USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1182 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 NoAdj-H: A 44 HIS HE2 : A 44 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 49 HIS HE2 : A 49 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 81 HIS HE2 : A 81 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 85 HIS HE2 : A 85 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 111 HIS HE2 : A 111 HIS NE2 : A 601 ZNZN :(H bumps) USER MOD NoAdj-H: A 115 HIS HE2 : A 115 HIS NE2 : A 601 ZNZN :(H bumps) USER MOD NoAdj-H: A 141 HIS HE2 : A 141 HIS NE2 : A 801 ZNZN :(H bumps) USER MOD NoAdj-H: A 145 HIS HE2 : A 145 HIS NE2 : A 801 ZNZN :(H bumps) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 30:sc= 0.806 USER MOD Single : A 3 SER OG : rot 13:sc= 0.993 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -3.35! K(o=-3.4!,f=-0.31) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -6.12! K(o=-6.1!,f=-2.4) USER MOD Single : A 15 SER OG : rot 34:sc= 0.0279 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -5.93! C(o=-5.9!,f=-13!) USER MOD Single : A 25 SER OG : rot 150:sc= -0.017 USER MOD Single : A 28 LYS NZ :NH3+ -147:sc= -0.881 (180deg=-1.23) USER MOD Single : A 29 LYS NZ :NH3+ -121:sc= -0.0398 (180deg=-1.24) USER MOD Single : A 30 SER OG : rot 180:sc= 0.0238 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= -1.47 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.339 USER MOD Single : A 38 MET CE :methyl -179:sc= -3.44! (180deg=-3.47!) USER MOD Single : A 39 HIS : no HD1:sc=-0.00733 X(o=-0.0073,f=-0.0046) USER MOD Single : A 43 THR OG1 : rot 80:sc= 0.0496 USER MOD Single : A 46 THR OG1 : rot 81:sc= 1.07 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -2.45! K(o=-2.5!,f=-0.74) USER MOD Single : A 56 ASN : amide:sc= -1.47! C(o=-1.5!,f=-0.86!) USER MOD Single : A 57 ASN : amide:sc= -1.49! C(o=-1.5!,f=-5!) USER MOD Single : A 58 HIS : no HD1:sc= -0.8 K(o=-0.8,f=-2.3!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 158:sc=-0.00529 (180deg=-0.416) USER MOD Single : A 75 LYS NZ :NH3+ -100:sc= -0.0013 (180deg=-0.208) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 161:sc= 1.1 (180deg=0.622) USER MOD Single : A 80 ASN : amide:sc= -0.669 K(o=-0.67,f=-2.1) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.331 USER MOD Single : A 89 LYS NZ :NH3+ -145:sc= -0.0122 (180deg=-0.16) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 105:sc= -0.92 USER MOD Single : A 107 ASN : amide:sc= -0.6 K(o=-0.6,f=0) USER MOD Single : A 109 LYS NZ :NH3+ -144:sc= 0.985 (180deg=0.174) USER MOD Single : A 112 LYS NZ :NH3+ -137:sc= -2.18 (180deg=-3.75!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 93:sc= 1.21 USER MOD Single : A 119 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.113) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc= -4.25! C(o=-4.3!,f=-3.4!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ -136:sc= -0.32 (180deg=-2.15!) USER MOD Single : A 142 MET CE :methyl -140:sc= -2.33 (180deg=-6.26!) USER MOD Single : A 143 HIS : no HD1:sc= -0.17 X(o=-0.17,f=-0.0098) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0.0182 USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= -0.448 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -24.953 21.130 -49.873 1.00 0.00 N ATOM 2 CA GLY A 1 -25.404 19.760 -49.715 1.00 0.00 C ATOM 3 C GLY A 1 -24.653 18.795 -50.611 1.00 0.00 C ATOM 4 O GLY A 1 -25.067 18.536 -51.740 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.497 21.750 -49.239 1.00 0.00 H new ATOM 0 H2 GLY A 1 -23.943 21.192 -49.635 1.00 0.00 H new ATOM 0 H3 GLY A 1 -25.096 21.431 -50.858 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -25.279 19.457 -48.675 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -26.469 19.704 -49.938 1.00 0.00 H new ATOM 8 N SER A 2 -23.543 18.264 -50.107 1.00 0.00 N ATOM 9 CA SER A 2 -22.729 17.327 -50.872 1.00 0.00 C ATOM 10 C SER A 2 -22.259 16.172 -49.993 1.00 0.00 C ATOM 11 O SER A 2 -21.529 16.373 -49.022 1.00 0.00 O ATOM 12 CB SER A 2 -21.521 18.045 -51.478 1.00 0.00 C ATOM 13 OG SER A 2 -20.609 18.448 -50.471 1.00 0.00 O ATOM 0 H SER A 2 -23.187 18.467 -49.173 1.00 0.00 H new ATOM 0 HA SER A 2 -23.344 16.922 -51.676 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.019 17.385 -52.185 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.856 18.917 -52.039 1.00 0.00 H new ATOM 0 HG SER A 2 -20.659 17.825 -49.716 1.00 0.00 H new ATOM 19 N SER A 3 -22.684 14.962 -50.340 1.00 0.00 N ATOM 20 CA SER A 3 -22.311 13.774 -49.581 1.00 0.00 C ATOM 21 C SER A 3 -22.508 12.512 -50.416 1.00 0.00 C ATOM 22 O SER A 3 -23.631 12.158 -50.772 1.00 0.00 O ATOM 23 CB SER A 3 -23.137 13.683 -48.297 1.00 0.00 C ATOM 24 OG SER A 3 -24.460 13.254 -48.570 1.00 0.00 O ATOM 0 H SER A 3 -23.287 14.778 -51.142 1.00 0.00 H new ATOM 0 HA SER A 3 -21.256 13.856 -49.321 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.662 12.989 -47.604 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.161 14.656 -47.807 1.00 0.00 H new ATOM 0 HG SER A 3 -24.509 12.907 -49.485 1.00 0.00 H new ATOM 30 N GLY A 4 -21.405 11.836 -50.725 1.00 0.00 N ATOM 31 CA GLY A 4 -21.477 10.621 -51.516 1.00 0.00 C ATOM 32 C GLY A 4 -20.705 9.476 -50.890 1.00 0.00 C ATOM 33 O GLY A 4 -20.213 9.591 -49.768 1.00 0.00 O ATOM 0 H GLY A 4 -20.464 12.108 -50.442 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.521 10.330 -51.635 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.085 10.817 -52.514 1.00 0.00 H new ATOM 37 N SER A 5 -20.600 8.369 -51.618 1.00 0.00 N ATOM 38 CA SER A 5 -19.887 7.196 -51.125 1.00 0.00 C ATOM 39 C SER A 5 -18.527 7.587 -50.555 1.00 0.00 C ATOM 40 O SER A 5 -17.855 8.476 -51.077 1.00 0.00 O ATOM 41 CB SER A 5 -19.708 6.173 -52.248 1.00 0.00 C ATOM 42 OG SER A 5 -18.806 5.148 -51.866 1.00 0.00 O ATOM 0 H SER A 5 -20.999 8.260 -52.550 1.00 0.00 H new ATOM 0 HA SER A 5 -20.480 6.749 -50.327 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.673 5.736 -52.503 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.338 6.672 -53.143 1.00 0.00 H new ATOM 0 HG SER A 5 -18.710 4.506 -52.600 1.00 0.00 H new ATOM 48 N SER A 6 -18.127 6.914 -49.481 1.00 0.00 N ATOM 49 CA SER A 6 -16.849 7.192 -48.837 1.00 0.00 C ATOM 50 C SER A 6 -16.422 6.027 -47.949 1.00 0.00 C ATOM 51 O SER A 6 -17.258 5.337 -47.367 1.00 0.00 O ATOM 52 CB SER A 6 -16.941 8.473 -48.006 1.00 0.00 C ATOM 53 OG SER A 6 -15.709 8.755 -47.364 1.00 0.00 O ATOM 0 H SER A 6 -18.670 6.172 -49.039 1.00 0.00 H new ATOM 0 HA SER A 6 -16.099 7.325 -49.617 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.219 9.308 -48.649 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.728 8.370 -47.259 1.00 0.00 H new ATOM 0 HG SER A 6 -15.794 9.579 -46.841 1.00 0.00 H new ATOM 59 N GLY A 7 -15.113 5.813 -47.852 1.00 0.00 N ATOM 60 CA GLY A 7 -14.597 4.730 -47.035 1.00 0.00 C ATOM 61 C GLY A 7 -13.507 5.189 -46.087 1.00 0.00 C ATOM 62 O GLY A 7 -12.325 5.154 -46.427 1.00 0.00 O ATOM 0 H GLY A 7 -14.401 6.370 -48.324 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.413 4.291 -46.461 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.205 3.945 -47.682 1.00 0.00 H new ATOM 66 N GLN A 8 -13.905 5.621 -44.895 1.00 0.00 N ATOM 67 CA GLN A 8 -12.952 6.091 -43.896 1.00 0.00 C ATOM 68 C GLN A 8 -12.554 4.962 -42.951 1.00 0.00 C ATOM 69 O GLN A 8 -13.351 4.082 -42.625 1.00 0.00 O ATOM 70 CB GLN A 8 -13.548 7.253 -43.099 1.00 0.00 C ATOM 71 CG GLN A 8 -13.872 8.471 -43.949 1.00 0.00 C ATOM 72 CD GLN A 8 -12.728 8.866 -44.862 1.00 0.00 C ATOM 73 OE1 GLN A 8 -11.968 9.787 -44.560 1.00 0.00 O ATOM 74 NE2 GLN A 8 -12.599 8.171 -45.986 1.00 0.00 N ATOM 0 H GLN A 8 -14.880 5.655 -44.597 1.00 0.00 H new ATOM 0 HA GLN A 8 -12.059 6.437 -44.416 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -14.458 6.914 -42.603 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.847 7.543 -42.316 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -14.757 8.265 -44.550 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -14.118 9.309 -43.297 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -13.251 7.416 -46.196 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -11.847 8.392 -46.639 1.00 0.00 H new ATOM 83 N PRO A 9 -11.291 4.986 -42.499 1.00 0.00 N ATOM 84 CA PRO A 9 -10.758 3.971 -41.584 1.00 0.00 C ATOM 85 C PRO A 9 -11.363 4.074 -40.189 1.00 0.00 C ATOM 86 O PRO A 9 -12.391 4.724 -39.994 1.00 0.00 O ATOM 87 CB PRO A 9 -9.260 4.284 -41.542 1.00 0.00 C ATOM 88 CG PRO A 9 -9.166 5.731 -41.881 1.00 0.00 C ATOM 89 CD PRO A 9 -10.287 6.005 -42.845 1.00 0.00 C ATOM 0 HA PRO A 9 -10.987 2.959 -41.919 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -8.840 4.080 -40.557 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.708 3.673 -42.256 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.260 6.348 -40.987 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -8.200 5.965 -42.329 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -10.681 7.014 -42.726 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -9.959 5.911 -43.880 1.00 0.00 H new ATOM 97 N ILE A 10 -10.720 3.429 -39.221 1.00 0.00 N ATOM 98 CA ILE A 10 -11.195 3.450 -37.843 1.00 0.00 C ATOM 99 C ILE A 10 -10.552 4.588 -37.057 1.00 0.00 C ATOM 100 O ILE A 10 -9.330 4.745 -37.057 1.00 0.00 O ATOM 101 CB ILE A 10 -10.904 2.118 -37.127 1.00 0.00 C ATOM 102 CG1 ILE A 10 -11.130 0.942 -38.079 1.00 0.00 C ATOM 103 CG2 ILE A 10 -11.777 1.980 -35.889 1.00 0.00 C ATOM 104 CD1 ILE A 10 -10.798 -0.402 -37.470 1.00 0.00 C ATOM 0 H ILE A 10 -9.869 2.886 -39.366 1.00 0.00 H new ATOM 0 HA ILE A 10 -12.273 3.603 -37.883 1.00 0.00 H new ATOM 0 HB ILE A 10 -9.860 2.112 -36.814 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -12.172 0.939 -38.399 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -10.523 1.087 -38.973 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -11.560 1.034 -35.394 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.571 2.803 -35.205 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.827 2.004 -36.180 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -10.982 -1.189 -38.202 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -9.749 -0.419 -37.176 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -11.424 -0.569 -36.593 1.00 0.00 H new ATOM 116 N LYS A 11 -11.382 5.379 -36.386 1.00 0.00 N ATOM 117 CA LYS A 11 -10.896 6.502 -35.593 1.00 0.00 C ATOM 118 C LYS A 11 -10.444 6.037 -34.212 1.00 0.00 C ATOM 119 O LYS A 11 -11.161 5.307 -33.528 1.00 0.00 O ATOM 120 CB LYS A 11 -11.988 7.565 -35.452 1.00 0.00 C ATOM 121 CG LYS A 11 -12.461 8.129 -36.781 1.00 0.00 C ATOM 122 CD LYS A 11 -11.427 9.059 -37.392 1.00 0.00 C ATOM 123 CE LYS A 11 -12.063 10.036 -38.369 1.00 0.00 C ATOM 124 NZ LYS A 11 -12.501 9.360 -39.622 1.00 0.00 N ATOM 0 H LYS A 11 -12.395 5.263 -36.375 1.00 0.00 H new ATOM 0 HA LYS A 11 -10.040 6.936 -36.110 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -12.839 7.132 -34.927 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -11.613 8.380 -34.834 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -12.669 7.311 -37.471 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -13.397 8.669 -36.636 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.921 9.612 -36.601 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -10.667 8.471 -37.907 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -12.920 10.516 -37.897 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -11.350 10.824 -38.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -12.929 10.059 -40.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.679 8.923 -40.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -13.201 8.625 -39.394 1.00 0.00 H new ATOM 138 N GLN A 12 -9.252 6.465 -33.809 1.00 0.00 N ATOM 139 CA GLN A 12 -8.706 6.092 -32.509 1.00 0.00 C ATOM 140 C GLN A 12 -9.195 7.042 -31.421 1.00 0.00 C ATOM 141 O GLN A 12 -9.350 8.240 -31.654 1.00 0.00 O ATOM 142 CB GLN A 12 -7.177 6.093 -32.555 1.00 0.00 C ATOM 143 CG GLN A 12 -6.553 7.360 -31.994 1.00 0.00 C ATOM 144 CD GLN A 12 -6.857 8.583 -32.836 1.00 0.00 C ATOM 145 OE1 GLN A 12 -6.737 8.553 -34.061 1.00 0.00 O ATOM 146 NE2 GLN A 12 -7.254 9.669 -32.182 1.00 0.00 N ATOM 0 H GLN A 12 -8.646 7.070 -34.363 1.00 0.00 H new ATOM 0 HA GLN A 12 -9.054 5.087 -32.271 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -6.804 5.235 -31.995 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -6.853 5.965 -33.588 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -6.918 7.522 -30.980 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -5.473 7.229 -31.927 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -7.340 9.650 -31.166 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -7.473 10.522 -32.696 1.00 0.00 H new ATOM 155 N GLU A 13 -9.435 6.499 -30.232 1.00 0.00 N ATOM 156 CA GLU A 13 -9.907 7.299 -29.108 1.00 0.00 C ATOM 157 C GLU A 13 -8.735 7.832 -28.289 1.00 0.00 C ATOM 158 O GLU A 13 -7.712 7.162 -28.140 1.00 0.00 O ATOM 159 CB GLU A 13 -10.833 6.470 -28.215 1.00 0.00 C ATOM 160 CG GLU A 13 -10.113 5.776 -27.071 1.00 0.00 C ATOM 161 CD GLU A 13 -10.936 4.662 -26.454 1.00 0.00 C ATOM 162 OE1 GLU A 13 -11.088 3.606 -27.104 1.00 0.00 O ATOM 163 OE2 GLU A 13 -11.429 4.846 -25.322 1.00 0.00 O ATOM 0 H GLU A 13 -9.310 5.509 -30.022 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.464 8.147 -29.508 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -11.607 7.120 -27.806 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -11.336 5.720 -28.825 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.170 5.367 -27.435 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -9.867 6.509 -26.303 1.00 0.00 H new ATOM 170 N LEU A 14 -8.892 9.040 -27.760 1.00 0.00 N ATOM 171 CA LEU A 14 -7.847 9.665 -26.956 1.00 0.00 C ATOM 172 C LEU A 14 -8.351 9.968 -25.549 1.00 0.00 C ATOM 173 O LEU A 14 -9.553 9.924 -25.286 1.00 0.00 O ATOM 174 CB LEU A 14 -7.361 10.952 -27.624 1.00 0.00 C ATOM 175 CG LEU A 14 -7.151 10.884 -29.137 1.00 0.00 C ATOM 176 CD1 LEU A 14 -7.118 12.282 -29.735 1.00 0.00 C ATOM 177 CD2 LEU A 14 -5.870 10.131 -29.465 1.00 0.00 C ATOM 0 H LEU A 14 -9.733 9.607 -27.873 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.014 8.966 -26.882 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.081 11.742 -27.412 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.420 11.246 -27.159 1.00 0.00 H new ATOM 0 HG LEU A 14 -7.989 10.343 -29.576 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -6.968 12.213 -30.812 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.062 12.787 -29.532 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.300 12.849 -29.290 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -5.737 10.093 -30.546 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -5.021 10.643 -29.013 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -5.933 9.117 -29.071 1.00 0.00 H new ATOM 189 N SER A 15 -7.425 10.279 -24.647 1.00 0.00 N ATOM 190 CA SER A 15 -7.775 10.589 -23.266 1.00 0.00 C ATOM 191 C SER A 15 -6.962 11.773 -22.752 1.00 0.00 C ATOM 192 O SER A 15 -5.735 11.787 -22.849 1.00 0.00 O ATOM 193 CB SER A 15 -7.542 9.369 -22.373 1.00 0.00 C ATOM 194 OG SER A 15 -6.262 8.806 -22.602 1.00 0.00 O ATOM 0 H SER A 15 -6.426 10.323 -24.848 1.00 0.00 H new ATOM 0 HA SER A 15 -8.831 10.856 -23.236 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.633 9.658 -21.326 1.00 0.00 H new ATOM 0 HB3 SER A 15 -8.311 8.621 -22.566 1.00 0.00 H new ATOM 0 HG SER A 15 -5.624 9.519 -22.814 1.00 0.00 H new ATOM 200 N CYS A 16 -7.655 12.765 -22.204 1.00 0.00 N ATOM 201 CA CYS A 16 -7.000 13.954 -21.674 1.00 0.00 C ATOM 202 C CYS A 16 -7.168 14.039 -20.159 1.00 0.00 C ATOM 203 O CYS A 16 -8.176 14.541 -19.662 1.00 0.00 O ATOM 204 CB CYS A 16 -7.570 15.212 -22.332 1.00 0.00 C ATOM 205 SG CYS A 16 -7.319 16.736 -21.366 1.00 0.00 S ATOM 0 H CYS A 16 -8.671 12.769 -22.115 1.00 0.00 H new ATOM 0 HA CYS A 16 -5.936 13.883 -21.901 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -7.110 15.336 -23.312 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -8.638 15.071 -22.497 1.00 0.00 H new ATOM 210 N LYS A 17 -6.173 13.544 -19.431 1.00 0.00 N ATOM 211 CA LYS A 17 -6.208 13.564 -17.973 1.00 0.00 C ATOM 212 C LYS A 17 -5.590 14.850 -17.432 1.00 0.00 C ATOM 213 O LYS A 17 -4.369 14.968 -17.332 1.00 0.00 O ATOM 214 CB LYS A 17 -5.465 12.351 -17.408 1.00 0.00 C ATOM 215 CG LYS A 17 -5.887 11.034 -18.035 1.00 0.00 C ATOM 216 CD LYS A 17 -7.382 10.804 -17.896 1.00 0.00 C ATOM 217 CE LYS A 17 -8.144 11.351 -19.094 1.00 0.00 C ATOM 218 NZ LYS A 17 -9.386 10.574 -19.363 1.00 0.00 N ATOM 0 H LYS A 17 -5.332 13.124 -19.827 1.00 0.00 H new ATOM 0 HA LYS A 17 -7.251 13.522 -17.658 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.394 12.489 -17.558 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.632 12.302 -16.332 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.614 11.028 -19.090 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.346 10.215 -17.561 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -7.579 9.737 -17.794 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.742 11.283 -16.985 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -8.400 12.395 -18.915 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.502 11.326 -19.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.877 10.978 -20.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.140 9.583 -19.