798 1.00 0.00 N ATOM 0 H LYS A 108 -15.196 -13.105 -5.076 1.00 0.00 H new ATOM 0 HA LYS A 108 -13.001 -14.837 -5.237 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -14.727 -16.565 -5.525 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -15.258 -15.404 -4.326 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -16.344 -14.169 -6.439 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -16.220 -15.752 -7.180 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -17.548 -15.236 -4.469 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -18.428 -15.354 -5.980 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -17.352 -17.666 -6.317 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -16.721 -17.539 -4.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -18.843 -18.706 -4.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.994 -17.248 -3.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -19.605 -17.371 -5.439 1.00 0.00 H new ATOM 1237 N TYR A 134 -13.183 -18.526 -3.502 1.00 0.00 N ATOM 1238 CA TYR A 134 -14.089 -17.578 -2.874 1.00 0.00 C ATOM 1239 C TYR A 134 -13.452 -16.193 -2.797 1.00 0.00 C ATOM 1240 O TYR A 134 -12.386 -15.961 -3.364 1.00 0.00 O ATOM 1241 CB TYR A 134 -14.461 -18.047 -1.471 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.830 -19.391 -1.199 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.695 -19.479 -0.388 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -14.379 -20.550 -1.762 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -12.106 -20.724 -0.140 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -13.792 -21.793 -1.518 1.00 0.00 C ATOM 1247 CZ TYR A 134 -12.654 -21.882 -0.707 1.00 0.00 C ATOM 1248 OH TYR A 134 -12.072 -23.111 -0.470 1.00 0.00 O ATOM 0 HA TYR A 134 -14.991 -17.519 -3.483 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -14.123 -17.320 -0.733 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -15.545 -18.117 -1.376 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.272 -18.586 0.048 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -15.258 -20.482 -2.386 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -11.230 -20.792 0.488 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -14.215 -22.685 -1.955 1.00 0.00 H new ATOM 0 HH TYR A 134 -12.578 -23.808 -0.937 1.00 0.00 H new ATOM 1258 N ASP A 135 -14.111 -15.281 -2.090 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.599 -13.923 -1.947 1.00 0.00 C ATOM 1260 C ASP A 135 -12.635 -13.832 -0.768 1.00 0.00 C ATOM 1261 O ASP A 135 -12.765 -14.567 0.210 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.754 -12.953 -1.734 1.00 0.00 C ATOM 1263 CG ASP A 135 -16.001 -13.447 -2.460 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -16.700 -14.276 -1.898 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -16.240 -12.990 -3.565 1.00 0.00 O ATOM 0 H ASP A 135 -14.994 -15.455 -1.610 1.00 0.00 H new ATOM 0 HA ASP A 135 -13.064 -13.660 -2.860 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.961 -12.852 -0.669 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.479 -11.964 -2.100 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.666 -12.933 -0.873 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.678 -12.756 0.181 1.00 0.00 C ATOM 1272 C ALA A 136 -10.523 -11.282 0.532 1.00 0.00 C ATOM 1273 O ALA A 136 -10.553 -10.419 -0.335 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.334 -13.323 -0.276 1.00 0.00 C ATOM 0 H ALA A 136 -11.543 -12.316 -1.676 1.00 0.00 H new ATOM 0 HA ALA A 136 -11.017 -13.289 1.070 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.595 -13.190 0.514 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.443 -14.385 -0.496 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.004 -12.799 -1.173 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.354 -10.999 1.813 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.193 -9.625 2.272 1.00 0.00 C ATOM 1282 C TYR A 137 -8.721 -9.297 2.494 1.00 0.00 C ATOM 1283 O TYR A 137 -8.072 -9.877 3.361 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.950 -9.425 3.585 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.371 -9.030 3.296 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.417 -9.930 3.533 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.642 -7.759 2.788 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.736 -9.556 3.260 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.955 -7.383 2.517 1.00 0.00 C ATOM 1290 CZ TYR A 137 -15.006 -8.280 2.750 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.306 -7.918 2.469 1.00 0.00 O ATOM 0 H TYR A 137 -10.324 -11.699 2.554 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.593 -8.962 1.505 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -10.930 -10.344 4.171 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.463 -8.655 4.183 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.205 -10.913 3.927 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.833 -7.067 2.605 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.544 -10.249 3.442 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -14.164 -6.398 2.126 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.496 -8.088 1.523 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.203 -8.363 1.709 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.805 -7.968 1.829 1.00 0.00 C ATOM 1303 C ILE A 138 -6.702 -6.760 2.755 1.00 0.00 C ATOM 1304 O ILE A 138 -7.145 -5.669 2.414 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.247 -7.601 0.445 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.554 -8.727 -0.547 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.737 -7.404 0.550 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.147 -8.303 -1.959 1.00 0.00 C ATOM 0 H ILE A 138 -8.725 -7.867 0.987 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.228 -8.797 2.239 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.711 -6.679 0.094 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -6.018 -9.632 -0.261 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.617 -8.966 -0.522 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.335 -7.143 -0.429 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.523 -6.601 1.256 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.273 -8.327 0.899 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.368 -9.109 -2.659 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.703 -7.411 -2.245 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.079 -8.087 -1.980 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.116 -6.958 3.931 1.00 0.00 N ATOM 1321 CA VAL A 139 -5.986 -5.878 4.897 1.00 0.00 C ATOM 1322 C VAL A 139 -4.518 -5.546 5.124 1.00 0.00 C ATOM 1323 O VAL A 139 -3.645 -6.410 5.009 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.622 -6.303 6.225 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -8.017 -6.882 5.965 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -5.740 -7.348 6.902 1.00 0.00 C ATOM 0 H VAL A 139 -5.727 -7.850 4.235 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.493 -4.994 4.509 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.713 -5.436 6.879 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.468 -7.184 6.910 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.642 -6.126 5.490 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.935 -7.749 5.309 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.193 -7.650 7.846 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.642 -8.218 6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.754 -6.924 7.092 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.260 -4.294 5.457 1.00 0.00 N ATOM 1337 CA GLU A 140 -2.891 -3.851 5.710 1.00 0.00 C ATOM 1338 C GLU A 140 -2.684 -3.585 7.198 1.00 0.00 C ATOM 1339 O GLU A 140 -3.185 -2.601 7.741 1.00 0.00 O ATOM 1340 CB GLU A 140 -2.592 -2.577 4.913 1.00 0.00 C ATOM 1341 CG GLU A 140 -2.774 -2.854 3.419 1.00 0.00 C ATOM 1342 CD GLU A 140 -1.737 -3.867 2.947 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -0.724 -4.002 3.614 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -1.971 -4.493 1.928 1.00 0.00 O ATOM 0 H GLU A 140 -4.969 -3.568 5.559 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.210 -4.641 5.393 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.258 -1.774 5.228 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.573 -2.243 5.110 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -3.778 -3.234 3.231 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -2.673 -1.927 2.854 1.00 0.00 H new ATOM 1351 N ALA A 141 -1.937 -4.471 7.852 1.00 0.00 N ATOM 1352 CA ALA A 141 -1.673 -4.319 9.276 1.00 0.00 C ATOM 1353 C ALA A 141 -0.937 -3.015 9.549 1.00 0.00 C ATOM 1354 O ALA A 141 -0.034 -2.635 8.804 1.00 0.00 O ATOM 1355 CB ALA A 141 -0.836 -5.497 9.775 1.00 0.00 C ATOM 0 H ALA A 141 -1.509 -5.292 7.423 1.00 0.00 H new ATOM 0 HA ALA A 141 -2.626 -4.299 9.805 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -0.641 -5.379 10.841 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.379 -6.427 9.606 1.00 0.00 H new ATOM 0 HB3 ALA A 141 0.110 -5.526 9.234 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.326 -2.335 10.623 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.690 -1.071 10.974 1.00 0.00 C ATOM 1363 C ASN A 142 0.806 -1.269 11.178 1.00 0.00 C ATOM 1364 O ASN A 142 1.615 -0.425 10.787 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.309 -0.518 12.261 1.00 0.00 C ATOM 1366 CG ASN A 142 -0.789 0.889 12.542 1.00 0.00 C ATOM 1367 OD1 ASN A 142 0.336 1.226 12.172 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -1.547 1.741 13.175 1.00 0.00 N ATOM 0 H ASN A 142 -2.068 -2.633 11.257 1.00 0.00 H new ATOM 0 HA ASN A 142 -0.848 -0.365 10.159 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -2.395 -0.499 12.170 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -1.070 -1.174 13.098 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -1.208 2.684 13.363 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -2.479 1.464 13.482 1.00 0.00 H new ATOM 1375 N ALA A 143 1.172 -2.385 11.793 1.00 0.00 N ATOM 1376 CA ALA A 143 2.576 -2.675 12.048 1.00 0.00 C ATOM 1377 C ALA A 143 2.903 -4.128 11.689 1.00 0.00 C ATOM 1378 O ALA A 143 2.010 -4.982 11.596 1.00 0.00 O ATOM 1379 CB ALA A 143 2.904 -2.417 13.529 1.00 0.00 C ATOM 0 H ALA A 143 0.522 -3.099 12.122 1.00 0.00 H new ATOM 0 HA ALA A 143 3.183 -2.019 11.424 1.00 0.00 H new ATOM 0 HB1 ALA A 143 3.956 -2.636 13.712 1.00 0.00 H new ATOM 0 HB2 ALA A 143 2.704 -1.373 13.770 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.285 -3.059 14.156 1.00 0.00 H new ATOM 1385 N PRO A 144 4.166 -4.427 11.523 1.00 0.00 N ATOM 1386 CA PRO A 144 4.632 -5.803 11.183 1.00 0.00 C ATOM 1387 C PRO A 144 4.302 -6.793 12.296 1.00 0.00 C ATOM 1388 O PRO A 144 4.355 -8.003 12.097 1.00 0.00 O ATOM 1389 CB PRO A 144 6.147 -5.653 11.006 1.00 0.00 C ATOM 1390 CG PRO A 144 6.502 -4.404 11.739 1.00 0.00 C ATOM 1391 CD PRO A 144 5.297 -3.485 11.609 1.00 0.00 C ATOM 0 HA PRO A 144 4.145 -6.196 10.291 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.678 -6.513 11.413 1.00 0.00 H new ATOM 0 HB3 PRO A 144 6.416 -5.581 9.952 1.00 0.00 H new ATOM 0 HG2 PRO A 144 6.721 -4.615 12.786 1.00 0.00 H new ATOM 0 HG3 PRO A 144 7.393 -3.942 11.314 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.203 -2.820 12.467 1.00 0.00 H new ATOM 0 HD3 PRO A 144 5.365 -2.854 10.723 1.00 0.00 H new ATOM 1399 N ASN A 145 3.964 -6.277 13.471 1.00 0.00 N ATOM 1400 CA ASN A 145 3.606 -7.135 14.591 1.00 0.00 C ATOM 1401 C ASN A 145 2.086 -7.236 14.717 1.00 0.00 C ATOM 1402 O ASN A 145 1.572 -7.981 15.553 1.00 0.00 O ATOM 1403 CB ASN A 145 4.193 -6.575 15.883 1.00 0.00 C ATOM 1404 CG ASN A 145 5.713 -6.596 15.812 1.00 0.00 C ATOM 1405 OD1 ASN A 145 6.302 -7.598 15.405 1.00 0.00 O ATOM 1406 ND2 ASN A 145 6.389 -5.543 16.182 1.00 0.00 N ATOM 0 H ASN A 145 3.931 -5.277 13.671 1.00 0.00 H new ATOM 0 HA ASN A 145 4.013 -8.130 14.412 1.00 0.00 H new ATOM 0 HB2 ASN A 145 3.842 -5.555 16.041 1.00 0.00 H new ATOM 0 HB3 ASN A 145 3.852 -7.165 16.734 1.00 0.00 H new ATOM 0 HD21 ASN A 145 7.408 -5.548 