USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1343 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: B 26 ASN :FLIP amide:sc= -2.09 F(o=-4,f=-2.8) USER MOD Set 1.2: B 91 ASN :FLIP amide:sc= -0.715 F(o=-4,f=-2.8) USER MOD Set 2.1: B 47 CYS SG : rot 180:sc= 0.994 USER MOD Set 2.2: B 55 SER OG : rot -111:sc= 0.377 USER MOD Set 3.1: B 37 SER OG : rot 77:sc= 0.362 USER MOD Set 3.2: B 38 CYS SG : rot 180:sc= -0.355 USER MOD Set 4.1: A 6 LYS NZ :NH3+ 159:sc= 0.239 (180deg=0) USER MOD Set 4.2: A 26 CYS SG : rot -68:sc= 1.31 USER MOD Set 5.1: A 9 LYS NZ :NH3+ 144:sc= -0.211 (180deg=-2.59!) USER MOD Set 5.2: B 75 TYR OH : rot -160:sc= -7.71! USER MOD Single : A 1 MET CE :methyl -141:sc= -0.342 (180deg=-1.45) USER MOD Single : A 1 MET N :NH3+ -139:sc= 0.0181 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -2.71 K(o=-2.7,f=-5.5!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 70:sc= 0.658 USER MOD Single : A 15 SER OG : rot 180:sc= -0.28 USER MOD Single : A 18 LYS NZ :NH3+ -165:sc= 0.405 (180deg=0.287) USER MOD Single : A 25 SER OG : rot 100:sc= -6.25! USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 32 LYS NZ :NH3+ -149:sc= -0.29 (180deg=-2.44!) USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -1.5 K(o=-1.5,f=-6.4!) USER MOD Single : A 44 SER OG : rot -82:sc= -3.88! USER MOD Single : A 47 CYS SG : rot -151:sc= -1.38! USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= -1.55! USER MOD Single : A 66 ASN :FLIP amide:sc= -0.275 F(o=-1.6,f=-0.27) USER MOD Single : A 73 THR OG1 : rot 28:sc= 0.294 USER MOD Single : A 76 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.77) USER MOD Single : A 79 GLN : amide:sc= -0.166 X(o=-0.17,f=0) USER MOD Single : A 81 HIS :FLIP no HD1:sc= 0.162 F(o=-1.4,f=0.16) USER MOD Single : B 12 SER OG : rot 37:sc= 0.297 USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 LYS NZ :NH3+ -129:sc= -1.2 (180deg=-4.25!) USER MOD Single : B 21 CYS SG : rot 55:sc= 0.453 USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 GLN : amide:sc= -0.966 X(o=-0.97,f=-0.97) USER MOD Single : B 32 HIS :FLIP no HD1:sc= -9.42! C(o=-14!,f=-9.4!) USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 THR OG1 : rot -80:sc= -4.3! USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.106 USER MOD Single : B 68 THR OG1 : rot -17:sc= 0.965 USER MOD Single : B 78 CYS SG : rot -30:sc= -0.293 USER MOD Single : B 81 SER OG : rot -20:sc= -0.461 USER MOD Single : B 82 ASN : amide:sc= -0.0329 K(o=-0.033,f=-1.3) USER MOD Single : B 83 THR OG1 : rot -83:sc= 0.699 USER MOD Single : B 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 SER OG : rot -130:sc= -0.023 USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 96 TYR OH : rot 180:sc= 0 USER MOD Single : B 97 ASN : amide:sc= -0.276 X(o=-0.28,f=-0.28) USER MOD Single : B 98 ASN : amide:sc=-0.00754 K(o=-0.0075,f=-1.7!) USER MOD Single : B 99 