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.010 10.618 -18.532 1.00 0.00 H new ATOM 232 N TRP A 18 -6.441 15.808 -17.083 1.00 0.00 N ATOM 233 CA TRP A 18 -5.978 17.084 -16.550 1.00 0.00 C ATOM 234 C TRP A 18 -6.259 17.184 -15.055 1.00 0.00 C ATOM 235 O TRP A 18 -7.415 17.182 -14.631 1.00 0.00 O ATOM 236 CB TRP A 18 -6.652 18.243 -17.287 1.00 0.00 C ATOM 237 CG TRP A 18 -5.958 19.556 -17.090 1.00 0.00 C ATOM 238 CD1 TRP A 18 -6.012 20.353 -15.982 1.00 0.00 C ATOM 239 CD2 TRP A 18 -5.108 20.226 -18.027 1.00 0.00 C ATOM 240 NE1 TRP A 18 -5.247 21.478 -16.174 1.00 0.00 N ATOM 241 CE2 TRP A 18 -4.681 21.423 -17.420 1.00 0.00 C ATOM 242 CE3 TRP A 18 -4.664 19.930 -19.319 1.00 0.00 C ATOM 243 CZ2 TRP A 18 -3.834 22.322 -18.063 1.00 0.00 C ATOM 244 CZ3 TRP A 18 -3.824 20.823 -19.955 1.00 0.00 C ATOM 245 CH2 TRP A 18 -3.415 22.007 -19.327 1.00 0.00 C ATOM 0 H TRP A 18 -7.455 15.726 -17.159 1.00 0.00 H new ATOM 0 HA TRP A 18 -4.900 17.143 -16.703 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -6.687 18.015 -18.352 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.683 18.331 -16.945 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.574 20.131 -15.087 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.121 22.232 -15.498 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -4.972 19.019 -19.811 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.519 23.236 -17.581 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -3.476 20.605 -20.954 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -2.756 22.684 -19.851 1.00 0.00 H new ATOM 256 N ILE A 19 -5.197 17.271 -14.262 1.00 0.00 N ATOM 257 CA ILE A 19 -5.331 17.373 -12.814 1.00 0.00 C ATOM 258 C ILE A 19 -4.867 18.737 -12.314 1.00 0.00 C ATOM 259 O ILE A 19 -3.668 19.013 -12.255 1.00 0.00 O ATOM 260 CB ILE A 19 -4.527 16.274 -12.096 1.00 0.00 C ATOM 261 CG1 ILE A 19 -4.945 14.892 -12.601 1.00 0.00 C ATOM 262 CG2 ILE A 19 -4.721 16.375 -10.590 1.00 0.00 C ATOM 263 CD1 ILE A 19 -4.724 13.787 -11.593 1.00 0.00 C ATOM 0 H ILE A 19 -4.234 17.273 -14.598 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.389 17.246 -12.585 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.469 16.415 -12.317 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.000 14.918 -12.874 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -4.387 14.662 -13.508 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.147 15.592 -10.096 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.378 17.350 -10.244 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.778 16.256 -10.350 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.043 12.836 -12.020 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -3.666 13.734 -11.338 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.304 13.994 -10.694 1.00 0.00 H new ATOM 275 N ASP A 20 -5.823 19.585 -11.953 1.00 0.00 N ATOM 276 CA ASP A 20 -5.513 20.920 -11.454 1.00 0.00 C ATOM 277 C ASP A 20 -5.169 20.879 -9.968 1.00 0.00 C ATOM 278 O ASP A 20 -5.961 20.411 -9.152 1.00 0.00 O ATOM 279 CB ASP A 20 -6.693 21.864 -11.691 1.00 0.00 C ATOM 280 CG ASP A 20 -6.252 23.294 -11.928 1.00 0.00 C ATOM 281 OD1 ASP A 20 -5.825 23.603 -13.061 1.00 0.00 O ATOM 282 OD2 ASP A 20 -6.333 24.106 -10.982 1.00 0.00 O ATOM 0 H ASP A 20 -6.820 19.372 -11.996 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.645 21.292 -11.999 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.266 21.516 -12.551 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.360 21.831 -10.829 1.00 0.00 H new ATOM 287 N GLU A 21 -3.981 21.369 -9.627 1.00 0.00 N ATOM 288 CA GLU A 21 -3.532 21.386 -8.240 1.00 0.00 C ATOM 289 C GLU A 21 -4.411 22.303 -7.395 1.00 0.00 C ATOM 290 O GLU A 21 -4.528 22.125 -6.183 1.00 0.00 O ATOM 291 CB GLU A 21 -2.074 21.841 -8.158 1.00 0.00 C ATOM 292 CG GLU A 21 -1.153 21.112 -9.122 1.00 0.00 C ATOM 293 CD GLU A 21 -0.492 19.901 -8.493 1.00 0.00 C ATOM 294 OE1 GLU A 21 0.094 20.045 -7.400 1.00 0.00 O ATOM 295 OE2 GLU A 21 -0.560 18.809 -9.096 1.00 0.00 O ATOM 0 H GLU A 21 -3.313 21.759 -10.292 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.611 20.372 -7.847 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -2.024 22.911 -8.360 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.712 21.692 -7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.723 20.797 -9.996 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.384 21.799 -9.474 1.00 0.00 H new ATOM 302 N ALA A 22 -5.027 23.286 -8.044 1.00 0.00 N ATOM 303 CA ALA A 22 -5.897 24.230 -7.353 1.00 0.00 C ATOM 304 C ALA A 22 -7.365 23.936 -7.641 1.00 0.00 C ATOM 305 O ALA A 22 -8.187 24.850 -7.713 1.00 0.00 O ATOM 306 CB ALA A 22 -5.553 25.656 -7.757 1.00 0.00 C ATOM 0 H ALA A 22 -4.940 23.449 -9.047 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.735 24.118 -6.281 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.210 26.351 -7.234 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.517 25.869 -7.494 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.686 25.771 -8.833 1.00 0.00 H new ATOM 312 N GLN A 23 -7.687 22.657 -7.804 1.00 0.00 N ATOM 313 CA GLN A 23 -9.057 22.245 -8.085 1.00 0.00 C ATOM 314 C GLN A 23 -9.913 22.306 -6.825 1.00 0.00 C ATOM 315 O GLN A 23 -9.536 21.775 -5.779 1.00 0.00 O ATOM 316 CB GLN A 23 -9.077 20.828 -8.661 1.00 0.00 C ATOM 317 CG GLN A 23 -8.422 19.794 -7.758 1.00 0.00 C ATOM 318 CD GLN A 23 -8.286 18.440 -8.425 1.00 0.00 C ATOM 319 OE1 GLN A 23 -9.273 17.732 -8.627 1.00 0.00 O ATOM 320 NE2 GLN A 23 -7.058 18.070 -8.770 1.00 0.00 N ATOM 0 H GLN A 23 -7.018 21.889 -7.746 1.00 0.00 H new ATOM 0 HA GLN A 23 -9.474 22.934 -8.819 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -10.110 20.534 -8.845 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.569 20.830 -9.625 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -7.435 20.149 -7.461 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -9.010 19.688 -6.846 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -6.268 18.688 -8.584 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -6.905 17.168 -9.221 1.00 0.00 H new ATOM 329 N LEU A 24 -11.066 22.957 -6.930 1.00 0.00 N ATOM 330 CA LEU A 24 -11.977 23.088 -5.798 1.00 0.00 C ATOM 331 C LEU A 24 -12.738 21.788 -5.558 1.00 0.00 C ATOM 332 O LEU A 24 -13.643 21.732 -4.725 1.00 0.00 O ATOM 333 CB LEU A 24 -12.963 24.232 -6.042 1.00 0.00 C ATOM 334 CG LEU A 24 -13.550 24.889 -4.793 1.00 0.00 C ATOM 335 CD1 LEU A 24 -12.548 25.851 -4.175 1.00 0.00 C ATOM 336 CD2 LEU A 24 -14.847 25.611 -5.129 1.00 0.00 C ATOM 0 H LEU A 24 -11.392 23.403 -7.788 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.385 23.310 -4.910 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.460 25.000 -6.630 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.785 23.853 -6.649 1.00 0.00 H new ATOM 0 HG LEU A 24 -13.770 24.108 -4.065 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -12.984 26.309 -3.287 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.645 25.307 -3.897 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -12.296 26.627 -4.897 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -15.250 26.073 -4.228 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -14.652 26.381 -5.875 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -15.569 24.897 -5.525 1.00 0.00 H new ATOM 348 N SER A 25 -12.364 20.745 -6.292 1.00 0.00 N ATOM 349 CA SER A 25 -13.012 19.445 -6.160 1.00 0.00 C ATOM 350 C SER A 25 -12.059 18.423 -5.547 1.00 0.00 C ATOM 351 O SER A 25 -10.840 18.542 -5.671 1.00 0.00 O ATOM 352 CB SER A 25 -13.497 18.953 -7.524 1.00 0.00 C ATOM 353 OG SER A 25 -13.959 17.615 -7.449 1.00 0.00 O ATOM 0 H SER A 25 -11.616 20.775 -6.984 1.00 0.00 H new ATOM 0 HA SER A 25 -13.870 19.559 -5.497 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.299 19.598 -7.883 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.685 19.021 -8.248 1.00 0.00 H new ATOM 0 HG SER A 25 -14.664 17.474 -8.116 1.00 0.00 H new ATOM 359 N ARG A 26 -12.625 17.419 -4.885 1.00 0.00 N ATOM 360 CA ARG A 26 -11.827 16.376 -4.251 1.00 0.00 C ATOM 361 C ARG A 26 -12.595 15.058 -4.204 1.00 0.00 C ATOM 362 O ARG A 26 -13.821 15.029 -4.100 1.00 0.00 O ATOM 363 CB ARG A 26 -11.429 16.798 -2.836 1.00 0.00 C ATOM 364 CG ARG A 26 -10.122 17.571 -2.776 1.00 0.00 C ATOM 365 CD ARG A 26 -8.954 16.664 -2.422 1.00 0.00 C ATOM 366 NE ARG A 26 -9.277 15.760 -1.322 1.00 0.00 N ATOM 367 CZ ARG A 26 -9.422 16.157 -0.062 1.00 0.00 C ATOM 368 NH1 ARG A 26 -9.274 17.436 0.254 1.00 0.00 N ATOM 369 NH2 ARG A 26 -9.717 15.274 0.883 1.00 0.00 N ATOM 0 H ARG A 26 -13.633 17.306 -4.774 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.925 16.230 -4.846 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -12.224 17.411 -2.412 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.345 15.909 -2.211 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -9.935 18.047 -3.738 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.203 18.368 -2.036 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -8.669 16.082 -3.298 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -8.092 17.273 -2.150 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.398 14.769 -1.532 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -9.048 18.118 -0.471 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -9.386 17.738 1.222 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.833 14.289 0.643 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -9.828 15.580 1.850 1.00 0.00 H new ATOM 383 N PRO A 27 -11.857 13.940 -4.282 1.00 0.00 N ATOM 384 CA PRO A 27 -10.397 13.963 -4.406 1.00 0.00 C ATOM 385 C PRO A 27 -9.939 14.477 -5.767 1.00 0.00 C ATOM 386 O PRO A 27 -10.744 14.640 -6.684 1.00 0.00 O ATOM 387 CB PRO A 27 -10.003 12.494 -4.230 1.00 0.00 C ATOM 388 CG PRO A 27 -11.210 11.726 -4.646 1.00 0.00 C ATOM 389 CD PRO A 27 -12.393 12.569 -4.255 1.00 0.00 C ATOM 0 HA PRO A 27 -9.937 14.632 -3.679 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -9.140 12.239 -4.845 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -9.733 12.278 -3.196 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.202 11.539 -5.720 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -11.243 10.754 -4.153 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -13.222 12.447 -4.953 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.767 12.303 -3.266 1.00 0.00 H new ATOM 397 N LYS A 28 -8.641 14.731 -5.891 1.00 0.00 N ATOM 398 CA LYS A 28 -8.074 15.225 -7.141 1.00 0.00 C ATOM 399 C LYS A 28 -8.588 14.419 -8.328 1.00 0.00 C ATOM 400 O LYS A 28 -8.214 13.260 -8.514 1.00 0.00 O ATOM 401 CB LYS A 28 -6.545 15.163 -7.091 1.00 0.00 C ATOM 402 CG LYS A 28 -5.946 15.877 -5.892 1.00 0.00 C ATOM 403 CD LYS A 28 -5.580 17.314 -6.225 1.00 0.00 C ATOM 404 CE LYS A 28 -6.645 18.287 -5.742 1.00 0.00 C ATOM 405 NZ LYS A 28 -6.814 18.235 -4.263 1.00 0.00 N ATOM 0 H LYS A 28 -7.961 14.603 -5.141 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.385 16.262 -7.267 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.232 14.119 -7.075 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.142 15.602 -8.003 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -6.658 15.864 -5.066 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -5.057 15.343 -5.556 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.623 17.563 -5.766 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -5.453 17.418 -7.303 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -6.374 19.300 -6.041 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.595 18.055 -6.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -7.808 18.422 -4.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -6.544 17.293 -3.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.208 18.954 -3.819 1.00 0.00 H new ATOM 419 N LYS A 29 -9.446 15.038 -9.131 1.00 0.00 N ATOM 420 CA LYS A 29 -10.010 14.379 -10.304 1.00 0.00 C ATOM 421 C LYS A 29 -9.366 14.901 -11.584 1.00 0.00 C ATOM 422 O LYS A 29 -8.899 16.038 -11.636 1.00 0.00 O ATOM 423 CB LYS A 29 -11.524 14.597 -10.357 1.00 0.00 C ATOM 424 CG LYS A 29 -11.924 16.052 -10.529 1.00 0.00 C ATOM 425 CD LYS A 29 -13.413 16.252 -10.300 1.00 0.00 C ATOM 426 CE LYS A 29 -14.227 15.806 -11.504 1.00 0.00 C ATOM 427 NZ LYS A 29 -14.556 14.355 -11.444 1.00 0.00 N ATOM 0 H LYS A 29 -9.767 15.996 -8.991 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.804 13.312 -10.224 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.938 14.016 -11.181 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -11.970 14.212 -9.440 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.361 16.670 -9.830 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.661 16.386 -11.533 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -13.725 15.690 -9.420 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -13.612 17.304 -10.094 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.149 16.386 -11.554 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.669 16.015 -12.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -14.170 13.876 -12.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -14.140 13.940 -10.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -15.589 14.234 -11.421 1.00 0.00 H new ATOM 441 N SER A 30 -9.345 14.062 -12.615 1.00 0.00 N ATOM 442 CA SER A 30 -8.755 14.438 -13.894 1.00 0.00 C ATOM 443 C SER A 30 -9.838 14.802 -14.905 1.00 0.00 C ATOM 444 O SER A 30 -10.930 14.234 -14.894 1.00 0.00 O ATOM 445 CB SER A 30 -7.896 13.295 -14.439 1.00 0.00 C ATOM 446 OG SER A 30 -8.483 12.037 -14.158 1.00 0.00 O ATOM 0 H SER A 30 -9.730 13.118 -12.589 1.00 0.00 H new ATOM 0 HA SER A 30 -8.124 15.312 -13.733 1.00 0.00 H new ATOM 0 HB2 SER A 30 -7.773 13.410 -15.516 1.00 0.00 H new ATOM 0 HB3 SER A 30 -6.900 13.342 -13.998 1.00 0.00 H new ATOM 0 HG SER A 30 -7.916 11.324 -14.518 1.00 0.00 H new ATOM 452 N CYS A 31 -9.527 15.754 -15.779 1.00 0.00 N ATOM 453 CA CYS A 31 -10.471 16.196 -16.797 1.00 0.00 C ATOM 454 C CYS A 31 -11.056 15.005 -17.551 1.00 0.00 C ATOM 455 O CYS A 31 -10.415 14.443 -18.439 1.00 0.00 O ATOM 456 CB CYS A 31 -9.786 17.148 -17.780 1.00 0.00 C ATOM 457 SG CYS A 31 -10.588 17.236 -19.413 1.00 0.00 S ATOM 0 H CYS A 31 -8.627 16.234 -15.802 1.00 0.00 H new ATOM 0 HA CYS A 31 -11.284 16.723 -16.297 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -9.762 18.147 -17.345 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -8.751 16.833 -17.912 1.00 0.00 H new ATOM 462 N ASP A 32 -12.277 14.626 -17.190 1.00 0.00 N ATOM 463 CA ASP A 32 -12.950 13.502 -17.832 1.00 0.00 C ATOM 464 C ASP A 32 -13.511 13.909 -19.191 1.00 0.00 C ATOM 465 O ASP A 32 -14.458 14.691 -19.274 1.00 0.00 O ATOM 466 CB ASP A 32 -14.075 12.976 -16.939 1.00 0.00 C ATOM 467 CG ASP A 32 -14.712 11.716 -17.493 1.00 0.00 C ATOM 468 OD1 ASP A 32 -14.010 10.687 -17.585 1.00 0.00 O ATOM 469 OD2 ASP A 32 -15.912 11.759 -17.832 1.00 0.00 O ATOM 0 H ASP A 32 -12.821 15.080 -16.456 1.00 0.00 H new ATOM 0 HA ASP A 32 -12.217 12.710 -17.984 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -13.680 12.773 -15.944 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -14.838 13.747 -16.828 1.00 0.00 H new ATOM 474 N ARG A 33 -12.918 13.375 -20.254 1.00 0.00 N ATOM 475 CA ARG A 33 -13.357 13.684 -21.609 1.00 0.00 C ATOM 476 C ARG A 33 -12.702 12.748 -22.620 1.00 0.00 C ATOM 477 O ARG A 33 -11.743 12.044 -22.301 1.00 0.00 O ATOM 478 CB ARG A 33 -13.028 15.138 -21.956 1.00 0.00 C ATOM 479 CG ARG A 33 -13.801 15.669 -23.151 1.00 0.00 C ATOM 480 CD ARG A 33 -14.003 17.174 -23.060 1.00 0.00 C ATOM 481 NE ARG A 33 -14.326 17.762 -24.357 1.00 0.00 N ATOM 482 CZ ARG A 33 -15.536 17.721 -24.902 1.00 0.00 C ATOM 483 NH1 ARG A 33 -16.534 17.123 -24.265 1.00 0.00 N ATOM 484 NH2 ARG A 33 -15.752 18.280 -26.086 1.00 0.00 N ATOM 0 H ARG A 33 -12.132 12.726 -20.203 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.437 13.542 -21.655 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.238 15.766 -21.090 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.960 15.222 -22.159 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -13.265 15.428 -24.069 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -14.770 15.174 -23.208 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -14.805 17.390 -22.354 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.099 17.638 -22.667 1.00 0.00 H new ATOM 0 HE ARG A 33 -13.581 18.230 -24.873 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -16.373 16.693 -23.354 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -17.463 17.093 -24.686 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -14.988 18.742 -26.579 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -16.682 18.248 -26.503 1.00 0.00 H new ATOM 498 N THR A 34 -13.225 12.744 -23.842 1.00 0.00 N ATOM 499 CA THR A 34 -12.693 11.894 -24.899 1.00 0.00 C ATOM 500 C THR A 34 -12.797 12.576 -26.259 1.00 0.00 C ATOM 501 O THR A 34 -13.446 13.614 -26.395 1.00 0.00 O ATOM 502 CB THR A 34 -13.430 10.543 -24.958 1.00 0.00 C ATOM 503 OG1 THR A 34 -14.846 10.754 -24.910 1.00 0.00 O ATOM 504 CG2 THR A 34 -13.007 9.645 -23.805 1.00 0.00 C ATOM 0 H THR A 34 -14.018 13.321 -24.124 1.00 0.00 H new ATOM 0 HA THR A 34 -11.643 11.717 -24.663 1.00 0.00 H new ATOM 0 HB THR A 34 -13.168 10.052 -25.895 1.00 0.00 H new ATOM 0 HG1 THR A 34 -15.307 9.890 -24.950 1.00 0.00 H new ATOM 0 HG21 THR A 34 -13.541 8.697 -23.868 1.00 0.00 H new ATOM 0 HG22 THR A 34 -11.934 9.462 -23.861 1.00 0.00 H new ATOM 0 HG23 THR A 34 -13.243 10.132 -22.859 1.00 0.00 H new ATOM 512 N PHE A 35 -12.156 11.987 -27.262 1.00 0.00 N ATOM 513 CA PHE A 35 -12.176 12.539 -28.612 1.00 0.00 C ATOM 514 C PHE A 35 -12.060 11.430 -29.654 1.00 0.00 C ATOM 515 O PHE A 35 -11.746 10.286 -29.327 1.00 0.00 O ATOM 516 CB PHE A 35 -11.038 13.545 -28.791 1.00 0.00 C ATOM 517 CG PHE A 35 -10.930 14.535 -27.667 1.00 0.00 C ATOM 518 CD1 PHE A 35 -10.362 14.170 -26.457 1.00 0.00 C ATOM 519 CD2 PHE A 35 -11.396 15.831 -27.820 1.00 0.00 C ATOM 520 CE1 PHE A 35 -10.262 15.079 -25.421 1.00 0.00 C ATOM 521 CE2 PHE A 35 -11.299 16.744 -26.787 1.00 0.00 C ATOM 522 CZ PHE A 35 -10.730 16.368 -25.586 1.00 0.00 C ATOM 0 H PHE A 35 -11.616 11.127 -27.166 1.00 0.00 H new ATOM 0 HA PHE A 35 -13.128 13.050 -28.756 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -10.096 13.004 -28.879 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -11.185 14.084 -29.727 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -9.993 13.164 -26.322 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -11.840 16.131 -28.758 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -9.818 14.782 -24.482 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -11.668 17.750 -26.919 1.00 0.00 H new ATOM 0 HZ PHE A 35 -10.651 17.080 -24.778 1.00 0.00 H new ATOM 532 N SER A 36 -12.315 11.779 -30.911 1.00 0.00 N ATOM 533 CA SER A 36 -12.243 10.814 -32.002 1.00 0.00 C ATOM 534 C SER A 36 -10.921 10.940 -32.752 1.00 0.00 C ATOM 535 O SER A 36 -10.304 9.940 -33.122 1.00 0.00 O ATOM 536 CB SER A 36 -13.412 11.017 -32.968 1.00 0.00 C ATOM 537 OG SER A 36 -13.213 12.164 -33.776 1.00 0.00 O ATOM 0 H SER A 36 -12.573 12.723 -31.199 1.00 0.00 H new ATOM 0 HA SER A 36 -12.304 9.813 -31.574 1.00 0.00 H new ATOM 0 HB2 SER A 36 -13.521 10.137 -33.601 1.00 0.00 H new ATOM 0 HB3 SER A 36 -14.339 11.122 -32.405 