USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1166 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 9 MET CE :methyl -169:sc= -1.34 (180deg=-0.794) USER MOD Set 1.2: A 118 CYS SG : rot 31:sc= 0.0166 USER MOD Set 2.1: A 83 HIS : no HD1:sc= 0.88 K(o=0.019,f=-5.9) USER MOD Set 2.2: A 86 THR OG1 : rot 117:sc= -0.861! USER MOD Set 3.1: A 25 CYS SG : rot 27:sc= -0.397 USER MOD Set 3.2: A 57 MET CE :methyl 148:sc= -0.256 (180deg=-0.977) USER MOD Set 3.3: A 79 ASN : amide:sc= -1.09 K(o=-1.7,f=-5.4!) USER MOD Set 4.1: A 47 ASN : amide:sc= -0.399 K(o=-1.4,f=-2.8) USER MOD Set 4.2: A 56 SER OG : rot 80:sc= -0.993 USER MOD Set 5.1: A 7 LYS NZ :NH3+ -104:sc= 1.12 (180deg=0.845) USER MOD Set 5.2: A 8 GLN : amide:sc= -4.65! C(o=-3.5!,f=-7.3!) USER MOD Set 6.1: A 1 MET CE :methyl -148:sc= 0 (180deg=0) USER MOD Set 6.2: A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -154:sc= 2.46 (180deg=1.71) USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.51! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -173:sc= -0.787 (180deg=-0.899) USER MOD Single : A 15 HIS : no HD1:sc= 0.0131 K(o=0.013,f=-2.1) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= 0.489 K(o=0.49,f=-0.76) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0408 K(o=-0.041,f=-1.6) USER MOD Single : A 50 GLN : amide:sc= -0.0397 X(o=-0.04,f=-0.48) USER MOD Single : A 51 SER OG : rot 81:sc= 1.22 USER MOD Single : A 54 HIS : +bothHN:sc= -0.545 K(o=-0.54,f=-7.9!) USER MOD Single : A 62 GLN : amide:sc=-0.00501 K(o=-0.005,f=-0.84) USER MOD Single : A 64 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -146:sc= -0.435 (180deg=-1.8!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc=-0.00417 K(o=-0.0042,f=-1.6) USER MOD Single : A 76 MET CE :methyl -136:sc= -0.36 (180deg=-2.68!) USER MOD Single : A 81 HIS : no HE2:sc= 0.734 K(o=0.74,f=-6.5!) USER MOD Single : A 82 SER OG : rot -129:sc=-0.00254 USER MOD Single : A 91 SER OG : rot 156:sc= 0.231 USER MOD Single : A 95 LYS NZ :NH3+ -146:sc= 0.742 (180deg=0.478) USER MOD Single : A 102 SER OG : rot -11:sc= 0.733 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 79:sc= 1.31 USER MOD Single : A 114 GLN : amide:sc= 1.13 K(o=1.1,f=-0.062) USER MOD Single : A 115 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0519) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 21:sc= 0.185 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -172:sc= 0.477 (180deg=0.328) USER MOD Single : A 136 LYS NZ :NH3+ 169:sc= 1.06 (180deg=0.883) USER MOD Single : A 141 HIS : no HD1:sc= -0.0347 X(o=-0.035,f=-0.0031) USER MOD Single : A 142 HIS : no HD1:sc= 1.16 K(o=1.2,f=-3.7!) USER MOD Single : A 143 HIS : no HD1:sc= 0.417 K(o=0.42,f=-2.1!) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS :FLIP no HD1:sc= -2.05! C(o=-3.8!,f=-2!) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.420 -2.759 5.202 1.00 0.00 N ATOM 2 CA MET A 1 -12.590 -3.115 4.025 1.00 0.00 C ATOM 3 C MET A 1 -11.790 -1.903 3.564 1.00 0.00 C ATOM 4 O MET A 1 -11.899 -0.821 4.148 1.00 0.00 O ATOM 5 CB MET A 1 -13.477 -3.620 2.877 1.00 0.00 C ATOM 6 CG MET A 1 -14.239 -2.519 2.143 1.00 0.00 C ATOM 7 SD MET A 1 -15.316 -1.562 3.228 1.00 0.00 S ATOM 8 CE MET A 1 -15.989 -0.373 2.071 1.00 0.00 C ATOM 0 H1 MET A 1 -13.605 -3.612 5.767 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.915 -2.060 5.784 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.323 -2.354 4.881 1.00 0.00 H new ATOM 0 HA MET A 1 -11.902 -3.910 4.313 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.854 -4.155 2.160 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.193 -4.338 3.275 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.525 -1.848 1.665 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.837 -2.966 1.349 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.181 0.568 2.587 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.275 -0.206 1.265 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.921 -0.756 1.656 1.00 0.00 H new ATOM 20 N ILE A 2 -10.993 -2.077 2.520 1.00 0.00 N ATOM 21 CA ILE A 2 -10.208 -0.982 1.977 1.00 0.00 C ATOM 22 C ILE A 2 -10.723 -0.602 0.589 1.00 0.00 C ATOM 23 O ILE A 2 -11.098 -1.463 -0.208 1.00 0.00 O ATOM 24 CB ILE A 2 -8.697 -1.330 1.920 1.00 0.00 C ATOM 25 CG1 ILE A 2 -7.877 -0.091 1.551 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.429 -2.459 0.934 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.378 -0.309 1.618 1.00 0.00 C ATOM 0 H ILE A 2 -10.874 -2.966 2.033 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.321 -0.128 2.645 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.392 -1.670 2.910 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.145 0.223 0.542 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.147 0.725 2.221 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.362 -2.681 0.916 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -8.979 -3.348 1.241 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -8.754 -2.157 -0.062 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -5.864 0.612 1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.097 -0.593 2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.094 -1.103 0.927 1.00 0.00 H new ATOM 39 N THR A 3 -10.782 0.687 0.322 1.00 0.00 N ATOM 40 CA THR A 3 -11.268 1.177 -0.950 1.00 0.00 C ATOM 41 C THR A 3 -10.238 2.093 -1.595 1.00 0.00 C ATOM 42 O THR A 3 -9.706 2.994 -0.943 1.00 0.00 O ATOM 43 CB THR A 3 -12.591 1.939 -0.763 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.514 1.134 -0.017 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.206 2.313 -2.102 1.00 0.00 C ATOM 0 H THR A 3 -10.497 1.418 0.974 1.00 0.00 H new ATOM 0 HA THR A 3 -11.440 0.320 -1.601 1.00 0.00 H new ATOM 0 HB THR A 3 -12.378 2.858 -0.217 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.354 1.624 0.101 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.140 2.850 -1.936 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.515 2.949 -2.655 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.405 1.408 -2.676 1.00 0.00 H new ATOM 53 N LEU A 4 -9.943 1.850 -2.860 1.00 0.00 N ATOM 54 CA LEU A 4 -9.020 2.692 -3.593 1.00 0.00 C ATOM 55 C LEU A 4 -9.496 2.870 -5.022 1.00 0.00 C ATOM 56 O LEU A 4 -10.361 2.137 -5.498 1.00 0.00 O ATOM 57 CB LEU A 4 -7.592 2.130 -3.549 1.00 0.00 C ATOM 58 CG LEU A 4 -7.414 0.685 -4.028 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.161 0.638 -5.528 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.279 0.012 -3.272 1.00 0.00 C ATOM 0 H LEU A 4 -10.330 1.076 -3.399 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.995 3.670 -3.113 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.953 2.772 -4.155 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.230 2.197 -2.523 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.337 0.141 -3.824 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.038 -0.398 -5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.008 1.080 -6.054 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.256 1.199 -5.762 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.165 -1.013 -3.624 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.352 0.559 -3.444 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.505 0.007 -2.206 1.00 0.00 H new ATOM 72 N THR A 5 -8.933 3.846 -5.695 1.00 0.00 N ATOM 73 CA THR A 5 -9.399 4.210 -7.016 1.00 0.00 C ATOM 74 C THR A 5 -8.460 3.711 -8.106 1.00 0.00 C ATOM 75 O THR A 5 -7.387 3.173 -7.821 1.00 0.00 O ATOM 76 CB THR A 5 -9.558 5.733 -7.127 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.307 6.381 -6.851 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.611 6.224 -6.148 1.00 0.00 C ATOM 0 H THR A 5 -8.151 4.404 -5.351 1.00 0.00 H new ATOM 0 HA THR A 5 -10.367 3.731 -7.161 1.00 0.00 H new ATOM 0 HB THR A 5 -9.873 5.976 -8.142 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.418 7.352 -6.926 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.714 7.305 -6.237 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.566 5.749 -6.372 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.309 5.970 -5.132 1.00 0.00 H new ATOM 86 N LYS A 6 -8.882 3.888 -9.353 1.00 0.00 N ATOM 87 CA LYS A 6 -8.073 3.540 -10.514 1.00 0.00 C ATOM 88 C LYS A 6 -6.728 4.244 -10.449 1.00 0.00 C ATOM 89 O LYS A 6 -5.688 3.658 -10.737 1.00 0.00 O ATOM 90 CB LYS A 6 -8.796 3.975 -11.780 1.00 0.00 C ATOM 91 CG LYS A 6 -8.187 3.436 -13.060 1.00 0.00 C ATOM 92 CD LYS A 6 -8.899 4.003 -14.272 1.00 0.00 C ATOM 93 CE LYS A 6 -8.340 3.456 -15.571 1.00 0.00 C ATOM 94 NZ LYS A 6 -9.012 4.072 -16.744 1.00 0.00 N ATOM 0 H LYS A 6 -9.795 4.277 -9.587 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.915 2.462 -10.522 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.835 3.651 -11.721 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.803 5.064 -11.825 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.128 3.692 -13.101 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.252 2.348 -13.070 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.962 3.770 -14.209 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.810 5.089 -14.269 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -7.268 3.649 -15.619 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.471 2.374 -15.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -8.610 3.680 -17.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -10.031 3.866 -16.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -8.866 5.102 -16.727 1.00 0.00 H new ATOM 108 N LYS A 7 -6.777 5.513 -10.069 1.00 0.00 N ATOM 109 CA LYS A 7 -5.586 6.331 -9.922 1.00 0.00 C ATOM 110 C LYS A 7 -4.614 5.690 -8.932 1.00 0.00 C ATOM 111 O LYS A 7 -3.406 5.706 -9.147 1.00 0.00 O ATOM 112 CB LYS A 7 -6.001 7.733 -9.464 1.00 0.00 C ATOM 113 CG LYS A 7 -4.959 8.815 -9.699 1.00 0.00 C ATOM 114 CD LYS A 7 -4.010 8.977 -8.516 1.00 0.00 C ATOM 115 CE LYS A 7 -4.722 9.540 -7.292 1.00 0.00 C ATOM 116 NZ LYS A 7 -3.825 9.604 -6.105 1.00 0.00 N ATOM 0 H LYS A 7 -7.645 6.003 -9.854 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.071 6.408 -10.879 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -6.918 8.013 -9.983 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.234 7.698 -8.400 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.383 8.573 -10.592 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.461 9.763 -9.891 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.570 8.011 -8.268 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.190 9.638 -8.796 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -5.096 10.539 -7.518 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -5.588 8.920 -7.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -4.060 8.831 -5.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -2.836 9.509 -6.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -3.952 10.517 -5.623 1.00 0.00 H new ATOM 130 N GLN A 8 -5.149 5.103 -7.866 1.00 0.00 N ATOM 131 CA GLN A 8 -4.325 4.406 -6.880 1.00 0.00 C ATOM 132 C GLN A 8 -3.698 3.170 -7.496 1.00 0.00 C ATOM 133 O GLN A 8 -2.507 2.918 -7.322 1.00 0.00 O ATOM 134 CB GLN A 8 -5.164 3.990 -5.673 1.00 0.00 C ATOM 135 CG GLN A 8 -5.941 5.127 -5.047 1.00 0.00 C ATOM 136 CD GLN A 8 -5.048 6.267 -4.631 1.00 0.00 C ATOM 137 OE1 GLN A 8 -4.821 7.198 -5.390 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.518 6.183 -3.432 1.00 0.00 N ATOM 0 H GLN A 8 -6.148 5.095 -7.661 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.541 5.090 -6.554 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.862 3.211 -5.979 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.508 3.553 -4.920 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.684 5.491 -5.757 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.484 4.758 -4.177 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.736 5.387 -2.833 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.888 6.914 -3.100 1.00 0.00 H new ATOM 147 N MET A 9 -4.510 2.397 -8.208 1.00 0.00 N ATOM 148 CA MET A 9 -4.024 1.207 -8.887 1.00 0.00 C ATOM 149 C MET A 9 -2.907 1.585 -9.850 1.00 0.00 C ATOM 150 O MET A 9 -1.852 0.965 -9.860 1.00 0.00 O ATOM 151 CB MET A 9 -5.168 0.516 -9.636 1.00 0.00 C ATOM 152 CG MET A 9 -4.778 -0.820 -10.249 1.00 0.00 C ATOM 153 SD MET A 9 -4.240 -2.019 -9.013 1.00 0.00 S ATOM 154 CE MET A 9 -5.725 -2.166 -8.018 1.00 0.00 C ATOM 0 H MET A 9 -5.507 2.575 -8.329 1.00 0.00 H new ATOM 0 HA MET A 9 -3.631 0.510 -8.147 1.00 0.00 H new ATOM 0 HB2 MET A 9 -6.000 0.361 -8.948 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.526 1.177 -10.425 1.00 0.00 H new ATOM 0 HG2 MET A 9 -5.628 -1.226 -10.798 1.00 0.00 H new ATOM 0 HG3 MET A 9 -3.977 -0.664 -10.972 1.00 0.00 H new ATOM 0 HE1 MET A 9 -5.498 -2.716 -7.105 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.091 -1.172 -7.761 1.00 0.00 H new ATOM 0 HE3 MET A 9 -6.490 -2.700 -8.582 1.00 0.00 H new ATOM 164 N GLU A 10 -3.143 2.633 -10.625 1.00 0.00 N ATOM 165 CA GLU A 10 -2.163 3.155 -11.554 1.00 0.00 C ATOM 166 C GLU A 10 -0.903 3.631 -10.833 1.00 0.00 C ATOM 167 O GLU A 10 0.208 3.360 -11.278 1.00 0.00 O ATOM 168 CB GLU A 10 -2.796 4.300 -12.334 1.00 0.00 C ATOM 169 CG GLU A 10 -3.642 3.845 -13.511 1.00 0.00 C ATOM 170 CD GLU A 10 -2.811 3.238 -14.623 1.00 0.00 C ATOM 171 OE1 GLU A 10 -2.472 2.042 -14.538 1.00 0.00 O ATOM 172 OE2 GLU A 10 -2.487 3.961 -15.592 1.00 0.00 O ATOM 0 H GLU A 10 -4.025 3.145 -10.624 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.860 2.360 -12.235 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.417 4.888 -11.658 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.008 4.959 -12.698 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.373 3.113 -13.167 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.201 4.695 -13.902 1.00 0.00 H new ATOM 179 N GLU A 11 -1.081 4.337 -9.720 1.00 0.00 N ATOM 180 CA GLU A 11 0.037 4.824 -8.927 1.00 0.00 C ATOM 181 C GLU A 11 0.876 3.668 -8.387 1.00 0.00 C ATOM 182 O GLU A 11 2.108 3.718 -8.411 1.00 0.00 O ATOM 183 CB GLU A 11 -0.482 5.700 -7.785 1.00 0.00 C ATOM 184 CG GLU A 11 -0.726 7.148 -8.186 1.00 0.00 C ATOM 185 CD GLU A 11 -0.843 8.086 -6.994 1.00 0.00 C ATOM 186 OE1 GLU A 11 -1.765 7.906 -6.166 1.00 0.00 O ATOM 187 OE2 GLU A 11 -0.024 9.026 -6.892 1.00 0.00 O ATOM 0 H GLU A 11 -1.997 4.585 -9.347 1.00 0.00 H new ATOM 0 HA GLU A 11 0.682 5.424 -9.568 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.412 5.275 -7.407 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.236 5.675 -6.965 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.090 7.484 -8.826 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.640 7.206 -8.777 1.00 0.00 H new ATOM 194 N MET A 12 0.208 2.626 -7.911 1.00 0.00 N ATOM 195 CA MET A 12 0.900 1.441 -7.420 1.00 0.00 C ATOM 196 C MET A 12 1.537 0.677 -8.575 1.00 0.00 C ATOM 197 O MET A 12 2.691 0.263 -8.491 1.00 0.00 O ATOM 198 CB MET A 12 -0.059 0.527 -6.653 1.00 0.00 C ATOM 199 CG MET A 12 -0.592 1.137 -5.366 1.00 0.00 C ATOM 200 SD MET A 12 -1.649 0.009 -4.439 1.00 0.00 S ATOM 201 CE MET A 12 -2.935 -0.325 -5.642 1.00 0.00 C ATOM 0 H MET A 12 -0.809 2.577 -7.854 1.00 0.00 H new ATOM 0 HA MET A 12 1.685 1.769 -6.738 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.899 0.274 -7.299 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.454 -0.405 -6.417 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.247 1.439 -4.739 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.154 2.040 -5.604 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.728 -0.909 -5.174 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.345 0.617 -6.008 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.515 -0.887 -6.477 1.00 0.00 H new ATOM 211 N LEU A 13 0.781 0.514 -9.658 1.00 0.00 N ATOM 212 CA LEU A 13 1.248 -0.209 -10.837 1.00 0.00 C ATOM 213 C LEU A 13 2.464 0.462 -11.461 1.00 0.00 C ATOM 214 O LEU A 13 3.439 -0.208 -11.798 1.00 0.00 O ATOM 215 CB LEU A 13 0.127 -0.330 -11.871 1.00 0.00 C ATOM 216 CG LEU A 13 -0.941 -1.374 -11.537 1.00 0.00 C ATOM 217 CD1 LEU A 13 -1.995 -1.426 -12.628 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.312 -2.747 -11.330 1.00 0.00 C ATOM 0 H LEU A 13 -0.168 0.878 -9.743 1.00 0.00 H new ATOM 0 HA LEU A 13 1.544 -1.207 -10.513 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.355 0.641 -11.979 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.567 -0.577 -12.837 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.425 -1.080 -10.605 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.746 -2.174 -12.373 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.472 -0.450 -12.720 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.525 -1.691 -13.575 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.091 -3.472 -11.094 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.204 -3.052 -12.241 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.402 -2.700 -10.507 1.00 0.00 H new ATOM 230 N ALA A 14 2.405 1.781 -11.608 1.00 0.00 N ATOM 231 CA ALA A 14 3.516 2.542 -12.176 1.00 0.00 C ATOM 232 C ALA A 14 4.780 2.346 -11.350 1.00 0.00 C ATOM 233 O ALA A 14 5.874 2.202 -11.893 1.00 0.00 O ATOM 234 CB ALA A 14 3.165 4.021 -12.267 1.00 0.00 C ATOM 0 H ALA A 14 1.600 2.347 -11.342 1.00 0.00 H new ATOM 0 HA ALA A 14 3.702 2.170 -13.184 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.006 4.569 -12.692 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.289 4.149 -12.903 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.948 4.406 -11.270 1.00 0.00 H new ATOM 240 N HIS A 15 4.621 2.335 -10.034 1.00 0.00 N ATOM 241 CA HIS A 15 5.738 2.098 -9.133 1.00 0.00 C ATOM 242 C HIS A 15 6.188 0.645 -9.225 1.00 0.00 C ATOM 243 O HIS A 15 7.379 0.346 -9.153 1.00 0.00 O ATOM 244 CB HIS A 15 5.334 2.434 -7.696 1.00 0.00 C ATOM 245 CG HIS A 15 6.479 2.438 -6.723 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.433 3.431 -6.686 1.00 0.00 N ATOM 247 CD2 HIS A 15 6.807 1.569 -5.739 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.299 3.172 -5.725 1.00 0.00 C ATOM 249 NE2 HIS A 15 7.942 2.047 -5.130 1.00 0.00 N ATOM 0 H HIS A 15 3.727 2.488 -9.567 1.00 0.00 H new ATOM 0 HA HIS A 15 6.568 2.741 -9.425 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.857 3.414 -7.684 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.589 1.712 -7.361 