16.135 1.00 0.00 H new ATOM 0 HD22 ASN A 145 5.899 -4.714 16.519 1.00 0.00 H new ATOM 1413 N ASP A 146 1.360 -6.472 13.894 1.00 0.00 N ATOM 1414 CA ASP A 146 -0.098 -6.479 13.932 1.00 0.00 C ATOM 1415 C ASP A 146 -0.658 -7.493 12.944 1.00 0.00 C ATOM 1416 O ASP A 146 -1.753 -8.005 13.128 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.631 -5.084 13.585 1.00 0.00 C ATOM 1418 CG ASP A 146 -0.298 -4.105 14.705 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.067 -4.563 15.776 1.00 0.00 O ATOM 1420 OD2 ASP A 146 -0.411 -2.912 14.477 1.00 0.00 O ATOM 0 H ASP A 146 1.761 -5.844 13.197 1.00 0.00 H new ATOM 0 HA ASP A 146 -0.415 -6.756 14.937 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.192 -4.741 12.648 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.710 -5.125 13.435 1.00 0.00 H new ATOM 1425 N VAL A 147 0.114 -7.775 11.912 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.301 -8.746 10.893 1.00 0.00 C ATOM 1427 C VAL A 147 -0.769 -10.028 11.563 1.00 0.00 C ATOM 1428 O VAL A 147 -1.700 -10.684 11.098 1.00 0.00 O ATOM 1429 CB VAL A 147 0.860 -9.057 9.931 1.00 0.00 C ATOM 1430 CG1 VAL A 147 2.201 -8.792 10.624 1.00 0.00 C ATOM 1431 CG2 VAL A 147 0.809 -10.532 9.510 1.00 0.00 C ATOM 0 H VAL A 147 1.028 -7.353 11.749 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.121 -8.315 10.319 1.00 0.00 H new ATOM 0 HB VAL A 147 0.764 -8.417 9.054 1.00 0.00 H new ATOM 0 HG11 VAL A 147 3.016 -9.015 9.936 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.255 -7.745 10.924 1.00 0.00 H new ATOM 0 HG13 VAL A 147 2.287 -9.427 11.506 1.00 0.00 H new ATOM 0 HG21 VAL A 147 1.633 -10.745 8.829 1.00 0.00 H new ATOM 0 HG22 VAL A 147 0.895 -11.166 10.393 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -0.137 -10.735 9.008 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.121 -10.364 12.657 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.482 -11.576 13.400 1.00 0.00 C ATOM 1443 C LYS A 148 -1.768 -11.360 14.191 1.00 0.00 C ATOM 1444 O LYS A 148 -2.564 -12.280 14.377 1.00 0.00 O ATOM 1445 CB LYS A 148 0.643 -11.972 14.361 1.00 0.00 C ATOM 1446 CG LYS A 148 1.067 -10.758 15.194 1.00 0.00 C ATOM 1447 CD LYS A 148 0.884 -11.061 16.680 1.00 0.00 C ATOM 1448 CE LYS A 148 2.154 -11.708 17.233 1.00 0.00 C ATOM 1449 NZ LYS A 148 2.739 -10.829 18.283 1.00 0.00 N ATOM 0 H LYS A 148 0.651 -9.830 13.057 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.637 -12.377 12.678 1.00 0.00 H new ATOM 0 HB2 LYS A 148 0.307 -12.775 15.017 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.495 -12.355 13.799 1.00 0.00 H new ATOM 0 HG2 LYS A 148 2.109 -10.511 14.989 1.00 0.00 H new ATOM 0 HG3 LYS A 148 0.472 -9.888 14.915 1.00 0.00 H new ATOM 0 HD2 LYS A 148 0.665 -10.142 17.224 1.00 0.00 H new ATOM 0 HD3 LYS A 148 0.033 -11.727 16.823 1.00 0.00 H new ATOM 0 HE2 LYS A 148 1.924 -12.688 17.650 1.00 0.00 H new ATOM 0 HE3 LYS A 148 2.875 -11.864 16.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 3.603 -11.267 18.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 2.972 -9.903 17.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 2.051 -10.702 19.052 1.00 0.00 H new ATOM 1463 N THR A 149 -1.961 -10.135 14.652 1.00 0.00 N ATOM 1464 CA THR A 149 -3.147 -9.778 15.418 1.00 0.00 C ATOM 1465 C THR A 149 -4.370 -9.728 14.511 1.00 0.00 C ATOM 1466 O THR A 149 -5.466 -10.127 14.892 1.00 0.00 O ATOM 1467 CB THR A 149 -2.948 -8.431 16.117 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.797 -8.496 16.951 1.00 0.00 O ATOM 1469 CG2 THR A 149 -4.174 -8.117 16.981 1.00 0.00 C ATOM 0 H THR A 149 -1.307 -9.365 14.508 1.00 0.00 H new ATOM 0 HA THR A 149 -3.309 -10.542 16.178 1.00 0.00 H new ATOM 0 HB THR A 149 -2.817 -7.651 15.367 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.668 -7.633 17.398 1.00 0.00 H new ATOM 0 HG21 THR A 149 -4.032 -7.158 17.479 1.00 0.00 H new ATOM 0 HG22 THR A 149 -5.062 -8.071 16.350 1.00 0.00 H new ATOM 0 HG23 THR A 149 -4.301 -8.899 17.730 1.00 0.00 H new ATOM 1477 N ILE A 150 -4.183 -9.200 13.316 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.277 -9.080 12.368 1.00 0.00 C ATOM 1479 C ILE A 150 -5.690 -10.446 11.858 1.00 0.00 C ATOM 1480 O ILE A 150 -6.875 -10.732 11.698 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.856 -8.187 11.195 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.421 -6.815 11.721 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -6.040 -8.007 10.246 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.605 -6.074 12.359 1.00 0.00 C ATOM 0 H ILE A 150 -3.287 -8.848 12.978 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.129 -8.627 12.875 1.00 0.00 H new ATOM 0 HB ILE A 150 -4.025 -8.654 10.666 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.625 -6.938 12.455 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -4.012 -6.221 10.904 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.744 -7.372 9.411 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.355 -8.980 9.869 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.867 -7.540 10.781 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.272 -5.103 12.725 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.389 -5.932 11.615 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.996 -6.660 13.190 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.703 -11.290 11.601 1.00 0.00 N ATOM 1497 CA ALA A 151 -4.977 -12.633 11.106 1.00 0.00 C ATOM 1498 C ALA A 151 -5.682 -13.465 12.163 1.00 0.00 C ATOM 1499 O ALA A 151 -6.623 -14.204 11.864 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.663 -13.313 10.697 1.00 0.00 C ATOM 0 H ALA A 151 -3.714 -11.074 11.725 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.631 -12.555 10.238 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -3.872 -14.317 10.328 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.181 -12.731 9.912 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.001 -13.375 11.561 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.227 -13.337 13.402 1.00 0.00 N ATOM 1507 CA GLU A 152 -5.828 -14.100 14.495 1.00 0.00 C ATOM 1508 C GLU A 152 -7.192 -13.532 14.856 1.00 0.00 C ATOM 1509 O GLU A 152 -8.099 -14.269 15.234 1.00 0.00 O ATOM 1510 CB GLU A 152 -4.901 -14.087 15.716 1.00 0.00 C ATOM 1511 CG GLU A 152 -4.872 -12.692 16.319 1.00 0.00 C ATOM 1512 CD GLU A 152 -3.910 -12.644 17.496 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -3.260 -13.645 17.747 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -3.840 -11.606 18.133 1.00 0.00 O ATOM 0 H GLU A 152 -4.458 -12.725 13.676 1.00 0.00 H new ATOM 0 HA GLU A 152 -5.964 -15.131 14.168 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.248 -14.807 16.457 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -3.895 -14.389 15.425 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -4.568 -11.968 15.563 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -5.872 -12.410 16.647 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.326 -12.215 14.732 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.582 -11.546 15.034 1.00 0.00 C ATOM 1523 C ASP A 153 -9.626 -11.857 13.964 1.00 0.00 C ATOM 1524 O ASP A 153 -10.810 -11.991 14.257 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.370 -10.034 15.137 1.00 0.00 C ATOM 1526 CG ASP A 153 -7.643 -9.694 16.435 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -7.524 -10.573 17.274 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -7.223 -8.558 16.573 1.00 0.00 O ATOM 0 H ASP A 153 -6.579 -11.592 14.424 1.00 0.00 H new ATOM 0 HA ASP A 153 -8.945 -11.916 15.993 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.791 -9.681 14.284 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -9.331 -9.521 15.104 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.170 -11.969 12.720 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.061 -12.260 11.606 1.00 0.00 C ATOM 1535 C ALA A 154 -10.678 -13.641 11.769 1.00 0.00 C ATOM 1536 O ALA A 154 -11.805 -13.884 11.348 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.302 -12.165 10.282 1.00 0.00 C ATOM 0 H ALA A 154 -8.189 -11.862 12.460 1.00 0.00 H