1.00 0.00 H new ATOM 0 HG SER A 36 -13.973 12.271 -34.385 1.00 0.00 H new ATOM 543 N THR A 37 -10.489 12.178 -32.975 1.00 0.00 N ATOM 544 CA THR A 37 -9.242 12.436 -33.683 1.00 0.00 C ATOM 545 C THR A 37 -8.266 13.216 -32.809 1.00 0.00 C ATOM 546 O THR A 37 -8.653 13.796 -31.795 1.00 0.00 O ATOM 547 CB THR A 37 -9.486 13.221 -34.985 1.00 0.00 C ATOM 548 OG1 THR A 37 -9.642 14.615 -34.696 1.00 0.00 O ATOM 549 CG2 THR A 37 -10.725 12.706 -35.703 1.00 0.00 C ATOM 0 H THR A 37 -10.985 13.017 -32.675 1.00 0.00 H new ATOM 0 HA THR A 37 -8.812 11.465 -33.929 1.00 0.00 H new ATOM 0 HB THR A 37 -8.622 13.080 -35.635 1.00 0.00 H new ATOM 0 HG1 THR A 37 -9.795 15.107 -35.530 1.00 0.00 H new ATOM 0 HG21 THR A 37 -10.877 13.276 -36.620 1.00 0.00 H new ATOM 0 HG22 THR A 37 -10.592 11.652 -35.948 1.00 0.00 H new ATOM 0 HG23 THR A 37 -11.595 12.821 -35.056 1.00 0.00 H new ATOM 557 N MET A 38 -6.998 13.226 -33.209 1.00 0.00 N ATOM 558 CA MET A 38 -5.967 13.937 -32.462 1.00 0.00 C ATOM 559 C MET A 38 -6.237 15.438 -32.457 1.00 0.00 C ATOM 560 O MET A 38 -6.197 16.083 -31.409 1.00 0.00 O ATOM 561 CB MET A 38 -4.588 13.656 -33.062 1.00 0.00 C ATOM 562 CG MET A 38 -3.465 14.432 -32.392 1.00 0.00 C ATOM 563 SD MET A 38 -3.509 14.304 -30.594 1.00 0.00 S ATOM 564 CE MET A 38 -3.660 12.532 -30.384 1.00 0.00 C ATOM 0 H MET A 38 -6.660 12.750 -34.046 1.00 0.00 H new ATOM 0 HA MET A 38 -5.987 13.579 -31.432 1.00 0.00 H new ATOM 0 HB2 MET A 38 -4.378 12.589 -32.985 1.00 0.00 H new ATOM 0 HB3 MET A 38 -4.606 13.902 -34.124 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.506 14.062 -32.755 1.00 0.00 H new ATOM 0 HG3 MET A 38 -3.532 15.481 -32.679 1.00 0.00 H new ATOM 0 HE1 MET A 38 -3.717 12.295 -29.322 1.00 0.00 H new ATOM 0 HE2 MET A 38 -4.564 12.182 -30.883 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.791 12.039 -30.819 1.00 0.00 H new ATOM 574 N HIS A 39 -6.511 15.989 -33.636 1.00 0.00 N ATOM 575 CA HIS A 39 -6.788 17.415 -33.767 1.00 0.00 C ATOM 576 C HIS A 39 -7.874 17.850 -32.787 1.00 0.00 C ATOM 577 O HIS A 39 -7.805 18.936 -32.213 1.00 0.00 O ATOM 578 CB HIS A 39 -7.213 17.744 -35.198 1.00 0.00 C ATOM 579 CG HIS A 39 -6.141 17.497 -36.214 1.00 0.00 C ATOM 580 ND1 HIS A 39 -6.405 17.073 -37.499 1.00 0.00 N ATOM 581 CD2 HIS A 39 -4.796 17.618 -36.128 1.00 0.00 C ATOM 582 CE1 HIS A 39 -5.268 16.942 -38.159 1.00 0.00 C ATOM 583 NE2 HIS A 39 -4.277 17.267 -37.350 1.00 0.00 N ATOM 0 H HIS A 39 -6.547 15.470 -34.513 1.00 0.00 H new ATOM 0 HA HIS A 39 -5.874 17.961 -33.534 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -8.089 17.148 -35.454 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -7.514 18.790 -35.247 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -4.235 17.932 -35.260 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -5.167 16.623 -39.186 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -3.286 17.259 -37.593 1.00 0.00 H new ATOM 591 N GLU A 40 -8.875 16.996 -32.604 1.00 0.00 N ATOM 592 CA GLU A 40 -9.976 17.294 -31.695 1.00 0.00 C ATOM 593 C GLU A 40 -9.474 17.437 -30.261 1.00 0.00 C ATOM 594 O GLU A 40 -9.977 18.260 -29.495 1.00 0.00 O ATOM 595 CB GLU A 40 -11.038 16.195 -31.768 1.00 0.00 C ATOM 596 CG GLU A 40 -11.916 16.277 -33.005 1.00 0.00 C ATOM 597 CD GLU A 40 -13.062 15.285 -32.975 1.00 0.00 C ATOM 598 OE1 GLU A 40 -13.456 14.868 -31.866 1.00 0.00 O ATOM 599 OE2 GLU A 40 -13.563 14.924 -34.060 1.00 0.00 O ATOM 0 H GLU A 40 -8.947 16.093 -33.072 1.00 0.00 H new ATOM 0 HA GLU A 40 -10.421 18.241 -32.002 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.545 15.223 -31.747 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.669 16.252 -30.881 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -12.317 17.287 -33.095 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -11.307 16.096 -33.891 1.00 0.00 H new ATOM 606 N LEU A 41 -8.480 16.631 -29.905 1.00 0.00 N ATOM 607 CA LEU A 41 -7.909 16.667 -28.563 1.00 0.00 C ATOM 608 C LEU A 41 -7.019 17.892 -28.382 1.00 0.00 C ATOM 609 O LEU A 41 -7.155 18.634 -27.410 1.00 0.00 O ATOM 610 CB LEU A 41 -7.106 15.394 -28.295 1.00 0.00 C ATOM 611 CG LEU A 41 -6.112 15.459 -27.134 1.00 0.00 C ATOM 612 CD1 LEU A 41 -6.848 15.576 -25.808 1.00 0.00 C ATOM 613 CD2 LEU A 41 -5.208 14.235 -27.137 1.00 0.00 C ATOM 0 H LEU A 41 -8.053 15.945 -30.527 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.729 16.729 -27.848 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.806 14.581 -28.103 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.559 15.136 -29.202 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.491 16.346 -27.262 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -6.125 15.621 -24.993 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.453 16.483 -25.807 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.494 14.708 -25.673 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.507 14.298 -26.304 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.814 13.335 -27.034 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.654 14.194 -28.075 1.00 0.00 H new ATOM 625 N VAL A 42 -6.107 18.099 -29.328 1.00 0.00 N ATOM 626 CA VAL A 42 -5.196 19.236 -29.275 1.00 0.00 C ATOM 627 C VAL A 42 -5.953 20.537 -29.036 1.00 0.00 C ATOM 628 O VAL A 42 -5.691 21.254 -28.070 1.00 0.00 O ATOM 629 CB VAL A 42 -4.379 19.361 -30.575 1.00 0.00 C ATOM 630 CG1 VAL A 42 -3.698 20.719 -30.649 1.00 0.00 C ATOM 631 CG2 VAL A 42 -3.358 18.238 -30.672 1.00 0.00 C ATOM 0 H VAL A 42 -5.980 17.494 -30.139 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.516 19.058 -28.442 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.060 19.276 -31.422 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.126 20.789 -31.574 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.452 21.506 -30.628 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.028 20.837 -29.798 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.790 18.342 -31.596 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.679 18.289 -29.821 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.873 17.277 -30.668 1.00 0.00 H new ATOM 641 N THR A 43 -6.897 20.837 -29.924 1.00 0.00 N ATOM 642 CA THR A 43 -7.693 22.053 -29.811 1.00 0.00 C ATOM 643 C THR A 43 -8.280 22.197 -28.411 1.00 0.00 C ATOM 644 O THR A 43 -8.533 23.309 -27.945 1.00 0.00 O ATOM 645 CB THR A 43 -8.839 22.072 -30.840 1.00 0.00 C ATOM 646 OG1 THR A 43 -8.304 22.097 -32.168 1.00 0.00 O ATOM 647 CG2 THR A 43 -9.738 23.280 -30.627 1.00 0.00 C ATOM 0 H THR A 43 -7.128 20.255 -30.729 1.00 0.00 H new ATOM 0 HA THR A 43 -7.023 22.889 -30.009 1.00 0.00 H new ATOM 0 HB THR A 43 -9.434 21.169 -30.705 1.00 0.00 H new ATOM 0 HG1 THR A 43 -8.025 21.193 -32.425 1.00 0.00 H new ATOM 0 HG21 THR A 43 -10.540 23.272 -31.365 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.167 23.242 -29.626 1.00 0.00 H new ATOM 0 HG23 THR A 43 -9.153 24.193 -30.737 1.00 0.00 H new ATOM 655 N HIS A 44 -8.494 21.067 -27.745 1.00 0.00 N ATOM 656 CA HIS A 44 -9.051 21.069 -26.396 1.00 0.00 C ATOM 657 C HIS A 44 -7.959 21.313 -25.358 1.00 0.00 C ATOM 658 O HIS A 44 -7.985 22.311 -24.639 1.00 0.00 O ATOM 659 CB HIS A 44 -9.755 19.742 -26.111 1.00 0.00 C ATOM 660 CG HIS A 44 -10.032 19.512 -24.657 1.00 0.00 C ATOM 661 ND1 HIS A 44 -11.205 19.899 -24.044 1.00 0.00 N ATOM 662 CD2 HIS A 44 -9.281 18.928 -23.694 1.00 0.00 C ATOM 663 CE1 HIS A 44 -11.162 19.565 -22.767 1.00 0.00 C ATOM 664 NE2 HIS A 44 -10.005 18.974 -22.529 1.00 0.00 N ATOM 0 H HIS A 44 -8.291 20.139 -28.116 1.00 0.00 H new ATOM 0 HA HIS A 44 -9.778 21.879 -26.330 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -10.696 19.714 -26.661 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -9.140 18.925 -26.489 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -11.984 20.370 -24.505 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.295 18.505 -23.819 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -11.941 19.745 -22.041 1.00 0.00 H new ATOM 672 N VAL A 45 -7.002 20.394 -25.286 1.00 0.00 N ATOM 673 CA VAL A 45 -5.901 20.509 -24.337 1.00 0.00 C ATOM 674 C VAL A 45 -5.187 21.848 -24.483 1.00 0.00 C ATOM 675 O VAL A 45 -4.517 22.312 -23.560 1.00 0.00 O ATOM 676 CB VAL A 45 -4.879 19.372 -24.521 1.00 0.00 C ATOM 677 CG1 VAL A 45 -3.814 19.431 -23.437 1.00 0.00 C ATOM 678 CG2 VAL A 45 -5.580 18.021 -24.518 1.00 0.00 C ATOM 0 H VAL A 45 -6.967 19.561 -25.874 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.335 20.439 -23.340 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.389 19.500 -25.486 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.101 18.620 -23.583 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -3.293 20.387 -23.491 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.284 19.329 -22.459 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.843 17.229 -24.649 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -6.098 17.882 -23.569 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.302 17.984 -25.334 1.00 0.00 H new ATOM 688 N THR A 46 -5.335 22.467 -25.651 1.00 0.00 N ATOM 689 CA THR A 46 -4.704 23.753 -25.920 1.00 0.00 C ATOM 690 C THR A 46 -5.645 24.906 -25.592 1.00 0.00 C ATOM 691 O THR A 46 -5.311 25.786 -24.800 1.00 0.00 O ATOM 692 CB THR A 46 -4.264 23.866 -27.392 1.00 0.00 C ATOM 693 OG1 THR A 46 -3.443 22.747 -27.745 1.00 0.00 O ATOM 694 CG2 THR A 46 -3.497 25.158 -27.629 1.00 0.00 C ATOM 0 H THR A 46 -5.887 22.098 -26.425 1.00 0.00 H new ATOM 0 HA THR A 46 -3.824 23.813 -25.280 1.00 0.00 H new ATOM 0 HB THR A 46 -5.158 23.872 -28.016 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.012 21.977 -27.953 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.196 25.216 -28.675 1.00 0.00 H new ATOM 0 HG22 THR A 46 -4.134 26.009 -27.387 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.610 25.176 -26.995 1.00 0.00 H new ATOM 702 N MET A 47 -6.823 24.895 -26.207 1.00 0.00 N ATOM 703 CA MET A 47 -7.813 25.941 -25.979 1.00 0.00 C ATOM 704 C MET A 47 -8.706 25.594 -24.792 1.00 0.00 C ATOM 705 O MET A 47 -8.905 26.411 -23.894 1.00 0.00 O ATOM 706 CB MET A 47 -8.667 26.147 -27.232 1.00 0.00 C ATOM 707 CG MET A 47 -7.863 26.151 -28.521 1.00 0.00 C ATOM 708 SD MET A 47 -8.806 26.774 -29.926 1.00 0.00 S ATOM 709 CE MET A 47 -7.679 28.008 -30.570 1.00 0.00 C ATOM 0 H MET A 47 -7.115 24.174 -26.867 1.00 0.00 H new ATOM 0 HA MET A 47 -7.283 26.866 -25.754 1.00 0.00 H new ATOM 0 HB2 MET A 47 -9.417 25.358 -27.284 1.00 0.00 H new ATOM 0 HB3 MET A 47 -9.203 27.092 -27.145 1.00 0.00 H new ATOM 0 HG2 MET A 47 -6.971 26.763 -28.387 1.00 0.00 H new ATOM 0 HG3 MET A 47 -7.524 25.138 -28.736 1.00 0.00 H new ATOM 0 HE1 MET A 47 -8.122 28.484 -31.445 1.00 0.00 H new ATOM 0 HE2 MET A 47 -7.488 28.761 -29.805 1.00 0.00 H new ATOM 0 HE3 MET A 47 -6.740 27.531 -30.852 1.00 0.00 H new ATOM 719 N GLU A 48 -9.242 24.377 -24.796 1.00 0.00 N ATOM 720 CA GLU A 48 -10.115 23.925 -23.719 1.00 0.00 C ATOM 721 C GLU A 48 -9.323 23.701 -22.434 1.00 0.00 C ATOM 722 O GLU A 48 -9.869 23.256 -21.424 1.00 0.00 O ATOM 723 CB GLU A 48 -10.830 22.633 -24.121 1.00 0.00 C ATOM 724 CG GLU A 48 -11.743 22.793 -25.325 1.00 0.00 C ATOM 725 CD GLU A 48 -13.106 23.345 -24.955 1.00 0.00 C ATOM 726 OE1 GLU A 48 -13.339 23.592 -23.753 1.00 0.00 O ATOM 727 OE2 GLU A 48 -13.940 23.528 -25.866 1.00 0.00 O ATOM 0 H GLU A 48 -9.087 23.688 -25.532 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.857 24.702 -23.537 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.085 21.868 -24.340 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.417 22.274 -23.276 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -11.271 23.457 -26.049 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.867 21.826 -25.813 1.00 0.00 H new ATOM 734 N HIS A 49 -8.031 24.011 -22.481 1.00 0.00 N ATOM 735 CA HIS A 49 -7.162 23.844 -21.321 1.00 0.00 C ATOM 736 C HIS A 49 -6.148 24.980 -21.234 1.00 0.00 C ATOM 737 O HIS A 49 -6.264 25.867 -20.387 1.00 0.00 O ATOM 738 CB HIS A 49 -6.436 22.501 -21.391 1.00 0.00 C ATOM 739 CG HIS A 49 -7.116 21.411 -20.620 1.00 0.00 C ATOM 740 ND1 HIS A 49 -7.278 21.447 -19.251 1.00 0.00 N ATOM 741 CD2 HIS A 49 -7.679 20.252 -21.034 1.00 0.00 C ATOM 742 CE1 HIS A 49 -7.910 20.356 -18.856 1.00 0.00 C ATOM 743 NE2 HIS A 49 -8.164 19.614 -19.919 1.00 0.00 N ATOM 0 H HIS A 49 -7.563 24.379 -23.309 1.00 0.00 H new ATOM 0 HA HIS A 49 -7.784 23.866 -20.426 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.350 22.198 -22.434 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -5.422 22.625 -21.011 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -6.960 22.198 -18.639 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -7.736 19.895 -22.052 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -8.174 20.112 -17.838 1.00 0.00 H new ATOM 751 N VAL A 50 -5.152 24.947 -22.115 1.00 0.00 N ATOM 752 CA VAL A 50 -4.118 25.974 -22.138 1.00 0.00 C ATOM 753 C VAL A 50 -4.676 27.306 -22.627 1.00 0.00 C ATOM 754 O VAL A 50 -3.967 28.311 -22.668 1.00 0.00 O ATOM 755 CB VAL A 50 -2.938 25.563 -23.038 1.00 0.00 C ATOM 756 CG1 VAL A 50 -1.991 26.734 -23.247 1.00 0.00 C ATOM 757 CG2 VAL A 50 -2.203 24.372 -22.442 1.00 0.00 C ATOM 0 H VAL A 50 -5.040 24.220 -22.822 1.00 0.00 H new ATOM 0 HA VAL A 50 -3.762 26.087 -21.114 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.332 25.268 -24.011 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.164 26.424 -23.885 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.527 27.555 -23.722 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.602 27.064 -22.284 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.372 24.095 -23.091 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.821 24.637 -21.456 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.889 23.530 -22.351 1.00 0.00 H new ATOM 767 N GLY A 51 -5.953 27.306 -22.998 1.00 0.00 N ATOM 768 CA GLY A 51 -6.585 28.520 -23.480 1.00 0.00 C ATOM 769 C GLY A 51 -5.971 29.020 -24.772 1.00 0.00 C ATOM 770 O GLY A 51 -5.416 28.242 -25.546 1.00 0.00 O ATOM 0 H GLY A 51 -6.561 26.487 -22.973 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.648 28.336 -23.634 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.503 29.296 -22.718 1.00 0.00 H new ATOM 774 N GLY A 52 -6.071 30.325 -25.007 1.00 0.00 N ATOM 775 CA GLY A 52 -5.518 30.906 -26.217 1.00 0.00 C ATOM 776 C GLY A 52 -4.367 31.850 -25.932 1.00 0.00 C ATOM 777 O GLY A 52 -3.756 31.815 -24.864 1.00 0.00 O ATOM 0 H GLY A 52 -6.525 30.990 -24.381 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.175 30.108 -26.876 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.302 31.444 -26.749 1.00 0.00 H new ATOM 781 N PRO A 53 -4.054 32.718 -26.906 1.00 0.00 N ATOM 782 CA PRO A 53 -2.966 33.692 -26.779 1.00 0.00 C ATOM 783 C PRO A 53 -3.284 34.789 -25.769 1.00 0.00 C ATOM 784 O PRO A 53 -2.405 35.550 -25.369 1.00 0.00 O ATOM 785 CB PRO A 53 -2.850 34.280 -28.188 1.00 0.00 C ATOM 786 CG PRO A 53 -4.200 34.093 -28.788 1.00 0.00 C ATOM 787 CD PRO A 53 -4.740 32.816 -28.205 1.00 0.00 C ATOM 0 HA PRO A 53 -2.047 33.231 -26.417 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.574 35.334 -28.156 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -2.084 33.767 -28.769 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -4.851 34.935 -28.553 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -4.139 34.031 -29.874 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -5.823 32.855 -28.086 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -4.520 31.959 -28.841 1.00 0.00 H new ATOM 795 N GLU A 54 -4.547 34.862 -25.360 1.00 0.00 N ATOM 796 CA GLU A 54 -4.980 35.867 -24.396 1.00 0.00 C ATOM 797 C GLU A 54 -4.644 35.436 -22.972 1.00 0.00 C ATOM 798 O GLU A 54 -4.705 36.237 -22.040 1.00 0.00 O ATOM 799 CB GLU A 54 -6.485 36.114 -24.524 1.00 0.00 C ATOM 800 CG GLU A 54 -6.943 37.420 -23.898 1.00 0.00 C ATOM 801 CD GLU A 54 -8.422 37.682 -24.111 1.00 0.00 C ATOM 802 OE1 GLU A 54 -9.233 37.202 -23.291 1.00 0.00 O ATOM 803 OE2 GLU A 54 -8.768 38.367 -25.096 1.00 0.00 O ATOM 0 H GLU A 54 -5.287 34.238 -25.681 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.447 36.793 -24.612 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.756 36.112 -25.580 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -7.021 35.289 -24.056 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -6.732 37.400 -22.829 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -6.367 38.243 -24.321 1.00 0.00 H new ATOM 810 N GLN A 55 -4.290 34.164 -22.813 1.00 0.00 N ATOM 811 CA GLN A 55 -3.945 33.626 -21.503 1.00 0.00 C ATOM 812 C GLN A 55 -2.577 34.127 -21.051 1.00 0.00 C ATOM 813 O GLN A 55 -1.655 34.254 -21.855 1.00 0.00 O ATOM 814 CB GLN A 55 -3.955 32.097 -21.538 1.00 0.00 C ATOM 815 CG GLN A 55 -5.331 31.492 -21.311 1.00 0.00 C ATOM 816 CD GLN A 55 -5.984 31.988 -20.036 1.00 0.00 C ATOM 817 OE1 GLN A 55 -7.205 31.930 -19.887 1.00 0.00 O ATOM 818 NE2 GLN A 55 -5.172 32.479 -19.107 1.00 0.00 N ATOM 0 H GLN A 55 -4.235 33.488 -23.575 1.00 0.00 H new ATOM 0 HA GLN A 55 -4.692 33.971 -20.788 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -3.574 31.762 -22.503 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -3.272 31.720 -20.777 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -5.973 31.730 -22.159 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.244 30.406 -21.271 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -4.166 32.508 -19.273 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -5.554 32.827 -18.228 1.00 0.00 H new ATOM 827 N ASN A 56 -2.454 34.411 -19.758 1.00 0.00 N ATOM 828 CA ASN A 56 -1.199 34.900 -19.199 1.00 0.00 C ATOM 829 C ASN A 56 -0.265 33.741 -18.865 1.00 0.00 C ATOM 830 O ASN A 56 0.690 33.470 -19.591 1.00 0.00 O ATOM 831 CB ASN A 56 -1.466 35.733 -17.944 1.00 0.00 C ATOM 832 CG ASN A 56 -0.291 35.727 -16.985 1.00 0.00 C ATOM 833 OD1 ASN A 56 0.780 36.250 -17.294 1.00 0.00 O ATOM 834 ND2 ASN A 56 -0.486 35.132 -15.814 1.00 0.00 N ATOM 0 H ASN A 56 -3.208 34.311 -19.078 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.716 35.528 -19.948 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -1.690 36.760 -18.234 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -2.349 35.346 -17.435 1.00 0.00 H new ATOM 0 HD21 ASN A 56 0.268 35.096 -15.129 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -1.390 34.711 -15.600 1.00 0.00 H new ATOM 841 N ASN A 57 -0.548 33.060 -17.759 