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.771 11.695 7.298 1.00 0.00 N ATOM 2 CA MET A 1 -0.477 12.373 7.592 1.00 0.00 C ATOM 3 C MET A 1 -0.588 13.874 7.308 1.00 0.00 C ATOM 4 O MET A 1 -1.613 14.485 7.533 1.00 0.00 O ATOM 5 CB MET A 1 0.531 11.717 6.648 1.00 0.00 C ATOM 6 CG MET A 1 1.932 11.806 7.252 1.00 0.00 C ATOM 7 SD MET A 1 2.734 10.186 7.153 1.00 0.00 S ATOM 8 CE MET A 1 4.415 10.787 6.866 1.00 0.00 C ATOM 0 H1 MET A 1 -1.969 10.989 8.036 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.536 12.400 7.279 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.713 11.222 6.373 1.00 0.00 H new ATOM 0 HA MET A 1 -0.183 12.273 8.637 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.262 10.674 6.480 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.511 12.212 5.677 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.523 12.550 6.718 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.872 12.132 8.291 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.913 10.142 6.142 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.376 11.805 6.479 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.970 10.776 7.804 1.00 0.00 H new ATOM 20 N LEU A 2 0.464 14.472 6.822 1.00 0.00 N ATOM 21 CA LEU A 2 0.431 15.933 6.527 1.00 0.00 C ATOM 22 C LEU A 2 -0.464 16.221 5.326 1.00 0.00 C ATOM 23 O LEU A 2 -1.138 15.352 4.810 1.00 0.00 O ATOM 24 CB LEU A 2 1.868 16.319 6.199 1.00 0.00 C ATOM 25 CG LEU A 2 2.525 16.941 7.428 1.00 0.00 C ATOM 26 CD1 LEU A 2 3.731 16.098 7.847 1.00 0.00 C ATOM 27 CD2 LEU A 2 2.983 18.359 7.083 1.00 0.00 C ATOM 0 H LEU A 2 1.350 14.010 6.615 1.00 0.00 H new ATOM 0 HA LEU A 2 0.034 16.497 7.371 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.428 15.439 5.881 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.885 17.025 5.369 1.00 0.00 H new ATOM 0 HG LEU A 2 1.811 16.975 8.251 1.00 0.00 H new ATOM 0 HD11 LEU A 2 4.199 16.544 8.725 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.403 15.086 8.085 1.00 0.00 H new ATOM 0 HD13 LEU A 2 4.452 16.063 7.030 1.00 0.00 H new ATOM 0 HD21 LEU A 2 3.454 18.812 7.956 1.00 0.00 H new ATOM 0 HD22 LEU A 2 3.700 18.320 6.263 1.00 0.00 H new ATOM 0 HD23 LEU A 2 2.122 18.957 6.784 1.00 0.00 H new ATOM 39 N GLN A 3 -0.466 17.441 4.878 1.00 0.00 N ATOM 40 CA GLN A 3 -1.306 17.805 3.706 1.00 0.00 C ATOM 41 C GLN A 3 -0.425 17.968 2.468 1.00 0.00 C ATOM 42 O GLN A 3 -0.709 18.752 1.585 1.00 0.00 O ATOM 43 CB GLN A 3 -1.933 19.141 4.094 1.00 0.00 C ATOM 44 CG GLN A 3 -3.458 19.016 4.099 1.00 0.00 C ATOM 45 CD GLN A 3 -3.994 19.258 2.689 1.00 0.00 C ATOM 46 OE1 GLN A 3 -4.335 20.369 2.338 1.00 0.00 O ATOM 47 NE2 GLN A 3 -4.082 18.255 1.858 1.00 0.00 N ATOM 0 H GLN A 3 0.080 18.206 5.274 1.00 0.00 H new ATOM 0 HA GLN A 3 -2.055 17.049 3.468 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -1.581 19.446 5.079 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -1.625 19.915 3.392 