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.275 0.666 -5.480 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.156 3.777 -5.468 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.428 1.607 -4.349 1.00 0.00 H new ATOM 258 N ALA A 16 5.220 -0.249 -9.389 1.00 0.00 N ATOM 259 CA ALA A 16 5.492 -1.677 -9.485 1.00 0.00 C ATOM 260 C ALA A 16 6.334 -2.005 -10.712 1.00 0.00 C ATOM 261 O ALA A 16 7.388 -2.623 -10.587 1.00 0.00 O ATOM 262 CB ALA A 16 4.193 -2.468 -9.513 1.00 0.00 C ATOM 0 H ALA A 16 4.232 -0.006 -9.459 1.00 0.00 H new ATOM 0 HA ALA A 16 6.062 -1.963 -8.601 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.417 -3.532 -9.585 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.631 -2.276 -8.599 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.600 -2.163 -10.375 1.00 0.00 H new ATOM 268 N ARG A 17 5.885 -1.569 -11.893 1.00 0.00 N ATOM 269 CA ARG A 17 6.624 -1.836 -13.132 1.00 0.00 C ATOM 270 C ARG A 17 8.016 -1.225 -13.069 1.00 0.00 C ATOM 271 O ARG A 17 8.996 -1.822 -13.517 1.00 0.00 O ATOM 272 CB ARG A 17 5.887 -1.296 -14.367 1.00 0.00 C ATOM 273 CG ARG A 17 4.768 -2.197 -14.873 1.00 0.00 C ATOM 274 CD ARG A 17 3.396 -1.715 -14.430 1.00 0.00 C ATOM 275 NE ARG A 17 3.093 -0.371 -14.931 1.00 0.00 N ATOM 276 CZ ARG A 17 1.874 0.047 -15.270 1.00 0.00 C ATOM 277 NH1 ARG A 17 0.841 -0.786 -15.209 1.00 0.00 N ATOM 278 NH2 ARG A 17 1.695 1.296 -15.686 1.00 0.00 N ATOM 0 H ARG A 17 5.024 -1.036 -12.018 1.00 0.00 H new ATOM 0 HA ARG A 17 6.703 -2.919 -13.227 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.470 -0.318 -14.128 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.609 -1.147 -15.170 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.802 -2.239 -15.962 1.00 0.00 H new ATOM 0 HG3 ARG A 17 4.929 -3.212 -14.510 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.636 -2.412 -14.783 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.347 -1.715 -13.341 1.00 0.00 H new ATOM 0 HE ARG A 17 3.866 0.287 -15.026 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.980 -1.749 -14.902 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.091 -0.463 -15.469 1.00 0.00 H new ATOM 0 HH21 ARG A 17 2.490 1.933 -15.745 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.763 1.618 -15.946 1.00 0.00 H new ATOM 292 N GLN A 18 8.087 -0.039 -12.489 1.00 0.00 N ATOM 293 CA GLN A 18 9.334 0.698 -12.367 1.00 0.00 C ATOM 294 C GLN A 18 10.364 -0.077 -11.541 1.00 0.00 C ATOM 295 O GLN A 18 11.559 -0.045 -11.832 1.00 0.00 O ATOM 296 CB GLN A 18 9.048 2.048 -11.715 1.00 0.00 C ATOM 297 CG GLN A 18 10.234 2.990 -11.688 1.00 0.00 C ATOM 298 CD GLN A 18 9.901 4.303 -11.015 1.00 0.00 C ATOM 299 OE1 GLN A 18 10.064 4.451 -9.806 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.434 5.270 -11.791 1.00 0.00 N ATOM 0 H GLN A 18 7.281 0.441 -12.089 1.00 0.00 H new ATOM 0 HA GLN A 18 9.754 0.843 -13.362 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.228 2.530 -12.248 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.709 1.880 -10.693 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.063 2.514 -11.164 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.569 3.180 -12.708 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.313 5.108 -12.791 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.196 6.177 -11.389 1.00 0.00 H new ATOM 309 N ALA A 19 9.891 -0.780 -10.524 1.00 0.00 N ATOM 310 CA ALA A 19 10.784 -1.472 -9.602 1.00 0.00 C ATOM 311 C ALA A 19 10.865 -2.976 -9.874 1.00 0.00 C ATOM 312 O ALA A 19 11.523 -3.710 -9.133 1.00 0.00 O ATOM 313 CB ALA A 19 10.351 -1.217 -8.169 1.00 0.00 C ATOM 0 H ALA A 19 8.898 -0.888 -10.315 1.00 0.00 H new ATOM 0 HA ALA A 19 11.784 -1.069 -9.760 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.024 -1.738 -7.488 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.384 -0.147 -7.964 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.334 -1.583 -8.025 1.00 0.00 H new ATOM 319 N LEU A 20 10.199 -3.436 -10.930 1.00 0.00 N ATOM 320 CA LEU A 20 10.270 -4.839 -11.322 1.00 0.00 C ATOM 321 C LEU A 20 11.693 -5.200 -11.747 1.00 0.00 C ATOM 322 O LEU A 20 12.428 -4.348 -12.248 1.00 0.00 O ATOM 323 CB LEU A 20 9.293 -5.136 -12.464 1.00 0.00 C ATOM 324 CG LEU A 20 7.815 -5.177 -12.076 1.00 0.00 C ATOM 325 CD1 LEU A 20 6.956 -5.484 -13.293 1.00 0.00 C ATOM 326 CD2 LEU A 20 7.577 -6.208 -10.983 1.00 0.00 C ATOM 0 H LEU A 20 9.606 -2.859 -11.527 1.00 0.00 H new ATOM 0 HA LEU A 20 9.991 -5.446 -10.461 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.426 -4.380 -13.238 1.00 0.00 H new ATOM 0 HB3 LEU A 20 9.561 -6.095 -12.907 1.00 0.00 H new ATOM 0 HG LEU A 20 7.533 -4.197 -11.691 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.906 -5.510 -13.000 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.104 -4.711 -14.047 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.242 -6.452 -13.705 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.519 -6.222 -10.720 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.875 -7.193 -11.341 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.166 -5.948 -10.103 1.00 0.00 H new ATOM 338 N PRO A 21 12.102 -6.465 -11.559 1.00 0.00 N ATOM 339 CA PRO A 21 11.278 -7.508 -10.973 1.00 0.00 C ATOM 340 C PRO A 21 11.572 -7.743 -9.486 1.00 0.00 C ATOM 341 O PRO A 21 12.097 -8.791 -9.100 1.00 0.00 O ATOM 342 CB PRO A 21 11.688 -8.727 -11.801 1.00 0.00 C ATOM 343 CG PRO A 21 13.102 -8.458 -12.245 1.00 0.00 C ATOM 344 CD PRO A 21 13.406 -7.005 -11.943 1.00 0.00 C ATOM 0 HA PRO A 21 10.215 -7.268 -10.999 1.00 0.00 H new ATOM 0 HB2 PRO A 21 11.630 -9.640 -11.209 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.027 -8.860 -12.657 1.00 0.00 H new ATOM 0 HG2 PRO A 21 13.799 -9.112 -11.722 1.00 0.00 H new ATOM 0 HG3 PRO A 21 13.214 -8.660 -13.310 1.00 0.00 H new ATOM 0 HD2 PRO A 21 14.136 -6.905 -11.140 1.00 0.00 H new ATOM 0 HD3 PRO A 21 13.815 -6.490 -12.812 1.00 0.00 H new ATOM 352 N ASN A 22 11.245 -6.764 -8.653 1.00 0.00 N ATOM 353 CA ASN A 22 11.427 -6.887 -7.214 1.00 0.00 C ATOM 354 C ASN A 22 10.109 -6.586 -6.518 1.00 0.00 C ATOM 355 O ASN A 22 9.127 -6.245 -7.183 1.00 0.00 O ATOM 356 CB ASN A 22 12.506 -5.916 -6.726 1.00 0.00 C ATOM 357 CG ASN A 22 13.812 -6.058 -7.482 1.00 0.00 C ATOM 358 OD1 ASN A 22 14.660 -6.877 -7.139 1.00 0.00 O ATOM 359 ND2 ASN A 22 13.981 -5.254 -8.519 1.00 0.00 N ATOM 0 H ASN A 22 10.851 -5.872 -8.952 1.00 0.00 H new ATOM 0 HA ASN A 22 11.745 -7.903 -6.979 1.00 0.00 H new ATOM 0 HB2 ASN A 22 12.142 -4.894 -6.829 1.00 0.00 H new ATOM 0 HB3 ASN A 22 12.686 -6.085 -5.664 1.00 0.00 H new ATOM 0 HD21 ASN A 22 14.841 -5.301 -9.066 1.00 0.00 H new ATOM 0 HD22 ASN A 22 13.252 -4.587 -8.771 1.00 0.00 H new ATOM 366 N GLU A 23 10.075 -6.711 -5.197 1.00 0.00 N ATOM 367 CA GLU A 23 8.878 -6.357 -4.448 1.00 0.00 C ATOM 368 C GLU A 23 8.797 -4.846 -4.268 1.00 0.00 C ATOM 369 O GLU A 23 9.261 -4.297 -3.265 1.00 0.00 O ATOM 370 CB GLU A 23 8.816 -7.071 -3.091 1.00 0.00 C ATOM 371 CG GLU A 23 8.511 -8.560 -3.198 1.00 0.00 C ATOM 372 CD GLU A 23 7.985 -9.155 -1.900 1.00 0.00 C ATOM 373 OE1 GLU A 23 6.804 -8.902 -1.564 1.00 0.00 O ATOM 374 OE2 GLU A 23 8.730 -9.892 -1.222 1.00 0.00 O ATOM 0 H GLU A 23 10.852 -7.050 -4.629 1.00 0.00 H new ATOM 0 HA GLU A 23 8.016 -6.692 -5.025 1.00 0.00 H new ATOM 0 HB2 GLU A 23 9.768 -6.940 -2.577 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.053 -6.596 -2.474 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.777 -8.719 -3.988 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.416 -9.090 -3.493 1.00 0.00 H new ATOM 381 N ALA A 24 8.238 -4.181 -5.276 1.00 0.00 N ATOM 382 CA ALA A 24 8.074 -2.734 -5.268 1.00 0.00 C ATOM 383 C ALA A 24 7.228 -2.295 -4.085 1.00 0.00 C ATOM 384 O ALA A 24 6.032 -2.579 -4.028 1.00 0.00 O ATOM 385 CB ALA A 24 7.439 -2.271 -6.569 1.00 0.00 C ATOM 0 H ALA A 24 7.887 -4.632 -6.121 1.00 0.00 H new ATOM 0 HA ALA A 24 9.059 -2.277 -5.173 1.00 0.00 H new ATOM 0 HB1 ALA A 24 7.321 -1.188 -6.551 1.00 0.00 H new ATOM 0 HB2 ALA A 24 8.078 -2.553 -7.406 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.462 -2.740 -6.684 1.00 0.00 H new ATOM 391 N CYS A 25 7.848 -1.605 -3.144 1.00 0.00 N ATOM 392 CA CYS A 25 7.162 -1.231 -1.920 1.00 0.00 C ATOM 393 C CYS A 25 7.045 0.284 -1.783 1.00 0.00 C ATOM 394 O CYS A 25 7.674 1.048 -2.522 1.00 0.00 O ATOM 395 CB CYS A 25 7.889 -1.826 -0.711 1.00 0.00 C ATOM 396 SG CYS A 25 6.902 -1.865 0.806 1.00 0.00 S ATOM 0 H CYS A 25 8.818 -1.294 -3.203 1.00 0.00 H new ATOM 0 HA CYS A 25 6.150 -1.634 -1.962 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.202 -2.842 -0.953 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.795 -1.249 -0.526 1.00 0.00 H new ATOM 0 HG CYS A 25 5.640 -1.930 0.501 1.00 0.00 H new ATOM 402 N GLY A 26 6.216 0.693 -0.839 1.00 0.00 N ATOM 403 CA GLY A 26 5.981 2.093 -0.563 1.00 0.00 C ATOM 404 C GLY A 26 4.983 2.236 0.564 1.00 0.00 C ATOM 405 O GLY A 26 4.759 1.281 1.306 1.00 0.00 O ATOM 0 H GLY A 26 5.686 0.058 -0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.918 2.582 -0.295 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.606 2.591 -1.457 1.00 0.00 H new ATOM 409 N LEU A 27 4.355 3.396 0.686 1.00 0.00 N ATOM 410 CA LEU A 27 3.364 3.604 1.735 1.00 0.00 C ATOM 411 C LEU A 27 2.032 4.035 1.141 1.00 0.00 C ATOM 412 O LEU A 27 1.978 4.593 0.043 1.00 0.00 O ATOM 413 CB LEU A 27 3.843 4.652 2.748 1.00 0.00 C ATOM 414 CG LEU A 27 4.997 4.213 3.653 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.393 5.342 4.592 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.613 2.970 4.445 1.00 0.00 C ATOM 0 H LEU A 27 4.510 4.201 0.079 1.00 0.00 H new ATOM 0 HA LEU A 27 3.230 2.655 2.253 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.151 5.545 2.203 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.999 4.937 3.377 1.00 0.00 H new ATOM 0 HG LEU A 27 5.854 3.968 3.025 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.215 5.014 5.229 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.709 6.207 4.008 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.540 5.615 5.213 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.446 2.673 5.082 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.742 3.187 5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.376 2.159 3.757 1.00 0.00 H new ATOM 428 N LEU A 28 0.960 3.759 1.869 1.00 0.00 N ATOM 429 CA LEU A 28 -0.377 4.124 1.434 1.00 0.00 C ATOM 430 C LEU A 28 -1.024 5.062 2.440 1.00 0.00 C ATOM 431 O LEU A 28 -0.939 4.842 3.651 1.00 0.00 O ATOM 432 CB LEU A 28 -1.242 2.874 1.257 1.00 0.00 C ATOM 433 CG LEU A 28 -0.809 1.942 0.124 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.658 0.685 0.123 1.00 0.00 C ATOM 435 CD2 LEU A 28 -0.914 2.652 -1.218 1.00 0.00 C ATOM 0 H LEU A 28 0.993 3.280 2.769 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.297 4.636 0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.237 2.312 2.191 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.271 3.185 1.078 1.00 0.00 H new ATOM 0 HG LEU A 28 0.231 1.660 0.286 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.339 0.031 -0.688 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.541 0.166 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.705 0.953 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.602 1.975 -2.013 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.946 2.960 -1.387 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.269 3.531 -1.216 1.00 0.00 H new ATOM 447 N GLY A 29 -1.674 6.098 1.937 1.00 0.00 N ATOM 448 CA GLY A 29 -2.303 7.061 2.804 1.00 0.00 C ATOM 449 C GLY A 29 -3.781 7.184 2.529 1.00 0.00 C ATOM 450 O GLY A 29 -4.260 6.766 1.475 1.00 0.00 O ATOM 0 H GLY A 29 -1.776 6.287 0.940 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.150 6.769 3.843 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.827 8.033 2.673 1.00 0.00 H new ATOM 454 N GLY A 30 -4.500 7.731 3.484 1.00 0.00 N ATOM 455 CA GLY A 30 -5.923 7.905 3.336 1.00 0.00 C ATOM 456 C GLY A 30 -6.597 7.997 4.679 1.00 0.00 C ATOM 457 O GLY A 30 -5.939 8.227 5.694 1.00 0.00 O ATOM 0 H GLY A 30 -4.120 8.062 4.371 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.125 8.809 2.761 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.339 7.069 2.773 1.00 0.00 H new ATOM 461 N ARG A 31 -7.901 7.822 4.714 1.00 0.00 N ATOM 462 CA ARG A 31 -8.607 7.893 5.966 1.00 0.00 C ATOM 463 C ARG A 31 -9.122 6.531 6.377 1.00 0.00 C ATOM 464 O ARG A 31 -9.561 5.742 5.545 1.00 0.00 O ATOM 465 CB ARG A 31 -9.790 8.849 5.891 1.00 0.00 C ATOM 466 CG ARG A 31 -10.314 9.201 7.265 1.00 0.00 C ATOM 467 CD ARG A 31 -11.651 9.920 7.220 1.00 0.00 C ATOM 468 NE ARG A 31 -11.503 11.362 7.401 1.00 0.00 N ATOM 469 CZ ARG A 31 -12.299 12.103 8.173 1.00 0.00 C ATOM 470 NH1 ARG A 31 -13.276 11.532 8.873 1.00 0.00 N ATOM 471 NH2 ARG A 31 -12.099 13.414 8.259 1.00 0.00 N ATOM 0 H ARG A 31 -8.484 7.632 3.899 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.893 8.260 6.704 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -9.490 9.759 5.372 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.588 8.395 5.303 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -10.417 8.290 7.854 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.585 9.830 7.776 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -12.137 9.723 6.264 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -12.303 9.522 7.997 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.744 11.831 6.906 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -13.419 10.523 8.821 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -13.882 12.103 9.462 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -11.339 13.849 7.736 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -12.705 13.985 8.848 1.00 0.00 H new ATOM 485 N ARG A 32 -9.058 6.272 7.665 1.00 0.00 N ATOM 486 CA ARG A 32 -9.755 5.151 8.255 1.00 0.00 C ATOM 487 C ARG A 32 -10.853 5.712 9.141 1.00 0.00 C ATOM 488 O ARG A 32 -10.587 6.483 10.065 1.00 0.00 O ATOM 489 CB ARG A 32 -8.802 4.256 9.064 1.00 0.00 C ATOM 490 CG ARG A 32 -7.951 5.006 10.081 1.00 0.00 C ATOM 491 CD ARG A 32 -7.122 4.058 10.941 1.00 0.00 C ATOM 492 NE ARG A 32 -6.321 3.133 10.135 1.00 0.00 N ATOM 493 CZ ARG A 32 -5.007 3.256 9.927 1.00 0.00 C ATOM 494 NH1 ARG A 32 -4.329 4.273 10.443 1.00 0.00 N ATOM 495 NH2 ARG A 32 -4.366 2.349 9.202 1.00 0.00 N ATOM 0 H ARG A 32 -8.523 6.831 8.330 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.178 4.523 7.471 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -9.388 3.499 9.585 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.143 3.729 8.374 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.288 5.697 9.560 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.597 5.606 10.722 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.463 4.639 11.586 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.785 3.488 11.592 1.00 0.00 H new ATOM 0 HE ARG A 32 -6.799 2.342 9.704 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.811 4.973 11.007 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.326 4.354 10.276 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -4.876 1.560 8.805 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -3.363 2.440 9.042 1.00 0.00 H new ATOM 509 N ASP A 33 -12.084 5.350 8.844 1.00 0.00 N ATOM 510 CA ASP A 33 -13.228 5.929 9.536 1.00 0.00 C ATOM 511 C ASP A 33 -13.952 4.833 10.302 1.00 0.00 C ATOM 512 O ASP A 33 -15.150 4.910 10.570 1.00 0.00 O ATOM 513 CB ASP A 33 -14.152 6.603 8.517 1.00 0.00 C ATOM 514 CG ASP A 33 -14.832 7.853 9.046 1.00 0.00 C ATOM 515 OD1 ASP A 33 -15.827 7.731 9.789 1.00 0.00 O ATOM 516 OD2 ASP A 33 -14.385 8.975 8.693 1.00 0.00 O ATOM 0 H ASP A 33 -12.323 4.660 8.131 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.899 6.687 10.247 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.573 6.862 7.630 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.914 5.890 8.203 1.00 0.00 H new ATOM 521 N GLY A 34 -13.179 3.826 10.674 1.00 0.00 N ATOM 522 CA GLY A 34 -13.709 2.650 11.323 1.00 0.00 C ATOM 523 C GLY A 34 -13.096 1.405 10.726 1.00 0.00 C ATOM 524 O GLY A 34 -11.871 1.246 10.732 1.00 0.00 O ATOM 0 H GLY A 34 -12.169 3.806 10.533 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -13.500 2.690 12.392 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.793 2.621 11.211 1.00 0.00 H new ATOM 528 N ASP A 35 -13.926 0.536 10.177 1.00 0.00 N ATOM 529 CA ASP A 35 -13.432 -0.635 9.471 1.00 0.00 C ATOM 530 C ASP A 35 -13.228 -0.285 8.004 1.00 0.00 C ATOM 531 O ASP A 35 -12.638 -1.045 7.233 1.00 0.00 O ATOM 532 CB ASP A 35 -14.402 -1.810 9.610 1.00 0.00 C ATOM 533 CG ASP A 35 -13.861 -3.087 8.990 1.00 0.00 C ATOM 534 OD1 ASP A 35 -12.874 -3.640 9.519 1.00 0.00 O ATOM 535 OD2 ASP A 35 -14.418 -3.543 7.969 1.00 0.00 O ATOM 0 H ASP A 35 -14.942 0.618 10.206 1.00 0.00 H new ATOM 0 HA ASP A 35 -12.481 -0.938 9.910 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.610 -1.982 10.666 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -15.349 -1.553 9.136 1.00 0.00 H new ATOM 540 N ASP A 36 -13.717 0.889 7.627 1.00 0.00 N ATOM 541 CA ASP A 36 -13.535 1.390 6.277 1.00 0.00 C ATOM 542 C ASP A 36 -12.346 2.321 6.195 1.00 0.00 C ATOM 543 O ASP A 36 -12.141 3.193 7.040 1.00 0.00 O ATOM 544 CB ASP A 36 -14.779 2.111 5.758 1.00 0.00 C ATOM 545 CG ASP A 36 -15.659 2.670 6.857 1.00 0.00 C ATOM 546 OD1 ASP A 36 -15.371 3.772 7.360 1.00 0.00 O ATOM 547 OD2 ASP A 36 -16.656 2.007 7.221 1.00 0.00 O ATOM 0 H ASP A 36 -14.243 1.511 8.241 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.355 0.519 5.647 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.470 2.925 5.102 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -15.364 1.419 5.153 1.00 0.00 H new ATOM 552 N ARG A 37 -11.550 2.082 5.179 1.00 0.00 N ATOM 553 CA ARG A 37 -10.421 2.933 4.851 1.00 0.00 C ATOM 554 C ARG A 37 -10.438 3.283 3.365 1.00 0.00 C ATOM 555 O ARG A 37 -10.592 2.402 2.516 1.00 0.00 O ATOM 556 CB ARG A 37 -9.076 2.292 5.244 1.00 0.00 C ATOM 557 CG ARG A 37 -9.073 0.768 5.335 1.00 0.00 C ATOM 558 CD ARG A 37 -9.498 0.275 6.715 1.00 0.00 C ATOM 559 NE ARG A 37 -9.346 -1.176 6.835 1.00 0.00 N ATOM 560 CZ ARG A 37 -9.606 -1.883 7.936 1.00 0.00 C ATOM 561 NH1 ARG A 37 -10.077 -1.297 9.033 1.00 0.00 N ATOM 562 NH2 ARG A 37 -9.397 -3.190 7.929 1.00 0.00 N ATOM 0 H ARG A 37 -11.665 1.287 4.550 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.520 3.849 5.434 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -8.323 2.596 4.517 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -8.769 2.696 6.209 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -9.746 0.359 4.581 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.075 0.394 5.108 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -8.899 0.769 7.480 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -10.537 0.550 6.897 1.00 0.00 H new ATOM 0 HE ARG A 37 -9.016 -1.685 6.015 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -10.245 -0.291 9.042 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -10.270 -1.854 9.866 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -9.041 -3.645 7.088 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -9.592 -3.742 8.764 1.00 0.00 H new ATOM 576 N TRP A 38 -10.285 4.563 3.058 1.00 0.00 N ATOM 577 CA TRP A 38 -10.279 5.029 1.675 1.00 0.00 C ATOM 578 C TRP A 38 -8.923 5.624 1.327 1.00 0.00 C ATOM 579 O TRP A 38 -8.488 6.597 1.947 1.00 0.00 O ATOM 580 CB TRP A 38 -11.386 6.066 1.445 1.00 0.00 C ATOM 581 CG TRP A 38 -12.752 5.547 1.769 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.524 4.730 0.994 1.00 0.00 C ATOM 583 CD2 TRP A 38 -13.506 5.810 2.953 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.708 4.458 1.633 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.722 5.109 2.837 1.00 0.00 C ATOM 586 CE3 TRP A 38 -13.270 6.564 4.106 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.696 5.141 3.826 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -14.241 6.595 5.087 1.00 0.00 C ATOM 589 CH2 TRP A 38 -15.441 5.885 4.943 1.00 0.00 C ATOM 0 H TRP A 38 -10.163 5.302 3.750 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.468 4.175 1.025 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -11.184 6.946 2.055 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.364 6.388 0.404 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.244 4.353 0.021 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.456 3.867 1.270 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -12.347 7.111 4.227 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.622 4.597 3.