1.00 0.00 N ATOM 842 CA ASN A 57 0.266 31.930 -17.328 1.00 0.00 C ATOM 843 C ASN A 57 -0.216 30.634 -17.972 1.00 0.00 C ATOM 844 O ASN A 57 -1.309 30.149 -17.675 1.00 0.00 O ATOM 845 CB ASN A 57 0.228 31.799 -15.804 1.00 0.00 C ATOM 846 CG ASN A 57 -1.095 31.253 -15.303 1.00 0.00 C ATOM 847 OD1 ASN A 57 -2.151 31.534 -15.871 1.00 0.00 O ATOM 848 ND2 ASN A 57 -1.044 30.467 -14.234 1.00 0.00 N ATOM 0 H ASN A 57 -1.335 33.271 -17.145 1.00 0.00 H new ATOM 0 HA ASN A 57 1.293 32.113 -17.646 1.00 0.00 H new ATOM 0 HB2 ASN A 57 1.035 31.143 -15.478 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.409 32.775 -15.354 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -1.902 30.070 -13.852 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -0.147 30.261 -13.795 1.00 0.00 H new ATOM 855 N HIS A 58 0.606 30.077 -18.856 1.00 0.00 N ATOM 856 CA HIS A 58 0.264 28.836 -19.543 1.00 0.00 C ATOM 857 C HIS A 58 0.955 27.645 -18.888 1.00 0.00 C ATOM 858 O HIS A 58 2.161 27.451 -19.043 1.00 0.00 O ATOM 859 CB HIS A 58 0.655 28.920 -21.018 1.00 0.00 C ATOM 860 CG HIS A 58 0.231 30.196 -21.679 1.00 0.00 C ATOM 861 ND1 HIS A 58 1.096 31.242 -21.922 1.00 0.00 N ATOM 862 CD2 HIS A 58 -0.975 30.590 -22.150 1.00 0.00 C ATOM 863 CE1 HIS A 58 0.440 32.225 -22.512 1.00 0.00 C ATOM 864 NE2 HIS A 58 -0.818 31.855 -22.662 1.00 0.00 N ATOM 0 H HIS A 58 1.513 30.465 -19.113 1.00 0.00 H new ATOM 0 HA HIS A 58 -0.814 28.694 -19.469 1.00 0.00 H new ATOM 0 HB2 HIS A 58 1.737 28.818 -21.105 1.00 0.00 H new ATOM 0 HB3 HIS A 58 0.211 28.079 -21.551 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -1.890 30.017 -22.128 1.00 0.00 H new ATOM 0 HE1 HIS A 58 0.861 33.171 -22.819 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -1.554 32.417 -23.089 1.00 0.00 H new ATOM 872 N VAL A 59 0.184 26.849 -18.154 1.00 0.00 N ATOM 873 CA VAL A 59 0.723 25.676 -17.475 1.00 0.00 C ATOM 874 C VAL A 59 -0.202 24.474 -17.638 1.00 0.00 C ATOM 875 O VAL A 59 -1.423 24.600 -17.547 1.00 0.00 O ATOM 876 CB VAL A 59 0.937 25.945 -15.974 1.00 0.00 C ATOM 877 CG1 VAL A 59 1.626 24.761 -15.312 1.00 0.00 C ATOM 878 CG2 VAL A 59 1.740 27.221 -15.772 1.00 0.00 C ATOM 0 H VAL A 59 -0.816 26.995 -18.014 1.00 0.00 H new ATOM 0 HA VAL A 59 1.685 25.456 -17.938 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.037 26.077 -15.503 1.00 0.00 H new ATOM 0 HG11 VAL A 59 1.769 24.969 -14.252 1.00 0.00 H new ATOM 0 HG12 VAL A 59 1.009 23.870 -15.427 1.00 0.00 H new ATOM 0 HG13 VAL A 59 2.595 24.594 -15.783 1.00 0.00 H new ATOM 0 HG21 VAL A 59 1.882 27.396 -14.706 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.711 27.120 -16.256 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.202 28.062 -16.210 1.00 0.00 H new ATOM 888 N CYS A 60 0.389 23.309 -17.879 1.00 0.00 N ATOM 889 CA CYS A 60 -0.380 22.083 -18.054 1.00 0.00 C ATOM 890 C CYS A 60 -0.146 21.123 -16.891 1.00 0.00 C ATOM 891 O CYS A 60 0.963 20.625 -16.697 1.00 0.00 O ATOM 892 CB CYS A 60 -0.005 21.405 -19.373 1.00 0.00 C ATOM 893 SG CYS A 60 0.131 19.591 -19.265 1.00 0.00 S ATOM 0 H CYS A 60 1.399 23.188 -17.958 1.00 0.00 H new ATOM 0 HA CYS A 60 -1.437 22.347 -18.077 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -0.753 21.658 -20.125 1.00 0.00 H new ATOM 0 HB3 CYS A 60 0.946 21.810 -19.720 1.00 0.00 H new ATOM 898 N TYR A 61 -1.198 20.867 -16.121 1.00 0.00 N ATOM 899 CA TYR A 61 -1.107 19.969 -14.976 1.00 0.00 C ATOM 900 C TYR A 61 -1.634 18.581 -15.330 1.00 0.00 C ATOM 901 O TYR A 61 -2.839 18.335 -15.295 1.00 0.00 O ATOM 902 CB TYR A 61 -1.890 20.537 -13.792 1.00 0.00 C ATOM 903 CG TYR A 61 -1.540 21.972 -13.467 1.00 0.00 C ATOM 904 CD1 TYR A 61 -2.197 23.026 -14.092 1.00 0.00 C ATOM 905 CD2 TYR A 61 -0.554 22.274 -12.537 1.00 0.00 C ATOM 906 CE1 TYR A 61 -1.880 24.338 -13.799 1.00 0.00 C ATOM 907 CE2 TYR A 61 -0.231 23.583 -12.237 1.00 0.00 C ATOM 908 CZ TYR A 61 -0.897 24.612 -12.871 1.00 0.00 C ATOM 909 OH TYR A 61 -0.578 25.918 -12.576 1.00 0.00 O ATOM 0 H TYR A 61 -2.124 21.269 -16.269 1.00 0.00 H new ATOM 0 HA TYR A 61 -0.057 19.880 -14.699 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -2.956 20.472 -14.008 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -1.704 19.919 -12.914 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -2.968 22.815 -14.819 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -0.030 21.471 -12.039 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -2.399 25.145 -14.294 1.00 0.00 H new ATOM 0 HE2 TYR A 61 0.538 23.800 -11.511 1.00 0.00 H new ATOM 0 HH TYR A 61 0.133 25.937 -11.902 1.00 0.00 H new ATOM 919 N TRP A 62 -0.721 17.678 -15.669 1.00 0.00 N ATOM 920 CA TRP A 62 -1.092 16.314 -16.029 1.00 0.00 C ATOM 921 C TRP A 62 -1.094 15.409 -14.802 1.00 0.00 C ATOM 922 O TRP A 62 -0.281 15.580 -13.894 1.00 0.00 O ATOM 923 CB TRP A 62 -0.130 15.764 -17.083 1.00 0.00 C ATOM 924 CG TRP A 62 -0.781 14.812 -18.041 1.00 0.00 C ATOM 925 CD1 TRP A 62 -0.728 13.448 -18.004 1.00 0.00 C ATOM 926 CD2 TRP A 62 -1.580 15.154 -19.179 1.00 0.00 C ATOM 927 NE1 TRP A 62 -1.446 12.921 -19.050 1.00 0.00 N ATOM 928 CE2 TRP A 62 -1.980 13.947 -19.785 1.00 0.00 C ATOM 929 CE3 TRP A 62 -1.999 16.362 -19.743 1.00 0.00 C ATOM 930 CZ2 TRP A 62 -2.776 13.916 -20.927 1.00 0.00 C ATOM 931 CZ3 TRP A 62 -2.789 16.329 -20.876 1.00 0.00 C ATOM 932 CH2 TRP A 62 -3.171 15.113 -21.458 1.00 0.00 C ATOM 0 H TRP A 62 0.281 17.865 -15.702 1.00 0.00 H new ATOM 0 HA TRP A 62 -2.100 16.335 -16.443 1.00 0.00 H new ATOM 0 HB2 TRP A 62 0.299 16.595 -17.643 1.00 0.00 H new ATOM 0 HB3 TRP A 62 0.695 15.257 -16.583 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -0.199 12.869 -17.262 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -1.563 11.927 -19.248 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -1.710 17.304 -19.301 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -3.071 12.980 -21.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -3.118 17.257 -21.321 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -3.790 15.121 -22.343 1.00 0.00 H new ATOM 943 N GLU A 63 -2.011 14.447 -14.783 1.00 0.00 N ATOM 944 CA GLU A 63 -2.117 13.516 -13.666 1.00 0.00 C ATOM 945 C GLU A 63 -0.741 12.998 -13.257 1.00 0.00 C ATOM 946 O GLU A 63 -0.555 12.517 -12.140 1.00 0.00 O ATOM 947 CB GLU A 63 -3.026 12.343 -14.035 1.00 0.00 C ATOM 948 CG GLU A 63 -3.040 11.233 -12.998 1.00 0.00 C ATOM 949 CD GLU A 63 -4.238 10.314 -13.142 1.00 0.00 C ATOM 950 OE1 GLU A 63 -4.456 9.795 -14.257 1.00 0.00 O ATOM 951 OE2 GLU A 63 -4.957 10.113 -12.141 1.00 0.00 O ATOM 0 H GLU A 63 -2.691 14.292 -15.528 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.551 14.051 -12.821 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.042 12.712 -14.174 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.703 11.931 -14.991 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.125 10.647 -13.086 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.042 11.673 -12.001 1.00 0.00 H new ATOM 958 N GLU A 64 0.219 13.101 -14.170 1.00 0.00 N ATOM 959 CA GLU A 64 1.578 12.641 -13.905 1.00 0.00 C ATOM 960 C GLU A 64 2.573 13.316 -14.844 1.00 0.00 C ATOM 961 O GLU A 64 3.572 12.716 -15.244 1.00 0.00 O ATOM 962 CB GLU A 64 1.665 11.121 -14.058 1.00 0.00 C ATOM 963 CG GLU A 64 1.555 10.647 -15.498 1.00 0.00 C ATOM 964 CD GLU A 64 0.117 10.476 -15.947 1.00 0.00 C ATOM 965 OE1 GLU A 64 -0.793 10.687 -15.118 1.00 0.00 O ATOM 966 OE2 GLU A 64 -0.099 10.130 -17.128 1.00 0.00 O ATOM 0 H GLU A 64 0.082 13.499 -15.099 1.00 0.00 H new ATOM 0 HA GLU A 64 1.832 12.910 -12.880 1.00 0.00 H new ATOM 0 HB2 GLU A 64 2.612 10.776 -13.642 1.00 0.00 H new ATOM 0 HB3 GLU A 64 0.871 10.659 -13.471 1.00 0.00 H new ATOM 0 HG2 GLU A 64 2.053 11.363 -16.151 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.081 9.698 -15.606 1.00 0.00 H new ATOM 973 N CYS A 65 2.294 14.567 -15.193 1.00 0.00 N ATOM 974 CA CYS A 65 3.162 15.325 -16.086 1.00 0.00 C ATOM 975 C CYS A 65 4.623 15.193 -15.665 1.00 0.00 C ATOM 976 O CYS A 65 4.970 15.311 -14.490 1.00 0.00 O ATOM 977 CB CYS A 65 2.755 16.800 -16.098 1.00 0.00 C ATOM 978 SG CYS A 65 3.250 17.696 -17.605 1.00 0.00 S ATOM 0 H CYS A 65 1.472 15.078 -14.870 1.00 0.00 H new ATOM 0 HA CYS A 65 3.053 14.917 -17.091 1.00 0.00 H new ATOM 0 HB2 CYS A 65 1.673 16.868 -15.987 1.00 0.00 H new ATOM 0 HB3 CYS A 65 3.196 17.295 -15.233 1.00 0.00 H new ATOM 983 N PRO A 66 5.501 14.941 -16.647 1.00 0.00 N ATOM 984 CA PRO A 66 6.939 14.788 -16.404 1.00 0.00 C ATOM 985 C PRO A 66 7.604 16.103 -16.013 1.00 0.00 C ATOM 986 O PRO A 66 8.735 16.117 -15.528 1.00 0.00 O ATOM 987 CB PRO A 66 7.476 14.296 -17.751 1.00 0.00 C ATOM 988 CG PRO A 66 6.498 14.799 -18.755 1.00 0.00 C ATOM 989 CD PRO A 66 5.158 14.787 -18.071 1.00 0.00 C ATOM 0 HA PRO A 66 7.143 14.110 -15.575 1.00 0.00 H new ATOM 0 HB2 PRO A 66 8.476 14.684 -17.944 1.00 0.00 H new ATOM 0 HB3 PRO A 66 7.545 13.209 -17.776 1.00 0.00 H new ATOM 0 HG2 PRO A 66 6.759 15.805 -19.084 1.00 0.00 H new ATOM 0 HG3 PRO A 66 6.489 14.166 -19.642 1.00 0.00 H new ATOM 0 HD2 PRO A 66 4.521 15.599 -18.421 1.00 0.00 H new ATOM 0 HD3 PRO A 66 4.620 13.857 -18.257 1.00 0.00 H new ATOM 997 N ARG A 67 6.894 17.206 -16.227 1.00 0.00 N ATOM 998 CA ARG A 67 7.417 18.526 -15.898 1.00 0.00 C ATOM 999 C ARG A 67 7.028 18.926 -14.477 1.00 0.00 C ATOM 1000 O ARG A 67 7.700 19.742 -13.846 1.00 0.00 O ATOM 1001 CB ARG A 67 6.898 19.567 -16.892 1.00 0.00 C ATOM 1002 CG ARG A 67 7.170 19.210 -18.344 1.00 0.00 C ATOM 1003 CD ARG A 67 8.652 19.305 -18.673 1.00 0.00 C ATOM 1004 NE ARG A 67 9.182 20.644 -18.430 1.00 0.00 N ATOM 1005 CZ ARG A 67 10.349 21.069 -18.900 1.00 0.00 C ATOM 1006 NH1 ARG A 67 11.105 20.264 -19.634 1.00 0.00 N ATOM 1007 NH2 ARG A 67 10.763 22.301 -18.635 1.00 0.00 N ATOM 0 H ARG A 67 5.956 17.211 -16.627 1.00 0.00 H new ATOM 0 HA ARG A 67 8.504 18.484 -15.961 1.00 0.00 H new ATOM 0 HB2 ARG A 67 5.824 19.688 -16.751 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.359 20.530 -16.671 1.00 0.00 H new ATOM 0 HG2 ARG A 67 6.816 18.199 -18.544 1.00 0.00 H new ATOM 0 HG3 ARG A 67 6.608 19.879 -18.996 1.00 0.00 H new ATOM 0 HD2 ARG A 67 9.204 18.582 -18.072 1.00 0.00 H new ATOM 0 HD3 ARG A 67 8.809 19.037 -19.718 1.00 0.00 H new ATOM 0 HE ARG A 67 8.625 21.288 -17.868 1.00 0.00 H new ATOM 0 HH11 ARG A 67 10.791 19.316 -19.839 1.00 0.00 H new ATOM 0 HH12 ARG A 67 12.001 20.593 -19.994 1.00 0.00 H new ATOM 0 HH21 ARG A 67 10.185 22.923 -18.070 1.00 0.00 H new ATOM 0 HH22 ARG A 67 11.660 22.627 -18.996 1.00 0.00 H new ATOM 1021 N GLU A 68 5.939 18.347 -13.982 1.00 0.00 N ATOM 1022 CA GLU A 68 5.460 18.645 -12.638 1.00 0.00 C ATOM 1023 C GLU A 68 4.889 20.058 -12.564 1.00 0.00 C ATOM 1024 O GLU A 68 4.913 20.695 -11.512 1.00 0.00 O ATOM 1025 CB GLU A 68 6.594 18.488 -11.622 1.00 0.00 C ATOM 1026 CG GLU A 68 7.428 17.235 -11.830 1.00 0.00 C ATOM 1027 CD GLU A 68 8.102 16.765 -10.555 1.00 0.00 C ATOM 1028 OE1 GLU A 68 9.107 17.386 -10.151 1.00 0.00 O ATOM 1029 OE2 GLU A 68 7.623 15.775 -9.962 1.00 0.00 O ATOM 0 H GLU A 68 5.372 17.669 -14.491 1.00 0.00 H new ATOM 0 HA GLU A 68 4.666 17.938 -12.398 1.00 0.00 H new ATOM 0 HB2 GLU A 68 7.244 19.361 -11.678 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.171 18.470 -10.618 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.791 16.439 -12.215 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.187 17.430 -12.587 1.00 0.00 H new ATOM 1036 N GLY A 69 4.375 20.542 -13.691 1.00 0.00 N ATOM 1037 CA GLY A 69 3.805 21.876 -13.733 1.00 0.00 C ATOM 1038 C GLY A 69 4.781 22.907 -14.263 1.00 0.00 C ATOM 1039 O GLY A 69 4.378 23.921 -14.832 1.00 0.00 O ATOM 0 H GLY A 69 4.343 20.034 -14.575 1.00 0.00 H new ATOM 0 HA2 GLY A 69 2.914 21.867 -14.361 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.486 22.163 -12.731 1.00 0.00 H new ATOM 1043 N LYS A 70 6.071 22.649 -14.076 1.00 0.00 N ATOM 1044 CA LYS A 70 7.110 23.562 -14.538 1.00 0.00 C ATOM 1045 C LYS A 70 6.752 24.148 -15.900 1.00 0.00 C ATOM 1046 O LYS A 70 6.855 23.473 -16.924 1.00 0.00 O ATOM 1047 CB LYS A 70 8.455 22.836 -14.622 1.00 0.00 C ATOM 1048 CG LYS A 70 9.321 23.018 -13.387 1.00 0.00 C ATOM 1049 CD LYS A 70 9.035 21.952 -12.343 1.00 0.00 C ATOM 1050 CE LYS A 70 9.905 20.721 -12.550 1.00 0.00 C ATOM 1051 NZ LYS A 70 11.214 20.844 -11.851 1.00 0.00 N ATOM 0 H LYS A 70 6.422 21.814 -13.607 1.00 0.00 H new ATOM 0 HA LYS A 70 7.188 24.378 -13.819 1.00 0.00 H new ATOM 0 HB2 LYS A 70 8.275 21.772 -14.776 1.00 0.00 H new ATOM 0 HB3 LYS A 70 9.000 23.197 -15.494 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.373 22.978 -13.670 1.00 0.00 H new ATOM 0 HG3 LYS A 70 9.143 24.005 -12.959 1.00 0.00 H new ATOM 0 HD2 LYS A 70 9.211 22.360 -11.348 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.984 21.668 -12.390 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.379 19.839 -12.184 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.075 20.571 -13.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 11.778 19.986 -12.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 11.727 21.671 -12.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 11.053 20.961 -10.830 1.00 0.00 H new ATOM 1065 N SER A 71 6.332 25.409 -15.904 1.00 0.00 N ATOM 1066 CA SER A 71 5.956 26.086 -17.140 1.00 0.00 C ATOM 1067 C SER A 71 7.182 26.355 -18.007 1.00 0.00 C ATOM 1068 O SER A 71 8.297 25.956 -17.667 1.00 0.00 O ATOM 1069 CB SER A 71 5.239 27.401 -16.829 1.00 0.00 C ATOM 1070 OG SER A 71 6.162 28.471 -16.719 1.00 0.00 O ATOM 0 H SER A 71 6.243 25.983 -15.065 1.00 0.00 H new ATOM 0 HA SER A 71 5.279 25.433 -17.691 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.516 27.619 -17.615 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.679 27.303 -15.899 1.00 0.00 H new ATOM 0 HG SER A 71 5.679 29.301 -16.522 1.00 0.00 H new ATOM 1076 N PHE A 72 6.969 27.034 -19.129 1.00 0.00 N ATOM 1077 CA PHE A 72 8.056 27.356 -20.046 1.00 0.00 C ATOM 1078 C PHE A 72 8.225 28.866 -20.180 1.00 0.00 C ATOM 1079 O PHE A 72 7.528 29.641 -19.524 1.00 0.00 O ATOM 1080 CB PHE A 72 7.792 26.737 -21.421 1.00 0.00 C ATOM 1081 CG PHE A 72 7.496 25.266 -21.369 1.00 0.00 C ATOM 1082 CD1 PHE A 72 6.325 24.801 -20.792 1.00 0.00 C ATOM 1083 CD2 PHE A 72 8.388 24.347 -21.898 1.00 0.00 C ATOM 1084 CE1 PHE A 72 6.051 23.447 -20.742 1.00 0.00 C ATOM 1085 CE2 PHE A 72 8.119 22.992 -21.852 1.00 0.00 C ATOM 1086 CZ PHE A 72 6.948 22.542 -21.274 1.00 0.00 C ATOM 0 H PHE A 72 6.053 27.372 -19.425 1.00 0.00 H new ATOM 0 HA PHE A 72 8.977 26.940 -19.638 1.00 0.00 H new ATOM 0 HB2 PHE A 72 6.952 27.252 -21.887 1.00 0.00 H new ATOM 0 HB3 PHE A 72 8.661 26.902 -22.058 1.00 0.00 H new ATOM 0 HD1 PHE A 72 5.618 25.504 -20.377 1.00 0.00 H new ATOM 0 HD2 PHE A 72 9.305 24.694 -22.352 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.136 23.097 -20.287 1.00 0.00 H new ATOM 0 HE2 PHE A 72 8.823 22.286 -22.267 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.734 21.484 -21.238 1.00 0.00 H new ATOM 1096 N LYS A 73 9.156 29.278 -21.033 1.00 0.00 N ATOM 1097 CA LYS A 73 9.419 30.695 -21.255 1.00 0.00 C ATOM 1098 C LYS A 73 8.826 31.157 -22.582 1.00 0.00 C ATOM 1099 O LYS A 73 9.230 32.182 -23.130 1.00 0.00 O ATOM 1100 CB LYS A 73 10.925 30.965 -21.236 1.00 0.00 C ATOM 1101 CG LYS A 73 11.595 30.584 -19.927 1.00 0.00 C ATOM 1102 CD LYS A 73 12.785 31.480 -19.628 1.00 0.00 C ATOM 1103 CE LYS A 73 14.028 31.025 -20.377 1.00 0.00 C ATOM 1104 NZ LYS A 73 14.054 31.541 -21.773 1.00 0.00 N ATOM 0 H LYS A 73 9.742 28.650 -21.583 1.00 0.00 H new ATOM 0 HA LYS A 73 8.945 31.257 -20.450 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.395 30.412 -22.049 1.00 0.00 H new ATOM 0 HB3 LYS A 73 11.098 32.024 -21.428 1.00 0.00 H new ATOM 0 HG2 LYS A 73 10.873 30.654 -19.114 1.00 0.00 H new ATOM 0 HG3 LYS A 73 11.923 29.546 -19.974 1.00 0.00 H new ATOM 0 HD2 LYS A 73 12.547 32.507 -19.906 1.00 0.00 H new ATOM 0 HD3 LYS A 73 12.983 31.477 -18.556 1.00 0.00 H new ATOM 0 HE2 LYS A 73 14.917 31.367 -19.847 1.00 0.00 H new ATOM 0 HE3 LYS A 73 14.065 29.936 -20.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 15.033 31.542 -22.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 13.469 30.932 -22.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 13.679 32.511 -21.792 1.00 0.00 H new ATOM 1118 N ALA A 74 7.864 30.395 -23.092 1.00 0.00 N ATOM 1119 CA ALA A 74 7.213 30.729 -24.353 1.00 0.00 C ATOM 1120 C ALA A 74 5.953 29.894 -24.558 1.00 0.00 C ATOM 1121 O ALA A 74 5.753 28.879 -23.890 1.00 0.00 O ATOM 1122 CB ALA A 74 8.176 30.529 -25.513 1.00 0.00 C ATOM 0 H ALA A 74 7.518 29.542 -22.651 1.00 0.00 H new ATOM 0 HA ALA A 74 6.920 31.778 -24.316 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.677 30.782 -26.448 1.00 0.00 H new ATOM 0 HB2 ALA A 74 9.045 31.173 -25.380 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.498 29.488 -25.544 1.00 0.00 H new ATOM 1128 N LYS A 75 5.107 30.327 -25.486 1.00 0.00 N ATOM 1129 CA LYS A 75 3.866 29.620 -25.780 1.00 0.00 C ATOM 1130 C LYS A 75 4.148 28.301 -26.494 1.00 0.00 C ATOM 1131 O LYS A 75 3.701 27.240 -26.057 1.00 0.00 O ATOM 1132 CB LYS A 75 2.950 30.492 -26.641 1.00 0.00 C ATOM 1133 CG LYS A 75 1.587 29.873 -26.899 1.00 0.00 C ATOM 1134 CD LYS A 75 0.632 30.126 -25.743 1.00 0.00 C ATOM 1135 CE LYS A 75 -0.813 30.169 -26.214 1.00 0.00 C ATOM 1136 NZ LYS A 75 -1.468 28.835 -26.122 1.00 0.00 N ATOM 0 H LYS A 75 5.258 31.165 -26.048 1.00 0.00 H new ATOM 0 HA LYS A 75 3.368 29.403 -24.835 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.815 31.456 -26.151 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.439 30.685 -27.596 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.167 30.285 -27.816 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.697 28.800 -27.053 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.749 29.342 -24.995 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.886 31.069 -25.259 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.369 30.889 -25.613 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.848 30.520 -27.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.478 28.388 -27.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.940 28.234 -25.