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -3.751 18.025 4.446 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.890 19.737 4.793 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.795 17.322 2.153 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.437 18.405 0.914 1.00 0.00 H new ATOM 56 N LYS A 4 0.638 17.218 2.395 1.00 0.00 N ATOM 57 CA LYS A 4 1.540 17.308 1.212 1.00 0.00 C ATOM 58 C LYS A 4 2.658 16.269 1.322 1.00 0.00 C ATOM 59 O LYS A 4 3.824 16.610 1.325 1.00 0.00 O ATOM 60 CB LYS A 4 2.116 18.724 1.257 1.00 0.00 C ATOM 61 CG LYS A 4 1.515 19.556 0.121 1.00 0.00 C ATOM 62 CD LYS A 4 2.575 20.510 -0.434 1.00 0.00 C ATOM 63 CE LYS A 4 2.215 21.950 -0.058 1.00 0.00 C ATOM 64 NZ LYS A 4 2.449 22.740 -1.299 1.00 0.00 N ATOM 0 H LYS A 4 0.923 16.544 3.106 1.00 0.00 H new ATOM 0 HA LYS A 4 1.015 17.113 0.277 1.00 0.00 H new ATOM 0 HB2 LYS A 4 1.894 19.188 2.218 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.201 18.690 1.162 1.00 0.00 H new ATOM 0 HG2 LYS A 4 1.151 18.900 -0.670 1.00 0.00 H new ATOM 0 HG3 LYS A 4 0.657 20.122 0.485 1.00 0.00 H new ATOM 0 HD2 LYS A 4 3.556 20.253 -0.034 1.00 0.00 H new ATOM 0 HD3 LYS A 4 2.637 20.411 -1.518 1.00 0.00 H new ATOM 0 HE2 LYS A 4 1.178 22.026 0.269 1.00 0.00 H new ATOM 0 HE3 LYS A 4 2.835 22.311 0.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 2.224 23.740 -1.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 3.446 22.654 -1.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 1.841 22.378 -2.061 1.00 0.00 H new ATOM 78 N PRO A 5 2.260 15.029 1.407 1.00 0.00 N ATOM 79 CA PRO A 5 3.236 13.922 1.517 1.00 0.00 C ATOM 80 C PRO A 5 3.821 13.584 0.142 1.00 0.00 C ATOM 81 O PRO A 5 3.411 14.123 -0.866 1.00 0.00 O ATOM 82 CB PRO A 5 2.400 12.763 2.048 1.00 0.00 C ATOM 83 CG PRO A 5 0.993 13.059 1.622 1.00 0.00 C ATOM 84 CD PRO A 5 0.875 14.550 1.414 1.00 0.00 C ATOM 0 HA PRO A 5 4.085 14.161 2.158 1.00 0.00 H new ATOM 0 HB2 PRO A 5 2.742 11.812 1.640 1.00 0.00 H new ATOM 0 HB3 PRO A 5 2.475 12.689 3.133 1.00 0.00 H new ATOM 0 HG2 PRO A 5 0.752 12.525 0.703 1.00 0.00 H new ATOM 0 HG3 PRO A 5 0.286 12.722 2.380 1.00 0.00 H new ATOM 0 HD2 PRO A 5 0.370 14.781 0.476 1.00 0.00 H new ATOM 0 HD3 PRO A 5 0.297 15.018 2.211 1.00 0.00 H new ATOM 92 N LYS A 6 4.773 12.693 0.096 1.00 0.00 N ATOM 93 CA LYS A 6 5.381 12.319 -1.214 1.00 0.00 C ATOM 94 C LYS A 6 4.811 10.981 -1.694 1.00 0.00 C ATOM 95 O LYS A 6 4.698 10.038 -0.937 1.00 0.00 O ATOM 96 CB LYS A 6 6.879 12.196 -0.936 1.00 0.00 C ATOM 97 CG LYS A 6 7.661 12.965 -2.001 1.00 0.00 C ATOM 98 CD LYS A 6 9.157 12.895 -1.689 1.00 0.00 C ATOM 99 CE LYS A 6 9.621 14.236 -1.114 1.00 0.00 C ATOM 100 NZ LYS A 6 10.228 13.899 0.204 1.00 0.00 N ATOM 0 H LYS A 6 5.156 12.208 0.907 1.00 0.00 H new ATOM 0 HA LYS A 6 5.172 13.053 -1.993 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.109 12.589 0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 