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -14.073 7.177 5.981 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -16.179 5.927 5.731 1.00 0.00 H new ATOM 600 N VAL A 39 -8.260 5.027 0.347 1.00 0.00 N ATOM 601 CA VAL A 39 -6.935 5.463 -0.072 1.00 0.00 C ATOM 602 C VAL A 39 -7.057 6.577 -1.104 1.00 0.00 C ATOM 603 O VAL A 39 -7.636 6.378 -2.175 1.00 0.00 O ATOM 604 CB VAL A 39 -6.135 4.295 -0.687 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.644 4.588 -0.663 1.00 0.00 C ATOM 606 CG2 VAL A 39 -6.431 2.995 0.043 1.00 0.00 C ATOM 0 H VAL A 39 -8.623 4.231 -0.178 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.407 5.826 0.810 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.446 4.186 -1.726 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.102 3.750 -1.102 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.442 5.492 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.318 4.732 0.367 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.856 2.186 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.154 3.096 1.092 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.495 2.770 -0.032 1.00 0.00 H new ATOM 616 N GLU A 40 -6.515 7.745 -0.789 1.00 0.00 N ATOM 617 CA GLU A 40 -6.644 8.897 -1.671 1.00 0.00 C ATOM 618 C GLU A 40 -5.373 9.141 -2.484 1.00 0.00 C ATOM 619 O GLU A 40 -5.435 9.592 -3.632 1.00 0.00 O ATOM 620 CB GLU A 40 -7.040 10.145 -0.865 1.00 0.00 C ATOM 621 CG GLU A 40 -6.348 10.281 0.488 1.00 0.00 C ATOM 622 CD GLU A 40 -4.867 10.591 0.384 1.00 0.00 C ATOM 623 OE1 GLU A 40 -4.521 11.689 -0.091 1.00 0.00 O ATOM 624 OE2 GLU A 40 -4.050 9.728 0.767 1.00 0.00 O ATOM 0 H GLU A 40 -5.985 7.920 0.065 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.437 8.681 -2.387 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.818 11.030 -1.461 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.118 10.130 -0.706 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.837 11.070 1.059 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.478 9.355 1.048 1.00 0.00 H new ATOM 631 N ARG A 41 -4.228 8.827 -1.903 1.00 0.00 N ATOM 632 CA ARG A 41 -2.956 9.044 -2.570 1.00 0.00 C ATOM 633 C ARG A 41 -1.987 7.915 -2.253 1.00 0.00 C ATOM 634 O ARG A 41 -1.949 7.410 -1.129 1.00 0.00 O ATOM 635 CB ARG A 41 -2.363 10.382 -2.127 1.00 0.00 C ATOM 636 CG ARG A 41 -1.038 10.733 -2.779 1.00 0.00 C ATOM 637 CD ARG A 41 -0.495 12.043 -2.236 1.00 0.00 C ATOM 638 NE ARG A 41 0.760 12.431 -2.877 1.00 0.00 N ATOM 639 CZ ARG A 41 1.519 13.442 -2.466 1.00 0.00 C ATOM 640 NH1 ARG A 41 1.181 14.125 -1.379 1.00 0.00 N ATOM 641 NH2 ARG A 41 2.624 13.757 -3.132 1.00 0.00 N ATOM 0 H ARG A 41 -4.153 8.421 -0.970 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.124 9.063 -3.647 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.081 11.173 -2.345 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.227 10.364 -1.046 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.318 9.935 -2.600 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.168 10.809 -3.859 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.235 12.830 -2.384 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.338 11.951 -1.161 1.00 0.00 H new ATOM 0 HE ARG A 41 1.072 11.895 -3.687 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.340 13.874 -0.860 1.00 0.00 H new ATOM 0 HH12 ARG A 41 1.763 14.901 -1.063 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.891 13.223 -3.959 1.00 0.00 H new ATOM 0 HH22 ARG A 41 3.206 14.533 -2.816 1.00 0.00 H new ATOM 655 N VAL A 42 -1.235 7.494 -3.255 1.00 0.00 N ATOM 656 CA VAL A 42 -0.173 6.532 -3.046 1.00 0.00 C ATOM 657 C VAL A 42 1.132 7.277 -2.794 1.00 0.00 C ATOM 658 O VAL A 42 1.427 8.265 -3.466 1.00 0.00 O ATOM 659 CB VAL A 42 -0.024 5.581 -4.254 1.00 0.00 C ATOM 660 CG1 VAL A 42 1.145 4.622 -4.060 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.318 4.809 -4.482 1.00 0.00 C ATOM 0 H VAL A 42 -1.342 7.805 -4.221 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.423 5.920 -2.179 1.00 0.00 H new ATOM 0 HB VAL A 42 0.184 6.185 -5.137 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.225 3.965 -4.926 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.068 5.191 -3.950 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.979 4.023 -3.165 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.198 4.143 -5.336 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.553 4.222 -3.594 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.130 5.509 -4.679 1.00 0.00 H new ATOM 671 N TYR A 43 1.890 6.826 -1.807 1.00 0.00 N ATOM 672 CA TYR A 43 3.135 7.480 -1.434 1.00 0.00 C ATOM 673 C TYR A 43 4.328 6.606 -1.804 1.00 0.00 C ATOM 674 O TYR A 43 4.782 5.779 -1.008 1.00 0.00 O ATOM 675 CB TYR A 43 3.138 7.816 0.063 1.00 0.00 C ATOM 676 CG TYR A 43 2.083 8.838 0.455 1.00 0.00 C ATOM 677 CD1 TYR A 43 0.740 8.488 0.523 1.00 0.00 C ATOM 678 CD2 TYR A 43 2.433 10.151 0.751 1.00 0.00 C ATOM 679 CE1 TYR A 43 -0.225 9.415 0.869 1.00 0.00 C ATOM 680 CE2 TYR A 43 1.472 11.084 1.101 1.00 0.00 C ATOM 681 CZ TYR A 43 0.145 10.712 1.155 1.00 0.00 C ATOM 682 OH TYR A 43 -0.816 11.638 1.498 1.00 0.00 O ATOM 0 H TYR A 43 1.663 6.005 -1.247 1.00 0.00 H new ATOM 0 HA TYR A 43 3.218 8.415 -1.988 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.977 6.901 0.633 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.121 8.195 0.341 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.445 7.473 0.301 1.00 0.00 H new ATOM 0 HD2 TYR A 43 3.471 10.447 0.707 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -1.264 9.125 0.915 1.00 0.00 H new ATOM 0 HE2 TYR A 43 1.760 12.099 1.331 1.00 0.00 H new ATOM 0 HH TYR A 43 -0.390 12.504 1.670 1.00 0.00 H new ATOM 692 N PRO A 44 4.812 6.740 -3.049 1.00 0.00 N ATOM 693 CA PRO A 44 5.903 5.922 -3.573 1.00 0.00 C ATOM 694 C PRO A 44 7.243 6.275 -2.944 1.00 0.00 C ATOM 695 O PRO A 44 7.767 7.374 -3.132 1.00 0.00 O ATOM 696 CB PRO A 44 5.920 6.238 -5.078 1.00 0.00 C ATOM 697 CG PRO A 44 4.684 7.033 -5.340 1.00 0.00 C ATOM 698 CD PRO A 44 4.351 7.712 -4.047 1.00 0.00 C ATOM 0 HA PRO A 44 5.750 4.865 -3.354 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.813 6.802 -5.349 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.929 5.323 -5.670 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.849 7.762 -6.133 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.867 6.389 -5.665 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.863 8.669 -3.948 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.283 7.911 -3.956 1.00 0.00 H new ATOM 706 N LEU A 45 7.785 5.340 -2.181 1.00 0.00 N ATOM 707 CA LEU A 45 9.095 5.515 -1.580 1.00 0.00 C ATOM 708 C LEU A 45 10.141 4.840 -2.453 1.00 0.00 C ATOM 709 O LEU A 45 9.806 3.977 -3.269 1.00 0.00 O ATOM 710 CB LEU A 45 9.125 4.911 -0.174 1.00 0.00 C ATOM 711 CG LEU A 45 7.985 5.346 0.751 1.00 0.00 C ATOM 712 CD1 LEU A 45 8.152 4.723 2.127 1.00 0.00 C ATOM 713 CD2 LEU A 45 7.912 6.864 0.855 1.00 0.00 C ATOM 0 H LEU A 45 7.336 4.450 -1.963 1.00 0.00 H new ATOM 0 HA LEU A 45 9.311 6.581 -1.503 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.104 3.825 -0.263 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.073 5.174 0.296 1.00 0.00 H new ATOM 0 HG LEU A 45 7.047 4.994 0.321 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.334 5.042 2.773 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.142 3.637 2.038 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.100 5.043 2.559 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.094 7.144 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.851 7.247 1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.739 7.289 -0.134 1.00 0.00 H new ATOM 725 N ASN A 46 11.394 5.237 -2.292 1.00 0.00 N ATOM 726 CA ASN A 46 12.488 4.618 -3.028 1.00 0.00 C ATOM 727 C ASN A 46 12.565 3.127 -2.702 1.00 0.00 C ATOM 728 O ASN A 46 12.208 2.706 -1.599 1.00 0.00 O ATOM 729 CB ASN A 46 13.818 5.299 -2.688 1.00 0.00 C ATOM 730 CG ASN A 46 14.984 4.744 -3.486 1.00 0.00 C ATOM 731 OD1 ASN A 46 14.831 4.334 -4.639 1.00 0.00 O ATOM 732 ND2 ASN A 46 16.157 4.720 -2.874 1.00 0.00 N ATOM 0 H ASN A 46 11.679 5.984 -1.659 1.00 0.00 H new ATOM 0 HA ASN A 46 12.298 4.739 -4.095 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.732 6.369 -2.876 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.021 5.178 -1.624 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.977 4.353 -3.357 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.241 5.069 -1.919 1.00 0.00 H new ATOM 739 N ASN A 47 13.016 2.332 -3.659 1.00 0.00 N ATOM 740 CA ASN A 47 13.094 0.893 -3.462 1.00 0.00 C ATOM 741 C ASN A 47 14.513 0.502 -3.067 1.00 0.00 C ATOM 742 O ASN A 47 15.416 0.467 -3.902 1.00 0.00 O ATOM 743 CB ASN A 47 12.651 0.139 -4.719 1.00 0.00 C ATOM 744 CG ASN A 47 12.163 -1.264 -4.399 1.00 0.00 C ATOM 745 OD1 ASN A 47 10.986 -1.460 -4.091 1.00 0.00 O ATOM 746 ND2 ASN A 47 13.051 -2.248 -4.460 1.00 0.00 N ATOM 0 H ASN A 47 13.332 2.655 -4.574 1.00 0.00 H new ATOM 0 HA ASN A 47 12.414 0.615 -2.656 1.00 0.00 H new ATOM 0 HB2 ASN A 47 11.855 0.696 -5.214 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.484 0.082 -5.420 1.00 0.00 H new ATOM 0 HD21 ASN A 47 12.768 -3.205 -4.248 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.017 -2.048 -4.719 1.00 0.00 H new ATOM 753 N LEU A 48 14.693 0.214 -1.784 1.00 0.00 N ATOM 754 CA LEU A 48 16.005 -0.026 -1.216 1.00 0.00 C ATOM 755 C LEU A 48 16.561 -1.388 -1.609 1.00 0.00 C ATOM 756 O LEU A 48 17.666 -1.474 -2.148 1.00 0.00 O ATOM 757 CB LEU A 48 15.948 0.078 0.311 1.00 0.00 C ATOM 758 CG LEU A 48 15.765 1.490 0.889 1.00 0.00 C ATOM 759 CD1 LEU A 48 16.854 2.429 0.394 1.00 0.00 C ATOM 760 CD2 LEU A 48 14.390 2.056 0.571 1.00 0.00 C ATOM 0 H LEU A 48 13.930 0.141 -1.111 1.00 0.00 H new ATOM 0 HA LEU A 48 16.672 0.738 -1.617 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.128 -0.546 0.666 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.868 -0.342 0.717 1.00 0.00 H new ATOM 0 HG LEU A 48 15.847 1.406 1.973 1.00 0.00 H new ATOM 0 HD11 LEU A 48 16.700 3.421 0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.829 2.050 0.702 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.815 2.490 -0.694 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.300 3.055 0.997 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.260 2.109 -0.510 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.623 1.410 0.998 1.00 0.00 H new ATOM 772 N ASP A 49 15.809 -2.450 -1.337 1.00 0.00 N ATOM 773 CA ASP A 49 16.328 -3.799 -1.539 1.00 0.00 C ATOM 774 C ASP A 49 15.966 -4.313 -2.918 1.00 0.00 C ATOM 775 O ASP A 49 14.789 -4.386 -3.279 1.00 0.00 O ATOM 776 CB ASP A 49 15.791 -4.776 -0.488 1.00 0.00 C ATOM 777 CG ASP A 49 16.743 -5.928 -0.230 1.00 0.00 C ATOM 778 OD1 ASP A 49 17.392 -6.403 -1.182 1.00 0.00 O ATOM 779 OD2 ASP A 49 16.841 -6.371 0.934 1.00 0.00 O ATOM 0 H ASP A 49 14.854 -2.406 -0.982 1.00 0.00 H new ATOM 0 HA ASP A 49 17.412 -3.739 -1.441 1.00 0.00 H new ATOM 0 HB2 ASP A 49 15.612 -4.240 0.444 1.00 0.00 H new ATOM 0 HB3 ASP A 49 14.830 -5.170 -0.819 1.00 0.00 H new ATOM 784 N GLN A 50 16.981 -4.681 -3.681 1.00 0.00 N ATOM 785 CA GLN A 50 16.774 -5.277 -4.990 1.00 0.00 C ATOM 786 C GLN A 50 16.575 -6.782 -4.838 1.00 0.00 C ATOM 787 O GLN A 50 17.338 -7.586 -5.379 1.00 0.00 O ATOM 788 CB GLN A 50 17.967 -4.984 -5.906 1.00 0.00 C ATOM 789 CG GLN A 50 18.267 -3.500 -6.061 1.00 0.00 C ATOM 790 CD GLN A 50 17.119 -2.723 -6.684 1.00 0.00 C ATOM 791 OE1 GLN A 50 16.366 -3.247 -7.503 1.00 0.00 O ATOM 792 NE2 GLN A 50 16.977 -1.466 -6.295 1.00 0.00 N ATOM 0 H GLN A 50 17.960 -4.577 -3.415 1.00 0.00 H new ATOM 0 HA GLN A 50 15.883 -4.843 -5.444 1.00 0.00 H new ATOM 0 HB2 GLN A 50 18.850 -5.485 -5.510 1.00 0.00 H new ATOM 0 HB3 GLN A 50 17.773 -5.411 -6.890 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.496 -3.077 -5.083 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.158 -3.378 -6.677 1.00 0.00 H new ATOM 0 HE21 GLN A 50 17.622 -1.067 -5.613 1.00 0.00 H new ATOM 0 HE22 GLN A 50 16.222 -0.896 -6.677 1.00 0.00 H new ATOM 801 N SER A 51 15.555 -7.149 -4.074 1.00 0.00 N ATOM 802 CA SER A 51 15.260 -8.544 -3.795 1.00 0.00 C ATOM 803 C SER A 51 13.794 -8.863 -4.095 1.00 0.00 C ATOM 804 O SER A 51 12.916 -8.030 -3.877 1.00 0.00 O ATOM 805 CB SER A 51 15.577 -8.849 -2.330 1.00 0.00 C ATOM 806 OG SER A 51 16.967 -8.756 -2.074 1.00 0.00 O ATOM 0 H SER A 51 14.913 -6.490 -3.633 1.00 0.00 H new ATOM 0 HA SER A 51 15.879 -9.168 -4.439 1.00 0.00 H new ATOM 0 HB2 SER A 51 15.039 -8.153 -1.687 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.225 -9.850 -2.080 1.00 0.00 H new ATOM 0 HG SER A 51 17.214 -7.816 -1.947 1.00 0.00 H new ATOM 812 N PRO A 52 13.511 -10.080 -4.596 1.00 0.00 N ATOM 813 CA PRO A 52 12.152 -10.525 -4.897 1.00 0.00 C ATOM 814 C PRO A 52 11.442 -11.102 -3.674 1.00 0.00 C ATOM 815 O PRO A 52 10.332 -11.629 -3.780 1.00 0.00 O ATOM 816 CB PRO A 52 12.352 -11.618 -5.960 1.00 0.00 C ATOM 817 CG PRO A 52 13.835 -11.817 -6.097 1.00 0.00 C ATOM 818 CD PRO A 52 14.485 -11.119 -4.934 1.00 0.00 C ATOM 0 HA PRO A 52 11.524 -9.698 -5.230 1.00 0.00 H new ATOM 0 HB2 PRO A 52 11.863 -12.545 -5.660 1.00 0.00 H new ATOM 0 HB3 PRO A 52 11.912 -11.319 -6.911 1.00 0.00 H new ATOM 0 HG2 PRO A 52 14.083 -12.878 -6.096 1.00 0.00 H new ATOM 0 HG3 PRO A 52 14.193 -11.407 -7.041 1.00 0.00 H new ATOM 0 HD2 PRO A 52 14.658 -11.798 -4.099 1.00 0.00 H new ATOM 0 HD3 PRO A 52 15.452 -10.695 -5.205 1.00 0.00 H new ATOM 826 N GLU A 53 12.101 -11.021 -2.523 1.00 0.00 N ATOM 827 CA GLU A 53 11.535 -11.514 -1.272 1.00 0.00 C ATOM 828 C GLU A 53 11.624 -10.448 -0.186 1.00 0.00 C ATOM 829 O GLU A 53 11.333 -10.710 0.981 1.00 0.00 O ATOM 830 CB GLU A 53 12.280 -12.769 -0.813 1.00 0.00 C ATOM 831 CG GLU A 53 12.277 -13.892 -1.834 1.00 0.00 C ATOM 832 CD GLU A 53 13.664 -14.424 -2.109 1.00 0.00 C ATOM 833 OE1 GLU A 53 14.351 -13.876 -2.995 1.00 0.00 O ATOM 834 OE2 GLU A 53 14.078 -15.397 -1.445 1.00 0.00 O ATOM 0 H GLU A 53 13.033 -10.616 -2.430 1.00 0.00 H new ATOM 0 HA GLU A 53 10.487 -11.758 -1.446 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.312 -12.504 -0.582 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.829 -13.130 0.111 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.644 -14.704 -1.475 1.00 0.00 H new ATOM 0 HG3 GLU A 53 11.838 -13.532 -2.764 1.00 0.00 H new ATOM 841 N HIS A 54 12.035 -9.249 -0.574 1.00 0.00 N ATOM 842 CA HIS A 54 12.234 -8.161 0.376 1.00 0.00 C ATOM 843 C HIS A 54 11.538 -6.908 -0.116 1.00 0.00 C ATOM 844 O HIS A 54 11.423 -6.688 -1.319 1.00 0.00 O ATOM 845 CB HIS A 54 13.722 -7.851 0.575 1.00 0.00 C ATOM 846 CG HIS A 54 14.479 -8.834 1.421 1.00 0.00 C ATOM 847 ND1 HIS A 54 15.755 -8.592 1.871 1.00 0.00 N ATOM 848 CD2 HIS A 54 14.140 -10.052 1.908 1.00 0.00 C ATOM 849 CE1 HIS A 54 16.168 -9.614 2.596 1.00 0.00 C ATOM 850 NE2 HIS A 54 15.206 -10.514 2.638 1.00 0.00 N ATOM 0 H HIS A 54 12.238 -9.004 -1.543 1.00 0.00 H new ATOM 0 HA HIS A 54 11.812 -8.480 1.329 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.198 -7.798 -0.404 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.812 -6.863 1.027 1.00 0.00 H new ATOM 0 HD1 HIS A 54 16.299 -7.752 1.675 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.203 -10.565 1.751 1.00 0.00 H new ATOM 0 HE1 HIS A 54 17.132 -9.699 3.075 1.00 0.00 H new ATOM 0 HE2 HIS A 54 15.247 -11.406 3.131 1.00 0.00 H new ATOM 859 N PHE A 55 11.099 -6.083 0.814 1.00 0.00 N ATOM 860 CA PHE A 55 10.438 -4.838 0.468 1.00 0.00 C ATOM 861 C PHE A 55 11.165 -3.664 1.108 1.00 0.00 C ATOM 862 O PHE A 55 11.874 -3.825 2.102 1.00 0.00 O ATOM 863 CB PHE A 55 8.960 -4.863 0.887 1.00 0.00 C ATOM 864 CG PHE A 55 8.730 -5.021 2.368 1.00 0.00 C ATOM 865 CD1 PHE A 55 8.703 -6.278 2.950 1.00 0.00 C ATOM 866 CD2 PHE A 55 8.531 -3.909 3.173 1.00 0.00 C ATOM 867 CE1 PHE A 55 8.485 -6.423 4.306 1.00 0.00 C ATOM 868 CE2 PHE A 55 8.314 -4.049 4.531 1.00 0.00 C ATOM 869 CZ PHE A 55 8.291 -5.307 5.097 1.00 0.00 C ATOM 0 H PHE A 55 11.188 -6.252 