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.444 28.950 -25.783 1.00 0.00 H new ATOM 1150 N TYR A 76 4.892 28.375 -27.592 1.00 0.00 N ATOM 1151 CA TYR A 76 5.232 27.188 -28.366 1.00 0.00 C ATOM 1152 C TYR A 76 5.904 26.138 -27.486 1.00 0.00 C ATOM 1153 O TYR A 76 5.814 24.939 -27.750 1.00 0.00 O ATOM 1154 CB TYR A 76 6.153 27.558 -29.530 1.00 0.00 C ATOM 1155 CG TYR A 76 7.048 28.742 -29.240 1.00 0.00 C ATOM 1156 CD1 TYR A 76 8.190 28.600 -28.462 1.00 0.00 C ATOM 1157 CD2 TYR A 76 6.752 30.002 -29.746 1.00 0.00 C ATOM 1158 CE1 TYR A 76 9.011 29.679 -28.194 1.00 0.00 C ATOM 1159 CE2 TYR A 76 7.567 31.086 -29.484 1.00 0.00 C ATOM 1160 CZ TYR A 76 8.695 30.920 -28.708 1.00 0.00 C ATOM 1161 OH TYR A 76 9.510 31.997 -28.445 1.00 0.00 O ATOM 0 H TYR A 76 5.271 29.245 -27.966 1.00 0.00 H new ATOM 0 HA TYR A 76 4.308 26.767 -28.762 1.00 0.00 H new ATOM 0 HB2 TYR A 76 6.773 26.697 -29.780 1.00 0.00 H new ATOM 0 HB3 TYR A 76 5.545 27.779 -30.408 1.00 0.00 H new ATOM 0 HD1 TYR A 76 8.441 27.630 -28.060 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.870 30.136 -30.354 1.00 0.00 H new ATOM 0 HE1 TYR A 76 9.894 29.552 -27.586 1.00 0.00 H new ATOM 0 HE2 TYR A 76 7.322 32.059 -29.885 1.00 0.00 H new ATOM 0 HH TYR A 76 9.147 32.796 -28.881 1.00 0.00 H new ATOM 1171 N LYS A 77 6.576 26.598 -26.436 1.00 0.00 N ATOM 1172 CA LYS A 77 7.263 25.701 -25.514 1.00 0.00 C ATOM 1173 C LYS A 77 6.270 24.782 -24.809 1.00 0.00 C ATOM 1174 O LYS A 77 6.535 23.594 -24.620 1.00 0.00 O ATOM 1175 CB LYS A 77 8.051 26.507 -24.479 1.00 0.00 C ATOM 1176 CG LYS A 77 9.041 27.482 -25.093 1.00 0.00 C ATOM 1177 CD LYS A 77 10.407 26.844 -25.284 1.00 0.00 C ATOM 1178 CE LYS A 77 10.538 26.210 -26.660 1.00 0.00 C ATOM 1179 NZ LYS A 77 11.083 27.167 -27.662 1.00 0.00 N ATOM 0 H LYS A 77 6.660 27.587 -26.202 1.00 0.00 H new ATOM 0 HA LYS A 77 7.954 25.087 -26.091 1.00 0.00 H new ATOM 0 HB2 LYS A 77 7.351 27.059 -23.852 1.00 0.00 H new ATOM 0 HB3 LYS A 77 8.589 25.818 -23.827 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.663 27.829 -26.055 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.134 28.359 -24.452 1.00 0.00 H new ATOM 0 HD2 LYS A 77 11.183 27.598 -25.154 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.567 26.087 -24.516 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.190 25.339 -26.598 1.00 0.00 H new ATOM 0 HE3 LYS A 77 9.562 25.855 -26.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 11.456 26.641 -28.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 10.326 27.806 -27.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 11.848 27.724 -27.230 1.00 0.00 H new ATOM 1193 N LEU A 78 5.126 25.337 -24.424 1.00 0.00 N ATOM 1194 CA LEU A 78 4.093 24.567 -23.742 1.00 0.00 C ATOM 1195 C LEU A 78 3.270 23.757 -24.738 1.00 0.00 C ATOM 1196 O LEU A 78 2.987 22.580 -24.514 1.00 0.00 O ATOM 1197 CB LEU A 78 3.178 25.498 -22.945 1.00 0.00 C ATOM 1198 CG LEU A 78 1.896 24.870 -22.395 1.00 0.00 C ATOM 1199 CD1 LEU A 78 2.206 23.564 -21.680 1.00 0.00 C ATOM 1200 CD2 LEU A 78 1.188 25.838 -21.458 1.00 0.00 C ATOM 0 H LEU A 78 4.891 26.318 -24.573 1.00 0.00 H new ATOM 0 HA LEU A 78 4.583 23.875 -23.057 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.747 25.906 -22.109 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.903 26.338 -23.583 1.00 0.00 H new ATOM 0 HG LEU A 78 1.232 24.654 -23.232 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.282 23.132 -21.295 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.669 22.868 -22.379 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.889 23.756 -20.852 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.278 25.375 -21.076 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.846 26.085 -20.625 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.932 26.748 -22.001 1.00 0.00 H new ATOM 1212 N VAL A 79 2.890 24.395 -25.841 1.00 0.00 N ATOM 1213 CA VAL A 79 2.103 23.733 -26.875 1.00 0.00 C ATOM 1214 C VAL A 79 2.825 22.503 -27.412 1.00 0.00 C ATOM 1215 O VAL A 79 2.206 21.473 -27.676 1.00 0.00 O ATOM 1216 CB VAL A 79 1.797 24.687 -28.044 1.00 0.00 C ATOM 1217 CG1 VAL A 79 1.048 23.956 -29.148 1.00 0.00 C ATOM 1218 CG2 VAL A 79 1.003 25.889 -27.557 1.00 0.00 C ATOM 0 H VAL A 79 3.115 25.370 -26.041 1.00 0.00 H new ATOM 0 HA VAL A 79 1.165 23.426 -26.412 1.00 0.00 H new ATOM 0 HB VAL A 79 2.741 25.046 -28.454 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.840 24.646 -29.966 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.657 23.130 -29.516 1.00 0.00 H new ATOM 0 HG13 VAL A 79 0.109 23.567 -28.755 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.796 26.553 -28.397 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.063 25.551 -27.121 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.580 26.426 -26.804 1.00 0.00 H new ATOM 1228 N ASN A 80 4.140 22.617 -27.572 1.00 0.00 N ATOM 1229 CA ASN A 80 4.948 21.514 -28.079 1.00 0.00 C ATOM 1230 C ASN A 80 5.110 20.428 -27.019 1.00 0.00 C ATOM 1231 O ASN A 80 5.372 19.268 -27.339 1.00 0.00 O ATOM 1232 CB ASN A 80 6.322 22.021 -28.521 1.00 0.00 C ATOM 1233 CG ASN A 80 6.240 22.932 -29.730 1.00 0.00 C ATOM 1234 OD1 ASN A 80 5.154 23.213 -30.237 1.00 0.00 O ATOM 1235 ND2 ASN A 80 7.392 23.398 -30.199 1.00 0.00 N ATOM 0 H ASN A 80 4.669 23.463 -27.358 1.00 0.00 H new ATOM 0 HA ASN A 80 4.434 21.085 -28.939 1.00 0.00 H new ATOM 0 HB2 ASN A 80 6.791 22.558 -27.696 1.00 0.00 H new ATOM 0 HB3 ASN A 80 6.963 21.170 -28.753 1.00 0.00 H new ATOM 0 HD21 ASN A 80 7.400 24.015 -31.011 1.00 0.00 H new ATOM 0 HD22 ASN A 80 8.269 23.139 -29.747 1.00 0.00 H new ATOM 1242 N HIS A 81 4.953 20.812 -25.757 1.00 0.00 N ATOM 1243 CA HIS A 81 5.081 19.871 -24.650 1.00 0.00 C ATOM 1244 C HIS A 81 3.910 18.894 -24.628 1.00 0.00 C ATOM 1245 O HIS A 81 4.103 17.679 -24.581 1.00 0.00 O ATOM 1246 CB HIS A 81 5.158 20.623 -23.320 1.00 0.00 C ATOM 1247 CG HIS A 81 4.512 19.894 -22.182 1.00 0.00 C ATOM 1248 ND1 HIS A 81 5.126 18.864 -21.502 1.00 0.00 N ATOM 1249 CD2 HIS A 81 3.298 20.053 -21.605 1.00 0.00 C ATOM 1250 CE1 HIS A 81 4.318 18.420 -20.556 1.00 0.00 C ATOM 1251 NE2 HIS A 81 3.202 19.125 -20.597 1.00 0.00 N ATOM 0 H HIS A 81 4.737 21.768 -25.475 1.00 0.00 H new ATOM 0 HA HIS A 81 6.001 19.304 -24.793 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.204 20.807 -23.076 1.00 0.00 H new ATOM 0 HB3 HIS A 81 4.682 21.597 -23.434 1.00 0.00 H new ATOM 0 HD1 HIS A 81 6.059 18.501 -21.699 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.545 20.775 -21.885 1.00 0.00 H new ATOM 0 HE1 HIS A 81 4.533 17.617 -19.866 1.00 0.00 H new ATOM 1259 N ILE A 82 2.696 19.433 -24.663 1.00 0.00 N ATOM 1260 CA ILE A 82 1.494 18.609 -24.648 1.00 0.00 C ATOM 1261 C ILE A 82 1.571 17.505 -25.698 1.00 0.00 C ATOM 1262 O ILE A 82 0.854 16.508 -25.619 1.00 0.00 O ATOM 1263 CB ILE A 82 0.229 19.452 -24.898 1.00 0.00 C ATOM 1264 CG1 ILE A 82 0.304 20.765 -24.116 1.00 0.00 C ATOM 1265 CG2 ILE A 82 -1.015 18.668 -24.510 1.00 0.00 C ATOM 1266 CD1 ILE A 82 -1.028 21.473 -23.997 1.00 0.00 C ATOM 0 H ILE A 82 2.519 20.437 -24.702 1.00 0.00 H new ATOM 0 HA ILE A 82 1.432 18.161 -23.656 1.00 0.00 H new ATOM 0 HB ILE A 82 0.169 19.686 -25.961 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.689 20.562 -23.117 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.017 21.429 -24.604 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.900 19.277 -24.692 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.072 17.757 -25.106 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.966 18.407 -23.453 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.900 22.396 -23.431 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -1.406 21.707 -24.992 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.739 20.827 -23.482 1.00 0.00 H new ATOM 1278 N ARG A 83 2.447 17.691 -26.680 1.00 0.00 N ATOM 1279 CA ARG A 83 2.618 16.711 -27.746 1.00 0.00 C ATOM 1280 C ARG A 83 2.982 15.344 -27.174 1.00 0.00 C ATOM 1281 O ARG A 83 2.788 14.316 -27.823 1.00 0.00 O ATOM 1282 CB ARG A 83 3.702 17.172 -28.722 1.00 0.00 C ATOM 1283 CG ARG A 83 3.462 18.563 -29.286 1.00 0.00 C ATOM 1284 CD ARG A 83 2.112 18.659 -29.978 1.00 0.00 C ATOM 1285 NE ARG A 83 1.014 18.784 -29.023 1.00 0.00 N ATOM 1286 CZ ARG A 83 -0.171 19.301 -29.329 1.00 0.00 C ATOM 1287 NH1 ARG A 83 -0.410 19.737 -30.558 1.00 0.00 N ATOM 1288 NH2 ARG A 83 -1.120 19.381 -28.405 1.00 0.00 N ATOM 0 H ARG A 83 3.049 18.511 -26.760 1.00 0.00 H new ATOM 0 HA ARG A 83 1.672 16.623 -28.280 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.666 17.156 -28.214 1.00 0.00 H new ATOM 0 HB3 ARG A 83 3.764 16.461 -29.546 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.512 19.297 -28.481 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.253 18.811 -29.994 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.109 19.519 -30.648 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.957 17.773 -30.594 1.00 0.00 H new ATOM 0 HE ARG A 83 1.165 18.456 -28.069 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.317 19.676 -31.271 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -1.321 20.133 -30.790 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.940 19.045 -27.459 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.029 19.778 -28.641 1.00 0.00 H new ATOM 1302 N VAL A 84 3.513 15.340 -25.955 1.00 0.00 N ATOM 1303 CA VAL A 84 3.904 14.100 -25.296 1.00 0.00 C ATOM 1304 C VAL A 84 2.730 13.484 -24.544 1.00 0.00 C ATOM 1305 O VAL A 84 2.788 12.329 -24.119 1.00 0.00 O ATOM 1306 CB VAL A 84 5.066 14.331 -24.311 1.00 0.00 C ATOM 1307 CG1 VAL A 84 6.128 15.220 -24.937 1.00 0.00 C ATOM 1308 CG2 VAL A 84 4.551 14.933 -23.012 1.00 0.00 C ATOM 0 H VAL A 84 3.682 16.182 -25.404 1.00 0.00 H new ATOM 0 HA VAL A 84 4.231 13.415 -26.078 1.00 0.00 H new ATOM 0 HB VAL A 84 5.523 13.368 -24.082 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.940 15.372 -24.226 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.517 14.744 -25.837 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.689 16.183 -25.197 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.385 15.090 -22.328 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.068 15.888 -23.220 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.831 14.254 -22.557 1.00 0.00 H new ATOM 1318 N HIS A 85 1.663 14.261 -24.383 1.00 0.00 N ATOM 1319 CA HIS A 85 0.473 13.791 -23.683 1.00 0.00 C ATOM 1320 C HIS A 85 -0.498 13.121 -24.651 1.00 0.00 C ATOM 1321 O HIS A 85 -1.415 12.412 -24.237 1.00 0.00 O ATOM 1322 CB HIS A 85 -0.219 14.954 -22.972 1.00 0.00 C ATOM 1323 CG HIS A 85 0.566 15.505 -21.822 1.00 0.00 C ATOM 1324 ND1 HIS A 85 1.512 14.772 -21.137 1.00 0.00 N ATOM 1325 CD2 HIS A 85 0.542 16.725 -21.237 1.00 0.00 C ATOM 1326 CE1 HIS A 85 2.035 15.517 -20.180 1.00 0.00 C ATOM 1327 NE2 HIS A 85 1.464 16.708 -20.220 1.00 0.00 N ATOM 0 H HIS A 85 1.598 15.219 -24.728 1.00 0.00 H new ATOM 0 HA HIS A 85 0.785 13.055 -22.941 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.402 15.752 -23.692 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -1.192 14.621 -22.611 1.00 0.00 H new ATOM 0 HD1 HIS A 85 1.768 13.805 -21.338 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -0.086 17.558 -21.518 1.00 0.00 H new ATOM 0 HE1 HIS A 85 2.799 15.206 -19.483 1.00 0.00 H new ATOM 1335 N THR A 86 -0.290 13.351 -25.944 1.00 0.00 N ATOM 1336 CA THR A 86 -1.147 12.772 -26.971 1.00 0.00 C ATOM 1337 C THR A 86 -0.684 11.369 -27.347 1.00 0.00 C ATOM 1338 O THR A 86 -1.270 10.376 -26.920 1.00 0.00 O ATOM 1339 CB THR A 86 -1.176 13.648 -28.238 1.00 0.00 C ATOM 1340 OG1 THR A 86 0.155 13.850 -28.724 1.00 0.00 O ATOM 1341 CG2 THR A 86 -1.827 14.993 -27.951 1.00 0.00 C ATOM 0 H THR A 86 0.465 13.934 -26.305 1.00 0.00 H new ATOM 0 HA THR A 86 -2.152 12.720 -26.552 1.00 0.00 H new ATOM 0 HB THR A 86 -1.765 13.132 -28.997 1.00 0.00 H new ATOM 0 HG1 THR A 86 0.128 14.406 -29.530 1.00 0.00 H new ATOM 0 HG21 THR A 86 -1.836 15.594 -28.860 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.850 14.836 -27.609 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.262 15.513 -27.178 1.00 0.00 H new ATOM 1349 N GLY A 87 0.374 11.296 -28.150 1.00 0.00 N ATOM 1350 CA GLY A 87 0.899 10.009 -28.569 1.00 0.00 C ATOM 1351 C GLY A 87 2.414 9.975 -28.575 1.00 0.00 C ATOM 1352 O GLY A 87 3.018 8.923 -28.366 1.00 0.00 O ATOM 0 H GLY A 87 0.876 12.104 -28.517 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.524 9.233 -27.902 1.00 0.00 H new ATOM 0 HA3 GLY A 87 0.530 9.777 -29.568 1.00 0.00 H new ATOM 1356 N GLU A 88 3.030 11.128 -28.817 1.00 0.00 N ATOM 1357 CA GLU A 88 4.484 11.224 -28.853 1.00 0.00 C ATOM 1358 C GLU A 88 5.078 10.997 -27.465 1.00 0.00 C ATOM 1359 O GLU A 88 4.424 11.237 -26.450 1.00 0.00 O ATOM 1360 CB GLU A 88 4.914 12.592 -29.386 1.00 0.00 C ATOM 1361 CG GLU A 88 6.249 12.570 -30.112 1.00 0.00 C ATOM 1362 CD GLU A 88 6.361 13.662 -31.159 1.00 0.00 C ATOM 1363 OE1 GLU A 88 5.709 14.713 -30.993 1.00 0.00 O ATOM 1364 OE2 GLU A 88 7.101 13.463 -32.145 1.00 0.00 O ATOM 0 H GLU A 88 2.545 12.008 -28.991 1.00 0.00 H new ATOM 0 HA GLU A 88 4.858 10.448 -29.521 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.147 12.966 -30.064 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.974 13.294 -28.554 1.00 0.00 H new ATOM 0 HG2 GLU A 88 7.055 12.683 -29.387 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.383 11.599 -30.589 1.00 0.00 H new ATOM 1371 N LYS A 89 6.322 10.531 -27.430 1.00 0.00 N ATOM 1372 CA LYS A 89 7.006 10.271 -26.169 1.00 0.00 C ATOM 1373 C LYS A 89 7.884 11.454 -25.773 1.00 0.00 C ATOM 1374 O LYS A 89 8.340 12.229 -26.613 1.00 0.00 O ATOM 1375 CB LYS A 89 7.858 9.004 -26.279 1.00 0.00 C ATOM 1376 CG LYS A 89 7.264 7.949 -27.196 1.00 0.00 C ATOM 1377 CD LYS A 89 6.180 7.147 -26.495 1.00 0.00 C ATOM 1378 CE LYS A 89 6.746 5.890 -25.851 1.00 0.00 C ATOM 1379 NZ LYS A 89 5.685 4.882 -25.578 1.00 0.00 N ATOM 0 H LYS A 89 6.877 10.326 -28.261 1.00 0.00 H new ATOM 0 HA LYS A 89 6.250 10.127 -25.397 1.00 0.00 H new ATOM 0 HB2 LYS A 89 8.849 9.273 -26.643 1.00 0.00 H new ATOM 0 HB3 LYS A 89 7.989 8.577 -25.285 1.00 0.00 H new ATOM 0 HG2 LYS A 89 6.848 8.428 -28.082 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.052 7.277 -27.537 1.00 0.00 H new ATOM 0 HD2 LYS A 89 5.704 7.765 -25.734 1.00 0.00 H new ATOM 0 HD3 LYS A 89 5.407 6.873 -27.213 1.00 0.00 H new ATOM 0 HE2 LYS A 89 7.501 5.455 -26.506 1.00 0.00 H new ATOM 0 HE3 LYS A 89 7.246 6.153 -24.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 5.907 4.374 -24.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 4.768 5.362 -25.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 5.638 4.205 -26.366 1.00 0.00 H new ATOM 1393 N PRO A 90 8.130 11.596 -24.462 1.00 0.00 N ATOM 1394 CA PRO A 90 8.956 12.681 -23.924 1.00 0.00 C ATOM 1395 C PRO A 90 10.430 12.519 -24.282 1.00 0.00 C ATOM 1396 O PRO A 90 11.058 13.442 -24.800 1.00 0.00 O ATOM 1397 CB PRO A 90 8.758 12.563 -22.411 1.00 0.00 C ATOM 1398 CG PRO A 90 8.395 11.135 -22.187 1.00 0.00 C ATOM 1399 CD PRO A 90 7.619 10.709 -23.403 1.00 0.00 C ATOM 0 HA PRO A 90 8.669 13.651 -24.330 1.00 0.00 H new ATOM 0 HB2 PRO A 90 9.666 12.830 -21.871 1.00 0.00 H new ATOM 0 HB3 PRO A 90 7.971 13.231 -22.061 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.287 10.521 -22.058 1.00 0.00 H new ATOM 0 HG3 PRO A 90 7.797 11.022 -21.283 1.00 0.00 H new ATOM 0 HD2 PRO A 90 7.790 9.659 -23.641 1.00 0.00 H new ATOM 0 HD3 PRO A 90 6.546 10.833 -23.258 1.00 0.00 H new ATOM 1407 N PHE A 91 10.975 11.340 -24.004 1.00 0.00 N ATOM 1408 CA PHE A 91 12.376 11.057 -24.296 1.00 0.00 C ATOM 1409 C PHE A 91 12.608 9.556 -24.443 1.00 0.00 C ATOM 1410 O PHE A 91 12.039 8.740 -23.717 1.00 0.00 O ATOM 1411 CB PHE A 91 13.273 11.618 -23.191 1.00 0.00 C ATOM 1412 CG PHE A 91 12.587 11.727 -21.859 1.00 0.00 C ATOM 1413 CD1 PHE A 91 12.158 10.591 -21.191 1.00 0.00 C ATOM 1414 CD2 PHE A 91 12.370 12.965 -21.276 1.00 0.00 C ATOM 1415 CE1 PHE A 91 11.527 10.687 -19.965 1.00 0.00 C ATOM 1416 CE2 PHE A 91 11.740 13.067 -20.050 1.00 0.00 C ATOM 1417 CZ PHE A 91 11.317 11.927 -19.395 1.00 0.00 C ATOM 0 H PHE A 91 10.468 10.565 -23.577 1.00 0.00 H new ATOM 0 HA PHE A 91 12.630 11.540 -25.240 1.00 0.00 H new ATOM 0 HB2 PHE A 91 14.151 10.980 -23.088 1.00 0.00 H new ATOM 0 HB3 PHE A 91 13.629 12.604 -23.489 1.00 0.00 H new ATOM 0 HD1 PHE A 91 12.319 9.619 -21.634 1.00 0.00 H new ATOM 0 HD2 PHE A 91 12.697 13.860 -21.785 1.00 0.00 H new ATOM 0 HE1 PHE A 91 11.199 9.794 -19.454 1.00 0.00 H new ATOM 0 HE2 PHE A 91 11.579 14.038 -19.604 1.00 0.00 H new ATOM 0 HZ PHE A 91 10.823 12.005 -18.438 1.00 0.00 H new ATOM 1427 N PRO A 92 13.465 9.181 -25.404 1.00 0.00 N ATOM 1428 CA PRO A 92 13.794 7.777 -25.669 1.00 0.00 C ATOM 1429 C PRO A 92 14.623 7.155 -24.551 1.00 0.00 C ATOM 1430 O PRO A 92 14.709 7.701 -23.450 1.00 0.00 O ATOM 1431 CB PRO A 92 14.606 7.842 -26.965 1.00 0.00 C ATOM 1432 CG PRO A 92 15.191 9.212 -26.978 1.00 0.00 C ATOM 1433 CD PRO A 92 14.181 10.100 -26.306 1.00 0.00 C ATOM 0 HA PRO A 92 12.902 7.155 -25.740 1.00 0.00 H new ATOM 0 HB2 PRO A 92 15.384 7.079 -26.983 1.00 0.00 H new ATOM 0 HB3 PRO A 92 13.974 7.673 -27.837 1.00 0.00 H new ATOM 0 HG2 PRO A 92 16.144 9.235 -26.449 1.00 0.00 H new ATOM 0 HG3 PRO A 92 15.385 9.544 -27.998 1.00 0.00 H new ATOM 0 HD2 PRO A 92 14.661 10.910 -25.756 1.00 0.00 H new ATOM 0 HD3 PRO A 92 13.507 10.560 -27.028 1.00 0.00 H new ATOM 1441 N CYS A 93 15.232 6.010 -24.840 1.00 0.00 N ATOM 1442 CA CYS A 93 16.055 5.313 -23.859 1.00 0.00 C ATOM 1443 C CYS A 93 17.519 5.726 -23.985 1.00 0.00 C ATOM 1444 O CYS A 93 18.069 5.826 -25.082 1.00 0.00 O ATOM 1445 CB CYS A 93 15.924 3.799 -24.037 1.00 0.00 C ATOM 1446 SG CYS A 93 16.923 2.824 -22.866 1.00 0.00 S ATOM 0 H CYS A 93 15.171 5.545 -25.746 1.00 0.00 H new ATOM 0 HA CYS A 93 15.703 5.588 -22.865 1.00 0.00 H new ATOM 0 HB2 CYS A 93 14.876 3.520 -23.925 1.00 0.00 H new ATOM 0 HB3 CYS A 93 16.216 3.537 -25.054 1.00 0.00 H new ATOM 1451 N PRO A 94 18.166 5.971 -22.836 1.00 0.00 N ATOM 1452 CA PRO A 94 19.574 6.376 -22.791 1.00 0.00 C ATOM 1453 C PRO A 94 20.515 5.246 -23.194 1.00 0.00 C ATOM 1454 O PRO A 94 21.737 5.396 -23.149 1.00 0.00 O ATOM 1455 CB PRO A 94 19.788 6.752 -21.323 1.00 0.00 C ATOM 1456 CG PRO A 94 18.762 5.970 -20.578 1.00 0.00 C ATOM 1457 CD PRO A 94 17.572 5.871 -21.492 1.00 0.00 C ATOM 0 HA PRO A 94 19.788 7.186 -23.488 1.00 0.00 H new ATOM 0 HB2 PRO A 94 20.795 6.499 -20.992 1.00 0.00 H new ATOM 0 HB3 PRO A 94 19.660 7.823 -21.166 1.00 0.00 H new ATOM 0 HG2 PRO A 94 19.138 4.980 -20.319 1.00 0.00 H new ATOM 0 HG3 PRO A 94 18.496 6.465 -19.644 1.00 0.00 H new ATOM 0 HD2 PRO