6 7.175 11.147 -0.939 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.465 12.543 -2.987 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.333 14.004 -2.028 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.354 12.094 -0.977 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.718 12.662 -2.594 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.345 14.718 -1.771 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.786 14.927 -0.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.870 14.663 0.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.476 13.787 0.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.762 13.010 0.123 1.00 0.00 H new ATOM 114 N SER A 7 4.451 10.893 -2.945 1.00 0.00 N ATOM 115 CA SER A 7 3.886 9.616 -3.471 1.00 0.00 C ATOM 116 C SER A 7 5.010 8.622 -3.775 1.00 0.00 C ATOM 117 O SER A 7 5.848 8.859 -4.623 1.00 0.00 O ATOM 118 CB SER A 7 3.159 10.008 -4.756 1.00 0.00 C ATOM 119 OG SER A 7 3.800 11.140 -5.332 1.00 0.00 O ATOM 0 H SER A 7 4.523 11.649 -3.626 1.00 0.00 H new ATOM 0 HA SER A 7 3.222 9.133 -2.754 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.165 9.175 -5.459 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.115 10.237 -4.542 1.00 0.00 H new ATOM 0 HG SER A 7 4.679 10.878 -5.678 1.00 0.00 H new ATOM 125 N VAL A 8 5.037 7.510 -3.090 1.00 0.00 N ATOM 126 CA VAL A 8 6.109 6.504 -3.345 1.00 0.00 C ATOM 127 C VAL A 8 5.537 5.083 -3.288 1.00 0.00 C ATOM 128 O VAL A 8 5.210 4.577 -2.233 1.00 0.00 O ATOM 129 CB VAL A 8 7.127 6.720 -2.226 1.00 0.00 C ATOM 130 CG1 VAL A 8 6.402 6.814 -0.883 1.00 0.00 C ATOM 131 CG2 VAL A 8 8.107 5.545 -2.195 1.00 0.00 C ATOM 0 H VAL A 8 4.365 7.255 -2.366 1.00 0.00 H new ATOM 0 HA VAL A 8 6.556 6.621 -4.332 1.00 0.00 H new ATOM 0 HB VAL A 8 7.673 7.646 -2.408 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.130 6.968 -0.087 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.704 7.651 -0.904 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.854 5.890 -0.700 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.834 5.698 -1.397 1.00 0.00 H new ATOM 0 HG22 VAL A 8 7.560 4.620 -2.015 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.626 5.479 -3.151 1.00 0.00 H new ATOM 141 N LYS A 9 5.421 4.433 -4.415 1.00 0.00 N ATOM 142 CA LYS A 9 4.877 3.042 -4.428 1.00 0.00 C ATOM 143 C LYS A 9 5.999 2.037 -4.137 1.00 0.00 C ATOM 144 O LYS A 9 6.956 1.931 -4.879 1.00 0.00 O ATOM 145 CB LYS A 9 4.341 2.845 -5.845 1.00 0.00 C ATOM 146 CG LYS A 9 3.060 3.660 -6.024 1.00 0.00 C ATOM 147 CD LYS A 9 2.785 3.863 -7.516 1.00 0.00 C ATOM 148 CE LYS A 9 1.841 5.053 -7.706 1.00 0.00 C ATOM 149 NZ LYS A 9 2.531 6.202 -7.055 1.00 0.00 N ATOM 0 H LYS A 9 5.680 4.805 -5.329 1.00 0.00 H new ATOM 0 HA LYS A 9 4.106 2.890 -3.673 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.088 3.157 -6.574 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.141 1.789 -6.026 1.00 0.00 H new ATOM 0 HG2 LYS A 9 2.221 3.145 -5.556 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.159 4.625 -5.527 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.720 4.039 -8.048 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.341 2.962 -7.940 1.00 0.00 H new ATOM 0 HE2 LYS A 9 1.661 5.249 -8.763 1.00 0.00 H new ATOM 0 HE3 LYS A 9 0.871 4.864 -7.