1.816 1.00 0.00 H new ATOM 0 HA PHE A 55 10.472 -4.719 -0.615 1.00 0.00 H new ATOM 0 HB2 PHE A 55 8.486 -3.939 0.556 1.00 0.00 H new ATOM 0 HB3 PHE A 55 8.462 -5.681 0.366 1.00 0.00 H new ATOM 0 HD1 PHE A 55 8.854 -7.154 2.337 1.00 0.00 H new ATOM 0 HD2 PHE A 55 8.546 -2.922 2.734 1.00 0.00 H new ATOM 0 HE1 PHE A 55 8.466 -7.408 4.748 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.163 -3.175 5.148 1.00 0.00 H new ATOM 0 HZ PHE A 55 8.121 -5.419 6.158 1.00 0.00 H new ATOM 879 N SER A 56 10.991 -2.491 0.529 1.00 0.00 N ATOM 880 CA SER A 56 11.716 -1.312 0.953 1.00 0.00 C ATOM 881 C SER A 56 10.962 -0.528 2.019 1.00 0.00 C ATOM 882 O SER A 56 9.769 -0.268 1.889 1.00 0.00 O ATOM 883 CB SER A 56 11.957 -0.433 -0.256 1.00 0.00 C ATOM 884 OG SER A 56 12.467 -1.208 -1.322 1.00 0.00 O ATOM 0 H SER A 56 10.346 -2.331 -0.245 1.00 0.00 H new ATOM 0 HA SER A 56 12.661 -1.629 1.395 1.00 0.00 H new ATOM 0 HB2 SER A 56 11.027 0.048 -0.558 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.660 0.361 -0.004 1.00 0.00 H new ATOM 0 HG SER A 56 11.731 -1.682 -1.763 1.00 0.00 H new ATOM 890 N MET A 57 11.675 -0.163 3.069 1.00 0.00 N ATOM 891 CA MET A 57 11.122 0.649 4.132 1.00 0.00 C ATOM 892 C MET A 57 12.233 1.455 4.796 1.00 0.00 C ATOM 893 O MET A 57 12.957 0.943 5.651 1.00 0.00 O ATOM 894 CB MET A 57 10.434 -0.250 5.156 1.00 0.00 C ATOM 895 CG MET A 57 9.581 0.504 6.151 1.00 0.00 C ATOM 896 SD MET A 57 8.187 1.349 5.372 1.00 0.00 S ATOM 897 CE MET A 57 7.348 -0.021 4.576 1.00 0.00 C ATOM 0 H MET A 57 12.652 -0.422 3.207 1.00 0.00 H new ATOM 0 HA MET A 57 10.388 1.340 3.718 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.810 -0.973 4.631 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.192 -0.816 5.697 1.00 0.00 H new ATOM 0 HG2 MET A 57 9.206 -0.191 6.902 1.00 0.00 H new ATOM 0 HG3 MET A 57 10.199 1.235 6.673 1.00 0.00 H new ATOM 0 HE1 MET A 57 6.275 0.171 4.557 1.00 0.00 H new ATOM 0 HE2 MET A 57 7.715 -0.129 3.555 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.543 -0.939 5.131 1.00 0.00 H new ATOM 907 N ASP A 58 12.399 2.702 4.374 1.00 0.00 N ATOM 908 CA ASP A 58 13.448 3.559 4.922 1.00 0.00 C ATOM 909 C ASP A 58 12.844 4.621 5.835 1.00 0.00 C ATOM 910 O ASP A 58 11.795 5.181 5.522 1.00 0.00 O ATOM 911 CB ASP A 58 14.227 4.222 3.780 1.00 0.00 C ATOM 912 CG ASP A 58 15.212 5.274 4.259 1.00 0.00 C ATOM 913 OD1 ASP A 58 16.369 4.920 4.570 1.00 0.00 O ATOM 914 OD2 ASP A 58 14.828 6.461 4.323 1.00 0.00 O ATOM 0 H ASP A 58 11.824 3.143 3.656 1.00 0.00 H new ATOM 0 HA ASP A 58 14.132 2.947 5.510 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.766 3.455 3.224 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.522 4.682 3.087 1.00 0.00 H new ATOM 919 N PRO A 59 13.516 4.931 6.961 1.00 0.00 N ATOM 920 CA PRO A 59 13.016 5.895 7.952 1.00 0.00 C ATOM 921 C PRO A 59 12.790 7.296 7.381 1.00 0.00 C ATOM 922 O PRO A 59 11.788 7.941 7.694 1.00 0.00 O ATOM 923 CB PRO A 59 14.113 5.924 9.025 1.00 0.00 C ATOM 924 CG PRO A 59 15.314 5.319 8.384 1.00 0.00 C ATOM 925 CD PRO A 59 14.796 4.334 7.380 1.00 0.00 C ATOM 0 HA PRO A 59 12.038 5.594 8.327 1.00 0.00 H new ATOM 0 HB2 PRO A 59 14.315 6.944 9.352 1.00 0.00 H new ATOM 0 HB3 PRO A 59 13.813 5.359 9.908 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.925 6.082 7.902 1.00 0.00 H new ATOM 0 HG3 PRO A 59 15.945 4.826 9.124 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.481 4.216 6.540 1.00 0.00 H new ATOM 0 HD3 PRO A 59 14.656 3.346 7.819 1.00 0.00 H new ATOM 933 N ARG A 60 13.706 7.765 6.537 1.00 0.00 N ATOM 934 CA ARG A 60 13.585 9.102 5.961 1.00 0.00 C ATOM 935 C ARG A 60 12.461 9.142 4.936 1.00 0.00 C ATOM 936 O ARG A 60 11.704 10.113 4.867 1.00 0.00 O ATOM 937 CB ARG A 60 14.901 9.568 5.324 1.00 0.00 C ATOM 938 CG ARG A 60 15.849 10.245 6.305 1.00 0.00 C ATOM 939 CD ARG A 60 16.481 9.259 7.273 1.00 0.00 C ATOM 940 NE ARG A 60 17.646 8.588 6.700 1.00 0.00 N ATOM 941 CZ ARG A 60 18.348 7.645 7.327 1.00 0.00 C ATOM 942 NH1 ARG A 60 17.991 7.249 8.543 1.00 0.00 N ATOM 943 NH2 ARG A 60 19.414 7.111 6.742 1.00 0.00 N ATOM 0 H ARG A 60 14.532 7.246 6.239 1.00 0.00 H new ATOM 0 HA ARG A 60 13.349 9.788 6.775 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.404 8.709 4.880 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.677 10.260 4.512 1.00 0.00 H new ATOM 0 HG2 ARG A 60 16.634 10.760 5.751 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.305 11.004 6.867 1.00 0.00 H new ATOM 0 HD2 ARG A 60 16.777 9.784 8.181 1.00 0.00 H new ATOM 0 HD3 ARG A 60 15.741 8.513 7.563 1.00 0.00 H new ATOM 0 HE ARG A 60 17.940 8.858 5.761 1.00 0.00 H new ATOM 0 HH11 ARG A 60 17.179 7.667 8.998 1.00 0.00 H new ATOM 0 HH12 ARG A 60 18.529 6.527 9.023 1.00 0.00 H new ATOM 0 HH21 ARG A 60 19.695 7.423 5.813 1.00 0.00 H new ATOM 0 HH22 ARG A 60 19.951 6.389 7.222 1.00 0.00 H new ATOM 957 N GLU A 61 12.348 8.080 4.150 1.00 0.00 N ATOM 958 CA GLU A 61 11.252 7.955 3.195 1.00 0.00 C ATOM 959 C GLU A 61 9.910 7.925 3.928 1.00 0.00 C ATOM 960 O GLU A 61 8.957 8.599 3.530 1.00 0.00 O ATOM 961 CB GLU A 61 11.421 6.693 2.345 1.00 0.00 C ATOM 962 CG GLU A 61 12.591 6.756 1.374 1.00 0.00 C ATOM 963 CD GLU A 61 12.404 7.798 0.289 1.00 0.00 C ATOM 964 OE1 GLU A 61 11.795 7.476 -0.755 1.00 0.00 O ATOM 965 OE2 GLU A 61 12.886 8.939 0.459 1.00 0.00 O ATOM 0 H GLU A 61 12.999 7.294 4.153 1.00 0.00 H new ATOM 0 HA GLU A 61 11.270 8.821 2.534 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.556 5.837 3.006 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.504 6.520 1.782 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.504 6.975 1.927 1.00 0.00 H new ATOM 0 HG3 GLU A 61 12.726 5.778 0.912 1.00 0.00 H new ATOM 972 N GLN A 62 9.854 7.156 5.013 1.00 0.00 N ATOM 973 CA GLN A 62 8.642 7.058 5.825 1.00 0.00 C ATOM 974 C GLN A 62 8.257 8.419 6.394 1.00 0.00 C ATOM 975 O GLN A 62 7.111 8.853 6.268 1.00 0.00 O ATOM 976 CB GLN A 62 8.838 6.078 6.983 1.00 0.00 C ATOM 977 CG GLN A 62 9.030 4.636 6.555 1.00 0.00 C ATOM 978 CD GLN A 62 9.317 3.726 7.731 1.00 0.00 C ATOM 979 OE1 GLN A 62 10.471 3.514 8.102 1.00 0.00 O ATOM 980 NE2 GLN A 62 8.269 3.181 8.327 1.00 0.00 N ATOM 0 H GLN A 62 10.633 6.591 5.351 1.00 0.00 H new ATOM 0 HA GLN A 62 7.845 6.697 5.175 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.705 6.390 7.565 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.973 6.137 7.643 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.135 4.289 6.039 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.852 4.576 5.842 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.328 3.382 7.989 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.402 2.560 9.125 1.00 0.00 H new ATOM 989 N LEU A 63 9.226 9.092 7.005 1.00 0.00 N ATOM 990 CA LEU A 63 8.981 10.373 7.657 1.00 0.00 C ATOM 991 C LEU A 63 8.465 11.404 6.662 1.00 0.00 C ATOM 992 O LEU A 63 7.514 12.132 6.946 1.00 0.00 O ATOM 993 CB LEU A 63 10.263 10.882 8.326 1.00 0.00 C ATOM 994 CG LEU A 63 10.115 12.191 9.107 1.00 0.00 C ATOM 995 CD1 LEU A 63 9.116 12.027 10.245 1.00 0.00 C ATOM 996 CD2 LEU A 63 11.464 12.647 9.642 1.00 0.00 C ATOM 0 H LEU A 63 10.192 8.770 7.062 1.00 0.00 H new ATOM 0 HA LEU A 63 8.217 10.223 8.420 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.630 10.112 9.005 1.00 0.00 H new ATOM 0 HB3 LEU A 63 11.024 11.020 7.558 1.00 0.00 H new ATOM 0 HG LEU A 63 9.737 12.955 8.428 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.025 12.968 10.788 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.144 11.747 9.838 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.463 11.248 10.924 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.340 13.579 10.194 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.870 11.883 10.305 1.00 0.00 H new ATOM 0 HD23 LEU A 63 12.150 12.807 8.810 1.00 0.00 H new ATOM 1008 N THR A 64 9.081 11.444 5.490 1.00 0.00 N ATOM 1009 CA THR A 64 8.698 12.394 4.455 1.00 0.00 C ATOM 1010 C THR A 64 7.263 12.141 3.972 1.00 0.00 C ATOM 1011 O THR A 64 6.509 13.082 3.710 1.00 0.00 O ATOM 1012 CB THR A 64 9.677 12.321 3.266 1.00 0.00 C ATOM 1013 OG1 THR A 64 11.026 12.485 3.739 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.369 13.394 2.231 1.00 0.00 C ATOM 0 H THR A 64 9.851 10.827 5.231 1.00 0.00 H new ATOM 0 HA THR A 64 8.741 13.393 4.888 1.00 0.00 H new ATOM 0 HB THR A 64 9.564 11.345 2.793 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.350 11.635 4.104 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.076 13.317 1.405 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.355 13.256 1.855 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.455 14.378 2.691 1.00 0.00 H new ATOM 1022 N ALA A 65 6.880 10.871 3.888 1.00 0.00 N ATOM 1023 CA ALA A 65 5.544 10.506 3.432 1.00 0.00 C ATOM 1024 C ALA A 65 4.493 10.835 4.488 1.00 0.00 C ATOM 1025 O ALA A 65 3.448 11.402 4.176 1.00 0.00 O ATOM 1026 CB ALA A 65 5.489 9.030 3.071 1.00 0.00 C ATOM 0 H ALA A 65 7.475 10.079 4.129 1.00 0.00 H new ATOM 0 HA ALA A 65 5.322 11.092 2.540 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.485 8.775 2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.203 8.823 2.274 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.740 8.432 3.947 1.00 0.00 H new ATOM 1032 N VAL A 66 4.779 10.485 5.739 1.00 0.00 N ATOM 1033 CA VAL A 66 3.858 10.758 6.844 1.00 0.00 C ATOM 1034 C VAL A 66 3.708 12.263 7.065 1.00 0.00 C ATOM 1035 O VAL A 66 2.630 12.749 7.409 1.00 0.00 O ATOM 1036 CB VAL A 66 4.334 10.087 8.153 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.394 10.408 9.311 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.443 8.583 7.969 1.00 0.00 C ATOM 0 H VAL A 66 5.640 10.012 6.015 1.00 0.00 H new ATOM 0 HA VAL A 66 2.890 10.338 6.571 1.00 0.00 H new ATOM 0 HB VAL A 66 5.319 10.486 8.394 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.755 9.922 10.218 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.362 11.487 9.465 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.393 10.045 9.078 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.779 8.126 8.900 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.468 8.178 7.697 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.160 8.364 7.178 1.00 0.00 H new ATOM 1048 N LYS A 67 4.795 12.990 6.846 1.00 0.00 N ATOM 1049 CA LYS A 67 4.807 14.438 7.003 1.00 0.00 C ATOM 1050 C LYS A 67 3.779 15.099 6.090 1.00 0.00 C ATOM 1051 O LYS A 67 3.026 15.978 6.513 1.00 0.00 O ATOM 1052 CB LYS A 67 6.205 14.970 6.688 1.00 0.00 C ATOM 1053 CG LYS A 67 6.375 16.464 6.904 1.00 0.00 C ATOM 1054 CD LYS A 67 7.777 16.909 6.520 1.00 0.00 C ATOM 1055 CE LYS A 67 7.977 18.399 6.733 1.00 0.00 C ATOM 1056 NZ LYS A 67 9.347 18.825 6.344 1.00 0.00 N ATOM 0 H LYS A 67 5.690 12.595 6.556 1.00 0.00 H new ATOM 0 HA LYS A 67 4.544 14.678 8.033 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.929 14.442 7.308 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.443 14.736 5.650 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.641 17.008 6.310 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.184 16.709 7.949 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.508 16.357 7.111 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.962 16.664 5.474 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.243 18.953 6.148 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.802 18.645 7.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.450 19.848 6.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.046 18.313 6.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.504 18.612 5.338 1.00 0.00 H new ATOM 1070 N ASP A 68 3.751 14.670 4.837 1.00 0.00 N ATOM 1071 CA ASP A 68 2.793 15.198 3.871 1.00 0.00 C ATOM 1072 C ASP A 68 1.390 14.709 4.221 1.00 0.00 C ATOM 1073 O ASP A 68 0.423 15.473 4.216 1.00 0.00 O ATOM 1074 CB ASP A 68 3.174 14.740 2.457 1.00 0.00 C ATOM 1075 CG ASP A 68 2.463 15.520 1.362 1.00 0.00 C ATOM 1076 OD1 ASP A 68 1.258 15.300 1.147 1.00 0.00 O ATOM 1077 OD2 ASP A 68 3.128 16.341 0.687 1.00 0.00 O ATOM 0 H ASP A 68 4.379 13.958 4.463 1.00 0.00 H new ATOM 0 HA ASP A 68 2.809 16.287 3.905 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.251 14.843 2.327 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.940 13.681 2.350 1.00 0.00 H new ATOM 1082 N MET A 69 1.317 13.435 4.577 1.00 0.00 N ATOM 1083 CA MET A 69 0.057 12.759 4.869 1.00 0.00 C ATOM 1084 C MET A 69 -0.690 13.428 6.021 1.00 0.00 C ATOM 1085 O MET A 69 -1.884 13.716 5.917 1.00 0.00 O ATOM 1086 CB MET A 69 0.358 11.313 5.236 1.00 0.00 C ATOM 1087 CG MET A 69 -0.805 10.360 5.041 1.00 0.00 C ATOM 1088 SD MET A 69 -0.347 8.657 5.418 1.00 0.00 S ATOM 1089 CE MET A 69 1.062 8.432 4.334 1.00 0.00 C ATOM 0 H MET A 69 2.136 12.835 4.673 1.00 0.00 H new ATOM 0 HA MET A 69 -0.579 12.813 3.985 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.200 10.967 4.636 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.672 11.274 6.279 1.00 0.00 H new ATOM 0 HG2 MET A 69 -1.634 10.663 5.680 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.157 10.422 4.011 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.088 7.401 3.980 1.00 0.00 H new ATOM 0 HE2 MET A 69 0.977 9.106 3.482 1.00 0.00 H new ATOM 0 HE3 MET A 69 1.980 8.651 4.880 1.00 0.00 H new ATOM 1099 N ARG A 70 0.027 13.688 7.112 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.592 14.249 8.313 1.00 0.00 C ATOM 1101 C ARG A 70 -1.059 15.683 8.063 1.00 0.00 C ATOM 1102 O ARG A 70 -1.995 16.167 8.705 1.00 0.00 O ATOM 1103 CB ARG A 70 0.378 14.212 9.501 1.00 0.00 C ATOM 1104 CG ARG A 70 1.475 15.260 9.422 1.00 0.00 C ATOM 1105 CD ARG A 70 2.287 15.327 10.702 1.00 0.00 C ATOM 1106 NE ARG A 70 3.055 16.566 10.786 1.00 0.00 N ATOM 1107 CZ ARG A 70 3.708 16.967 11.873 1.00 0.00 C ATOM 1108 NH1 ARG A 70 3.762 16.183 12.945 1.00 0.00 N ATOM 1109 NH2 ARG A 70 4.315 18.147 11.887 1.00 0.00 N ATOM 0 H ARG A 70 1.030 13.521 7.191 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.459 13.635 8.556 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -0.185 14.356 10.423 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.834 13.224 9.556 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.135 15.032 8.585 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.031 16.235 9.222 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.620 15.252 11.561 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.964 14.474 10.749 1.00 0.00 H new ATOM 0 HE ARG A 70 3.093 17.162 9.959 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.302 15.273 12.935 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.263 16.492 13.778 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.281 18.748 11.063 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.815 18.453 12.721 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.404 16.355 7.124 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.765 17.718 6.757 1.00 0.00 C ATOM 1125 C LYS A 71 -2.126 17.733 6.079 1.00 0.00 C ATOM 1126 O LYS A 71 -2.951 18.619 6.310 1.00 0.00 O ATOM 1127 CB LYS A 71 0.279 18.298 5.806 1.00 0.00 C ATOM 1128 CG LYS A 71 -0.025 19.715 5.356 1.00 0.00 C ATOM 1129 CD LYS A 71 0.697 20.056 4.064 1.00 0.00 C ATOM 1130 CE LYS A 71 0.284 19.121 2.938 1.00 0.00 C ATOM 1131 NZ LYS A 71 0.837 19.548 1.630 1.00 0.00 N ATOM 0 H LYS A 71 0.385 15.975 6.600 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.806 18.323 7.663 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.252 18.283 6.297 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.354 17.656 4.928 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -1.100 19.830 5.215 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.271 20.417 6.136 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.478 21.086 3.783 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.774 19.990 4.218 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.624 18.110 3.163 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -0.804 19.085 2.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.532 18.884 0.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.492 20.502 1.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.876 19.558 1.679 1.00 0.00 H new ATOM 1145 N ASN A 72 -2.351 16.725 5.252 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.588 16.608 4.489 1.00 0.00 C ATOM 1147 C ASN A 72 -4.740 16.174 5.389 1.00 0.00 C ATOM 1148 O ASN A 72 -5.911 16.250 5.007 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.402 15.610 3.345 1.00 0.00 C ATOM 1150 CG ASN A 72 -2.292 16.022 2.396 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -2.066 17.211 2.163 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -1.582 15.047 1.848 1.00 0.00 N ATOM 0 H ASN A 72 -1.687 15.968 5.090 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.833 17.585 4.072 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -3.178 14.626 3.757 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -4.336 15.518 2.790 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -0.819 15.269 1.209 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -1.799 14.074 2.065 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.401 15.731 6.592 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.409 15.340 7.556 1.00 0.00 C ATOM 1161 C GLY A 73 -5.740 13.869 7.473 1.00 0.00 C ATOM 1162 O GLY A 73 -6.754 13.420 8.008 1.00 0.00 O ATOM 0 H GLY A 73 -3.439 15.635 6.919 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.058 15.575 8.561 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.314 15.924 7.389 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.892 13.111 6.803 1.00 0.00 N ATOM 1167 CA TRP A 74 -5.110 11.684 6.654 1.00 0.00 C ATOM 1168 C TRP A 74 -4.074 10.894 7.437 1.00 0.00 C ATOM 1169 O TRP A 74 -3.137 11.463 7.997 1.00 0.00 O ATOM 1170 CB TRP A 74 -5.094 11.290 5.181 1.00 0.00 C ATOM 1171 CG TRP A 74 -6.357 11.657 4.464 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -7.618 11.240 4.774 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -6.483 12.497 3.313 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -8.521 11.763 3.882 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -7.849 12.541 2.976 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -5.578 13.221 2.537 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -8.326 13.269 1.890 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -6.051 13.946 1.459 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -7.415 13.969 1.146 1.00 0.00 C ATOM 0 H TRP A 74 -4.046 13.460 6.353 1.00 0.00 H new ATOM 0 HA TRP A 74 -6.093 11.445 7.060 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -4.250 11.774 4.690 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.936 10.215 5.100 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -7.870 10.593 5.601 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -9.528 11.599 3.892 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -4.524 13.215 2.774 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -9.377 13.281 1.