A 94 17.039 4.930 -21.357 1.00 0.00 H new ATOM 0 HD3 PRO A 94 16.856 6.672 -21.308 1.00 0.00 H new ATOM 1465 N PHE A 95 19.940 4.114 -23.587 1.00 0.00 N ATOM 1466 CA PHE A 95 20.728 2.958 -23.998 1.00 0.00 C ATOM 1467 C PHE A 95 20.887 2.919 -25.515 1.00 0.00 C ATOM 1468 O PHE A 95 19.930 3.090 -26.269 1.00 0.00 O ATOM 1469 CB PHE A 95 20.070 1.666 -23.509 1.00 0.00 C ATOM 1470 CG PHE A 95 21.038 0.533 -23.325 1.00 0.00 C ATOM 1471 CD1 PHE A 95 21.629 -0.076 -24.421 1.00 0.00 C ATOM 1472 CD2 PHE A 95 21.358 0.075 -22.057 1.00 0.00 C ATOM 1473 CE1 PHE A 95 22.520 -1.119 -24.255 1.00 0.00 C ATOM 1474 CE2 PHE A 95 22.249 -0.967 -21.885 1.00 0.00 C ATOM 1475 CZ PHE A 95 22.830 -1.566 -22.986 1.00 0.00 C ATOM 0 H PHE A 95 18.931 3.973 -23.629 1.00 0.00 H new ATOM 0 HA PHE A 95 21.717 3.046 -23.549 1.00 0.00 H new ATOM 0 HB2 PHE A 95 19.566 1.860 -22.562 1.00 0.00 H new ATOM 0 HB3 PHE A 95 19.303 1.366 -24.223 1.00 0.00 H new ATOM 0 HD1 PHE A 95 21.390 0.269 -25.416 1.00 0.00 H new ATOM 0 HD2 PHE A 95 20.905 0.538 -21.193 1.00 0.00 H new ATOM 0 HE1 PHE A 95 22.974 -1.584 -25.118 1.00 0.00 H new ATOM 0 HE2 PHE A 95 22.491 -1.313 -20.891 1.00 0.00 H new ATOM 0 HZ PHE A 95 23.525 -2.382 -22.854 1.00 0.00 H new ATOM 1485 N PRO A 96 22.127 2.689 -25.973 1.00 0.00 N ATOM 1486 CA PRO A 96 22.441 2.622 -27.403 1.00 0.00 C ATOM 1487 C PRO A 96 21.859 1.379 -28.068 1.00 0.00 C ATOM 1488 O PRO A 96 21.145 1.473 -29.065 1.00 0.00 O ATOM 1489 CB PRO A 96 23.971 2.574 -27.428 1.00 0.00 C ATOM 1490 CG PRO A 96 24.353 1.998 -26.109 1.00 0.00 C ATOM 1491 CD PRO A 96 23.316 2.476 -25.131 1.00 0.00 C ATOM 0 HA PRO A 96 22.017 3.463 -27.952 1.00 0.00 H new ATOM 0 HB2 PRO A 96 24.334 1.957 -28.250 1.00 0.00 H new ATOM 0 HB3 PRO A 96 24.396 3.568 -27.564 1.00 0.00 H new ATOM 0 HG2 PRO A 96 24.377 0.909 -26.151 1.00 0.00 H new ATOM 0 HG3 PRO A 96 25.349 2.327 -25.813 1.00 0.00 H new ATOM 0 HD2 PRO A 96 23.129 1.738 -24.351 1.00 0.00 H new ATOM 0 HD3 PRO A 96 23.626 3.395 -24.633 1.00 0.00 H new ATOM 1499 N GLY A 97 22.169 0.213 -27.507 1.00 0.00 N ATOM 1500 CA GLY A 97 21.668 -1.032 -28.058 1.00 0.00 C ATOM 1501 C GLY A 97 20.290 -1.384 -27.535 1.00 0.00 C ATOM 1502 O GLY A 97 20.027 -2.534 -27.182 1.00 0.00 O ATOM 0 H GLY A 97 22.758 0.109 -26.681 1.00 0.00 H new ATOM 0 HA2 GLY A 97 21.632 -0.957 -29.145 1.00 0.00 H new ATOM 0 HA3 GLY A 97 22.362 -1.838 -27.817 1.00 0.00 H new ATOM 1506 N CYS A 98 19.407 -0.393 -27.483 1.00 0.00 N ATOM 1507 CA CYS A 98 18.048 -0.602 -26.997 1.00 0.00 C ATOM 1508 C CYS A 98 17.032 0.066 -27.919 1.00 0.00 C ATOM 1509 O CYS A 98 16.149 -0.593 -28.467 1.00 0.00 O ATOM 1510 CB CYS A 98 17.902 -0.054 -25.577 1.00 0.00 C ATOM 1511 SG CYS A 98 16.365 -0.557 -24.739 1.00 0.00 S ATOM 0 H CYS A 98 19.608 0.564 -27.772 1.00 0.00 H new ATOM 0 HA CYS A 98 17.853 -1.674 -26.987 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.753 -0.386 -24.982 1.00 0.00 H new ATOM 0 HB3 CYS A 98 17.944 1.035 -25.613 1.00 0.00 H new ATOM 1516 N GLY A 99 17.164 1.378 -28.085 1.00 0.00 N ATOM 1517 CA GLY A 99 16.251 2.114 -28.941 1.00 0.00 C ATOM 1518 C GLY A 99 14.816 2.036 -28.459 1.00 0.00 C ATOM 1519 O GLY A 99 13.880 2.135 -29.253 1.00 0.00 O ATOM 0 H GLY A 99 17.887 1.945 -27.642 1.00 0.00 H new ATOM 0 HA2 GLY A 99 16.560 3.158 -28.984 1.00 0.00 H new ATOM 0 HA3 GLY A 99 16.312 1.721 -29.956 1.00 0.00 H new ATOM 1523 N LYS A 100 14.640 1.858 -27.154 1.00 0.00 N ATOM 1524 CA LYS A 100 13.309 1.767 -26.566 1.00 0.00 C ATOM 1525 C LYS A 100 12.851 3.125 -26.043 1.00 0.00 C ATOM 1526 O LYS A 100 13.671 3.965 -25.671 1.00 0.00 O ATOM 1527 CB LYS A 100 13.300 0.742 -25.430 1.00 0.00 C ATOM 1528 CG LYS A 100 12.043 0.789 -24.578 1.00 0.00 C ATOM 1529 CD LYS A 100 10.867 0.135 -25.283 1.00 0.00 C ATOM 1530 CE LYS A 100 9.895 -0.484 -24.290 1.00 0.00 C ATOM 1531 NZ LYS A 100 9.039 -1.523 -24.925 1.00 0.00 N ATOM 0 H LYS A 100 15.404 1.774 -26.483 1.00 0.00 H new ATOM 0 HA LYS A 100 12.617 1.445 -27.344 1.00 0.00 H new ATOM 0 HB2 LYS A 100 13.405 -0.257 -25.853 1.00 0.00 H new ATOM 0 HB3 LYS A 100 14.168 0.911 -24.792 1.00 0.00 H new ATOM 0 HG2 LYS A 100 12.226 0.284 -23.629 1.00 0.00 H new ATOM 0 HG3 LYS A 100 11.798 1.825 -24.346 1.00 0.00 H new ATOM 0 HD2 LYS A 100 10.347 0.877 -25.889 1.00 0.00 H new ATOM 0 HD3 LYS A 100 11.232 -0.634 -25.964 1.00 0.00 H new ATOM 0 HE2 LYS A 100 10.452 -0.927 -23.465 1.00 0.00 H new ATOM 0 HE3 LYS A 100 9.264 0.297 -23.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 8.391 -1.920 -24.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 8.488 -1.095 -25.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 9.639 -2.281 -25.308 1.00 0.00 H new ATOM 1545 N ILE A 101 11.539 3.332 -26.017 1.00 0.00 N ATOM 1546 CA ILE A 101 10.973 4.587 -25.537 1.00 0.00 C ATOM 1547 C ILE A 101 9.718 4.342 -24.707 1.00 0.00 C ATOM 1548 O ILE A 101 8.925 3.450 -25.008 1.00 0.00 O ATOM 1549 CB ILE A 101 10.628 5.531 -26.704 1.00 0.00 C ATOM 1550 CG1 ILE A 101 11.665 5.399 -27.821 1.00 0.00 C ATOM 1551 CG2 ILE A 101 10.548 6.970 -26.215 1.00 0.00 C ATOM 1552 CD1 ILE A 101 11.314 6.179 -29.068 1.00 0.00 C ATOM 0 H ILE A 101 10.848 2.647 -26.323 1.00 0.00 H new ATOM 0 HA ILE A 101 11.732 5.058 -24.912 1.00 0.00 H new ATOM 0 HB ILE A 101 9.654 5.249 -27.104 1.00 0.00 H new ATOM 0 HG12 ILE A 101 12.632 5.739 -27.450 1.00 0.00 H new ATOM 0 HG13 ILE A 101 11.776 4.346 -28.080 1.00 0.00 H new ATOM 0 HG21 ILE A 101 10.303 7.625 -27.051 1.00 0.00 H new ATOM 0 HG22 ILE A 101 9.775 7.052 -25.451 1.00 0.00 H new ATOM 0 HG23 ILE A 101 11.508 7.264 -25.792 1.00 0.00 H new ATOM 0 HD11 ILE A 101 12.094 6.038 -29.817 1.00 0.00 H new ATOM 0 HD12 ILE A 101 10.363 5.823 -29.464 1.00 0.00 H new ATOM 0 HD13 ILE A 101 11.232 7.238 -28.824 1.00 0.00 H new ATOM 1564 N PHE A 102 9.543 5.142 -23.660 1.00 0.00 N ATOM 1565 CA PHE A 102 8.383 5.013 -22.786 1.00 0.00 C ATOM 1566 C PHE A 102 7.675 6.355 -22.621 1.00 0.00 C ATOM 1567 O PHE A 102 8.302 7.366 -22.306 1.00 0.00 O ATOM 1568 CB PHE A 102 8.807 4.476 -21.417 1.00 0.00 C ATOM 1569 CG PHE A 102 9.840 3.389 -21.494 1.00 0.00 C ATOM 1570 CD1 PHE A 102 11.094 3.644 -22.025 1.00 0.00 C ATOM 1571 CD2 PHE A 102 9.558 2.113 -21.034 1.00 0.00 C ATOM 1572 CE1 PHE A 102 12.048 2.646 -22.097 1.00 0.00 C ATOM 1573 CE2 PHE A 102 10.508 1.111 -21.103 1.00 0.00 C ATOM 1574 CZ PHE A 102 11.754 1.378 -21.636 1.00 0.00 C ATOM 0 H PHE A 102 10.189 5.886 -23.397 1.00 0.00 H new ATOM 0 HA PHE A 102 7.689 4.310 -23.246 1.00 0.00 H new ATOM 0 HB2 PHE A 102 9.200 5.298 -20.819 1.00 0.00 H new ATOM 0 HB3 PHE A 102 7.928 4.095 -20.897 1.00 0.00 H new ATOM 0 HD1 PHE A 102 11.329 4.634 -22.387 1.00 0.00 H new ATOM 0 HD2 PHE A 102 8.585 1.899 -20.617 1.00 0.00 H new ATOM 0 HE1 PHE A 102 13.022 2.858 -22.513 1.00 0.00 H new ATOM 0 HE2 PHE A 102 10.276 0.120 -20.741 1.00 0.00 H new ATOM 0 HZ PHE A 102 12.497 0.596 -21.692 1.00 0.00 H new ATOM 1584 N ALA A 103 6.363 6.355 -22.837 1.00 0.00 N ATOM 1585 CA ALA A 103 5.569 7.571 -22.711 1.00 0.00 C ATOM 1586 C ALA A 103 5.507 8.039 -21.261 1.00 0.00 C ATOM 1587 O ALA A 103 4.928 9.083 -20.960 1.00 0.00 O ATOM 1588 CB ALA A 103 4.166 7.343 -23.254 1.00 0.00 C ATOM 0 H ALA A 103 5.828 5.527 -23.100 1.00 0.00 H new ATOM 0 HA ALA A 103 6.052 8.353 -23.297 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.584 8.259 -23.154 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.224 7.063 -24.306 1.00 0.00 H new ATOM 0 HB3 ALA A 103 3.684 6.543 -22.692 1.00 0.00 H new ATOM 1594 N ARG A 104 6.108 7.261 -20.367 1.00 0.00 N ATOM 1595 CA ARG A 104 6.120 7.596 -18.948 1.00 0.00 C ATOM 1596 C ARG A 104 7.549 7.683 -18.422 1.00 0.00 C ATOM 1597 O ARG A 104 8.363 6.790 -18.656 1.00 0.00 O ATOM 1598 CB ARG A 104 5.334 6.553 -18.150 1.00 0.00 C ATOM 1599 CG ARG A 104 3.886 6.943 -17.899 1.00 0.00 C ATOM 1600 CD ARG A 104 3.006 5.719 -17.699 1.00 0.00 C ATOM 1601 NE ARG A 104 3.035 4.829 -18.857 1.00 0.00 N ATOM 1602 CZ ARG A 104 2.366 5.063 -19.980 1.00 0.00 C ATOM 1603 NH1 ARG A 104 1.620 6.153 -20.097 1.00 0.00 N ATOM 1604 NH2 ARG A 104 2.443 4.206 -20.990 1.00 0.00 N ATOM 0 H ARG A 104 6.593 6.394 -20.600 1.00 0.00 H new ATOM 0 HA ARG A 104 5.647 8.570 -18.826 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.358 5.604 -18.686 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.829 6.391 -17.193 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.828 7.582 -17.018 1.00 0.00 H new ATOM 0 HG3 ARG A 104 3.514 7.526 -18.741 1.00 0.00 H new ATOM 0 HD2 ARG A 104 3.338 5.175 -16.815 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.980 6.037 -17.511 1.00 0.00 H new ATOM 0 HE ARG A 104 3.600 3.982 -18.800 1.00 0.00 H new ATOM 0 HH11 ARG A 104 1.559 6.815 -19.323 1.00 0.00 H new ATOM 0 HH12 ARG A 104 1.107 6.330 -20.961 1.00 0.00 H new ATOM 0 HH21 ARG A 104 3.016 3.367 -20.904 1.00 0.00 H new ATOM 0 HH22 ARG A 104 1.929 4.386 -21.852 1.00 0.00 H new ATOM 1618 N SER A 105 7.847 8.765 -17.710 1.00 0.00 N ATOM 1619 CA SER A 105 9.179 8.972 -17.154 1.00 0.00 C ATOM 1620 C SER A 105 9.558 7.833 -16.213 1.00 0.00 C ATOM 1621 O SER A 105 10.652 7.277 -16.303 1.00 0.00 O ATOM 1622 CB SER A 105 9.243 10.307 -16.410 1.00 0.00 C ATOM 1623 OG SER A 105 8.479 11.298 -17.074 1.00 0.00 O ATOM 0 H SER A 105 7.184 9.512 -17.505 1.00 0.00 H new ATOM 0 HA SER A 105 9.891 8.990 -17.979 1.00 0.00 H new ATOM 0 HB2 SER A 105 8.872 10.178 -15.393 1.00 0.00 H new ATOM 0 HB3 SER A 105 10.280 10.634 -16.332 1.00 0.00 H new ATOM 0 HG SER A 105 7.646 11.453 -16.582 1.00 0.00 H new ATOM 1629 N GLU A 106 8.644 7.491 -15.310 1.00 0.00 N ATOM 1630 CA GLU A 106 8.882 6.419 -14.351 1.00 0.00 C ATOM 1631 C GLU A 106 9.255 5.123 -15.065 1.00 0.00 C ATOM 1632 O GLU A 106 10.081 4.351 -14.580 1.00 0.00 O ATOM 1633 CB GLU A 106 7.642 6.197 -13.482 1.00 0.00 C ATOM 1634 CG GLU A 106 7.192 7.441 -12.734 1.00 0.00 C ATOM 1635 CD GLU A 106 8.346 8.359 -12.381 1.00 0.00 C ATOM 1636 OE1 GLU A 106 8.867 9.033 -13.294 1.00 0.00 O ATOM 1637 OE2 GLU A 106 8.727 8.403 -11.193 1.00 0.00 O ATOM 0 H GLU A 106 7.733 7.941 -15.223 1.00 0.00 H new ATOM 0 HA GLU A 106 9.715 6.715 -13.714 1.00 0.00 H new ATOM 0 HB2 GLU A 106 6.825 5.847 -14.113 1.00 0.00 H new ATOM 0 HB3 GLU A 106 7.850 5.406 -12.762 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.472 7.987 -13.344 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.676 7.145 -11.821 1.00 0.00 H new ATOM 1644 N ASN A 107 8.638 4.892 -16.219 1.00 0.00 N ATOM 1645 CA ASN A 107 8.904 3.690 -17.001 1.00 0.00 C ATOM 1646 C ASN A 107 10.335 3.690 -17.529 1.00 0.00 C ATOM 1647 O ASN A 107 10.988 2.647 -17.586 1.00 0.00 O ATOM 1648 CB ASN A 107 7.918 3.585 -18.166 1.00 0.00 C ATOM 1649 CG ASN A 107 6.631 2.885 -17.773 1.00 0.00 C ATOM 1650 OD1 ASN A 107 6.121 2.041 -18.510 1.00 0.00 O ATOM 1651 ND2 ASN A 107 6.101 3.233 -16.607 1.00 0.00 N ATOM 0 H ASN A 107 7.950 5.521 -16.633 1.00 0.00 H new ATOM 0 HA ASN A 107 8.777 2.827 -16.348 1.00 0.00 H new ATOM 0 HB2 ASN A 107 7.687 4.585 -18.534 1.00 0.00 H new ATOM 0 HB3 ASN A 107 8.387 3.043 -18.988 1.00 0.00 H new ATOM 0 HD21 ASN A 107 5.236 2.796 -16.289 1.00 0.00 H new ATOM 0 HD22 ASN A 107 6.559 3.938 -16.029 1.00 0.00 H new ATOM 1658 N LEU A 108 10.818 4.866 -17.915 1.00 0.00 N ATOM 1659 CA LEU A 108 12.172 5.003 -18.439 1.00 0.00 C ATOM 1660 C LEU A 108 13.206 4.810 -17.333 1.00 0.00 C ATOM 1661 O LEU A 108 14.135 4.014 -17.469 1.00 0.00 O ATOM 1662 CB LEU A 108 12.353 6.376 -19.087 1.00 0.00 C ATOM 1663 CG LEU A 108 13.716 6.643 -19.726 1.00 0.00 C ATOM 1664 CD1 LEU A 108 14.237 5.391 -20.415 1.00 0.00 C ATOM 1665 CD2 LEU A 108 13.627 7.798 -20.712 1.00 0.00 C ATOM 0 H LEU A 108 10.292 5.739 -17.875 1.00 0.00 H new ATOM 0 HA LEU A 108 12.323 4.230 -19.192 1.00 0.00 H new ATOM 0 HB2 LEU A 108 11.586 6.499 -19.851 1.00 0.00 H new ATOM 0 HB3 LEU A 108 12.173 7.139 -18.330 1.00 0.00 H new ATOM 0 HG LEU A 108 14.417 6.918 -18.938 1.00 0.00 H new ATOM 0 HD11 LEU A 108 15.208 5.600 -20.864 1.00 0.00 H new ATOM 0 HD12 LEU A 108 14.340 4.590 -19.684 1.00 0.00 H new ATOM 0 HD13 LEU A 108 13.536 5.085 -21.192 1.00 0.00 H new ATOM 0 HD21 LEU A 108 14.607 7.973 -21.157 1.00 0.00 H new ATOM 0 HD22 LEU A 108 12.911 7.552 -21.496 1.00 0.00 H new ATOM 0 HD23 LEU A 108 13.299 8.697 -20.190 1.00 0.00 H new ATOM 1677 N LYS A 109 13.036 5.541 -16.237 1.00 0.00 N ATOM 1678 CA LYS A 109 13.950 5.449 -15.106 1.00 0.00 C ATOM 1679 C LYS A 109 13.976 4.033 -14.541 1.00 0.00 C ATOM 1680 O LYS A 109 15.044 3.481 -14.273 1.00 0.00 O ATOM 1681 CB LYS A 109 13.542 6.438 -14.012 1.00 0.00 C ATOM 1682 CG LYS A 109 12.553 5.865 -13.012 1.00 0.00 C ATOM 1683 CD LYS A 109 12.232 6.862 -11.911 1.00 0.00 C ATOM 1684 CE LYS A 109 11.162 6.328 -10.971 1.00 0.00 C ATOM 1685 NZ LYS A 109 10.905 7.260 -9.838 1.00 0.00 N ATOM 0 H LYS A 109 12.272 6.205 -16.108 1.00 0.00 H new ATOM 0 HA LYS A 109 14.951 5.699 -15.459 1.00 0.00 H new ATOM 0 HB2 LYS A 109 14.435 6.767 -13.480 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.105 7.321 -14.477 1.00 0.00 H new ATOM 0 HG2 LYS A 109 11.635 5.583 -13.528 1.00 0.00 H new ATOM 0 HG3 LYS A 109 12.964 4.956 -12.573 1.00 0.00 H new ATOM 0 HD2 LYS A 109 13.137 7.085 -11.345 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.894 7.799 -12.354 1.00 0.00 H new ATOM 0 HE2 LYS A 109 10.238 6.167 -11.526 1.00 0.00 H new ATOM 0 HE3 LYS A 109 11.472 5.359 -10.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 10.705 6.713 -8.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 11.743 7.856 -9.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.088 7.863 -10.063 1.00 0.00 H new ATOM 1699 N ILE A 110 12.796 3.449 -14.365 1.00 0.00 N ATOM 1700 CA ILE A 110 12.685 2.096 -13.835 1.00 0.00 C ATOM 1701 C ILE A 110 13.252 1.074 -14.814 1.00 0.00 C ATOM 1702 O ILE A 110 13.738 0.016 -14.411 1.00 0.00 O ATOM 1703 CB ILE A 110 11.221 1.733 -13.521 1.00 0.00 C ATOM 1704 CG1 ILE A 110 10.685 2.613 -12.391 1.00 0.00 C ATOM 1705 CG2 ILE A 110 11.108 0.261 -13.153 1.00 0.00 C ATOM 1706 CD1 ILE A 110 9.176 2.720 -12.372 1.00 0.00 C ATOM 0 H ILE A 110 11.903 3.892 -14.582 1.00 0.00 H new ATOM 0 HA ILE A 110 13.263 2.070 -12.911 1.00 0.00 H new ATOM 0 HB ILE A 110 10.619 1.912 -14.412 1.00 0.00 H new ATOM 0 HG12 ILE A 110 11.025 2.211 -11.436 1.00 0.00 H new ATOM 0 HG13 ILE A 110 11.111 3.612 -12.486 1.00 0.00 H new ATOM 0 HG21 ILE A 110 10.068 0.020 -12.934 1.00 0.00 H new ATOM 0 HG22 ILE A 110 11.454 -0.350 -13.986 1.00 0.00 H new ATOM 0 HG23 ILE A 110 11.721 0.057 -12.275 1.00 0.00 H new ATOM 0 HD11 ILE A 110 8.867 3.359 -11.545 1.00 0.00 H new ATOM 0 HD12 ILE A 110 8.830 3.150 -13.312 1.00 0.00 H new ATOM 0 HD13 ILE A 110 8.742 1.728 -12.246 1.00 0.00 H new ATOM 1718 N HIS A 111 13.188 1.397 -16.101 1.00 0.00 N ATOM 1719 CA HIS A 111 13.698 0.508 -17.139 1.00 0.00 C ATOM 1720 C HIS A 111 15.210 0.655 -17.286 1.00 0.00 C ATOM 1721 O HIS A 111 15.891 -0.260 -17.749 1.00 0.00 O ATOM 1722 CB HIS A 111 13.014 0.802 -18.474 1.00 0.00 C ATOM 1723 CG HIS A 111 13.767 0.284 -19.660 1.00 0.00 C ATOM 1724 ND1 HIS A 111 13.776 -1.046 -20.025 1.00 0.00 N ATOM 1725 CD2 HIS A 111 14.539 0.926 -20.568 1.00 0.00 C ATOM 1726 CE1 HIS A 111 14.522 -1.200 -21.104 1.00 0.00 C ATOM 1727 NE2 HIS A 111 14.996 -0.018 -21.454 1.00 0.00 N ATOM 0 H HIS A 111 12.788 2.268 -16.451 1.00 0.00 H new ATOM 0 HA HIS A 111 13.477 -0.518 -16.844 1.00 0.00 H new ATOM 0 HB2 HIS A 111 12.017 0.362 -18.467 1.00 0.00 H new ATOM 0 HB3 HIS A 111 12.886 1.879 -18.578 1.00 0.00 H new ATOM 0 HD1 HIS A 111 13.283 -1.794 -19.538 1.00 0.00 H new ATOM 0 HD2 HIS A 111 14.755 1.984 -20.591 1.00 0.00 H new ATOM 0 HE1 HIS A 111 14.712 -2.133 -21.613 1.00 0.00 H new ATOM 1735 N LYS A 112 15.728 1.812 -16.888 1.00 0.00 N ATOM 1736 CA LYS A 112 17.159 2.080 -16.974 1.00 0.00 C ATOM 1737 C LYS A 112 17.911 1.392 -15.839 1.00 0.00 C ATOM 1738 O LYS A 112 19.032 0.918 -16.022 1.00 0.00 O ATOM 1739 CB LYS A 112 17.420 3.587 -16.934 1.00 0.00 C ATOM 1740 CG LYS A 112 17.130 4.290 -18.249 1.00 0.00 C ATOM 1741 CD LYS A 112 16.736 5.741 -18.030 1.00 0.00 C ATOM 1742 CE LYS A 112 17.823 6.509 -17.294 1.00 0.00 C ATOM 1743 NZ LYS A 112 17.806 6.230 -15.831 1.00 0.00 N ATOM 0 H LYS A 112 15.178 2.580 -16.502 1.00 0.00 H new ATOM 0 HA LYS A 112 17.522 1.680 -17.921 1.00 0.00 H new ATOM 0 HB2 LYS A 112 16.807 4.033 -16.151 1.00 0.00 H new ATOM 0 HB3 LYS A 112 18.461 3.760 -16.661 1.00 0.00 H new ATOM 0 HG2 LYS A 112 18.011 4.244 -18.889 1.00 0.00 H new ATOM 0 HG3 LYS A 112 16.328 3.769 -18.772 1.00 0.00 H new ATOM 0 HD2 LYS A 112 16.542 6.215 -18.992 1.00 0.00 H new ATOM 0 HD3 LYS A 112 15.808 5.785 -17.460 1.00 0.00 H new ATOM 0 HE2 LYS A 112 18.797 6.242 -17.703 1.00 0.00 H new ATOM 0 HE3 LYS A 112 17.689 7.578 -17.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 17.935 7.119 -15.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 16.895 5.803 -15.