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.346 7.070 -7.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.174 6.317 -6.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.555 6.022 -7.028 1.00 0.00 H new ATOM 163 N LEU A 10 5.893 1.302 -3.063 1.00 0.00 N ATOM 164 CA LEU A 10 6.958 0.309 -2.728 1.00 0.00 C ATOM 165 C LEU A 10 6.763 -0.981 -3.529 1.00 0.00 C ATOM 166 O LEU A 10 5.746 -1.185 -4.162 1.00 0.00 O ATOM 167 CB LEU A 10 6.792 0.032 -1.235 1.00 0.00 C ATOM 168 CG LEU A 10 8.088 0.372 -0.500 1.00 0.00 C ATOM 169 CD1 LEU A 10 7.866 0.250 1.008 1.00 0.00 C ATOM 170 CD2 LEU A 10 9.189 -0.600 -0.931 1.00 0.00 C ATOM 0 H LEU A 10 5.117 1.345 -2.403 1.00 0.00 H new ATOM 0 HA LEU A 10 7.952 0.686 -2.969 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.970 0.625 -0.835 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.537 -1.016 -1.076 1.00 0.00 H new ATOM 0 HG LEU A 10 8.386 1.392 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 10 8.790 0.492 1.533 1.00 0.00 H new ATOM 0 HD12 LEU A 10 7.081 0.940 1.317 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.568 -0.770 1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 10 10.114 -0.358 -0.407 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.890 -1.620 -0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.348 -0.516 -2.006 1.00 0.00 H new ATOM 182 N ARG A 11 7.732 -1.854 -3.496 1.00 0.00 N ATOM 183 CA ARG A 11 7.610 -3.139 -4.246 1.00 0.00 C ATOM 184 C ARG A 11 8.310 -4.269 -3.482 1.00 0.00 C ATOM 185 O ARG A 11 8.988 -4.042 -2.500 1.00 0.00 O ATOM 186 CB ARG A 11 8.302 -2.890 -5.587 1.00 0.00 C ATOM 187 CG ARG A 11 7.938 -4.014 -6.560 1.00 0.00 C ATOM 188 CD ARG A 11 8.258 -3.579 -7.992 1.00 0.00 C ATOM 189 NE ARG A 11 7.053 -3.953 -8.784 1.00 0.00 N ATOM 190 CZ ARG A 11 5.965 -3.236 -8.701 1.00 0.00 C ATOM 191 NH1 ARG A 11 5.926 -2.188 -7.924 1.00 0.00 N ATOM 192 NH2 ARG A 11 4.910 -3.569 -9.396 1.00 0.00 N ATOM 0 H ARG A 11 8.605 -1.734 -2.982 1.00 0.00 H new ATOM 0 HA ARG A 11 6.570 -3.440 -4.376 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.995 -1.927 -5.995 1.00 0.00 H new ATOM 0 HB3 ARG A 11 9.382 -2.848 -5.450 1.00 0.00 H new ATOM 0 HG2 ARG A 11 8.494 -4.918 -6.311 1.00 0.00 H new ATOM 0 HG3 ARG A 11 6.879 -4.257 -6.471 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.449 -2.507 -8.046 1.00 0.00 H new ATOM 0 HD3 ARG A 11 9.149 -4.081 -8.368 1.00 0.00 H new ATOM 0 HE ARG A 11 7.078 -4.771 -9.393 1.00 0.00 H new ATOM 0 HH11 ARG A 11 6.747 -1.926 -7.379 1.00 0.00 H new ATOM 