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -5.357 14.504 0.848 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -7.755 14.550 0.302 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.250 9.583 7.472 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.393 8.714 8.264 1.00 0.00 C ATOM 1192 C VAL A 75 -2.806 7.610 7.399 1.00 0.00 C ATOM 1193 O VAL A 75 -3.226 7.412 6.256 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.159 8.079 9.445 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.586 9.145 10.443 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.368 7.300 8.945 1.00 0.00 C ATOM 0 H VAL A 75 -4.983 9.094 6.958 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.591 9.334 8.664 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.489 7.384 9.951 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.124 8.677 11.267 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.704 9.656 10.829 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.236 9.867 9.949 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.894 6.861 9.793 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.039 7.973 8.411 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.038 6.508 8.273 1.00 0.00 H new ATOM 1206 N MET A 76 -1.839 6.891 7.947 1.00 0.00 N ATOM 1207 CA MET A 76 -1.195 5.815 7.217 1.00 0.00 C ATOM 1208 C MET A 76 -2.018 4.541 7.348 1.00 0.00 C ATOM 1209 O MET A 76 -2.167 3.988 8.443 1.00 0.00 O ATOM 1210 CB MET A 76 0.237 5.609 7.725 1.00 0.00 C ATOM 1211 CG MET A 76 1.023 4.539 6.974 1.00 0.00 C ATOM 1212 SD MET A 76 0.833 2.891 7.684 1.00 0.00 S ATOM 1213 CE MET A 76 1.499 3.157 9.325 1.00 0.00 C ATOM 0 H MET A 76 -1.485 7.034 8.893 1.00 0.00 H new ATOM 0 HA MET A 76 -1.137 6.078 6.161 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.774 6.555 7.654 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.200 5.342 8.781 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.697 4.520 5.934 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.079 4.807 6.972 1.00 0.00 H new ATOM 0 HE1 MET A 76 2.154 2.327 9.591 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.067 4.087 9.341 1.00 0.00 H new ATOM 0 HE3 MET A 76 0.682 3.219 10.044 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.578 4.099 6.233 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.440 2.927 6.218 1.00 0.00 C ATOM 1225 C LEU A 77 -2.612 1.651 6.214 1.00 0.00 C ATOM 1226 O LEU A 77 -3.022 0.626 6.766 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.359 2.961 4.996 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.264 4.194 4.897 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -6.157 4.102 3.671 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -6.103 4.345 6.156 1.00 0.00 C ATOM 0 H LEU A 77 -2.450 4.537 5.321 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.051 2.940 7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.745 2.907 4.097 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.986 2.069 5.007 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.631 5.076 4.798 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.793 4.986 3.617 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.540 4.044 2.775 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.780 3.211 3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.739 5.226 6.066 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.726 3.460 6.287 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.447 4.457 7.019 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.441 1.726 5.611 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.578 0.576 5.515 1.00 0.00 C ATOM 1244 C GLY A 78 0.470 0.761 4.444 1.00 0.00 C ATOM 1245 O GLY A 78 0.948 1.878 4.222 1.00 0.00 O ATOM 0 H GLY A 78 -1.070 2.574 5.182 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.092 0.403 6.475 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.173 -0.310 5.294 1.00 0.00 H new ATOM 1249 N ASN A 79 0.806 -0.316 3.759 1.00 0.00 N ATOM 1250 CA ASN A 79 1.821 -0.272 2.722 1.00 0.00 C ATOM 1251 C ASN A 79 1.447 -1.201 1.582 1.00 0.00 C ATOM 1252 O ASN A 79 0.434 -1.899 1.642 1.00 0.00 O ATOM 1253 CB ASN A 79 3.203 -0.648 3.285 1.00 0.00 C ATOM 1254 CG ASN A 79 3.274 -2.054 3.873 1.00 0.00 C ATOM 1255 OD1 ASN A 79 2.615 -2.983 3.409 1.00 0.00 O ATOM 1256 ND2 ASN A 79 4.085 -2.219 4.907 1.00 0.00 N ATOM 0 H ASN A 79 0.389 -1.236 3.903 1.00 0.00 H new ATOM 0 HA ASN A 79 1.876 0.749 2.343 1.00 0.00 H new ATOM 0 HB2 ASN A 79 3.944 -0.560 2.490 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.477 0.071 4.057 1.00 0.00 H new ATOM 0 HD21 ASN A 79 4.177 -3.137 5.342 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.618 -1.428 5.268 1.00 0.00 H new ATOM 1263 N PHE A 80 2.265 -1.210 0.551 1.00 0.00 N ATOM 1264 CA PHE A 80 2.040 -2.091 -0.575 1.00 0.00 C ATOM 1265 C PHE A 80 3.363 -2.643 -1.071 1.00 0.00 C ATOM 1266 O PHE A 80 4.407 -2.007 -0.916 1.00 0.00 O ATOM 1267 CB PHE A 80 1.304 -1.363 -1.709 1.00 0.00 C ATOM 1268 CG PHE A 80 2.109 -0.281 -2.383 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.230 0.975 -1.809 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.738 -0.521 -3.595 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.964 1.969 -2.431 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.473 0.468 -4.221 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.586 1.716 -3.638 1.00 0.00 C ATOM 0 H PHE A 80 3.091 -0.618 0.469 1.00 0.00 H new ATOM 0 HA PHE A 80 1.410 -2.917 -0.245 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.003 -2.095 -2.459 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.391 -0.923 -1.309 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.746 1.180 -0.866 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.652 -1.494 -4.056 1.00 0.00 H new ATOM 0 HE1 PHE A 80 3.051 2.943 -1.973 1.00 0.00 H new ATOM 0 HE2 PHE A 80 3.958 0.266 -5.164 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.159 2.491 -4.125 1.00 0.00 H new ATOM 1283 N HIS A 81 3.318 -3.845 -1.619 1.00 0.00 N ATOM 1284 CA HIS A 81 4.469 -4.442 -2.278 1.00 0.00 C ATOM 1285 C HIS A 81 3.998 -5.519 -3.240 1.00 0.00 C ATOM 1286 O HIS A 81 3.146 -6.340 -2.901 1.00 0.00 O ATOM 1287 CB HIS A 81 5.505 -4.988 -1.272 1.00 0.00 C ATOM 1288 CG HIS A 81 4.978 -5.945 -0.237 1.00 0.00 C ATOM 1289 ND1 HIS A 81 5.253 -7.293 -0.251 1.00 0.00 N ATOM 1290 CD2 HIS A 81 4.242 -5.729 0.880 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.709 -7.861 0.805 1.00 0.00 C ATOM 1292 NE2 HIS A 81 4.092 -6.938 1.517 1.00 0.00 N ATOM 0 H HIS A 81 2.485 -4.434 -1.620 1.00 0.00 H new ATOM 0 HA HIS A 81 4.983 -3.663 -2.841 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.296 -5.488 -1.831 1.00 0.00 H new ATOM 0 HB3 HIS A 81 5.963 -4.143 -0.757 1.00 0.00 H new ATOM 0 HD1 HIS A 81 5.794 -7.777 -0.968 1.00 0.00 H new ATOM 0 HD2 HIS A 81 3.846 -4.780 1.210 1.00 0.00 H new ATOM 0 HE1 HIS A 81 4.760 -8.912 1.049 1.00 0.00 H new ATOM 1301 N SER A 82 4.547 -5.510 -4.441 1.00 0.00 N ATOM 1302 CA SER A 82 4.055 -6.364 -5.504 1.00 0.00 C ATOM 1303 C SER A 82 5.077 -7.431 -5.873 1.00 0.00 C ATOM 1304 O SER A 82 6.276 -7.252 -5.682 1.00 0.00 O ATOM 1305 CB SER A 82 3.716 -5.507 -6.725 1.00 0.00 C ATOM 1306 OG SER A 82 4.786 -4.632 -7.040 1.00 0.00 O ATOM 0 H SER A 82 5.336 -4.919 -4.704 1.00 0.00 H new ATOM 0 HA SER A 82 3.158 -6.874 -5.155 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.504 -6.151 -7.579 1.00 0.00 H new ATOM 0 HB3 SER A 82 2.813 -4.929 -6.529 1.00 0.00 H new ATOM 0 HG SER A 82 4.445 -3.718 -7.132 1.00 0.00 H new ATOM 1312 N HIS A 83 4.589 -8.545 -6.392 1.00 0.00 N ATOM 1313 CA HIS A 83 5.447 -9.668 -6.733 1.00 0.00 C ATOM 1314 C HIS A 83 5.678 -9.735 -8.238 1.00 0.00 C ATOM 1315 O HIS A 83 4.775 -9.450 -9.020 1.00 0.00 O ATOM 1316 CB HIS A 83 4.832 -10.972 -6.223 1.00 0.00 C ATOM 1317 CG HIS A 83 5.019 -11.176 -4.748 1.00 0.00 C ATOM 1318 ND1 HIS A 83 5.132 -12.417 -4.164 1.00 0.00 N ATOM 1319 CD2 HIS A 83 5.138 -10.280 -3.747 1.00 0.00 C ATOM 1320 CE1 HIS A 83 5.315 -12.272 -2.864 1.00 0.00 C ATOM 1321 NE2 HIS A 83 5.326 -10.980 -2.582 1.00 0.00 N ATOM 0 H HIS A 83 3.599 -8.696 -6.587 1.00 0.00 H new ATOM 0 HA HIS A 83 6.414 -9.525 -6.251 1.00 0.00 H new ATOM 0 HB2 HIS A 83 3.766 -10.978 -6.452 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.277 -11.810 -6.759 1.00 0.00 H new ATOM 0 HD2 HIS A 83 5.093 -9.205 -3.845 1.00 0.00 H new ATOM 0 HE1 HIS A 83 5.435 -13.074 -2.151 1.00 0.00 H new ATOM 0 HE2 HIS A 83 5.453 -10.573 -1.655 1.00 0.00 H new ATOM 1330 N PRO A 84 6.895 -10.129 -8.651 1.00 0.00 N ATOM 1331 CA PRO A 84 7.304 -10.126 -10.064 1.00 0.00 C ATOM 1332 C PRO A 84 6.484 -11.077 -10.931 1.00 0.00 C ATOM 1333 O PRO A 84 5.916 -10.674 -11.942 1.00 0.00 O ATOM 1334 CB PRO A 84 8.769 -10.583 -10.023 1.00 0.00 C ATOM 1335 CG PRO A 84 9.204 -10.396 -8.609 1.00 0.00 C ATOM 1336 CD PRO A 84 7.978 -10.597 -7.770 1.00 0.00 C ATOM 0 HA PRO A 84 7.156 -9.143 -10.510 1.00 0.00 H new ATOM 0 HB2 PRO A 84 8.864 -11.625 -10.328 1.00 0.00 H new ATOM 0 HB3 PRO A 84 9.383 -9.994 -10.704 1.00 0.00 H new ATOM 0 HG2 PRO A 84 9.981 -11.112 -8.342 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.622 -9.401 -8.458 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.847 -11.642 -7.490 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.023 -10.022 -6.845 1.00 0.00 H new ATOM 1344 N ALA A 85 6.441 -12.342 -10.540 1.00 0.00 N ATOM 1345 CA ALA A 85 5.708 -13.350 -11.296 1.00 0.00 C ATOM 1346 C ALA A 85 5.115 -14.393 -10.361 1.00 0.00 C ATOM 1347 O ALA A 85 4.675 -15.457 -10.793 1.00 0.00 O ATOM 1348 CB ALA A 85 6.622 -14.008 -12.319 1.00 0.00 C ATOM 0 H ALA A 85 6.905 -12.696 -9.703 1.00 0.00 H new ATOM 0 HA ALA A 85 4.890 -12.861 -11.824 1.00 0.00 H new ATOM 0 HB1 ALA A 85 6.063 -14.759 -12.877 1.00 0.00 H new ATOM 0 HB2 ALA A 85 7.001 -13.253 -13.007 1.00 0.00 H new ATOM 0 HB3 ALA A 85 7.458 -14.485 -11.807 1.00 0.00 H new ATOM 1354 N THR A 86 5.093 -14.071 -9.083 1.00 0.00 N ATOM 1355 CA THR A 86 4.598 -14.985 -8.072 1.00 0.00 C ATOM 1356 C THR A 86 3.211 -14.558 -7.591 1.00 0.00 C ATOM 1357 O THR A 86 2.838 -13.388 -7.723 1.00 0.00 O ATOM 1358 CB THR A 86 5.578 -15.057 -6.885 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.013 -13.739 -6.535 1.00 0.00 O ATOM 1360 CG2 THR A 86 6.786 -15.917 -7.226 1.00 0.00 C ATOM 0 H THR A 86 5.415 -13.175 -8.717 1.00 0.00 H new ATOM 0 HA THR A 86 4.517 -15.977 -8.517 1.00 0.00 H new ATOM 0 HB THR A 86 5.058 -15.510 -6.041 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.713 -13.526 -5.627 1.00 0.00 H new ATOM 0 HG21 THR A 86 7.461 -15.951 -6.371 1.00 0.00 H new ATOM 0 HG22 THR A 86 6.457 -16.927 -7.468 1.00 0.00 H new ATOM 0 HG23 THR A 86 7.307 -15.490 -8.083 1.00 0.00 H new ATOM 1368 N PRO A 87 2.428 -15.502 -7.039 1.00 0.00 N ATOM 1369 CA PRO A 87 1.053 -15.242 -6.597 1.00 0.00 C ATOM 1370 C PRO A 87 0.978 -14.219 -5.466 1.00 0.00 C ATOM 1371 O PRO A 87 1.977 -13.925 -4.804 1.00 0.00 O ATOM 1372 CB PRO A 87 0.561 -16.610 -6.106 1.00 0.00 C ATOM 1373 CG PRO A 87 1.801 -17.384 -5.816 1.00 0.00 C ATOM 1374 CD PRO A 87 2.825 -16.901 -6.799 1.00 0.00 C ATOM 0 HA PRO A 87 0.452 -14.819 -7.402 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -0.059 -16.510 -5.215 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.046 -17.106 -6.863 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.134 -17.219 -4.791 1.00 0.00 H new ATOM 0 HG3 PRO A 87 1.628 -18.455 -5.926 1.00 0.00 H new ATOM 0 HD2 PRO A 87 3.835 -16.969 -6.395 1.00 0.00 H new ATOM 0 HD3 PRO A 87 2.809 -17.487 -7.718 1.00 0.00 H new ATOM 1382 N ALA A 88 -0.218 -13.682 -5.251 1.00 0.00 N ATOM 1383 CA ALA A 88 -0.434 -12.690 -4.212 1.00 0.00 C ATOM 1384 C ALA A 88 -0.548 -13.352 -2.845 1.00 0.00 C ATOM 1385 O ALA A 88 -1.612 -13.842 -2.462 1.00 0.00 O ATOM 1386 CB ALA A 88 -1.676 -11.865 -4.516 1.00 0.00 C ATOM 0 H ALA A 88 -1.053 -13.920 -5.786 1.00 0.00 H new ATOM 0 HA ALA A 88 0.427 -12.022 -4.192 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.824 -11.126 -3.728 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.550 -11.356 -5.472 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.545 -12.521 -4.566 1.00 0.00 H new ATOM 1392 N ARG A 89 0.570 -13.406 -2.140 1.00 0.00 N ATOM 1393 CA ARG A 89 0.615 -13.931 -0.783 1.00 0.00 C ATOM 1394 C ARG A 89 1.654 -13.174 0.026 1.00 0.00 C ATOM 1395 O ARG A 89 2.606 -12.632 -0.543 1.00 0.00 O ATOM 1396 CB ARG A 89 0.950 -15.426 -0.773 1.00 0.00 C ATOM 1397 CG ARG A 89 -0.267 -16.331 -0.837 1.00 0.00 C ATOM 1398 CD ARG A 89 0.116 -17.784 -0.608 1.00 0.00 C ATOM 1399 NE ARG A 89 -1.058 -18.646 -0.464 1.00 0.00 N ATOM 1400 CZ ARG A 89 -1.015 -19.893 0.008 1.00 0.00 C ATOM 1401 NH1 ARG A 89 0.139 -20.436 0.386 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -2.132 -20.594 0.114 1.00 0.00 N ATOM 0 H ARG A 89 1.473 -13.087 -2.491 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.371 -13.799 -0.338 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.600 -15.648 -1.619 1.00 0.00 H new ATOM 0 HB3 ARG A 89 1.514 -15.656 0.131 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.994 -16.021 -0.086 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.749 -16.228 -1.809 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.723 -18.135 -1.443 1.00 0.00 H new ATOM 0 HD3 ARG A 89 0.733 -17.859 0.288 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.965 -18.270 -0.742 1.00 0.00 H new ATOM 0 HH11 ARG A 89 1.003 -19.898 0.316 1.00 0.00 H new ATOM 0 HH12 ARG A 89 0.160 -21.390 0.745 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -3.022 -20.181 -0.165 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.103 -21.548 0.474 1.00 0.00 H new ATOM 1416 N PRO A 90 1.477 -13.105 1.355 1.00 0.00 N ATOM 1417 CA PRO A 90 2.456 -12.484 2.247 1.00 0.00 C ATOM 1418 C PRO A 90 3.820 -13.149 2.126 1.00 0.00 C ATOM 1419 O PRO A 90 3.944 -14.373 2.237 1.00 0.00 O ATOM 1420 CB PRO A 90 1.871 -12.694 3.652 1.00 0.00 C ATOM 1421 CG PRO A 90 0.826 -13.746 3.493 1.00 0.00 C ATOM 1422 CD PRO A 90 0.309 -13.611 2.090 1.00 0.00 C ATOM 0 HA PRO A 90 2.618 -11.433 2.010 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.642 -13.009 4.355 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.443 -11.770 4.041 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.244 -14.739 3.660 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.024 -13.611 4.219 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.035 -14.566 1.693 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.533 -12.921 2.035 1.00 0.00 H new ATOM 1430 N SER A 91 4.836 -12.340 1.879 1.00 0.00 N ATOM 1431 CA SER A 91 6.188 -12.837 1.716 1.00 0.00 C ATOM 1432 C SER A 91 6.704 -13.340 3.061 1.00 0.00 C ATOM 1433 O SER A 91 6.272 -12.866 4.113 1.00 0.00 O ATOM 1434 CB SER A 91 7.079 -11.721 1.153 1.00 0.00 C ATOM 1435 OG SER A 91 8.351 -12.195 0.751 1.00 0.00 O ATOM 0 H SER A 91 4.747 -11.328 1.787 1.00 0.00 H new ATOM 0 HA SER A 91 6.204 -13.669 1.011 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.581 -11.258 0.301 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.206 -10.945 1.908 1.00 0.00 H new ATOM 0 HG SER A 91 8.724 -11.596 0.071 1.00 0.00 H new ATOM 1441 N ALA A 92 7.607 -14.305 3.027 1.00 0.00 N ATOM 1442 CA ALA A 92 8.125 -14.899 4.253 1.00 0.00 C ATOM 1443 C ALA A 92 8.845 -13.850 5.085 1.00 0.00 C ATOM 1444 O ALA A 92 8.608 -13.722 6.288 1.00 0.00 O ATOM 1445 CB ALA A 92 9.053 -16.065 3.936 1.00 0.00 C ATOM 0 H ALA A 92 7.997 -14.694 2.169 1.00 0.00 H new ATOM 0 HA ALA A 92 7.285 -15.283 4.833 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.429 -16.494 4.865 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.505 -16.826 3.381 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.891 -15.710 3.335 1.00 0.00 H new ATOM 1451 N GLU A 93 9.698 -13.078 4.430 1.00 0.00 N ATOM 1452 CA GLU A 93 10.418 -12.010 5.103 1.00 0.00 C ATOM 1453 C GLU A 93 9.446 -10.905 5.505 1.00 0.00 C ATOM 1454 O GLU A 93 9.609 -10.266 6.539 1.00 0.00 O ATOM 1455 CB GLU A 93 11.502 -11.439 4.196 1.00 0.00 C ATOM 1456 CG GLU A 93 12.656 -10.810 4.958 1.00 0.00 C ATOM 1457 CD GLU A 93 13.632 -11.843 5.472 1.00 0.00 C ATOM 1458 OE1 GLU A 93 13.271 -12.619 6.381 1.00 0.00 O ATOM 1459 OE2 GLU A 93 14.769 -11.898 4.949 1.00 0.00 O ATOM 0 H GLU A 93 9.908 -13.171 3.436 1.00 0.00 H new ATOM 0 HA GLU A 93 10.891 -12.419 5.996 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.888 -12.234 3.558 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.059 -10.690 3.539 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.180 -10.110 4.307 1.00 0.00 H new ATOM 0 HG3 GLU A 93 12.264 -10.234 5.796 1.00 0.00 H new ATOM 1466 N ASP A 94 8.435 -10.702 4.668 1.00 0.00 N ATOM 1467 CA ASP A 94 7.410 -9.687 4.908 1.00 0.00 C ATOM 1468 C ASP A 94 6.658 -9.966 6.206 1.00 0.00 C ATOM 1469 O ASP A 94 6.481 -9.074 7.032 1.00 0.00 O ATOM 1470 CB ASP A 94 6.448 -9.645 3.718 1.00 0.00 C ATOM 1471 CG ASP A 94 5.197 -8.820 3.962 1.00 0.00 C ATOM 1472 OD1 ASP A 94 5.286 -7.574 3.963 1.00 0.00 O ATOM 1473 OD2 ASP A 94 4.114 -9.423 4.097 1.00 0.00 O ATOM 0 H ASP A 94 8.301 -11.232 3.807 1.00 0.00 H new ATOM 0 HA ASP A 94 7.891 -8.715 5.012 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.974 -9.241 2.853 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.155 -10.664 3.465 1.00 0.00 H new ATOM 1478 N LYS A 95 6.243 -11.214 6.400 1.00 0.00 N ATOM 1479 CA LYS A 95 5.553 -11.603 7.627 1.00 0.00 C ATOM 1480 C LYS A 95 6.494 -11.457 8.825 1.00 0.00 C ATOM 1481 O LYS A 95 6.061 -11.162 9.940 1.00 0.00 O ATOM 1482 CB LYS A 95 5.021 -13.044 7.521 1.00 0.00 C ATOM 1483 CG LYS A 95 3.986 -13.405 8.586 1.00 0.00 C ATOM 1484 CD LYS A 95 4.632 -13.909 9.870 1.00 0.00 C ATOM 1485 CE LYS A 95 3.814 -13.538 11.104 1.00 0.00 C ATOM 1486 NZ LYS A 95 2.426 -14.077 11.060 1.00 0.00 N ATOM 0 H LYS A 95 6.371 -11.970 5.728 1.00 0.00 H new ATOM 0 HA LYS A 95 4.699 -10.942 7.772 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.577 -13.185 6.535 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.860 -13.736 7.595 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.375 -12.530 8.808 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.316 -14.170 8.194 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.742 -14.992 9.820 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.635 -13.491 9.960 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.317 -13.915 11.995 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.775 -12.453 11.