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 18.577 5.573 -15.594 1.00 0.00 H new ATOM 1757 N ARG A 113 17.285 1.341 -14.668 1.00 0.00 N ATOM 1758 CA ARG A 113 17.896 0.711 -13.503 1.00 0.00 C ATOM 1759 C ARG A 113 18.129 -0.777 -13.749 1.00 0.00 C ATOM 1760 O ARG A 113 18.989 -1.395 -13.120 1.00 0.00 O ATOM 1761 CB ARG A 113 17.010 0.902 -12.270 1.00 0.00 C ATOM 1762 CG ARG A 113 15.550 0.556 -12.510 1.00 0.00 C ATOM 1763 CD ARG A 113 14.735 0.661 -11.231 1.00 0.00 C ATOM 1764 NE ARG A 113 14.406 2.046 -10.903 1.00 0.00 N ATOM 1765 CZ ARG A 113 13.743 2.405 -9.810 1.00 0.00 C ATOM 1766 NH1 ARG A 113 13.339 1.486 -8.943 1.00 0.00 N ATOM 1767 NH2 ARG A 113 13.482 3.686 -9.582 1.00 0.00 N ATOM 0 H ARG A 113 16.356 1.728 -14.500 1.00 0.00 H new ATOM 0 HA ARG A 113 18.860 1.188 -13.327 1.00 0.00 H new ATOM 0 HB2 ARG A 113 17.393 0.283 -11.459 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.080 1.939 -11.940 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.135 1.226 -13.263 1.00 0.00 H new ATOM 0 HG3 ARG A 113 15.475 -0.456 -12.908 1.00 0.00 H new ATOM 0 HD2 ARG A 113 13.815 0.086 -11.339 1.00 0.00 H new ATOM 0 HD3 ARG A 113 15.294 0.217 -10.408 1.00 0.00 H new ATOM 0 HE ARG A 113 14.702 2.778 -11.549 1.00 0.00 H new ATOM 0 HH11 ARG A 113 13.537 0.500 -9.115 1.00 0.00 H new ATOM 0 HH12 ARG A 113 12.830 1.765 -8.104 1.00 0.00 H new ATOM 0 HH21 ARG A 113 13.791 4.396 -10.247 1.00 0.00 H new ATOM 0 HH22 ARG A 113 12.973 3.961 -8.742 1.00 0.00 H new ATOM 1781 N THR A 114 17.357 -1.348 -14.669 1.00 0.00 N ATOM 1782 CA THR A 114 17.477 -2.762 -14.997 1.00 0.00 C ATOM 1783 C THR A 114 18.613 -3.003 -15.986 1.00 0.00 C ATOM 1784 O THR A 114 19.146 -4.109 -16.078 1.00 0.00 O ATOM 1785 CB THR A 114 16.168 -3.315 -15.592 1.00 0.00 C ATOM 1786 OG1 THR A 114 16.202 -4.746 -15.606 1.00 0.00 O ATOM 1787 CG2 THR A 114 15.954 -2.794 -17.006 1.00 0.00 C ATOM 0 H THR A 114 16.642 -0.851 -15.200 1.00 0.00 H new ATOM 0 HA THR A 114 17.693 -3.285 -14.065 1.00 0.00 H new ATOM 0 HB THR A 114 15.340 -2.978 -14.968 1.00 0.00 H new ATOM 0 HG1 THR A 114 15.366 -5.089 -15.984 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.024 -3.198 -17.406 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.899 -1.706 -16.988 1.00 0.00 H new ATOM 0 HG23 THR A 114 16.786 -3.105 -17.638 1.00 0.00 H new ATOM 1795 N HIS A 115 18.979 -1.959 -16.724 1.00 0.00 N ATOM 1796 CA HIS A 115 20.053 -2.057 -17.706 1.00 0.00 C ATOM 1797 C HIS A 115 21.386 -2.352 -17.026 1.00 0.00 C ATOM 1798 O HIS A 115 22.394 -2.597 -17.690 1.00 0.00 O ATOM 1799 CB HIS A 115 20.154 -0.763 -18.513 1.00 0.00 C ATOM 1800 CG HIS A 115 19.308 -0.759 -19.749 1.00 0.00 C ATOM 1801 ND1 HIS A 115 19.159 -1.863 -20.562 1.00 0.00 N ATOM 1802 CD2 HIS A 115 18.561 0.221 -20.308 1.00 0.00 C ATOM 1803 CE1 HIS A 115 18.359 -1.560 -21.569 1.00 0.00 C ATOM 1804 NE2 HIS A 115 17.982 -0.302 -21.438 1.00 0.00 N ATOM 0 H HIS A 115 18.548 -1.037 -16.660 1.00 0.00 H new ATOM 0 HA HIS A 115 19.820 -2.880 -18.381 1.00 0.00 H new ATOM 0 HB2 HIS A 115 19.861 0.074 -17.880 1.00 0.00 H new ATOM 0 HB3 HIS A 115 21.194 -0.601 -18.795 1.00 0.00 H new ATOM 0 HD1 HIS A 115 19.598 -2.771 -20.410 1.00 0.00 H new ATOM 0 HD2 HIS A 115 18.442 1.227 -19.935 1.00 0.00 H new ATOM 0 HE1 HIS A 115 18.064 -2.228 -22.364 1.00 0.00 H new ATOM 1812 N THR A 116 21.385 -2.326 -15.696 1.00 0.00 N ATOM 1813 CA THR A 116 22.594 -2.588 -14.926 1.00 0.00 C ATOM 1814 C THR A 116 23.190 -3.945 -15.282 1.00 0.00 C ATOM 1815 O THR A 116 22.537 -4.773 -15.916 1.00 0.00 O ATOM 1816 CB THR A 116 22.316 -2.544 -13.412 1.00 0.00 C ATOM 1817 OG1 THR A 116 21.713 -1.293 -13.061 1.00 0.00 O ATOM 1818 CG2 THR A 116 23.601 -2.733 -12.620 1.00 0.00 C ATOM 0 H THR A 116 20.560 -2.126 -15.131 1.00 0.00 H new ATOM 0 HA THR A 116 23.307 -1.803 -15.180 1.00 0.00 H new ATOM 0 HB THR A 116 21.634 -3.358 -13.166 1.00 0.00 H new ATOM 0 HG1 THR A 116 20.737 -1.383 -13.082 1.00 0.00 H new ATOM 0 HG21 THR A 116 23.379 -2.698 -11.553 1.00 0.00 H new ATOM 0 HG22 THR A 116 24.042 -3.698 -12.868 1.00 0.00 H new ATOM 0 HG23 THR A 116 24.303 -1.938 -12.871 1.00 0.00 H new ATOM 1826 N GLY A 117 24.434 -4.167 -14.869 1.00 0.00 N ATOM 1827 CA GLY A 117 25.097 -5.426 -15.154 1.00 0.00 C ATOM 1828 C GLY A 117 26.366 -5.244 -15.962 1.00 0.00 C ATOM 1829 O GLY A 117 27.459 -5.169 -15.403 1.00 0.00 O ATOM 0 H GLY A 117 24.995 -3.497 -14.342 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.336 -5.927 -14.216 1.00 0.00 H new ATOM 0 HA3 GLY A 117 24.414 -6.078 -15.699 1.00 0.00 H new ATOM 1833 N GLU A 118 26.221 -5.174 -17.282 1.00 0.00 N ATOM 1834 CA GLU A 118 27.366 -5.002 -18.168 1.00 0.00 C ATOM 1835 C GLU A 118 27.239 -3.714 -18.977 1.00 0.00 C ATOM 1836 O GLU A 118 26.143 -3.327 -19.382 1.00 0.00 O ATOM 1837 CB GLU A 118 27.495 -6.200 -19.111 1.00 0.00 C ATOM 1838 CG GLU A 118 26.158 -6.767 -19.559 1.00 0.00 C ATOM 1839 CD GLU A 118 26.298 -7.754 -20.702 1.00 0.00 C ATOM 1840 OE1 GLU A 118 26.765 -7.343 -21.786 1.00 0.00 O ATOM 1841 OE2 GLU A 118 25.940 -8.935 -20.514 1.00 0.00 O ATOM 0 H GLU A 118 25.322 -5.234 -17.761 1.00 0.00 H new ATOM 0 HA GLU A 118 28.263 -4.937 -17.552 1.00 0.00 H new ATOM 0 HB2 GLU A 118 28.066 -5.900 -19.990 1.00 0.00 H new ATOM 0 HB3 GLU A 118 28.065 -6.985 -18.613 1.00 0.00 H new ATOM 0 HG2 GLU A 118 25.675 -7.260 -18.715 1.00 0.00 H new ATOM 0 HG3 GLU A 118 25.506 -5.950 -19.867 1.00 0.00 H new ATOM 1848 N LYS A 119 28.369 -3.055 -19.210 1.00 0.00 N ATOM 1849 CA LYS A 119 28.387 -1.811 -19.971 1.00 0.00 C ATOM 1850 C LYS A 119 28.818 -2.063 -21.413 1.00 0.00 C ATOM 1851 O LYS A 119 29.671 -2.905 -21.694 1.00 0.00 O ATOM 1852 CB LYS A 119 29.331 -0.801 -19.315 1.00 0.00 C ATOM 1853 CG LYS A 119 30.489 -1.444 -18.572 1.00 0.00 C ATOM 1854 CD LYS A 119 31.374 -2.249 -19.508 1.00 0.00 C ATOM 1855 CE LYS A 119 32.703 -2.598 -18.856 1.00 0.00 C ATOM 1856 NZ LYS A 119 32.516 -3.262 -17.536 1.00 0.00 N ATOM 0 H LYS A 119 29.285 -3.362 -18.883 1.00 0.00 H new ATOM 0 HA LYS A 119 27.376 -1.403 -19.977 1.00 0.00 H new ATOM 0 HB2 LYS A 119 29.727 -0.135 -20.082 1.00 0.00 H new ATOM 0 HB3 LYS A 119 28.762 -0.183 -18.620 1.00 0.00 H new ATOM 0 HG2 LYS A 119 31.083 -0.671 -18.083 1.00 0.00 H new ATOM 0 HG3 LYS A 119 30.103 -2.094 -17.787 1.00 0.00 H new ATOM 0 HD2 LYS A 119 30.859 -3.164 -19.800 1.00 0.00 H new ATOM 0 HD3 LYS A 119 31.553 -1.680 -20.420 1.00 0.00 H new ATOM 0 HE2 LYS A 119 33.270 -3.255 -19.516 1.00 0.00 H new ATOM 0 HE3 LYS A 119 33.293 -1.691 -18.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 33.421 -3.664 -17.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 32.184 -2.564 -16.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 31.812 -4.022 -17.626 1.00 0.00 H new ATOM 1870 N PRO A 120 28.216 -1.315 -22.350 1.00 0.00 N ATOM 1871 CA PRO A 120 28.523 -1.437 -23.778 1.00 0.00 C ATOM 1872 C PRO A 120 29.916 -0.918 -24.118 1.00 0.00 C ATOM 1873 O PRO A 120 30.643 -1.529 -24.901 1.00 0.00 O ATOM 1874 CB PRO A 120 27.451 -0.573 -24.447 1.00 0.00 C ATOM 1875 CG PRO A 120 27.061 0.419 -23.406 1.00 0.00 C ATOM 1876 CD PRO A 120 27.190 -0.292 -22.087 1.00 0.00 C ATOM 0 HA PRO A 120 28.519 -2.476 -24.108 1.00 0.00 H new ATOM 0 HB2 PRO A 120 27.839 -0.080 -25.338 1.00 0.00 H new ATOM 0 HB3 PRO A 120 26.597 -1.174 -24.761 1.00 0.00 H new ATOM 0 HG2 PRO A 120 27.707 1.296 -23.441 1.00 0.00 H new ATOM 0 HG3 PRO A 120 26.040 0.768 -23.563 1.00 0.00 H new ATOM 0 HD2 PRO A 120 27.495 0.388 -21.292 1.00 0.00 H new ATOM 0 HD3 PRO A 120 26.246 -0.740 -21.778 1.00 0.00 H new ATOM 1884 N PHE A 121 30.281 0.214 -23.525 1.00 0.00 N ATOM 1885 CA PHE A 121 31.587 0.817 -23.766 1.00 0.00 C ATOM 1886 C PHE A 121 32.406 0.871 -22.480 1.00 0.00 C ATOM 1887 O PHE A 121 31.934 1.350 -21.449 1.00 0.00 O ATOM 1888 CB PHE A 121 31.424 2.225 -24.341 1.00 0.00 C ATOM 1889 CG PHE A 121 30.777 2.249 -25.696 1.00 0.00 C ATOM 1890 CD1 PHE A 121 29.399 2.171 -25.821 1.00 0.00 C ATOM 1891 CD2 PHE A 121 31.546 2.351 -26.844 1.00 0.00 C ATOM 1892 CE1 PHE A 121 28.801 2.191 -27.067 1.00 0.00 C ATOM 1893 CE2 PHE A 121 30.954 2.372 -28.092 1.00 0.00 C ATOM 1894 CZ PHE A 121 29.579 2.294 -28.204 1.00 0.00 C ATOM 0 H PHE A 121 29.691 0.732 -22.874 1.00 0.00 H new ATOM 0 HA PHE A 121 32.118 0.197 -24.488 1.00 0.00 H new ATOM 0 HB2 PHE A 121 30.828 2.823 -23.652 1.00 0.00 H new ATOM 0 HB3 PHE A 121 32.404 2.697 -24.407 1.00 0.00 H new ATOM 0 HD1 PHE A 121 28.786 2.094 -24.935 1.00 0.00 H new ATOM 0 HD2 PHE A 121 32.621 2.415 -26.762 1.00 0.00 H new ATOM 0 HE1 PHE A 121 27.726 2.126 -27.152 1.00 0.00 H new ATOM 0 HE2 PHE A 121 31.565 2.449 -28.979 1.00 0.00 H new ATOM 0 HZ PHE A 121 29.113 2.314 -29.178 1.00 0.00 H new ATOM 1904 N LYS A 122 33.637 0.376 -22.548 1.00 0.00 N ATOM 1905 CA LYS A 122 34.524 0.367 -21.391 1.00 0.00 C ATOM 1906 C LYS A 122 35.821 1.112 -21.695 1.00 0.00 C ATOM 1907 O LYS A 122 36.393 0.967 -22.775 1.00 0.00 O ATOM 1908 CB LYS A 122 34.836 -1.071 -20.972 1.00 0.00 C ATOM 1909 CG LYS A 122 35.805 -1.169 -19.807 1.00 0.00 C ATOM 1910 CD LYS A 122 36.075 -2.614 -19.426 1.00 0.00 C ATOM 1911 CE LYS A 122 37.336 -2.743 -18.584 1.00 0.00 C ATOM 1912 NZ LYS A 122 37.077 -2.442 -17.149 1.00 0.00 N ATOM 0 H LYS A 122 34.043 -0.025 -23.393 1.00 0.00 H new ATOM 0 HA LYS A 122 34.016 0.875 -20.571 1.00 0.00 H new ATOM 0 HB2 LYS A 122 33.906 -1.572 -20.703 1.00 0.00 H new ATOM 0 HB3 LYS A 122 35.252 -1.607 -21.825 1.00 0.00 H new ATOM 0 HG2 LYS A 122 36.743 -0.680 -20.071 1.00 0.00 H new ATOM 0 HG3 LYS A 122 35.398 -0.635 -18.948 1.00 0.00 H new ATOM 0 HD2 LYS A 122 35.224 -3.010 -18.872 1.00 0.00 H new ATOM 0 HD3 LYS A 122 36.176 -3.217 -20.329 1.00 0.00 H new ATOM 0 HE2 LYS A 122 37.733 -3.754 -18.677 1.00 0.00 H new ATOM 0 HE3 LYS A 122 38.099 -2.064 -18.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 37.960 -2.541 -16.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 36.722 -1.469 -17.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 36.368 -3.106 -16.778 1.00 0.00 H new ATOM 1926 N CYS A 123 36.280 1.907 -20.734 1.00 0.00 N ATOM 1927 CA CYS A 123 37.509 2.673 -20.897 1.00 0.00 C ATOM 1928 C CYS A 123 38.631 1.792 -21.440 1.00 0.00 C ATOM 1929 O CYS A 123 38.924 0.733 -20.886 1.00 0.00 O ATOM 1930 CB CYS A 123 37.931 3.291 -19.563 1.00 0.00 C ATOM 1931 SG CYS A 123 39.364 4.410 -19.681 1.00 0.00 S ATOM 0 H CYS A 123 35.819 2.037 -19.834 1.00 0.00 H new ATOM 0 HA CYS A 123 37.318 3.471 -21.614 1.00 0.00 H new ATOM 0 HB2 CYS A 123 37.087 3.841 -19.147 1.00 0.00 H new ATOM 0 HB3 CYS A 123 38.166 2.490 -18.862 1.00 0.00 H new ATOM 1936 N GLU A 124 39.255 2.239 -22.526 1.00 0.00 N ATOM 1937 CA GLU A 124 40.344 1.491 -23.143 1.00 0.00 C ATOM 1938 C GLU A 124 41.628 1.632 -22.332 1.00 0.00 C ATOM 1939 O GLU A 124 42.606 0.922 -22.568 1.00 0.00 O ATOM 1940 CB GLU A 124 40.576 1.975 -24.576 1.00 0.00 C ATOM 1941 CG GLU A 124 39.318 2.484 -25.258 1.00 0.00 C ATOM 1942 CD GLU A 124 39.379 2.352 -26.768 1.00 0.00 C ATOM 1943 OE1 GLU A 124 39.251 1.216 -27.269 1.00 0.00 O ATOM 1944 OE2 GLU A 124 39.554 3.385 -27.447 1.00 0.00 O ATOM 0 H GLU A 124 39.025 3.115 -22.996 1.00 0.00 H new ATOM 0 HA GLU A 124 40.062 0.438 -23.164 1.00 0.00 H new ATOM 0 HB2 GLU A 124 41.321 2.771 -24.566 1.00 0.00 H new ATOM 0 HB3 GLU A 124 40.992 1.157 -25.164 1.00 0.00 H new ATOM 0 HG2 GLU A 124 38.457 1.931 -24.883 1.00 0.00 H new ATOM 0 HG3 GLU A 124 39.164 3.530 -24.994 1.00 0.00 H new ATOM 1951 N PHE A 125 41.619 2.555 -21.375 1.00 0.00 N ATOM 1952 CA PHE A 125 42.784 2.791 -20.530 1.00 0.00 C ATOM 1953 C PHE A 125 42.983 1.642 -19.545 1.00 0.00 C ATOM 1954 O PHE A 125 42.091 1.324 -18.760 1.00 0.00 O ATOM 1955 CB PHE A 125 42.629 4.109 -19.769 1.00 0.00 C ATOM 1956 CG PHE A 125 43.936 4.781 -19.460 1.00 0.00 C ATOM 1957 CD1 PHE A 125 44.502 5.670 -20.359 1.00 0.00 C ATOM 1958 CD2 PHE A 125 44.600 4.522 -18.272 1.00 0.00 C ATOM 1959 CE1 PHE A 125 45.705 6.290 -20.079 1.00 0.00 C ATOM 1960 CE2 PHE A 125 45.802 5.140 -17.985 1.00 0.00 C ATOM 1961 CZ PHE A 125 46.357 6.024 -18.891 1.00 0.00 C ATOM 0 H PHE A 125 40.818 3.151 -21.166 1.00 0.00 H new ATOM 0 HA PHE A 125 43.662 2.851 -21.173 1.00 0.00 H new ATOM 0 HB2 PHE A 125 42.011 4.788 -20.357 1.00 0.00 H new ATOM 0 HB3 PHE A 125 42.097 3.920 -18.836 1.00 0.00 H new ATOM 0 HD1 PHE A 125 43.997 5.881 -21.290 1.00 0.00 H new ATOM 0 HD2 PHE A 125 44.173 3.829 -17.562 1.00 0.00 H new ATOM 0 HE1 PHE A 125 46.135 6.982 -20.788 1.00 0.00 H new ATOM 0 HE2 PHE A 125 46.307 4.932 -17.053 1.00 0.00 H new ATOM 0 HZ PHE A 125 47.298 6.506 -18.670 1.00 0.00 H new ATOM 1971 N GLU A 126 44.159 1.025 -19.595 1.00 0.00 N ATOM 1972 CA GLU A 126 44.475 -0.089 -18.709 1.00 0.00 C ATOM 1973 C GLU A 126 44.460 0.356 -17.249 1.00 0.00 C ATOM 1974 O GLU A 126 44.597 1.541 -16.949 1.00 0.00 O ATOM 1975 CB GLU A 126 45.843 -0.677 -19.060 1.00 0.00 C ATOM 1976 CG GLU A 126 46.435 -1.541 -17.959 1.00 0.00 C ATOM 1977 CD GLU A 126 47.787 -2.117 -18.333 1.00 0.00 C ATOM 1978 OE1 GLU A 126 48.108 -2.142 -19.540 1.00 0.00 O ATOM 1979 OE2 GLU A 126 48.524 -2.542 -17.419 1.00 0.00 O ATOM 0 H GLU A 126 44.908 1.277 -20.239 1.00 0.00 H new ATOM 0 HA GLU A 126 43.712 -0.856 -18.845 1.00 0.00 H new ATOM 0 HB2 GLU A 126 45.751 -1.273 -19.968 1.00 0.00 H new ATOM 0 HB3 GLU A 126 46.533 0.137 -19.282 1.00 0.00 H new ATOM 0 HG2 GLU A 126 46.536 -0.947 -17.051 1.00 0.00 H new ATOM 0 HG3 GLU A 126 45.747 -2.356 -17.732 1.00 0.00 H new ATOM 1986 N GLY A 127 44.292 -0.604 -16.345 1.00 0.00 N ATOM 1987 CA GLY A 127 44.261 -0.293 -14.928 1.00 0.00 C ATOM 1988 C GLY A 127 43.182 0.713 -14.579 1.00 0.00 C ATOM 1989 O GLY A 127 43.194 1.297 -13.495 1.00 0.00 O ATOM 0 H GLY A 127 44.177 -1.592 -16.569 1.00 0.00 H new ATOM 0 HA2 GLY A 127 44.096 -1.209 -14.362 1.00 0.00 H new ATOM 0 HA3 GLY A 127 45.231 0.099 -14.624 1.00 0.00 H new ATOM 1993 N CYS A 128 42.246 0.918 -15.500 1.00 0.00 N ATOM 1994 CA CYS A 128 41.155 1.861 -15.286 1.00 0.00 C ATOM 1995 C CYS A 128 39.808 1.144 -15.285 1.00 0.00 C ATOM 1996 O CYS A 128 39.586 0.217 -16.064 1.00 0.00 O ATOM 1997 CB CYS A 128 41.169 2.943 -16.368 1.00 0.00 C ATOM 1998 SG CYS A 128 40.397 4.513 -15.860 1.00 0.00 S ATOM 0 H CYS A 128 42.221 0.443 -16.402 1.00 0.00 H new ATOM 0 HA CYS A 128 41.298 2.329 -14.312 1.00 0.00 H new ATOM 0 HB2 CYS A 128 42.201 3.136 -16.660 1.00 0.00 H new ATOM 0 HB3 CYS A 128 40.653 2.566 -17.251 1.00 0.00 H new ATOM 2003 N ASP A 129 38.913 1.581 -14.406 1.00 0.00 N ATOM 2004 CA ASP A 129 37.587 0.982 -14.304 1.00 0.00 C ATOM 2005 C ASP A 129 36.499 2.034 -14.504 1.00 0.00 C ATOM 2006 O ASP A 129 36.265 2.872 -13.633 1.00 0.00 O ATOM 2007 CB ASP A 129 37.414 0.303 -12.945 1.00 0.00 C ATOM 2008 CG ASP A 129 38.551 -0.646 -12.623 1.00 0.00 C ATOM 2009 OD1 ASP A 129 39.144 -1.205 -13.570 1.00 0.00 O ATOM 2010 OD2 ASP A 129 38.849 -0.829 -11.424 1.00 0.00 O ATOM 0 H ASP A 129 39.081 2.347 -13.754 1.00 0.00 H new ATOM 0 HA ASP A 129 37.492 0.233 -15.090 1.00 0.00 H new ATOM 0 HB2 ASP A 129 37.349 1.064 -12.168 1.00 0.00 H new ATOM 0 HB3 ASP A 129 36.472 -0.246 -12.934 1.00 0.00 H new ATOM 2015 N ARG A 130 35.839 1.983 -15.656 1.00 0.00 N ATOM 2016 CA ARG A 130 34.778 2.932 -15.971 1.00 0.00 C ATOM 2017 C ARG A 130 33.678 2.266 -16.791 1.00 0.00 C ATOM 2018 O ARG A 130 33.797 1.104 -17.180 1.00 0.00 O ATOM 2019 CB ARG A 130 35.346 4.129 -16.736 1.00 0.00 C ATOM 2020 CG ARG A 130 36.600 4.714 -16.108 1.00 0.00 C ATOM 2021 CD ARG A 130 36.293 5.406 -14.789 1.00 0.00 C ATOM 2022 NE ARG A 130 37.451 5.428 -13.900 1.00 0.00 N ATOM 2023 CZ ARG A 130 37.546 6.218 -12.836 1.00 0.00 C ATOM 2024 NH1 ARG A 130 36.557 7.047 -12.532 1.00 0.00 N ATOM 2025 NH2 ARG A 130 38.632 6.180 -12.075 1.00 0.00 N ATOM 0 H ARG A 130 36.020 1.295 -16.387 1.00 0.00 H new ATOM 0 HA ARG A 130 34.347 3.281 -15.033 1.00 0.00 H new ATOM 0 HB2 ARG A 130 35.571 3.823 -17.758 1.00 0.00 H new ATOM 0 HB3 ARG A 130 34.584 4.906 -16.796 1.00 0.00 H new ATOM 0 HG2 ARG A 130 37.329 3.921 -15.943 1.00 0.00 H new ATOM 0 HG3 ARG A 130 37.054 5.426 -16.797 1.00 0.00 H new ATOM 0 HD2 ARG A 130 35.966 6.427 -14.983 1.00 0.00 H new ATOM 0 HD3 ARG A 130 35.467 4.895 -14.295 1.00 0.00 H new ATOM 0 HE ARG A 130 38.230 4.803 -14.107 1.00 0.00 H new ATOM 0 HH11 ARG A 130 35.721 7.079 -13.115 1.00 0.00 H new ATOM 0 HH12 ARG A 130 36.632 7.653 -11.715 1.00 0.00 H new ATOM 0 HH21 ARG A 130 39.395 5.544 -12.307 1.00 0.00 H new ATOM 0 HH22 ARG A 130 38.704 6.787 -11.258 1.00 0.00 H new ATOM 2039 N ARG A 131 32.607 3.009 -17.050 1.00 0.00 N ATOM 2040 CA ARG A 131 31.485 2.489 -17.822 1.00 0.00 C ATOM 2041 C ARG A 131 30.794 3.608 -18.597 1.00 0.00 C ATOM 2042 O ARG A 131 30.276 4.557 -18.008 1.00 0.00 O ATOM 2043 CB ARG A 131 30.480 1.797 -16.899 1.00 0.00 C ATOM 2044 CG ARG A 131 30.023 2.664 -15.737 1.00 0.00 C ATOM 2045 CD ARG A 131 29.202 1.865 -14.736 1.00 0.00 C ATOM 2046 NE ARG A 131 28.915 2.633 -13.528 1.00 0.00 N ATOM 2047 CZ ARG A 131 29.794 2.822 -12.550 1.00 0.00 C ATOM 2048 NH1 ARG A 131 31.011 2.302 -12.639 1.00 0.00 N ATOM 2049 NH2 ARG A 131 29.458 3.533 -11.482 1.00 0.00 N ATOM 0 H ARG A 131 32.493 3.973 -16.737 1.00 0.00 H new ATOM 0 HA ARG A 131 31.873 1.762 -18.535 1.00 0.00 H new ATOM 0 HB2 ARG A 131 29.609 1.498 -17.483 1.00 0.00 H new ATOM 0 HB3 ARG A 131 30.929 0.885 -16.506 1.00 0.00 H new ATOM 0 HG2 ARG A 131 30.892 3.092 -15.237 1.00 0.00 H new ATOM 0 HG3 ARG A 131 29.429 3.497 -16.114 1.00 0.00 H new ATOM 0 HD2 ARG A 131 28.266 1.556 -15.200 1.00 0.00 H new ATOM 0 HD3 ARG A 131 29.741 0.956 -14.468 1.00 0.00 H new ATOM 0 HE ARG A 131 27.988 3.047 -13.429 1.00 0.00 H new ATOM 0 HH11 ARG A 131 31.273 1.756 -13.459 1.00 0.00 H new ATOM 0 HH12 ARG A 131 31.684 2.448 -11.887 1.00 0.00 H new ATOM 0 HH21 ARG A 131 28.524 3.936 -11.411 1.00 0.00 H new ATOM 0 HH22 ARG A 131 30.134 3.677 -10.732 1.00 0.00 H new ATOM 2063 N PHE A 132 30.790 3.489 -19.920 1.00 0.00 N ATOM 2064 CA PHE A 132 30.165 4.491 -20.776 1.00 0.00 C ATOM 2065 C PHE A 132 29.112 3.854 -21.679 1.00 0.00 C ATOM 2066 O PHE A 132 29.182 2.665 -21.988 1.00 0.00 O ATOM 2067 CB PHE A 132 31.222 5.198 -21.626 1.00 0.00 C ATOM 2068 CG PHE A 132 32.304 5.851 -20.815 1.00 0.00 C ATOM 2069 CD1 PHE A 132 32.032 6.971 -20.046 1.00 0.00 C ATOM 2070 CD2 PHE A 132 33.594 5.346 -20.823 1.00 0.00 C ATOM 2071 CE1 PHE A 132 33.026 7.574 -19.298 1.00 0.00 C ATOM 2072 CE2 PHE A 132 34.592 5.944 -20.077 1.00 0.00 C ATOM 2073 CZ PHE A 132 34.308 7.060 -19.315 1.00 0.00 C ATOM 0 H PHE A 132 31.212 2.709 -20.423 1.00 0.00 H new ATOM 0 HA PHE A 132 29.674 5.224 -20.136 1.00 0.00 H new ATOM 0 HB2 PHE A 132 31.674 4.475 -22.305 1.00 0.00 H new ATOM 0 HB3 PHE A 132 30.735 5.953 -22.243 1.00 0.00 H new ATOM 0 HD1 PHE A 132 31.032 7.378 -20.031 1.00 0.00 H new ATOM 0 HD2 PHE A 132 33.822 4.475 -21.419 1.00 0.00 H new ATOM 0 HE1 PHE A 132 32.801 8.446 -18.701 1.00 0.00 H new ATOM 0 HE2 PHE A 132 35.593 5.539 -20.090 1.00 0.00 H new ATOM 0 HZ PHE A 132 35.087 7.530 -18.733 1.00 0.00 H new ATOM 2083 N ALA A 133 28.138 4.654 -22.098 1.00 0.00 N ATOM 2084 CA ALA A 133 27.072 4.170 -22.966 1.00 0.00 C ATOM 2085 C ALA A 133 27.300 4.604 -24.410 1.00 0.00 C ATOM 2086 O ALA A 133 26.696 4.061 -25.334 1.00 0.00 O ATOM 2087 CB ALA A 133 25.721 4.667 -22.471 1.00 0.00 C ATOM 0 H ALA A 133 28.065 5.641 -21.850 1.00 0.00 H new ATOM 0 HA ALA A 133 27.080 3.080 -22.936 1.00 0.00 H new ATOM 0 HB1 ALA A 133 24.934 4.298 -23.129 1.00 0.00 H new ATOM 0 HB2 ALA A 133 25.548 4.303 -21.458 1.00 0.00 H new ATOM 0 HB3 ALA A 133 25.712 5.757 -22.471 1.00 0.00 H new ATOM 2093 N ASN A 134 28.175 5.587 -24.596 1.00 0.00 N ATOM 2094 CA ASN A 134 28.482 6.095 -25.928 1.00 0.00 C ATOM 2095 C ASN A 134 29.989 6.220 -26.129 1.00 0.00 C ATOM 2096 O ASN A 134 30.720 6.589 -25.210 1.00 0.00 O ATOM 2097 CB ASN A 134 27.813 7.454 -26.145 1.00 0.00 C ATOM 2098 CG ASN A 134 27.683 8.246 -24.858 1.00 0.00 C ATOM 2099 OD1 ASN A 134 28.253 9.329 -24.723 1.00 0.00 O ATOM 2100 ND2 ASN A 134 26.930 7.708 -23.906 1.00 0.00 N ATOM 0 H ASN A 134 28.684 6.047 -23.841 1.00 0.00 H new ATOM 0 HA ASN A 134 28.094 5.385 -26.658 1.00 0.00 H new ATOM 0 HB2 ASN A 134 28.393 8.030 -26.866 1.00 0.00 H new ATOM 0 HB3 ASN A 134 26.824 7.304 -26.578 1.00 0.00 H new ATOM 0 HD21 ASN A 134 26.805 8.195 -23.018 1.00 0.00 H new ATOM 0 HD22 ASN A 134 26.476 6.808 -24.062 1.00 0.00 H new ATOM 2107 N SER A 135 30.447 5.909 -27.338 1.00 0.00 N ATOM 2108 CA SER A 135 31.867 5.983 -27.659 1.00 0.00 C ATOM 2109 C SER A 135 32.422 7.372 -27.355 1.00 0.00 C ATOM 2110 O SER A 135 33.563 7.514 -26.915 1.00 0.00 O ATOM 2111 CB SER A 135 32.097 5.641 -29.132 1.00 0.00 C ATOM 2112 OG SER A 135 33.470 5.739 -29.471 1.00 0.00 O ATOM 0 H SER A 135 29.855 5.604 -28.111 1.00 0.00 H new ATOM 0 HA SER A 135 32.392 5.257 -27.038 1.00 0.00 H new ATOM 0 HB2 SER A 135 31.741 4.631 -29.334 1.00 0.00 H new ATOM 0 HB3 SER A 135 31.515 6.316 -29.760 1.00 0.00 H new ATOM 0 HG SER A 135 33.590 5.514 -30.417 1.00 0.00 H new ATOM 2118 N SER A 136 31.605 8.393 -27.593 1.00 0.00 N ATOM 2119 CA SER A 136 32.014 9.771 -27.349 1.00 0.00 C ATOM 2120 C SER A 136 32.470 9.955 -25.904 1.00 0.00 C ATOM 2121 O SER A 136 33.584 10.412 -25.647 1.00 0.00 O ATOM 2122 CB SER A 136 30.862 10.729 -27.657 1.00 0.00 C ATOM 2123 OG SER A 136 30.554 10.728 -29.041 1.00 0.00 O ATOM 0 H SER A 136 30.657 8.292 -27.954 1.00 0.00 H new ATOM 0 HA SER A 136 32.852 9.997 -28.008 1.00 0.00 H new ATOM 0 HB2 SER A 136 29.981 10.439 -27.085 1.00 0.00 H new ATOM 0 HB3 SER A 136 31.129 11.738 -27.341 1.00 0.00 H new ATOM 0 HG SER A 136 29.814 11.347 -29.212 1.00 0.00 H new ATOM 2129 N ASP A 137 31.600 9.596 -24.966 1.00 0.00 N ATOM 2130 CA ASP A 137 31.912 9.720 -23.547 1.00 0.00 C ATOM 2131 C ASP A 137 33.256 9.071 -23.227 1.00 0.00 C ATOM 2132 O ASP A 137 34.131 9.696 -22.628 1.00 0.00 O ATOM 2133 CB ASP A 137 30.810 9.079 -22.703 1.00 0.00 C ATOM 2134 CG ASP A 137 30.667 9.734 -21.343 1.00 0.00 C ATOM 2135 OD1 ASP A 137 31.695 10.175 -20.786 1.00 0.00 O ATOM 2136 OD2 ASP A 137 29.529 9.807 -20.836 1.00 0.00 O ATOM 0 H ASP A 137 30.674 9.217 -25.163 1.00 0.00 H new ATOM 0 HA ASP A 137 31.974 10.781 -23.306 1.00 0.00 H new ATOM 0 HB2 ASP A 137 29.862 9.146 -23.237 1.00 0.00 H new ATOM 0 HB3 ASP A 137 31.027 8.019 -22.571 1.00 0.00 H new ATOM 2141 N ARG A 138 33.411 7.815 -23.631 1.00 0.00 N ATOM 2142 CA ARG A 138 34.647 7.081 -23.385 1.00 0.00 C ATOM 2143 C ARG A 138 35.864 7.941 -23.712 1.00 0.00 C ATOM 2144 O ARG A 138 36.725 8.168 -22.861 1.00 0.00 O ATOM 2145 CB ARG A 138 34.678 5.798 -24.218 1.00 0.00 C ATOM 2146 CG ARG A 138 36.082 5.298 -24.516 1.00 0.00 C ATOM 2147 CD ARG A 138 36.086 3.816 -24.854 1.00 0.00 C ATOM 2148 NE ARG A 138 35.776 3.575 -26.261 1.00 0.00 N ATOM 2149 CZ ARG A 138 35.715 2.364 -26.803 1.00 0.00 C ATOM 2150 NH1 ARG A 138 35.940 1.289 -26.060 1.00 0.00 N ATOM 2151 NH2 ARG A 138 35.426 2.226 -28.091 1.00 0.00 N ATOM 0 H ARG A 138 32.697 7.284 -24.130 1.00 0.00 H new ATOM 0 HA ARG A 138 34.681 6.820 -22.327 1.00 0.00 H new ATOM 0 HB2 ARG A 138 34.129 5.019 -23.690 1.00 0.00 H new ATOM 0 HB3 ARG A 138 34.157 5.973 -25.159 1.00 0.00 H new ATOM 0 HG2 ARG A 138 36.501 5.863 -25.348 1.00 0.00 H new ATOM 0 HG3 ARG A 138 36.724 5.477 -23.653 1.00 0.00 H new ATOM 0 HD2 ARG A 138 37.063 3.394 -24.621 1.00 0.00 H new ATOM 0 HD3 ARG A 138 35.358 3.300 -24.229 1.00 0.00 H new ATOM 0 HE ARG A 138 35.597 4.381 -26.860 1.00 0.00 H new ATOM 0 HH11 ARG A 138 36.161 1.391 -25.069 1.00 0.00 H new ATOM 0 HH12 ARG A 138 35.892 0.360 -26.479 1.00 0.00 H new ATOM 0 HH21 ARG A 138 35.251 3.050 -28.665 1.00 0.00 H new ATOM 0 HH22 ARG A 138 35.379 1.296 -28.506 1.00 0.00 H new ATOM 2165 N LYS A 139 35.930 8.418 -24.951 1.00 0.00 N ATOM 2166 CA LYS A 139 37.040 9.254 -25.392 1.00 0.00 C ATOM 2167 C LYS A 139 37.124 10.530 -24.560 1.00 0.00 C ATOM 2168 O LYS A 139 38.214 11.001 -24.234 1.00 0.00 O ATOM 2169 CB LYS A 139 36.883 9.606 -26.872 1.00 0.00 C ATOM 2170 CG LYS A 139 37.197 8.452 -27.809 1.00 0.00 C ATOM 2171 CD LYS A 139 38.665 8.434 -28.199 1.00 0.00 C ATOM 2172 CE LYS A 139 38.958 9.423 -29.316 1.00 0.00 C ATOM 2173 NZ LYS A 139 40.412 9.726 -29.422 1.00 0.00 N ATOM 0 H LYS A 139 35.227 8.239 -25.668 1.00 0.00 H new ATOM 0 HA LYS A 139 37.963 8.691 -25.255 1.00 0.00 H new ATOM 0 HB2 LYS A 139 35.861 9.940 -27.051 1.00 0.00 H new ATOM 0 HB3 LYS A 139 37.539 10.444 -27.109 1.00 0.00 H new ATOM 0 HG2 LYS A 139 36.936 7.510 -27.327 1.00 0.00 H new ATOM 0 HG3 LYS A 139 36.582 8.533 -28.706 1.00 0.00 H new ATOM 0 HD2 LYS A 139 39.276 8.675 -27.329 1.00 0.00 H new ATOM 0 HD3 LYS A 139 38.945 7.430 -28.518 1.00 0.00 H new ATOM 0 HE2 LYS A 139 38.602 9.017 -30.263 1.00 0.00 H new ATOM 0 HE3 LYS A 139 38.407 10.346 -29.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 40.570 10.404 -30.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 40.747 10.137 -28.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 40.936 8.849 -29.618 1.00 0.00 H new ATOM 2187 N LYS A 140 35.966 11.085 -24.219 1.00 0.00 N ATOM 2188 CA LYS A 140 35.907 12.306 -23.423 1.00 0.00 C ATOM 2189 C LYS A 140 36.514 12.084 -22.042 1.00 0.00 C ATOM 2190 O LYS A 140 36.889 13.036 -21.357 1.00 0.00 O ATOM 2191 CB LYS A 140 34.459 12.780 -23.286 1.00 0.00 C ATOM 2192 CG LYS A 140 34.020 13.724 -24.392 1.00 0.00 C ATOM 2193 CD LYS A 140 32.507 13.850 -24.450 1.00 0.00 C ATOM 2194 CE LYS A 140 31.980 14.746 -23.340 1.00 0.00 C ATOM 2195 NZ LYS A 140 31.884 14.023 -22.042 1.00 0.00 N ATOM 0 H LYS A 140 35.055 10.709 -24.481 1.00 0.00 H new ATOM 0 HA LYS A 140 36.487 13.074 -23.936 1.00 0.00 H new ATOM 0 HB2 LYS A 140 33.801 11.911 -23.279 1.00 0.00 H new ATOM 0 HB3 LYS A 140 34.339 13.279 -22.325 1.00 0.00 H new ATOM 0 HG2 LYS A 140 34.462 14.707 -24.229 1.00 0.00 H new ATOM 0 HG3 LYS A 140 34.393 13.362 -25.350 1.00 0.00 H new ATOM 0 HD2 LYS A 140 32.211 14.255 -25.418 1.00 0.00 H new ATOM 0 HD3 LYS A 140 32.055 12.862 -24.367 1.00 0.00 H new ATOM 0 HE2 LYS A 140 32.636 15.609 -23.227 1.00 0.00 H new ATOM 0 HE3 LYS A 140 30.997 15.127 -23.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 30.979 14.252 -21.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 31.937 12.998 -22.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 32.669 14.313 -21.424 1.00 0.00 H new ATOM 2209 N HIS A 141 36.610 10.821 -21.638 1.00 0.00 N ATOM 2210 CA HIS A 141 37.173 10.474 -20.338 1.00 0.00 C ATOM 2211 C HIS A 141 38.690 10.334 -20.424 1.00 0.00 C ATOM 2212 O HIS A 141 39.354 10.055 -19.426 1.00 0.00 O ATOM 2213 CB HIS A 141 36.557 9.174 -19.822 1.00 0.00 C ATOM 2214 CG HIS A 141 37.357 8.523 -18.735 1.00 0.00 C ATOM 2215 ND1 HIS A 141 37.283 8.907 -17.413 1.00 0.00 N ATOM 2216 CD2 HIS A 141 38.248 7.505 -18.780 1.00 0.00 C ATOM 2217 CE1 HIS A 141 38.097 8.156 -16.692 1.00 0.00 C ATOM 2218 NE2 HIS A 141 38.694 7.297 -17.498 1.00 0.00 N ATOM 0 H HIS A 141 36.305 10.021 -22.192 1.00 0.00 H new ATOM 0 HA HIS A 141 36.939 11.279 -19.641 1.00 0.00 H new ATOM 0 HB2 HIS A 141 35.553 9.380 -19.450 1.00 0.00 H new ATOM 0 HB3 HIS A 141 36.452 8.476 -20.653 1.00 0.00 H new ATOM 0 HD1 HIS A 141 36.692 9.654 -17.048 1.00 0.00 H new ATOM 0 HD2 HIS A 141 38.552 6.958 -19.660 1.00 0.00 H new ATOM 0 HE1 HIS A 141 38.248 8.232 -15.625 1.00 0.00 H new ATOM 2226 N MET A 142 39.231 10.529 -21.622 1.00 0.00 N ATOM 2227 CA MET A 142 40.669 10.424 -21.837 1.00 0.00 C ATOM 2228 C MET A 142 41.357 11.761 -21.575 1.00 0.00 C ATOM 2229 O MET A 142 42.558 11.810 -21.309 1.00 0.00 O ATOM 2230 CB MET A 142 40.961 9.959 -23.265 1.00 0.00 C ATOM 2231 CG MET A 142 40.003 8.888 -23.762 1.00 0.00 C ATOM 2232 SD MET A 142 40.561 7.220 -23.367 1.00 0.00 S ATOM 2233 CE MET A 142 39.757 6.959 -21.788 1.00 0.00 C ATOM 0 H MET A 142 38.695 10.761 -22.458 1.00 0.00 H new ATOM 0 HA MET A 142 41.063 9.688 -21.136 1.00 0.00 H new ATOM 0 HB2 MET A 142 40.913 10.817 -23.935 1.00 0.00 H new ATOM 0 HB3 MET A 142 41.980 9.574 -23.312 1.00 0.00 H new ATOM 0 HG2 MET A 142 39.020 9.052 -23.321 1.00 0.00 H new ATOM 0 HG3 MET A 142 39.887 8.982 -24.842 1.00 0.00 H new ATOM 0 HE1 MET A 142 40.437 6.436 -21.115 1.00 0.00 H new ATOM 0 HE2 MET A 142 39.486 7.922 -21.354 1.00 0.00 H new ATOM 0 HE3 MET A 142 38.858 6.360 -21.932 1.00 0.00 H new ATOM 2243 N HIS A 143 40.588 12.842 -21.652 1.00 0.00 N ATOM 2244 CA HIS A 143 41.124 14.179 -21.423 1.00 0.00 C ATOM 2245 C HIS A 143 41.820 14.261 -20.068 1.00 0.00 C ATOM 2246 O HIS A 143 42.650 15.140 -19.837 1.00 0.00 O ATOM 2247 CB HIS A 143 40.005 15.219 -21.498 1.00 0.00 C ATOM 2248 CG HIS A 143 39.545 15.504 -22.895 1.00 0.00 C ATOM 2249 ND1 HIS A 143 39.886 16.651 -23.580 1.00 0.00 N ATOM 2250 CD2 HIS A 143 38.767 14.783 -23.735 1.00 0.00 C ATOM 2251 CE1 HIS A 143 39.337 16.623 -24.781 1.00 0.00 C ATOM 2252 NE2 HIS A 143 38.653 15.500 -24.901 1.00 0.00 N ATOM 0 H HIS A 143 39.592 12.819 -21.871 1.00 0.00 H new ATOM 0 HA HIS A 143 41.858 14.388 -22.202 1.00 0.00 H new ATOM 0 HB2 HIS A 143 39.157 14.871 -20.909 1.00 0.00 H new ATOM 0 HB3 HIS A 143 40.351 16.147 -21.042 1.00 0.00 H new ATOM 0 HD2 HIS A 143 38.319 13.822 -23.527 1.00 0.00 H new ATOM 0 HE1 HIS A 143 39.432 17.389 -25.537 1.00 0.00 H new ATOM 0 HE2 HIS A 143 38.126 15.212 -25.725 1.00 0.00 H new ATOM 2260 N VAL A 144 41.477 13.338 -19.175 1.00 0.00 N ATOM 2261 CA VAL A 144 42.069 13.305 -17.843 1.00 0.00 C ATOM 2262 C VAL A 144 43.188 12.272 -17.765 1.00 0.00 C ATOM 2263 O VAL A 144 43.996 12.286 -16.836 1.00 0.00 O ATOM 2264 CB VAL A 144 41.014 12.986 -16.768 1.00 0.00 C ATOM 2265 CG1 VAL A 144 39.864 12.192 -17.367 1.00 0.00 C ATOM 2266 CG2 VAL A 144 41.647 12.230 -15.609 1.00 0.00 C ATOM 0 H VAL A 144 40.792 12.603 -19.350 1.00 0.00 H new ATOM 0 HA VAL A 144 42.480 14.297 -17.654 1.00 0.00 H new ATOM 0 HB VAL A 144 40.615 13.925 -16.386 1.00 0.00 H new ATOM 0 HG11 VAL A 144 39.128 11.976 -16.592 1.00 0.00 H new ATOM 0 HG12 VAL A 144 39.395 12.773 -18.161 1.00 0.00 H new ATOM 0 HG13 VAL A 144 40.243 11.256 -17.778 1.00 0.00 H new ATOM 0 HG21 VAL A 144 40.887 12.013 -14.858 1.00 0.00 H new ATOM 0 HG22 VAL A 144 42.074 11.296 -15.974 1.00 0.00 H new ATOM 0 HG23 VAL A 144 42.433 12.839 -15.163 1.00 0.00 H new ATOM 2276 N HIS A 145 43.229 11.377 -18.747 1.00 0.00 N ATOM 2277 CA HIS A 145 44.251 10.336 -18.790 1.00 0.00 C ATOM 2278 C HIS A 145 45.578 10.898 -19.291 1.00 0.00 C ATOM 2279 O HIS A 145 46.645 10.533 -18.797 1.00 0.00 O ATOM 2280 CB HIS A 145 43.798 9.185 -19.688 1.00 0.00 C ATOM 2281 CG HIS A 145 43.036 8.121 -18.961 1.00 0.00 C ATOM 2282 ND1 HIS A 145 43.569 7.394 -17.917 1.00 0.00 N ATOM 2283 CD2 HIS A 145 41.774 7.663 -19.130 1.00 0.00 C ATOM 2284 CE1 HIS A 145 42.668 6.534 -17.477 1.00 0.00 C ATOM 2285 NE2 HIS A 145 41.569 6.677 -18.196 1.00 0.00 N ATOM 0 H HIS A 145 42.567 11.351 -19.523 1.00 0.00 H new ATOM 0 HA HIS A 145 44.396 9.960 -17.777 1.00 0.00 H new ATOM 0 HB2 HIS A 145 43.175 9.584 -20.489 1.00 0.00 H new ATOM 0 HB3 HIS A 145 44.673 8.736 -20.158 1.00 0.00 H new ATOM 0 HD1 HIS A 145 44.512 7.503 -17.543 1.00 0.00 H new ATOM 0 HD2 HIS A 145 41.060 8.009 -19.863 1.00 0.00 H new ATOM 0 HE1 HIS A 145 42.806 5.833 -16.667 1.00 0.00 H new ATOM 2293 N THR A 146 45.504 11.787 -20.277 1.00 0.00 N ATOM 2294 CA THR A 146 46.698 12.397 -20.846 1.00 0.00 C ATOM 2295 C THR A 146 47.380 13.317 -19.840 1.00 0.00 C ATOM 2296 O THR A 146 48.541 13.115 -19.486 1.00 0.00 O ATOM 2297 CB THR A 146 46.367 13.202 -22.117 1.00 0.00 C ATOM 2298 OG1 THR A 146 45.284 12.582 -22.821 1.00 0.00 O ATOM 2299 CG2 THR A 146 47.581 13.299 -23.028 1.00 0.00 C ATOM 0 H THR A 146 44.629 12.100 -20.698 1.00 0.00 H new ATOM 0 HA THR A 146 47.374 11.583 -21.106 1.00 0.00 H new ATOM 0 HB THR A 146 46.076 14.209 -21.817 1.00 0.00 H new ATOM 0 HG1 THR A 146 45.078 13.100 -23.627 1.00 0.00 H new ATOM 0 HG21 THR A 146 47.323 13.872 -23.919 1.00 0.00 H new ATOM 0 HG22 THR A 146 48.394 13.797 -22.499 1.00 0.00 H new ATOM 0 HG23 THR A 146 47.898 12.298 -23.320 1.00 0.00 H new ATOM 2307 N SER A 147 46.649 14.328 -19.380 1.00 0.00 N ATOM 2308 CA SER A 147 47.185 15.282 -18.416 1.00 0.00 C ATOM 2309 C SER A 147 47.535 14.588 -17.103 1.00 0.00 C ATOM 2310 O SER A 147 46.921 13.587 -16.734 1.00 0.00 O ATOM 2311 CB SER A 147 46.174 16.402 -18.159 1.00 0.00 C ATOM 2312 OG SER A 147 45.151 15.974 -17.277 1.00 0.00 O ATOM 0 H SER A 147 45.685 14.507 -19.659 1.00 0.00 H new ATOM 0 HA SER A 147 48.095 15.712 -18.835 1.00 0.00 H new ATOM 0 HB2 SER A 147 46.685 17.267 -17.736 1.00 0.00 H new ATOM 0 HB3 SER A 147 45.734 16.722 -19.103 1.00 0.00 H new ATOM 0 HG SER A 147 44.519 16.708 -17.128 1.00 0.00 H new ATOM 2318 N ASP A 148 48.528 15.127 -16.403 1.00 0.00 N ATOM 2319 CA ASP A 148 48.961 14.561 -15.131 1.00 0.00 C ATOM 2320 C ASP A 148 49.926 15.503 -14.418 1.00 0.00 C ATOM 2321 O ASP A 148 50.793 16.112 -15.044 1.00 0.00 O ATOM 2322 CB ASP A 148 49.626 13.202 -15.353 1.00 0.00 C ATOM 2323 CG ASP A 148 50.934 13.314 -16.112 1.00 0.00 C ATOM 2324 OD1 ASP A 148 50.984 14.080 -17.097 1.00 0.00 O ATOM 2325 OD2 ASP A 148 51.907 12.637 -15.720 1.00 0.00 O ATOM 0 H ASP A 148 49.048 15.955 -16.695 1.00 0.00 H new ATOM 0 HA ASP A 148 48.081 14.427 -14.502 1.00 0.00 H new ATOM 0 HB2 ASP A 148 49.809 12.728 -14.388 1.00 0.00 H new ATOM 0 HB3 ASP A 148 48.945 12.553 -15.903 1.00 0.00 H new ATOM 2330 N LYS A 149 49.769 15.619 -13.103 1.00 0.00 N ATOM 2331 CA LYS A 149 50.625 16.486 -12.303 1.00 0.00 C ATOM 2332 C LYS A 149 50.682 16.010 -10.856 1.00 0.00 C ATOM 2333 O LYS A 149 49.891 15.164 -10.439 1.00 0.00 O ATOM 2334 CB LYS A 149 50.117 17.929 -12.357 1.00 0.00 C ATOM 2335 CG LYS A 149 48.607 18.038 -12.473 1.00 0.00 C ATOM 2336 CD LYS A 149 47.925 17.769 -11.142 1.00 0.00 C ATOM 2337 CE LYS A 149 46.413 17.709 -11.293 1.00 0.00 C ATOM 2338 NZ LYS A 149 45.740 17.363 -10.010 1.00 0.00 N ATOM 0 H LYS A 149 49.056 15.123 -12.569 1.00 0.00 H new ATOM 0 HA LYS A 149 51.631 16.445 -12.720 1.00 0.00 H new ATOM 0 HB2 LYS A 149 50.443 18.454 -11.459 1.00 0.00 H new ATOM 0 HB3 LYS A 149 50.576 18.435 -13.206 1.00 0.00 H new ATOM 0 HG2 LYS A 149 48.339 19.034 -12.825 1.00 0.00 H new ATOM 0 HG3 LYS A 149 48.246 17.329 -13.218 1.00 0.00 H new ATOM 0 HD2 LYS A 149 48.288 16.828 -10.730 1.00 0.00 H new ATOM 0 HD3 LYS A 149 48.190 18.552 -10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 149 46.045 18.672 -11.648 1.00 0.00 H new ATOM 0 HE3 LYS A 149 46.153 16.970 -12.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 44.711 17.332 -10.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 46.072 16.433 -9.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 45.967 18.082 -9.294 1.00 0.00 H new ATOM 2352 N SER A 150 51.621 16.560 -10.093 1.00 0.00 N ATOM 2353 CA SER A 150 51.782 16.189 -8.692 1.00 0.00 C ATOM 2354 C SER A 150 50.776 16.929 -7.815 1.00 0.00 C ATOM 2355 O SER A 150 50.125 17.874 -8.259 1.00 0.00 O ATOM 2356 CB SER A 150 53.206 16.493 -8.222 1.00 0.00 C ATOM 2357 OG SER A 150 53.261 16.620 -6.811 1.00 0.00 O ATOM 0 H SER A 150 52.282 17.264 -10.421 1.00 0.00 H new ATOM 0 HA SER A 150 51.598 15.118 -8.602 1.00 0.00 H new ATOM 0 HB2 SER A 150 53.877 15.697 -8.545 1.00 0.00 H new ATOM 0 HB3 SER A 150 53.557 17.414 -8.687 1.00 0.00 H new ATOM 0 HG SER A 150 54.182 16.812 -6.536 1.00 0.00 H new ATOM 2363 N GLY A 151 50.654 16.491 -6.565 1.00 0.00 N ATOM 2364 CA GLY A 151 49.726 17.122 -5.645 1.00 0.00 C ATOM 2365 C GLY A 151 48.342 16.508 -5.707 1.00 0.00 C ATOM 2366 O GLY A 151 47.337 17.204 -5.860 1.00 0.00 O ATOM 0 H GLY A 151 51.181 15.711 -6.174 1.00 0.00 H new ATOM 0 HA2 GLY A 151 50.112 17.038 -4.629 1.00 0.00 H new ATOM 0 HA3 GLY A 151 49.659 18.186 -5.874 1.00 0.00 H new ATOM 2370 N PRO A 152 48.275 15.174 -5.587 1.00 0.00 N ATOM 2371 CA PRO A 152 47.009 14.438 -5.628 1.00 0.00 C ATOM 2372 C PRO A 152 46.152 14.689 -4.392 1.00 0.00 C ATOM 2373 O PRO A 152 46.664 15.049 -3.333 1.00 0.00 O ATOM 2374 CB PRO A 152 47.451 12.973 -5.683 1.00 0.00 C ATOM 2375 CG PRO A 152 48.802 12.962 -5.054 1.00 0.00 C ATOM 2376 CD PRO A 152 49.432 14.282 -5.402 1.00 0.00 C ATOM 0 HA PRO A 152 46.389 14.742 -6.471 1.00 0.00 H new ATOM 0 HB2 PRO A 152 46.757 12.329 -5.142 1.00 0.00 H new ATOM 0 HB3 PRO A 152 47.489 12.609 -6.710 1.00 0.00 H new ATOM 0 HG2 PRO A 152 48.728 12.838 -3.974 1.00 0.00 H new ATOM 0 HG3 PRO A 152 49.401 12.133 -5.430 1.00 0.00 H new ATOM 0 HD2 PRO A 152 50.089 14.636 -4.607 1.00 0.00 H new ATOM 0 HD3 PRO A 152 50.035 14.213 -6.307 1.00 0.00 H new ATOM 2384 N SER A 153 44.844 14.496 -4.535 1.00 0.00 N ATOM 2385 CA SER A 153 43.916 14.705 -3.430 1.00 0.00 C ATOM 2386 C SER A 153 43.617 13.390 -2.715 1.00 0.00 C ATOM 2387 O SER A 153 42.908 12.532 -3.241 1.00 0.00 O ATOM 2388 CB SER A 153 42.615 15.328 -3.940 1.00 0.00 C ATOM 2389 OG SER A 153 41.694 15.525 -2.881 1.00 0.00 O ATOM 0 H SER A 153 44.404 14.195 -5.405 1.00 0.00 H new ATOM 0 HA SER A 153 44.383 15.387 -2.720 1.00 0.00 H new ATOM 0 HB2 SER A 153 42.829 16.282 -4.422 1.00 0.00 H new ATOM 0 HB3 SER A 153 42.171 14.681 -4.697 1.00 0.00 H new ATOM 0 HG SER A 153 40.872 15.926 -3.233 1.00 0.00 H new ATOM 2395 N SER A 154 44.164 13.240 -1.513 1.00 0.00 N ATOM 2396 CA SER A 154 43.960 12.029 -0.727 1.00 0.00 C ATOM 2397 C SER A 154 42.547 11.486 -0.921 1.00 0.00 C ATOM 2398 O SER A 154 41.608 11.915 -0.253 1.00 0.00 O ATOM 2399 CB SER A 154 44.211 12.310 0.756 1.00 0.00 C ATOM 2400 OG SER A 154 45.557 12.692 0.982 1.00 0.00 O ATOM 0 H SER A 154 44.752 13.942 -1.062 1.00 0.00 H new ATOM 0 HA SER A 154 44.670 11.278 -1.073 1.00 0.00 H new ATOM 0 HB2 SER A 154 43.543 13.101 1.098 1.00 0.00 H new ATOM 0 HB3 SER A 154 43.979 11.421 1.342 1.00 0.00 H new ATOM 0 HG SER A 154 45.691 12.868 1.937 1.00 0.00 H new ATOM 2406 N GLY A 155 42.406 10.539 -1.843 1.00 0.00 N ATOM 2407 CA GLY A 155 41.105 9.952 -2.110 1.00 0.00 C ATOM 2408 C GLY A 155 41.129 9.005 -3.293 1.00 0.00 C ATOM 2409 O GLY A 155 42.212 8.657 -3.761 1.00 0.00 O ATOM 0 H GLY A 155 43.168 10.168 -2.410 1.00 0.00 H new ATOM 0 HA2 GLY A 155 40.764 9.415 -1.225 1.00 0.00 H new ATOM 0 HA3 GLY A 155 40.383 10.746 -2.299 1.00 0.00 H new TER 2413 GLY A 155 HETATM 2414 ZN ZN A 201 -9.113 18.026 -20.890 1.00 0.00 ZN HETATM 2415 ZN ZN A 401 1.939 18.456 -19.130 1.00 0.00 ZN HETATM 2416 ZN ZN A 601 16.555 0.627 -22.676 1.00 0.00 ZN HETATM 2417 ZN ZN A 801 39.819 5.603 -17.832 1.00 0.00 ZN