0 HH12 ARG A 11 5.074 -1.631 -7.862 1.00 0.00 H new ATOM 0 HH21 ARG A 11 4.937 -4.388 -10.003 1.00 0.00 H new ATOM 0 HH22 ARG A 11 4.060 -3.010 -9.332 1.00 0.00 H new ATOM 206 N ALA A 12 8.148 -5.485 -3.927 1.00 0.00 N ATOM 207 CA ALA A 12 8.801 -6.633 -3.232 1.00 0.00 C ATOM 208 C ALA A 12 9.331 -7.641 -4.261 1.00 0.00 C ATOM 209 O ALA A 12 8.984 -7.593 -5.424 1.00 0.00 O ATOM 210 CB ALA A 12 7.694 -7.263 -2.386 1.00 0.00 C ATOM 0 H ALA A 12 7.590 -5.735 -4.744 1.00 0.00 H new ATOM 0 HA ALA A 12 9.651 -6.321 -2.625 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.094 -8.118 -1.841 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.314 -6.527 -1.678 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.883 -7.594 -3.035 1.00 0.00 H new ATOM 216 N LEU A 13 10.168 -8.551 -3.841 1.00 0.00 N ATOM 217 CA LEU A 13 10.715 -9.558 -4.797 1.00 0.00 C ATOM 218 C LEU A 13 10.277 -10.968 -4.388 1.00 0.00 C ATOM 219 O LEU A 13 9.652 -11.678 -5.150 1.00 0.00 O ATOM 220 CB LEU A 13 12.235 -9.418 -4.701 1.00 0.00 C ATOM 221 CG LEU A 13 12.680 -8.153 -5.439 1.00 0.00 C ATOM 222 CD1 LEU A 13 14.180 -7.940 -5.231 1.00 0.00 C ATOM 223 CD2 LEU A 13 12.391 -8.310 -6.933 1.00 0.00 C ATOM 0 H LEU A 13 10.496 -8.641 -2.880 1.00 0.00 H new ATOM 0 HA LEU A 13 10.357 -9.397 -5.814 1.00 0.00 H new ATOM 0 HB2 LEU A 13 12.541 -9.368 -3.656 1.00 0.00 H new ATOM 0 HB3 LEU A 13 12.719 -10.293 -5.134 1.00 0.00 H new ATOM 0 HG LEU A 13 12.135 -7.294 -5.049 1.00 0.00 H new ATOM 0 HD11 LEU A 13 14.496 -7.039 -5.757 1.00 0.00 H new ATOM 0 HD12 LEU A 13 14.388 -7.831 -4.167 1.00 0.00 H new ATOM 0 HD13 LEU A 13 14.727 -8.798 -5.621 1.00 0.00 H new ATOM 0 HD21 LEU A 13 12.707 -7.410 -7.461 1.00 0.00 H new ATOM 0 HD22 LEU A 13 12.938 -9.169 -7.321 1.00 0.00 H new ATOM 0 HD23 LEU A 13 11.322 -8.462 -7.083 1.00 0.00 H new ATOM 235 N ARG A 14 10.599 -11.379 -3.192 1.00 0.00 N ATOM 236 CA ARG A 14 10.197 -12.744 -2.741 1.00 0.00 C ATOM 237 C ARG A 14 8.741 -13.013 -3.129 1.00 0.00 C ATOM 238 O ARG A 14 8.445 -13.929 -3.871 1.00 0.00 O ATOM 239 CB ARG A 14 10.355 -12.721 -1.220 1.00 0.00 C ATOM 240 CG ARG A 14 10.333 -14.152 -0.682 1.00 0.00 C ATOM 241 CD ARG A 14 10.189 -14.123 0.842 1.00 0.00 C ATOM 242 NE ARG A 14 11.582 -14.036 1.358 1.00 0.00 N ATOM 243 CZ ARG A 14 11.816 -14.141 2.639 1.00 0.00 C ATOM 244 NH1 ARG A 14 10.828 -14.321 3.474 1.00 0.00 N ATOM 245 NH2 ARG A 14 13.040 -14.063 3.085 1.00 0.00 N ATOM 0 H ARG A 14 11.122 -10.831 -2.508 1.00 0.00 H new ATOM 0 HA ARG A 14 10.800 -13.529 -3.198 1.00 0.00 H new ATOM 0 HB2 ARG A 14 11.292 -12.234 -0.949 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.551 -12.140 -0.769 1.00 0.00 H new ATOM 0 HG2 ARG A 14 9.506 -14.706 -1.126 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.250 -14.671 -0.961 1.00 0.00 H new ATOM 0 HD2 ARG A 14 9.594 -13.269 1.166 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.687 -15.019 