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 1.779 -13.407 11.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.137 -14.211 10.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.392 -14.990 11.557 1.00 0.00 H new ATOM 1500 N ARG A 96 7.785 -11.655 8.585 1.00 0.00 N ATOM 1501 CA ARG A 96 8.790 -11.516 9.634 1.00 0.00 C ATOM 1502 C ARG A 96 8.993 -10.057 10.022 1.00 0.00 C ATOM 1503 O ARG A 96 9.149 -9.743 11.199 1.00 0.00 O ATOM 1504 CB ARG A 96 10.121 -12.131 9.194 1.00 0.00 C ATOM 1505 CG ARG A 96 10.214 -13.627 9.440 1.00 0.00 C ATOM 1506 CD ARG A 96 10.594 -13.943 10.884 1.00 0.00 C ATOM 1507 NE ARG A 96 9.709 -13.302 11.858 1.00 0.00 N ATOM 1508 CZ ARG A 96 9.141 -13.937 12.885 1.00 0.00 C ATOM 1509 NH1 ARG A 96 9.340 -15.237 13.057 1.00 0.00 N ATOM 1510 NH2 ARG A 96 8.368 -13.266 13.733 1.00 0.00 N ATOM 0 H ARG A 96 8.161 -11.913 7.673 1.00 0.00 H new ATOM 0 HA ARG A 96 8.424 -12.053 10.509 1.00 0.00 H new ATOM 0 HB2 ARG A 96 10.267 -11.937 8.131 1.00 0.00 H new ATOM 0 HB3 ARG A 96 10.934 -11.634 9.724 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.257 -14.094 9.206 1.00 0.00 H new ATOM 0 HG3 ARG A 96 10.953 -14.061 8.767 1.00 0.00 H new ATOM 0 HD2 ARG A 96 10.569 -15.022 11.033 1.00 0.00 H new ATOM 0 HD3 ARG A 96 11.619 -13.620 11.064 1.00 0.00 H new ATOM 0 HE ARG A 96 9.514 -12.307 11.744 1.00 0.00 H new ATOM 0 HH11 ARG A 96 9.928 -15.754 12.403 1.00 0.00 H new ATOM 0 HH12 ARG A 96 8.905 -15.720 13.843 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.210 -12.267 13.598 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.933 -13.750 14.519 1.00 0.00 H new ATOM 1524 N LEU A 97 8.979 -9.173 9.033 1.00 0.00 N ATOM 1525 CA LEU A 97 9.196 -7.752 9.267 1.00 0.00 C ATOM 1526 C LEU A 97 7.906 -7.060 9.694 1.00 0.00 C ATOM 1527 O LEU A 97 7.922 -5.911 10.144 1.00 0.00 O ATOM 1528 CB LEU A 97 9.756 -7.094 8.005 1.00 0.00 C ATOM 1529 CG LEU A 97 11.091 -7.661 7.513 1.00 0.00 C ATOM 1530 CD1 LEU A 97 11.560 -6.925 6.269 1.00 0.00 C ATOM 1531 CD2 LEU A 97 12.144 -7.584 8.610 1.00 0.00 C ATOM 0 H LEU A 97 8.819 -9.417 8.056 1.00 0.00 H new ATOM 0 HA LEU A 97 9.918 -7.647 10.077 1.00 0.00 H new ATOM 0 HB2 LEU A 97 9.021 -7.192 7.206 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.880 -6.028 8.195 1.00 0.00 H new ATOM 0 HG LEU A 97 10.942 -8.709 7.255 1.00 0.00 H new ATOM 0 HD11 LEU A 97 12.510 -7.343 5.935 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.817 -7.036 5.479 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.690 -5.867 6.499 1.00 0.00 H new ATOM 0 HD21 LEU A 97 13.085 -7.992 8.240 1.00 0.00 H new ATOM 0 HD22 LEU A 97 12.289 -6.544 8.903 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.813 -8.161 9.473 1.00 0.00 H new ATOM 1543 N ALA A 98 6.789 -7.760 9.549 1.00 0.00 N ATOM 1544 CA ALA A 98 5.498 -7.229 9.953 1.00 0.00 C ATOM 1545 C ALA A 98 5.335 -7.294 11.466 1.00 0.00 C ATOM 1546 O ALA A 98 4.674 -8.190 12.000 1.00 0.00 O ATOM 1547 CB ALA A 98 4.366 -7.975 9.259 1.00 0.00 C ATOM 0 H ALA A 98 6.753 -8.699 9.153 1.00 0.00 H new ATOM 0 HA ALA A 98 5.454 -6.183 9.650 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.409 -7.561 9.576 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.468 -7.868 8.179 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.410 -9.031 9.524 1.00 0.00 H new ATOM 1553 N PHE A 99 5.976 -6.363 12.156 1.00 0.00 N ATOM 1554 CA PHE A 99 5.860 -6.267 13.602 1.00 0.00 C ATOM 1555 C PHE A 99 4.699 -5.359 13.980 1.00 0.00 C ATOM 1556 O PHE A 99 4.310 -5.282 15.145 1.00 0.00 O ATOM 1557 CB PHE A 99 7.163 -5.754 14.217 1.00 0.00 C ATOM 1558 CG PHE A 99 8.322 -6.692 14.026 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.387 -7.885 14.729 1.00 0.00 C ATOM 1560 CD2 PHE A 99 9.343 -6.386 13.141 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.448 -8.754 14.555 1.00 0.00 C ATOM 1562 CE2 PHE A 99 10.407 -7.250 12.962 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.459 -8.436 13.670 1.00 0.00 C ATOM 0 H PHE A 99 6.584 -5.661 11.735 1.00 0.00 H new ATOM 0 HA PHE A 99 5.666 -7.264 13.998 1.00 0.00 H new ATOM 0 HB2 PHE A 99 7.410 -4.789 13.775 1.00 0.00 H new ATOM 0 HB3 PHE A 99 7.012 -5.587 15.283 1.00 0.00 H new ATOM 0 HD1 PHE A 99 7.598 -8.139 15.422 1.00 0.00 H new ATOM 0 HD2 PHE A 99 9.307 -5.461 12.584 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.486 -9.680 15.110 1.00 0.00 H new ATOM 0 HE2 PHE A 99 11.197 -6.999 12.270 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.289 -9.113 13.531 1.00 0.00 H new ATOM 1573 N ASP A 100 4.155 -4.669 12.988 1.00 0.00 N ATOM 1574 CA ASP A 100 2.982 -3.835 13.196 1.00 0.00 C ATOM 1575 C ASP A 100 1.749 -4.717 13.354 1.00 0.00 C ATOM 1576 O ASP A 100 1.642 -5.762 12.711 1.00 0.00 O ATOM 1577 CB ASP A 100 2.810 -2.844 12.041 1.00 0.00 C ATOM 1578 CG ASP A 100 3.827 -1.720 12.093 1.00 0.00 C ATOM 1579 OD1 ASP A 100 5.010 -1.963 11.772 1.00 0.00 O ATOM 1580 OD2 ASP A 100 3.453 -0.591 12.481 1.00 0.00 O ATOM 0 H ASP A 100 4.508 -4.671 12.031 1.00 0.00 H new ATOM 0 HA ASP A 100 3.114 -3.254 14.109 1.00 0.00 H new ATOM 0 HB2 ASP A 100 2.905 -3.374 11.093 1.00 0.00 H new ATOM 0 HB3 ASP A 100 1.805 -2.424 12.072 1.00 0.00 H new ATOM 1585 N PRO A 101 0.807 -4.307 14.219 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.303 -5.161 14.657 1.00 0.00 C ATOM 1587 C PRO A 101 -1.214 -5.656 13.534 1.00 0.00 C ATOM 1588 O PRO A 101 -1.374 -6.864 13.356 1.00 0.00 O ATOM 1589 CB PRO A 101 -1.095 -4.264 15.617 1.00 0.00 C ATOM 1590 CG PRO A 101 -0.660 -2.872 15.310 1.00 0.00 C ATOM 1591 CD PRO A 101 0.764 -2.982 14.857 1.00 0.00 C ATOM 0 HA PRO A 101 0.084 -6.078 15.100 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -2.168 -4.382 15.469 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -0.887 -4.520 16.656 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -1.284 -2.429 14.534 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -0.743 -2.233 16.189 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.027 -2.189 14.158 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.460 -2.914 15.693 1.00 0.00 H new ATOM 1599 N SER A 102 -1.799 -4.739 12.772 1.00 0.00 N ATOM 1600 CA SER A 102 -2.796 -5.104 11.777 1.00 0.00 C ATOM 1601 C SER A 102 -3.013 -3.967 10.791 1.00 0.00 C ATOM 1602 O SER A 102 -4.125 -3.459 10.629 1.00 0.00 O ATOM 1603 CB SER A 102 -4.118 -5.464 12.457 1.00 0.00 C ATOM 1604 OG SER A 102 -3.979 -6.619 13.270 1.00 0.00 O ATOM 0 H SER A 102 -1.600 -3.740 12.825 1.00 0.00 H new ATOM 0 HA SER A 102 -2.430 -5.973 11.231 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.457 -4.626 13.066 1.00 0.00 H new ATOM 0 HB3 SER A 102 -4.883 -5.638 11.701 1.00 0.00 H new ATOM 0 HG SER A 102 -3.118 -7.049 13.083 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.936 -3.554 10.155 1.00 0.00 N ATOM 1611 CA LEU A 103 -2.005 -2.535 9.124 1.00 0.00 C ATOM 1612 C LEU A 103 -2.418 -3.161 7.798 1.00 0.00 C ATOM 1613 O LEU A 103 -2.249 -4.363 7.602 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.654 -1.839 8.991 1.00 0.00 C ATOM 1615 CG LEU A 103 -0.299 -0.890 10.136 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.094 -0.318 9.937 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -1.322 0.232 10.237 1.00 0.00 C ATOM 0 H LEU A 103 -0.997 -3.910 10.334 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.753 -1.793 9.403 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.123 -2.599 8.915 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.642 -1.277 8.057 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.313 -1.455 11.068 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.332 0.356 10.760 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.821 -1.130 9.911 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.131 0.232 8.996 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.053 0.897 11.057 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.338 0.795 9.304 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.309 -0.191 10.422 1.00 0.00 H new ATOM 1629 N SER A 104 -2.963 -2.357 6.899 1.00 0.00 N ATOM 1630 CA SER A 104 -3.424 -2.862 5.614 1.00 0.00 C ATOM 1631 C SER A 104 -2.254 -3.030 4.651 1.00 0.00 C ATOM 1632 O SER A 104 -1.714 -2.053 4.127 1.00 0.00 O ATOM 1633 CB SER A 104 -4.475 -1.916 5.026 1.00 0.00 C ATOM 1634 OG SER A 104 -5.571 -1.755 5.917 1.00 0.00 O ATOM 0 H SER A 104 -3.097 -1.355 7.034 1.00 0.00 H new ATOM 0 HA SER A 104 -3.880 -3.840 5.766 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.022 -0.946 4.822 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.831 -2.309 4.073 1.00 0.00 H new ATOM 0 HG SER A 104 -6.228 -1.145 5.521 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.844 -4.274 4.447 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.748 -4.576 3.538 1.00 0.00 C ATOM 1642 C TYR A 105 -1.305 -5.027 2.194 1.00 0.00 C ATOM 1643 O TYR A 105 -2.025 -6.020 2.115 1.00 0.00 O ATOM 1644 CB TYR A 105 0.156 -5.669 4.124 1.00 0.00 C ATOM 1645 CG TYR A 105 0.510 -5.456 5.581 1.00 0.00 C ATOM 1646 CD1 TYR A 105 1.303 -4.387 5.981 1.00 0.00 C ATOM 1647 CD2 TYR A 105 0.044 -6.327 6.557 1.00 0.00 C ATOM 1648 CE1 TYR A 105 1.619 -4.194 7.313 1.00 0.00 C ATOM 1649 CE2 TYR A 105 0.356 -6.141 7.889 1.00 0.00 C ATOM 1650 CZ TYR A 105 1.142 -5.074 8.263 1.00 0.00 C ATOM 1651 OH TYR A 105 1.447 -4.882 9.594 1.00 0.00 O ATOM 0 H TYR A 105 -2.254 -5.091 4.899 1.00 0.00 H new ATOM 0 HA TYR A 105 -0.152 -3.674 3.398 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.341 -6.633 4.018 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.075 -5.718 3.540 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.678 -3.697 5.240 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.574 -7.165 6.269 1.00 0.00 H new ATOM 0 HE1 TYR A 105 2.236 -3.359 7.609 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -0.015 -6.829 8.634 1.00 0.00 H new ATOM 0 HH TYR A 105 1.032 -5.590 10.130 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.999 -4.285 1.147 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.483 -4.624 -0.184 1.00 0.00 C ATOM 1663 C LEU A 106 -0.410 -5.348 -0.980 1.00 0.00 C ATOM 1664 O LEU A 106 0.754 -4.940 -0.993 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.952 -3.380 -0.948 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.352 -2.872 -0.586 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.400 -2.343 0.837 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.788 -1.801 -1.567 1.00 0.00 C ATOM 0 H LEU A 106 -0.420 -3.446 1.188 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.339 -5.287 -0.058 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.237 -2.576 -0.773 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.929 -3.600 -2.015 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.043 -3.713 -0.648 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.407 -1.991 1.061 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.132 -3.140 1.531 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.696 -1.518 0.942 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.784 -1.447 -1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.086 -0.968 -1.532 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.808 -2.217 -2.574 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.805 -6.429 -1.629 1.00 0.00 N ATOM 1681 CA ILE A 107 0.110 -7.231 -2.421 1.00 0.00 C ATOM 1682 C ILE A 107 -0.459 -7.458 -3.816 1.00 0.00 C ATOM 1683 O ILE A 107 -1.550 -8.011 -3.974 1.00 0.00 O ATOM 1684 CB ILE A 107 0.393 -8.593 -1.742 1.00 0.00 C ATOM 1685 CG1 ILE A 107 0.970 -8.369 -0.342 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.347 -9.433 -2.588 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.181 -9.643 0.446 1.00 0.00 C ATOM 0 H ILE A 107 -1.765 -6.774 -1.622 1.00 0.00 H new ATOM 0 HA ILE A 107 1.050 -6.685 -2.500 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.546 -9.139 -1.652 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.923 -7.847 -0.432 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.300 -7.715 0.216 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.531 -10.385 -2.091 1.00 0.00 H new ATOM 0 HG22 ILE A 107 0.902 -9.614 -3.566 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.290 -8.900 -2.711 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.592 -9.401 1.426 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.228 -10.157 0.569 1.00 0.00 H new ATOM 0 HD13 ILE A 107 1.876 -10.291 -0.089 1.00 0.00 H new ATOM 1699 N ILE A 108 0.271 -7.005 -4.821 1.00 0.00 N ATOM 1700 CA ILE A 108 -0.154 -7.153 -6.203 1.00 0.00 C ATOM 1701 C ILE A 108 0.653 -8.255 -6.883 1.00 0.00 C ATOM 1702 O ILE A 108 1.873 -8.327 -6.730 1.00 0.00 O ATOM 1703 CB ILE A 108 0.016 -5.833 -6.991 1.00 0.00 C ATOM 1704 CG1 ILE A 108 -0.715 -4.687 -6.281 1.00 0.00 C ATOM 1705 CG2 ILE A 108 -0.497 -5.991 -8.417 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -0.516 -3.336 -6.937 1.00 0.00 C ATOM 0 H ILE A 108 1.166 -6.529 -4.705 1.00 0.00 H new ATOM 0 HA ILE A 108 -1.211 -7.418 -6.198 1.00 0.00 H new ATOM 0 HB ILE A 108 1.078 -5.592 -7.033 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.781 -4.912 -6.250 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -0.371 -4.633 -5.248 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -0.369 -5.052 -8.956 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.065 -6.778 -8.921 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -1.554 -6.256 -8.396 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -1.063 -2.576 -6.379 1.00 0.00 H new ATOM 0 HD12 ILE A 108 0.545 -3.088 -6.944 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.887 -3.371 -7.961 1.00 0.00 H new ATOM 1718 N SER A 109 -0.027 -9.118 -7.615 1.00 0.00 N ATOM 1719 CA SER A 109 0.631 -10.202 -8.321 1.00 0.00 C ATOM 1720 C SER A 109 0.782 -9.858 -9.798 1.00 0.00 C ATOM 1721 O SER A 109 -0.209 -9.694 -10.515 1.00 0.00 O ATOM 1722 CB SER A 109 -0.166 -11.501 -8.156 1.00 0.00 C ATOM 1723 OG SER A 109 0.506 -12.602 -8.747 1.00 0.00 O ATOM 0 H SER A 109 -1.039 -9.089 -7.736 1.00 0.00 H new ATOM 0 HA SER A 109 1.624 -10.344 -7.895 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.327 -11.698 -7.096 1.00 0.00 H new ATOM 0 HB3 SER A 109 -1.149 -11.386 -8.612 1.00 0.00 H new ATOM 0 HG SER A 109 1.216 -12.912 -8.147 1.00 0.00 H new ATOM 1729 N LEU A 110 2.023 -9.732 -10.243 1.00 0.00 N ATOM 1730 CA LEU A 110 2.309 -9.466 -11.645 1.00 0.00 C ATOM 1731 C LEU A 110 2.574 -10.769 -12.391 1.00 0.00 C ATOM 1732 O LEU A 110 3.202 -10.772 -13.449 1.00 0.00 O ATOM 1733 CB LEU A 110 3.511 -8.523 -11.796 1.00 0.00 C ATOM 1734 CG LEU A 110 3.235 -7.034 -11.545 1.00 0.00 C ATOM 1735 CD1 LEU A 110 2.101 -6.544 -12.430 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.927 -6.769 -10.079 1.00 0.00 C ATOM 0 H LEU A 110 2.850 -9.810 -9.652 1.00 0.00 H new ATOM 0 HA LEU A 110 1.435 -8.979 -12.077 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.291 -8.848 -11.108 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.909 -8.633 -12.805 1.00 0.00 H new ATOM 0 HG LEU A 110 4.137 -6.478 -11.801 1.00 0.00 H new ATOM 0 HD11 LEU A 110 1.920 -5.486 -12.238 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.371 -6.681 -13.477 1.00 0.00 H new ATOM 0 HD13 LEU A 110 1.197 -7.112 -12.211 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.736 -5.706 -9.934 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.047 -7.339 -9.783 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.777 -7.072 -9.468 1.00 0.00 H new ATOM 1748 N ALA A 111 2.076 -11.875 -11.831 1.00 0.00 N ATOM 1749 CA ALA A 111 2.202 -13.187 -12.460 1.00 0.00 C ATOM 1750 C ALA A 111 1.626 -13.151 -13.871 1.00 0.00 C ATOM 1751 O ALA A 111 2.167 -13.749 -14.800 1.00 0.00 O ATOM 1752 CB ALA A 111 1.493 -14.240 -11.619 1.00 0.00 C ATOM 0 H ALA A 111 1.580 -11.885 -10.940 1.00 0.00 H new ATOM 0 HA ALA A 111 3.258 -13.449 -12.525 1.00 0.00 H new ATOM 0 HB1 ALA A 111 1.593 -15.215 -12.097 1.00 0.00 H new ATOM 0 HB2 ALA A 111 1.941 -14.275 -10.626 1.00 0.00 H new ATOM 0 HB3 ALA A 111 0.437 -13.985 -11.532 1.00 0.00 H new ATOM 1758 N GLU A 112 0.520 -12.441 -14.009 1.00 0.00 N ATOM 1759 CA GLU A 112 -0.076 -12.167 -15.302 1.00 0.00 C ATOM 1760 C GLU A 112 -0.029 -10.661 -15.547 1.00 0.00 C ATOM 1761 O GLU A 112 -0.961 -9.945 -15.194 1.00 0.00 O ATOM 1762 CB GLU A 112 -1.520 -12.682 -15.355 1.00 0.00 C ATOM 1763 CG GLU A 112 -2.199 -12.485 -16.703 1.00 0.00 C ATOM 1764 CD GLU A 112 -1.523 -13.255 -17.819 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -0.596 -12.705 -18.449 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -1.923 -14.411 -18.078 1.00 0.00 O ATOM 0 H GLU A 112 0.009 -12.037 -13.224 1.00 0.00 H new ATOM 0 HA GLU A 112 0.483 -12.684 -16.082 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.525 -13.744 -15.109 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -2.104 -12.174 -14.588 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -3.240 -12.799 -16.630 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -2.203 -11.424 -16.951 1.00 0.00 H new ATOM 1773 N PRO A 113 1.081 -10.153 -16.112 1.00 0.00 N ATOM 1774 CA PRO A 113 1.322 -8.708 -16.247 1.00 0.00 C ATOM 1775 C PRO A 113 0.288 -8.015 -17.121 1.00 0.00 C ATOM 1776 O PRO A 113 0.190 -6.788 -17.141 1.00 0.00 O ATOM 1777 CB PRO A 113 2.712 -8.620 -16.890 1.00 0.00 C ATOM 1778 CG PRO A 113 3.326 -9.964 -16.691 1.00 0.00 C ATOM 1779 CD PRO A 113 2.188 -10.943 -16.674 