new ATOM 0 HA ALA A 154 -10.864 -11.523 11.599 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -9.980 -12.385 9.457 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -8.901 -11.158 10.164 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.483 -12.884 10.280 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.919 -14.540 12.375 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.399 -15.905 12.588 1.00 0.00 C ATOM 1545 C LYS A 155 -11.649 -15.910 13.462 1.00 0.00 C ATOM 1546 O LYS A 155 -12.421 -16.870 13.453 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.315 -16.748 13.262 1.00 0.00 C ATOM 1548 CG LYS A 155 -8.179 -17.021 12.277 1.00 0.00 C ATOM 1549 CD LYS A 155 -8.669 -17.966 11.184 1.00 0.00 C ATOM 1550 CE LYS A 155 -7.471 -18.650 10.525 1.00 0.00 C ATOM 1551 NZ LYS A 155 -7.930 -19.415 9.329 1.00 0.00 N ATOM 0 H LYS A 155 -8.979 -14.357 12.726 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.643 -16.330 11.614 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -8.930 -16.227 14.139 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -9.739 -17.689 13.611 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.833 -16.086 11.836 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -7.329 -17.461 12.799 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -9.339 -18.713 11.609 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -9.240 -17.412 10.439 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.730 -17.906 10.232 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -6.986 -19.320 11.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -7.104 -19.739 8.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -8.487 -20.238 9.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -8.520 -18.802 8.730 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.848 -14.831 14.207 1.00 0.00 N ATOM 1566 CA LYS A 156 -13.017 -14.720 15.077 1.00 0.00 C ATOM 1567 C LYS A 156 -14.234 -14.215 14.294 1.00 0.00 C ATOM 1568 O LYS A 156 -15.335 -14.125 14.839 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.720 -13.760 16.229 1.00 0.00 C ATOM 1570 CG LYS A 156 -11.897 -14.483 17.295 1.00 0.00 C ATOM 1571 CD LYS A 156 -10.429 -14.070 17.169 1.00 0.00 C ATOM 1572 CE LYS A 156 -9.543 -15.122 17.842 1.00 0.00 C ATOM 1573 NZ LYS A 156 -9.146 -14.646 19.197 1.00 0.00 N ATOM 0 H LYS A 156 -11.223 -14.025 14.229 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.242 -15.710 15.473 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -12.175 -12.891 15.861 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -13.651 -13.393 16.660 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -12.272 -14.237 18.289 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -11.994 -15.562 17.176 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -10.158 -13.969 16.118 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -10.273 -13.096 17.634 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -10.079 -16.068 17.920 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -8.656 -15.307 17.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -8.544 -15.361 19.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -8.619 -13.754 19.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -9.997 -14.491 19.774 1.00 0.00 H new ATOM 1587 N ILE A 157 -14.033 -13.893 13.016 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.114 -13.407 12.180 1.00 0.00 C ATOM 1589 C ILE A 157 -15.808 -14.571 11.473 1.00 0.00 C ATOM 1590 O ILE A 157 -15.194 -15.316 10.703 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.564 -12.427 11.146 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -14.004 -11.188 11.856 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.679 -12.008 10.193 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -13.233 -10.320 10.854 1.00 0.00 C ATOM 0 H ILE A 157 -13.131 -13.962 12.544 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.843 -12.898 12.810 1.00 0.00 H new ATOM 0 HB ILE A 157 -13.767 -12.911 10.581 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -14.817 -10.613 12.299 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -13.346 -11.491 12.671 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.284 -11.309 9.456 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.072 -12.888 9.684 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.478 -11.528 10.757 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -12.837 -9.441 11.363 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -12.410 -10.896 10.431 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -13.903 -10.005 10.054 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.098 -14.710 11.732 1.00 0.00 N ATOM 1607 CA GLU A 158 -17.880 -15.774 11.116 1.00 0.00 C ATOM 1608 C GLU A 158 -17.823 -15.672 9.596 1.00 0.00 C ATOM 1609 O GLU A 158 -17.727 -14.580 9.038 1.00 0.00 O ATOM 1610 CB GLU A 158 -19.330 -15.703 11.586 1.00 0.00 C ATOM 1611 CG GLU A 158 -19.869 -14.298 11.337 1.00 0.00 C ATOM 1612 CD GLU A 158 -21.310 -14.199 11.830 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -21.827 -15.202 12.296 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -21.873 -13.123 11.737 1.00 0.00 O ATOM 0 H GLU A 158 -17.625 -14.104 12.361 1.00 0.00 H new ATOM 0 HA GLU A 158 -17.453 -16.731 11.418 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -19.934 -16.437 11.053 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -19.394 -15.947 12.646 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -19.248 -13.565 11.852 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -19.823 -14.065 10.273 1.00 0.00 H new ATOM 1621 N GLY A 159 -17.874 -16.822 8.932 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.817 -16.853 7.475 1.00 0.00 C ATOM 1623 C GLY A 159 -16.378 -17.000 6.988 1.00 0.00 C ATOM 1624 O GLY A 159 -16.137 -17.226 5.803 1.00 0.00 O ATOM 0 H GLY A 159 -17.954 -17.737 9.375 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -18.418 -17.682 7.101 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.250 -15.938 7.071 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.418 -16.879 7.906 1.00 0.00 N ATOM 1629 CA VAL A 160 -14.015 -17.011 7.543 1.00 0.00 C ATOM 1630 C VAL A 160 -13.715 -18.443 7.101 1.00 0.00 C ATOM 1631 O VAL A 160 -14.044 -19.404 7.798 1.00 0.00 O ATOM 1632 CB VAL A 160 -13.139 -16.645 8.743 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -13.426 -17.603 9.902 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -11.666 -16.749 8.350 1.00 0.00 C ATOM 0 H VAL A 160 -15.588 -16.692 8.894 1.00 0.00 H new ATOM 0 HA VAL A 160 -13.798 -16.336 6.715 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.362 -15.624 9.054 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -12.801 -17.340 10.755 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -14.476 -17.528 10.185 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -13.206 -18.625 9.592 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -11.042 -16.488 9.205 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -11.444 -17.769 8.037 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -11.460 -16.064 7.528 1.00 0.00 H new ATOM 1644 N SER A 161 -13.076 -18.578 5.947 1.00 0.00 N ATOM 1645 CA SER A 161 -12.723 -19.893 5.423 1.00 0.00 C ATOM 1646 C SER A 161 -11.255 -20.198 5.694 1.00 0.00 C ATOM 1647 O SER A 161 -10.905 -21.309 6.085 1.00 0.00 O ATOM 1648 CB SER A 161 -12.982 -19.940 3.919 1.00 0.00 C ATOM 1649 OG SER A 161 -12.255 -18.896 3.282 1.00 0.00 O ATOM 0 H SER A 161 -12.792 -17.797 5.356 1.00 0.00 H new ATOM 0 HA SER A 161 -13.339 -20.641 5.923 1.00 0.00 H new ATOM 0 HB2 SER A 161 -12.679 -20.907 3.517 1.00 0.00 H new ATOM 0 HB3 SER A 161 -14.048 -19.831 3.719 1.00 0.00 H new ATOM 0 HG SER A 161 -12.594 -18.769 2.371 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.402 -19.202 5.483 1.00 0.00 N ATOM 1656 CA GLU A 162 -8.966 -19.386 5.711 1.00 0.00 C ATOM 1657 C GLU A 162 -8.238 -18.048 5.695 1.00 0.00 C ATOM 1658 O GLU A 162 -8.604 -17.150 4.959 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.377 -20.308 4.642 1.00 0.00 C ATOM 