1.208 1.00 0.00 H new ATOM 0 HE ARG A 14 12.356 -13.894 0.710 1.00 0.00 H new ATOM 0 HH11 ARG A 14 9.871 -14.380 3.126 1.00 0.00 H new ATOM 0 HH12 ARG A 14 11.014 -14.403 4.474 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.812 -13.920 2.434 1.00 0.00 H new ATOM 0 HH22 ARG A 14 13.225 -14.145 4.085 1.00 0.00 H new ATOM 259 N SER A 15 7.830 -12.219 -2.637 1.00 0.00 N ATOM 260 CA SER A 15 6.394 -12.422 -2.981 1.00 0.00 C ATOM 261 C SER A 15 5.943 -11.353 -3.979 1.00 0.00 C ATOM 262 O SER A 15 6.379 -10.221 -3.913 1.00 0.00 O ATOM 263 CB SER A 15 5.644 -12.273 -1.659 1.00 0.00 C ATOM 264 OG SER A 15 4.308 -12.733 -1.821 1.00 0.00 O ATOM 0 H SER A 15 8.019 -11.437 -2.010 1.00 0.00 H new ATOM 0 HA SER A 15 6.209 -13.392 -3.443 1.00 0.00 H new ATOM 0 HB2 SER A 15 6.145 -12.844 -0.877 1.00 0.00 H new ATOM 0 HB3 SER A 15 5.646 -11.230 -1.343 1.00 0.00 H new ATOM 0 HG SER A 15 3.825 -12.640 -0.973 1.00 0.00 H new ATOM 270 N PRO A 16 5.082 -11.749 -4.876 1.00 0.00 N ATOM 271 CA PRO A 16 4.571 -10.809 -5.901 1.00 0.00 C ATOM 272 C PRO A 16 3.568 -9.834 -5.278 1.00 0.00 C ATOM 273 O PRO A 16 2.372 -10.034 -5.339 1.00 0.00 O ATOM 274 CB PRO A 16 3.883 -11.722 -6.911 1.00 0.00 C ATOM 275 CG PRO A 16 3.511 -12.949 -6.139 1.00 0.00 C ATOM 276 CD PRO A 16 4.512 -13.093 -5.019 1.00 0.00 C ATOM 0 HA PRO A 16 5.353 -10.196 -6.350 1.00 0.00 H new ATOM 0 HB2 PRO A 16 3.002 -11.243 -7.339 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.548 -11.965 -7.740 1.00 0.00 H new ATOM 0 HG2 PRO A 16 2.500 -12.862 -5.742 1.00 0.00 H new ATOM 0 HG3 PRO A 16 3.526 -13.828 -6.783 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.034 -13.424 -4.097 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.279 -13.828 -5.262 1.00 0.00 H new ATOM 284 N ARG A 17 4.049 -8.776 -4.682 1.00 0.00 N ATOM 285 CA ARG A 17 3.125 -7.786 -4.060 1.00 0.00 C ATOM 286 C ARG A 17 3.701 -6.374 -4.190 1.00 0.00 C ATOM 287 O ARG A 17 4.897 -6.190 -4.294 1.00 0.00 O ATOM 288 CB ARG A 17 3.032 -8.197 -2.590 1.00 0.00 C ATOM 289 CG ARG A 17 1.835 -7.501 -1.940 1.00 0.00 C ATOM 290 CD ARG A 17 1.434 -8.251 -0.667 1.00 0.00 C ATOM 291 NE ARG A 17 0.148 -8.921 -1.004 1.00 0.00 N ATOM 292 CZ ARG A 17 -0.629 -9.365 -0.053 1.00 0.00 C ATOM 293 NH1 ARG A 17 -0.282 -9.226 1.199 1.00 0.00 N ATOM 294 NH2 ARG A 17 -1.756 -9.951 -0.353 1.00 0.00 N ATOM 0 H ARG A 17 5.041 -8.555 -4.599 1.00 0.00 H new ATOM 0 HA ARG A 17 2.146 -7.775 -4.540 1.00 0.00 H new ATOM 0 HB2 ARG A 17 2.925 -9.279 -2.510 1.00 0.00 H new ATOM 0 HB3 ARG A 17 3.950 -7.928 -2.068 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.088 -6.468 -1.701 1.00 0.00 H new ATOM 0 HG3 ARG A 17 0.997 -7.471 -2.636 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.194 -8.978 -0.381 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.314 -7.567 0.173 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.127 -9.033 -1.980 