1.00 0.00 C ATOM 0 HA PRO A 113 1.255 -8.206 -15.282 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.640 -8.374 -17.949 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.313 -7.840 -16.422 1.00 0.00 H new ATOM 0 HG2 PRO A 113 4.027 -10.195 -17.493 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.887 -10.002 -15.757 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.956 -11.309 -17.674 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.414 -11.815 -16.060 1.00 0.00 H new ATOM 1787 N GLN A 114 -0.477 -8.812 -17.840 1.00 0.00 N ATOM 1788 CA GLN A 114 -1.553 -8.296 -18.664 1.00 0.00 C ATOM 1789 C GLN A 114 -2.708 -7.839 -17.780 1.00 0.00 C ATOM 1790 O GLN A 114 -3.375 -6.850 -18.073 1.00 0.00 O ATOM 1791 CB GLN A 114 -2.033 -9.372 -19.637 1.00 0.00 C ATOM 1792 CG GLN A 114 -0.940 -9.901 -20.551 1.00 0.00 C ATOM 1793 CD GLN A 114 -1.440 -10.992 -21.472 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -1.899 -10.724 -22.581 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -1.360 -12.230 -21.018 1.00 0.00 N ATOM 0 H GLN A 114 -0.373 -9.826 -17.870 1.00 0.00 H new ATOM 0 HA GLN A 114 -1.184 -7.445 -19.236 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -2.452 -10.202 -19.069 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -2.839 -8.964 -20.247 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -0.539 -9.081 -21.147 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -0.119 -10.287 -19.947 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -0.972 -12.409 -20.092 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -1.686 -13.006 -21.594 1.00 0.00 H new ATOM 1804 N LYS A 115 -2.917 -8.562 -16.683 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.005 -8.289 -15.758 1.00 0.00 C ATOM 1806 C LYS A 115 -3.546 -8.552 -14.325 1.00 0.00 C ATOM 1807 O LYS A 115 -3.715 -9.655 -13.806 1.00 0.00 O ATOM 1808 CB LYS A 115 -5.221 -9.163 -16.085 1.00 0.00 C ATOM 1809 CG LYS A 115 -5.878 -8.835 -17.419 1.00 0.00 C ATOM 1810 CD LYS A 115 -6.456 -7.428 -17.431 1.00 0.00 C ATOM 1811 CE LYS A 115 -7.643 -7.295 -16.491 1.00 0.00 C ATOM 1812 NZ LYS A 115 -8.841 -8.013 -17.002 1.00 0.00 N ATOM 0 H LYS A 115 -2.334 -9.354 -16.413 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.292 -7.242 -15.858 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.913 -10.209 -16.091 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.959 -9.052 -15.291 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.145 -8.934 -18.220 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.670 -9.556 -17.621 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.683 -6.716 -17.143 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.765 -7.171 -18.444 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.375 -7.689 -15.511 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.882 -6.240 -16.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -9.666 -7.774 -16.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.022 -7.729 -17.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.674 -9.039 -16.963 1.00 0.00 H new ATOM 1826 N PRO A 116 -2.922 -7.550 -13.689 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.379 -7.683 -12.334 1.00 0.00 C ATOM 1828 C PRO A 116 -3.463 -7.920 -11.286 1.00 0.00 C ATOM 1829 O PRO A 116 -4.410 -7.141 -11.170 1.00 0.00 O ATOM 1830 CB PRO A 116 -1.687 -6.337 -12.080 1.00 0.00 C ATOM 1831 CG PRO A 116 -1.536 -5.710 -13.425 1.00 0.00 C ATOM 1832 CD PRO A 116 -2.691 -6.207 -14.241 1.00 0.00 C ATOM 0 HA PRO A 116 -1.713 -8.542 -12.258 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.282 -5.708 -11.418 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.718 -6.477 -11.601 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -1.548 -4.622 -13.353 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -0.586 -5.989 -13.882 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.568 -5.568 -14.133 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.451 -6.242 -15.304 1.00 0.00 H new ATOM 1840 N VAL A 117 -3.313 -8.995 -10.523 1.00 0.00 N ATOM 1841 CA VAL A 117 -4.273 -9.334 -9.479 1.00 0.00 C ATOM 1842 C VAL A 117 -3.858 -8.694 -8.157 1.00 0.00 C ATOM 1843 O VAL A 117 -2.733 -8.886 -7.691 1.00 0.00 O ATOM 1844 CB VAL A 117 -4.393 -10.867 -9.294 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -5.428 -11.209 -8.230 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -4.734 -11.543 -10.616 1.00 0.00 C ATOM 0 H VAL A 117 -2.534 -9.649 -10.607 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.245 -8.949 -9.786 1.00 0.00 H new ATOM 0 HB VAL A 117 -3.427 -11.243 -8.956 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.493 -12.291 -8.120 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -5.133 -10.764 -7.279 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.400 -10.816 -8.528 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.814 -12.619 -10.464 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.683 -11.158 -10.987 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.949 -11.336 -11.343 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.758 -7.929 -7.562 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.456 -7.218 -6.329 1.00 0.00 C ATOM 1858 C CYS A 118 -5.230 -7.800 -5.152 1.00 0.00 C ATOM 1859 O CYS A 118 -6.431 -8.059 -5.255 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.794 -5.736 -6.494 1.00 0.00 C ATOM 1861 SG CYS A 118 -6.511 -5.425 -6.973 1.00 0.00 S ATOM 0 H CYS A 118 -5.705 -7.784 -7.912 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.392 -7.330 -6.121 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -4.590 -5.220 -5.556 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.133 -5.304 -7.246 1.00 0.00 H new ATOM 0 HG CYS A 118 -7.275 -6.351 -6.474 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.534 -8.025 -4.045 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.175 -8.433 -2.801 1.00 0.00 C ATOM 1869 C LYS A 119 -4.573 -7.656 -1.641 1.00 0.00 C ATOM 1870 O LYS A 119 -3.493 -7.079 -1.764 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.001 -9.931 -2.530 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.582 -10.841 -3.598 1.00 0.00 C ATOM 1873 CD LYS A 119 -5.464 -12.303 -3.192 1.00 0.00 C ATOM 1874 CE LYS A 119 -6.125 -13.228 -4.201 1.00 0.00 C ATOM 1875 NZ LYS A 119 -6.091 -14.645 -3.748 1.00 0.00 N ATOM 0 H LYS A 119 -3.520 -7.931 -3.983 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.240 -8.223 -2.898 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.937 -10.147 -2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.468 -10.170 -1.575 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.629 -10.590 -3.765 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.061 -10.679 -4.542 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.411 -12.568 -3.092 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.923 -12.446 -2.214 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.159 -12.919 -4.356 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.619 -13.140 -5.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.550 -15.248 -4.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.103 -14.946 -3.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.596 -14.732 -2.843 1.00 0.00 H new ATOM 1889 N SER A 120 -5.272 -7.639 -0.526 1.00 0.00 N ATOM 1890 CA SER A 120 -4.769 -7.004 0.679 1.00 0.00 C ATOM 1891 C SER A 120 -4.818 -7.997 1.832 1.00 0.00 C ATOM 1892 O SER A 120 -5.808 -8.710 2.008 1.00 0.00 O ATOM 1893 CB SER A 120 -5.583 -5.749 1.006 1.00 0.00 C ATOM 1894 OG SER A 120 -5.001 -5.022 2.077 1.00 0.00 O ATOM 0 H SER A 120 -6.196 -8.060 -0.427 1.00 0.00 H new ATOM 0 HA SER A 120 -3.735 -6.697 0.519 1.00 0.00 H new ATOM 0 HB2 SER A 120 -5.645 -5.113 0.123 1.00 0.00 H new ATOM 0 HB3 SER A 120 -6.603 -6.032 1.267 1.00 0.00 H new ATOM 0 HG SER A 120 -4.058 -5.272 2.168 1.00 0.00 H new ATOM 1900 N PHE A 121 -3.752 -8.052 2.607 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.656 -9.015 3.685 1.00 0.00 C ATOM 1902 C PHE A 121 -3.390 -8.321 5.010 1.00 0.00 C ATOM 1903 O PHE A 121 -2.626 -7.360 5.083 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.550 -10.033 3.394 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.850 -10.933 2.227 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.671 -12.037 2.383 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.315 -10.672 0.975 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -3.953 -12.866 1.315 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.595 -11.497 -0.098 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.415 -12.596 0.072 1.00 0.00 C ATOM 0 H PHE A 121 -2.941 -7.441 2.510 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.609 -9.539 3.756 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.619 -9.500 3.201 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.389 -10.645 4.282 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.096 -12.253 3.352 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.673 -9.815 0.837 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.594 -13.725 1.452 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.173 -11.283 -1.069 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.635 -13.242 -0.765 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.049 -8.805 6.046 1.00 0.00 N ATOM 1921 CA LEU A 122 -3.820 -8.335 7.396 1.00 0.00 C ATOM 1922 C LEU A 122 -3.044 -9.397 8.161 1.00 0.00 C ATOM 1923 O LEU A 122 -3.573 -10.471 8.458 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.151 -8.046 8.096 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.046 -7.015 7.401 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.370 -6.881 8.132 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.350 -5.665 7.325 1.00 0.00 C ATOM 0 H LEU A 122 -4.758 -9.535 5.974 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.246 -7.409 7.366 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.705 -8.980 8.188 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.943 -7.698 9.108 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.241 -7.362 6.386 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.993 -6.145 7.624 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -7.880 -7.844 8.140 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.189 -6.558 9.157 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.002 -4.947 6.828 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.125 -5.314 8.332 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.423 -5.765 6.760 1.00 0.00 H new ATOM 1939 N ILE A 123 -1.795 -9.109 8.469 1.00 0.00 N ATOM 1940 CA ILE A 123 -0.925 -10.095 9.083 1.00 0.00 C ATOM 1941 C ILE A 123 -1.091 -10.104 10.598 1.00 0.00 C ATOM 1942 O ILE A 123 -0.818 -9.111 11.273 1.00 0.00 O ATOM 1943 CB ILE A 123 0.555 -9.849 8.716 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.743 -9.945 7.197 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.459 -10.842 9.435 1.00 0.00 C ATOM 1946 CD1 ILE A 123 2.154 -9.649 6.733 1.00 0.00 C ATOM 0 H ILE A 123 -1.359 -8.202 8.305 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.217 -11.070 8.693 1.00 0.00 H new ATOM 0 HB ILE A 123 0.833 -8.846 9.039 1.00 0.00 H new ATOM 0 HG12 ILE A 123 0.466 -10.947 6.869 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.058 -9.250 6.711 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.497 -10.652 9.163 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.340 -10.729 10.512 1.00 0.00 H new ATOM 0 HG23 ILE A 123 1.188 -11.857 9.145 1.00 0.00 H new ATOM 0 HD11 ILE A 123 2.206 -9.737 5.648 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.429 -8.637 7.028 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.843 -10.360 7.188 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.565 -11.229 11.107 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.754 -11.424 12.534 1.00 0.00 C ATOM 1960 C LYS A 124 -0.655 -12.328 13.087 1.00 0.00 C ATOM 1961 O LYS A 124 0.288 -12.699 12.377 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.121 -12.070 12.806 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.322 -11.210 12.436 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.605 -12.034 12.477 1.00 0.00 C ATOM 1965 CE LYS A 124 -6.850 -11.189 12.237 1.00 0.00 C ATOM 1966 NZ LYS A 124 -7.227 -10.386 13.432 1.00 0.00 N ATOM 0 H LYS A 124 -1.830 -12.035 10.540 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.710 -10.452 13.025 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.180 -13.008 12.253 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.184 -12.320 13.865 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.401 -10.370 13.126 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.183 -10.792 11.439 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.552 -12.820 11.723 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.686 -12.527 13.446 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.676 -10.521 11.393 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -7.680 -11.839 11.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.079 -9.828 13.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -7.420 -11.023 14.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -6.446 -9.745 13.680 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.787 -12.676 14.354 1.00 0.00 N ATOM 1981 CA LYS A 125 0.082 -13.658 14.986 1.00 0.00 C ATOM 1982 C LYS A 125 -0.324 -15.052 14.541 1.00 0.00 C ATOM 1983 O LYS A 125 0.480 -15.830 14.030 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.041 -13.532 16.509 1.00 0.00 C ATOM 1985 CG LYS A 125 0.717 -14.590 17.308 1.00 0.00 C ATOM 1986 CD LYS A 125 -0.193 -15.742 17.727 1.00 0.00 C ATOM 1987 CE LYS A 125 -1.285 -15.277 18.681 1.00 0.00 C ATOM 1988 NZ LYS A 125 -2.255 -16.360 18.997 1.00 0.00 N ATOM 0 H LYS A 125 -1.497 -12.288 14.975 1.00 0.00 H new ATOM 0 HA LYS A 125 1.117 -13.481 14.694 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.318 -12.547 16.807 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.096 -13.582 16.778 1.00 0.00 H new ATOM 0 HG2 LYS A 125 1.541 -14.977 16.709 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.155 -14.132 18.195 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.648 -16.187 16.842 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.402 -16.520 18.206 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -0.830 -14.919 19.604 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.816 -14.434 18.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -3.052 -15.966 19.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.609 -16.778 18.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -1.783 -17.095 19.562 1.00 0.00 H new ATOM 2002 N ASP A 126 -1.599 -15.333 14.751 1.00 0.00 N ATOM 2003 CA ASP A 126 -2.192 -16.633 14.441 1.00 0.00 C ATOM 2004 C ASP A 126 -2.028 -16.986 12.968 1.00 0.00 C ATOM 2005 O ASP A 126 -1.738 -18.132 12.620 1.00 0.00 O ATOM 2006 CB ASP A 126 -3.680 -16.622 14.801 1.00 0.00 C ATOM 2007 CG ASP A 126 -3.926 -16.161 16.222 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -3.909 -14.938 16.461 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -4.124 -17.018 17.109 1.00 0.00 O ATOM 0 H ASP A 126 -2.261 -14.664 15.144 1.00 0.00 H new ATOM 0 HA ASP A 126 -1.671 -17.387 15.031 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -4.213 -15.967 14.112 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.090 -17.623 14.671 1.00 0.00 H new ATOM 2014 N GLY A 127 -2.208 -15.998 12.109 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.126 -16.230 10.684 1.00 0.00 C ATOM 2016 C GLY A 127 -2.299 -14.953 9.897 1.00 0.00 C ATOM 2017 O GLY A 127 -1.811 -13.898 10.300 1.00 0.00 O ATOM 0 H GLY A 127 -2.411 -15.034 12.374 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.162 -16.677 10.443 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.892 -16.946 10.388 1.00 0.00 H new ATOM 2021 N VAL A 128 -2.997 -15.044 8.782 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.249 -13.883 7.949 1.00 0.00 C ATOM 2023 C VAL A 128 -4.747 -13.735 7.678 1.00 0.00 C ATOM 2024 O VAL A 128 -5.453 -14.724 7.466 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.462 -13.969 6.620 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.933 -15.138 5.766 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.549 -12.657 5.847 1.00 0.00 C ATOM 0 H VAL A 128 -3.401 -15.912 8.431 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.904 -13.000 8.487 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.416 -14.146 6.869 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.358 -15.167 4.840 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.788 -16.070 6.313 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.991 -15.015 5.532 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.987 -12.745 4.917 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.592 -12.436 5.621 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.130 -11.851 6.450 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.239 -12.510 7.739 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.641 -12.236 7.461 1.00 0.00 C ATOM 2039 C ASP A 129 -6.754 -11.474 6.148 1.00 0.00 C ATOM 2040 O ASP A 129 -5.830 -10.761 5.763 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.275 -11.437 8.603 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.788 -11.380 8.500 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.408 -12.439 8.262 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.363 -10.287 8.681 1.00 0.00 O ATOM 0 H ASP A 129 -4.688 -11.686 7.979 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.179 -13.180 7.377 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.995 -11.886 9.556 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.875 -10.423 8.599 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.868 -11.630 5.462 1.00 0.00 N ATOM 2050 CA GLU A 130 -8.037 -11.037 4.149 1.00 0.00 C ATOM 2051 C GLU A 130 -8.766 -9.699 4.221 1.00 0.00 C ATOM 2052 O GLU A 130 -9.821 -9.582 4.848 1.00 0.00 O ATOM 2053 CB GLU A 130 -8.789 -12.006 3.243 1.00 0.00 C ATOM 2054 CG GLU A 130 -9.986 -12.664 3.910 1.00 0.00 C ATOM 2055 CD GLU A 130 -10.714 -13.611 2.985 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -10.200 -14.717 2.735 