1660 CG GLU A 162 -6.910 -20.592 4.967 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.343 -21.606 3.979 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -7.090 -22.049 3.121 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.171 -21.925 4.093 1.00 0.00 O ATOM 0 H GLU A 162 -10.669 -18.272 5.160 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.833 -19.841 6.692 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.939 -21.241 4.601 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.460 -19.843 3.660 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.334 -19.668 4.923 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -6.822 -20.974 5.984 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.203 -17.919 6.513 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.449 -16.670 6.570 1.00 0.00 C ATOM 1672 C VAL A 163 -4.960 -16.937 6.372 1.00 0.00 C ATOM 1673 O VAL A 163 -4.396 -17.847 6.981 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.662 -15.995 7.923 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -5.932 -14.650 7.945 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -8.156 -15.772 8.149 1.00 0.00 C ATOM 0 H VAL A 163 -6.868 -18.651 7.139 1.00 0.00 H new ATOM 0 HA VAL A 163 -6.804 -16.016 5.773 1.00 0.00 H new ATOM 0 HB VAL A 163 -6.267 -16.632 8.714 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -6.085 -14.169 8.911 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -4.866 -14.812 7.785 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.325 -14.010 7.155 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.310 -15.290 9.115 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -8.553 -15.135 7.358 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -8.673 -16.731 8.136 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.329 -16.136 5.524 1.00 0.00 N ATOM 1687 CA GLN A 164 -2.900 -16.293 5.263 1.00 0.00 C ATOM 1688 C GLN A 164 -2.224 -14.928 5.166 1.00 0.00 C ATOM 1689 O GLN A 164 -2.749 -14.004 4.548 1.00 0.00 O ATOM 1690 CB GLN A 164 -2.686 -17.068 3.961 1.00 0.00 C ATOM 1691 CG GLN A 164 -3.096 -16.197 2.771 1.00 0.00 C ATOM 1692 CD GLN A 164 -1.872 -15.499 2.183 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -0.772 -16.053 2.193 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -1.994 -14.308 1.667 1.00 0.00 N ATOM 0 H GLN A 164 -4.776 -15.378 5.009 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.456 -16.849 6.089 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -1.640 -17.360 3.868 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.273 -17.986 3.972 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -3.575 -16.812 2.009 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -3.829 -15.456 3.089 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -2.904 -13.847 1.657 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -1.180 -13.837 1.273 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.055 -14.808 5.787 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.314 -13.550 5.763 1.00 0.00 C ATOM 1705 C ASP A 165 0.612 -13.490 4.553 1.00 0.00 C ATOM 1706 O ASP A 165 0.673 -14.430 3.761 1.00 0.00 O ATOM 1707 CB ASP A 165 0.503 -13.401 7.048 1.00 0.00 C ATOM 1708 CG ASP A 165 1.586 -14.476 7.112 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.560 -15.369 6.280 1.00 0.00 O ATOM 1710 OD2 ASP A 165 2.427 -14.388 7.990 1.00 0.00 O ATOM 0 H ASP A 165 -0.603 -15.559 6.309 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.030 -12.731 5.692 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.960 -12.412 7.085 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.152 -13.482 7.916 1.00 0.00 H new ATOM 1715 N GLY A 166 1.336 -12.384 4.422 1.00 0.00 N ATOM 1716 CA GLY A 166 2.261 -12.218 3.311 1.00 0.00 C ATOM 1717 C GLY A 166 2.857 -10.813 3.298 1.00 0.00 C ATOM 1718 O GLY A 166 2.550 -9.987 4.157 1.00 0.00 O ATOM 0 H GLY A 166 1.300 -11.595 5.067 1.00 0.00 H new ATOM 0 HA2 GLY A 166 3.061 -12.955 3.386 1.00 0.00 H new ATOM 0 HA3 GLY A 166 1.742 -12.405 2.371 1.00 0.00 H new