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -11.811 -13.253 2.509 1.00 0.00 O ATOM 0 H GLU A 130 -8.672 -12.164 5.792 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.048 -10.844 3.734 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -9.128 -11.471 2.356 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -8.101 -12.781 2.905 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -9.652 -13.209 4.793 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -10.676 -11.893 4.253 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.190 -8.695 3.582 1.00 0.00 N ATOM 2065 CA GLU A 131 -8.807 -7.380 3.487 1.00 0.00 C ATOM 2066 C GLU A 131 -9.450 -7.227 2.112 1.00 0.00 C ATOM 2067 O GLU A 131 -8.797 -7.432 1.087 1.00 0.00 O ATOM 2068 CB GLU A 131 -7.755 -6.287 3.702 1.00 0.00 C ATOM 2069 CG GLU A 131 -8.279 -4.867 3.526 1.00 0.00 C ATOM 2070 CD GLU A 131 -9.027 -4.344 4.734 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -10.181 -4.766 4.959 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -8.472 -3.485 5.454 1.00 0.00 O ATOM 0 H GLU A 131 -7.286 -8.766 3.116 1.00 0.00 H new ATOM 0 HA GLU A 131 -9.571 -7.281 4.258 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.344 -6.388 4.706 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.934 -6.448 3.004 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -7.441 -4.203 3.312 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -8.939 -4.837 2.659 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.725 -6.881 2.093 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.459 -6.755 0.840 1.00 0.00 C ATOM 2081 C GLU A 132 -11.181 -5.409 0.190 1.00 0.00 C ATOM 2082 O GLU A 132 -11.150 -4.378 0.865 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.961 -6.928 1.070 1.00 0.00 C ATOM 2084 CG GLU A 132 -13.558 -8.102 0.311 1.00 0.00 C ATOM 2085 CD GLU A 132 -13.457 -7.943 -1.193 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -12.338 -8.055 -1.736 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -14.500 -7.730 -1.843 1.00 0.00 O ATOM 0 H GLU A 132 -11.276 -6.682 2.928 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.119 -7.544 0.170 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.144 -7.063 2.136 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.474 -6.014 0.772 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.049 -9.018 0.610 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.606 -8.214 0.590 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.982 -5.428 -1.122 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.641 -4.224 -1.865 1.00 0.00 C ATOM 2096 C ILE A 133 -11.798 -3.781 -2.750 1.00 0.00 C ATOM 2097 O ILE A 133 -12.371 -4.583 -3.493 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.382 -4.432 -2.738 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -8.200 -4.883 -1.872 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.037 -3.153 -3.491 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.944 -5.166 -2.666 1.00 0.00 C ATOM 0 H ILE A 133 -11.052 -6.269 -1.695 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.433 -3.447 -1.129 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.592 -5.213 -3.468 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.987 -4.111 -1.132 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.484 -5.781 -1.323 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -8.148 -3.318 -4.100 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.871 -2.873 -4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.844 -2.352 -2.778 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.149 -5.480 -1.990 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.141 -5.959 -3.388 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.636 -4.263 -3.194 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.145 -2.505 -2.648 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.163 -1.914 -3.497 1.00 0.00 C ATOM 2115 C ILE A 134 -12.510 -0.961 -4.492 1.00 0.00 C ATOM 2116 O ILE A 134 -11.721 -0.100 -4.097 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.208 -1.135 -2.668 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -14.803 -2.021 -1.570 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.311 -0.595 -3.569 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.530 -3.245 -2.087 1.00 0.00 C ATOM 0 H ILE A 134 -11.730 -1.857 -1.978 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.671 -2.723 -4.022 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.704 -0.293 -2.193 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.002 -2.342 -0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.495 -1.426 -0.973 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.038 -0.049 -2.967 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.879 0.075 -4.312 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.807 -1.424 -4.074 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.921 -3.818 -1.246 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -16.354 -2.934 -2.729 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.839 -3.865 -2.658 1.00 0.00 H new ATOM 2132 N LEU A 135 -12.820 -1.125 -5.774 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.271 -0.256 -6.806 1.00 0.00 C ATOM 2134 C LEU A 135 -13.311 0.756 -7.278 1.00 0.00 C ATOM 2135 O LEU A 135 -14.466 0.400 -7.523 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.786 -1.075 -8.005 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.673 -2.084 -7.715 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.168 -2.703 -9.008 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.527 -1.430 -6.961 1.00 0.00 C ATOM 0 H LEU A 135 -13.447 -1.850 -6.122 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.427 0.277 -6.369 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.638 -1.612 -8.423 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.435 -0.386 -8.774 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.088 -2.872 -7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.377 -3.418 -8.784 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -10.988 -3.215 -9.511 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -9.776 -1.920 -9.657 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.750 -2.169 -6.768 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.114 -0.618 -7.559 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.894 -1.033 -6.014 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.892 2.007 -7.404 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.764 3.075 -7.883 1.00 0.00 C ATOM 2153 C LYS A 136 -12.990 4.078 -8.733 1.00 0.00 C ATOM 2154 O LYS A 136 -11.761 4.115 -8.704 1.00 0.00 O ATOM 2155 CB LYS A 136 -14.417 3.803 -6.703 1.00 0.00 C ATOM 2156 CG LYS A 136 -15.826 3.327 -6.385 1.00 0.00 C ATOM 2157 CD LYS A 136 -16.767 3.572 -7.553 1.00 0.00 C ATOM 2158 CE LYS A 136 -18.210 3.247 -7.201 1.00 0.00 C ATOM 2159 NZ LYS A 136 -18.741 4.124 -6.122 1.00 0.00 N ATOM 0 H LYS A 136 -11.945 2.311 -7.179 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.538 2.618 -8.500 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.793 3.673 -5.819 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -14.446 4.871 -6.919 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.808 2.264 -6.146 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -16.197 3.846 -5.501 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -16.696 4.614 -7.863 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -16.456 2.965 -8.403 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -18.831 3.353 -8.090 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -18.279 2.206 -6.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -19.770 3.995 -6.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -18.292 3.873 -5.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -18.532 5.117 -6.348 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.717 4.882 -9.500 1.00 0.00 N ATOM 2174 CA GLU A 137 -13.115 5.962 -10.270 1.00 0.00 C ATOM 2175 C GLU A 137 -13.094 7.244 -9.457 1.00 0.00 C ATOM 2176 O GLU A 137 -12.249 8.117 -9.643 1.00 0.00 O ATOM 2177 CB GLU A 137 -13.925 6.206 -11.541 1.00 0.00 C ATOM 2178 CG GLU A 137 -13.784 5.130 -12.604 1.00 0.00 C ATOM 2179 CD GLU A 137 -12.375 5.020 -13.144 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -11.871 6.014 -13.710 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -11.774 3.937 -13.014 1.00 0.00 O ATOM 0 H GLU A 137 -14.729 4.805 -9.605 1.00 0.00 H new ATOM 0 HA GLU A 137 -12.095 5.674 -10.524 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -14.978 6.296 -11.272 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -13.623 7.162 -11.969 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -14.083 4.170 -12.184 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -14.467 5.346 -13.425 1.00 0.00 H new ATOM 2188 N GLU A 138 -14.028 7.318 -8.541 1.00 0.00 N ATOM 2189 CA GLU A 138 -14.285 8.525 -7.773 1.00 0.00 C ATOM 2190 C GLU A 138 -13.641 8.486 -6.389 1.00 0.00 C ATOM 2191 O GLU A 138 -13.668 7.464 -5.702 1.00 0.00 O ATOM 2192 CB GLU A 138 -15.794 8.722 -7.650 1.00 0.00 C ATOM 2193 CG GLU A 138 -16.536 7.430 -7.340 1.00 0.00 C ATOM 2194 CD GLU A 138 -18.032 7.613 -7.256 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -18.575 8.449 -8.011 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -18.668 6.927 -6.429 1.00 0.00 O ATOM 0 H GLU A 138 -14.640 6.538 -8.301 1.00 0.00 H new ATOM 0 HA GLU A 138 -13.835 9.365 -8.303 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -15.998 9.450 -6.864 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -16.178 9.141 -8.580 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -16.309 6.693 -8.111 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -16.172 7.026 -6.395 1.00 0.00 H new ATOM 2203 N LEU A 139 -13.061 9.616 -6.000 1.00 0.00 N ATOM 2204 CA LEU A 139 -12.487 9.785 -4.671 1.00 0.00 C ATOM 2205 C LEU A 139 -13.439 10.574 -3.775 1.00 0.00 C ATOM 2206 O LEU A 139 -14.582 10.835 -4.161 1.00 0.00 O ATOM 2207 CB LEU A 139 -11.143 10.517 -4.765 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.944 9.649 -5.152 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.737 10.515 -5.475 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -9.607 8.689 -4.022 1.00 0.00 C ATOM 0 H LEU A 139 -12.976 10.439 -6.596 1.00 0.00 H new ATOM 0 HA LEU A 139 -12.329 8.798 -4.237 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -11.238 11.321 -5.495 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.935 10.984 -3.802 1.00 0.00 H new ATOM 0 HG LEU A 139 -10.207 9.075 -6.041 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.895 9.879 -5.748 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.976 11.177 -6.307 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.473 11.111 -4.602 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.752 8.076 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -9.363 9.256 -3.124 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -10.464 8.046 -3.823 1.00 0.00 H new ATOM 2222 N GLU A 140 -12.936 10.971 -2.598 1.00 0.00 N ATOM 2223 CA GLU A 140 -13.675 11.740 -1.618 1.00 0.00 C ATOM 2224 C GLU A 140 -14.836 10.959 -0.986 1.00 0.00 C ATOM 2225 O GLU A 140 -15.372 10.013 -1.561 1.00 0.00 O ATOM 2226 CB GLU A 140 -14.149 13.032 -2.257 1.00 0.00 C ATOM 2227 CG GLU A 140 -14.842 13.966 -1.305 1.00 0.00 C ATOM 2228 CD GLU A 140 -14.000 14.349 -0.103 1.00 0.00 C ATOM 2229 OE1 GLU A 140 -13.941 13.554 0.864 1.00 0.00 O ATOM 2230 OE2 GLU A 140 -13.419 15.450 -0.105 1.00 0.00 O ATOM 0 H GLU A 140 -11.983 10.756 -2.306 1.00 0.00 H new ATOM 0 HA GLU A 140 -13.002 11.967 -0.791 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -13.292 13.545 -2.694 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -14.829 12.793 -3.075 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -15.127 14.871 -1.841 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -15.763 13.498 -0.958 1.00 0.00 H new ATOM 2237 N HIS A 141 -15.186 11.360 0.231 1.00 0.00 N ATOM 2238 CA HIS A 141 -16.288 10.768 0.977 1.00 0.00 C ATOM 2239 C HIS A 141 -16.867 11.788 1.955 1.00 0.00 C ATOM 2240 O HIS A 141 -18.083 11.883 2.112 1.00 0.00 O ATOM 2241 CB HIS A 141 -15.829 9.518 1.737 1.00 0.00 C ATOM 2242 CG HIS A 141 -16.385 8.238 1.184 1.00 0.00 C ATOM 2243 ND1 HIS A 141 -17.394 7.528 1.799 1.00 0.00 N ATOM 2244 CD2 HIS A 141 -16.060 7.532 0.074 1.00 0.00 C ATOM 2245 CE1 HIS A 141 -17.663 6.447 1.095 1.00 0.00 C ATOM 2246 NE2 HIS A 141 -16.869 6.424 0.044 1.00 0.00 N ATOM 0 H HIS A 141 -14.709 12.111 0.730 1.00 0.00 H new ATOM 0 HA HIS A 141 -17.059 10.473 0.266 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -14.740 9.470 1.716 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -16.124 9.610 2.782 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -15.304 7.793 -0.652 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -18.409 5.705 1.339 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -16.857 5.700 -0.675 1.00 0.00 H new ATOM 2255 N HIS A 142 -15.982 12.548 2.607 1.00 0.00 N ATOM 2256 CA HIS A 142 -16.389 13.597 3.550 1.00 0.00 C ATOM 2257 C HIS A 142 -15.179 14.358 4.097 1.00 0.00 C ATOM 2258 O HIS A 142 -15.129 14.705 5.276 1.00 0.00 O ATOM 2259 CB HIS A 142 -17.241 13.035 4.710 1.00 0.00 C ATOM 2260 CG HIS A 142 -16.654 11.865 5.457 1.00 0.00 C ATOM 2261 ND1 HIS A 142 -17.198 10.601 5.402 1.00 0.00 N ATOM 2262 CD2 HIS A 142 -15.602 11.776 6.308 1.00 0.00 C ATOM 2263 CE1 HIS A 142 -16.511 9.789 6.179 1.00 0.00 C ATOM 2264 NE2 HIS A 142 -15.535 10.472 6.744 1.00 0.00 N ATOM 0 H HIS A 142 -14.972 12.456 2.499 1.00 0.00 H new ATOM 0 HA HIS A 142 -17.010 14.296 2.990 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -17.425 13.840 5.422 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -18.210 12.736 4.310 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -14.939 12.580 6.591 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -16.713 8.739 6.328 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -14.845 10.097 7.395 1.00 0.00 H new ATOM 2273 N HIS A 143 -14.212 14.629 3.232 1.00 0.00 N ATOM 2274 CA HIS A 143 -13.024 15.388 3.614 1.00 0.00 C ATOM 2275 C HIS A 143 -13.198 16.865 3.254 1.00 0.00 C ATOM 2276 O HIS A 143 -12.356 17.698 3.595 1.00 0.00 O ATOM 2277 CB HIS A 143 -11.787 14.804 2.916 1.00 0.00 C ATOM 2278 CG HIS A 143 -10.492 15.470 3.278 1.00 0.00 C ATOM 2279 ND1 HIS A 143 -9.814 16.314 2.426 1.00 0.00 N ATOM 2280 CD2 HIS A 143 -9.736 15.391 4.399 1.00 0.00 C ATOM 2281 CE1 HIS A 143 -8.701 16.722 3.003 1.00 0.00 C ATOM 2282 NE2 HIS A 143 -8.629 16.179 4.200 1.00 0.00 N ATOM 0 H HIS A 143 -14.225 14.334 2.256 1.00 0.00 H new ATOM 0 HA HIS A 143 -12.886 15.314 4.693 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -11.716 13.744 3.159 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -11.928 14.875 1.837 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -9.962 14.815 5.285 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -7.972 17.389 2.567 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -7.874 16.321 4.871 1.00 0.00 H new ATOM 2291 N HIS A 144 -14.309 17.173 2.583 1.00 0.00 N ATOM 2292 CA HIS A 144 -14.619 18.533 2.129 1.00 0.00 C ATOM 2293 C HIS A 144 -13.687 18.952 1.000 1.00 0.00 C ATOM 2294 O HIS A 144 -12.541 19.347 1.229 1.00 0.00 O ATOM 2295 CB HIS A 144 -14.557 19.549 3.278 1.00 0.00 C ATOM 2296 CG HIS A 144 -15.591 19.326 4.334 1.00 0.00 C ATOM 2297 ND1 HIS A 144 -16.855 19.870 4.276 1.00 0.00 N ATOM 2298 CD2 HIS A 144 -15.545 18.608 5.479 1.00 0.00 C ATOM 2299 CE1 HIS A 144 -17.540 19.496 5.339 1.00 0.00 C ATOM 2300 NE2 HIS A 144 -16.768 18.728 6.085 1.00 0.00 N ATOM 0 H HIS A 144 -15.022 16.486 2.338 1.00 0.00 H new ATOM 0 HA HIS A 144 -15.642 18.521 1.754 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -13.568 19.507 3.735 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -14.677 20.553 2.870 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -14.701 18.044 5.848 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -18.560 19.772 5.562 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -17.038 18.295 6.968 1.00 0.00 H new ATOM 2309 N HIS A 145 -14.188 18.871 -0.223 1.00 0.00 N ATOM 2310 CA HIS A 145 -13.368 19.132 -1.402 1.00 0.00 C ATOM 2311 C HIS A 145 -13.854 20.370 -2.157 1.00 0.00 C ATOM 2312 O HIS A 145 -14.200 20.302 -3.338 1.00 0.00 O ATOM 2313 CB HIS A 145 -13.335 17.903 -2.331 1.00 0.00 C ATOM 2314 CG HIS A 145 -14.679 17.466 -2.857 1.00 0.00 C ATOM 2315 ND1 HIS A 145 -15.778 17.003 -2.215 1.00 0.00 N flip ATOM 2316 CD2 HIS A 145 -14.997 17.464 -4.200 1.00 0.00 C flip ATOM 2317 CE1 HIS A 145 -16.726 16.733 -3.170 1.00 0.00 C flip ATOM 2318 NE2 HIS A 145 -16.231 17.019 -4.358 1.00 0.00 N flip ATOM 0 H HIS A 145 -15.157 18.627 -0.428 1.00 0.00 H new ATOM 0 HA HIS A 145 -12.352 19.330 -1.060 1.00 0.00 H new ATOM 0 HB2 HIS A 145 -12.684 18.123 -3.177 1.00 0.00 H new ATOM 0 HB3 HIS A 145 -12.885 17.070 -1.791 1.00 0.00 H new ATOM 0 HD2 HIS A 145 -14.340 17.777 -4.998 1.00 0.00 H new ATOM 0 HE1 HIS A 145 -17.717 16.348 -2.979 1.00 0.00 H new ATOM 0 HE2 HIS A 145 -16.718 16.914 -5.248 1.00 0.00 H new ATOM 2327 N HIS A 146 -13.882 21.500 -1.471 1.00 0.00 N ATOM 2328 CA HIS A 146 -14.274 22.756 -2.092 1.00 0.00 C ATOM 2329 C HIS A 146 -13.757 23.932 -1.270 1.00 0.00 C ATOM 2330 O HIS A 146 -14.543 24.517 -0.501 1.00 0.00 O ATOM 2331 CB HIS A 146 -15.800 22.830 -2.240 1.00 0.00 C ATOM 2332 CG HIS A 146 -16.268 23.991 -3.063 1.00 0.00 C ATOM 2333 ND1 HIS A 146 -17.151 24.936 -2.595 1.00 0.00 N ATOM 2334 CD2 HIS A 146 -15.972 24.350 -4.335 1.00 0.00 C ATOM 2335 CE1 HIS A 146 -17.378 25.828 -3.542 1.00 0.00 C ATOM 2336 NE2 HIS A 146 -16.674 25.494 -4.606 1.00 0.00 N ATOM 2337 OXT HIS A 146 -12.553 24.245 -1.378 1.00 0.00 O ATOM 0 H HIS A 146 -13.638 21.575 -0.483 1.00 0.00 H new ATOM 0 HA HIS A 146 -13.832 22.806 -3.087 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -16.158 21.906 -2.694 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -16.250 22.893 -1.249 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -15.307 23.831 -5.009 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -18.030 26.685 -3.459 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -16.655 26.005 -5.488 1.00 0.00 H new TER 2346 HIS A 146