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.599 -8.769 1.436 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.892 -9.574 1.939 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -2.029 -10.062 -1.329 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -2.364 -10.298 0.389 1.00 0.00 H new ATOM 308 N LYS A 18 2.862 -5.376 -4.179 1.00 0.00 N ATOM 309 CA LYS A 18 3.368 -3.978 -4.296 1.00 0.00 C ATOM 310 C LYS A 18 2.584 -3.055 -3.359 1.00 0.00 C ATOM 311 O LYS A 18 1.410 -2.811 -3.550 1.00 0.00 O ATOM 312 CB LYS A 18 3.134 -3.587 -5.756 1.00 0.00 C ATOM 313 CG LYS A 18 1.726 -4.009 -6.180 1.00 0.00 C ATOM 314 CD LYS A 18 1.563 -3.792 -7.686 1.00 0.00 C ATOM 315 CE LYS A 18 0.074 -3.704 -8.031 1.00 0.00 C ATOM 316 NZ LYS A 18 0.010 -3.909 -9.505 1.00 0.00 N ATOM 0 H LYS A 18 1.850 -5.467 -4.094 1.00 0.00 H new ATOM 0 HA LYS A 18 4.419 -3.895 -4.019 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.255 -2.511 -5.879 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.876 -4.066 -6.395 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.558 -5.057 -5.932 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.981 -3.429 -5.635 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.072 -2.877 -7.990 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.026 -4.612 -8.235 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -0.500 -4.464 -7.501 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.341 -2.736 -7.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -0.924 -3.616 -9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 0.748 -3.340 -9.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.161 -4.915 -9.723 1.00 0.00 H new ATOM 330 N PHE A 19 3.228 -2.539 -2.347 1.00 0.00 N ATOM 331 CA PHE A 19 2.525 -1.633 -1.399 1.00 0.00 C ATOM 332 C PHE A 19 2.711 -0.179 -1.834 1.00 0.00 C ATOM 333 O PHE A 19 3.803 0.246 -2.150 1.00 0.00 O ATOM 334 CB PHE A 19 3.207 -1.872 -0.052 1.00 0.00 C ATOM 335 CG PHE A 19 2.897 -3.266 0.438 1.00 0.00 C ATOM 336 CD1 PHE A 19 3.436 -4.375 -0.224 1.00 0.00 C ATOM 337 CD2 PHE A 19 2.075 -3.449 1.556 1.00 0.00 C ATOM 338 CE1 PHE A 19 3.152 -5.668 0.232 1.00 0.00 C ATOM 339 CE2 PHE A 19 1.792 -4.741 2.014 1.00 0.00 C ATOM 340 CZ PHE A 19 2.331 -5.851 1.351 1.00 0.00 C ATOM 0 H PHE A 19 4.212 -2.707 -2.137 1.00 0.00 H new ATOM 0 HA PHE A 19 1.453 -1.824 -1.357 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.285 -1.743 -0.152 1.00 0.00 H new ATOM 0 HB3 PHE A 19 2.864 -1.136 0.675 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.071 -4.234 -1.086 1.00 0.00 H new ATOM 0 HD2 PHE A 19 1.659 -2.593 2.066 1.00 0.00 H new ATOM 0 HE1 PHE A 19 3.566 -6.524 -0.280 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.159 -4.882 2.878 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.113 -6.848 1.703 1.00 0.00 H new ATOM 350 N GLY A 20 1.658 0.589 -1.853 1.00 0.00 N ATOM 351 CA GLY A 20 1.795 2.012 -2.266 1.00 0.00 C ATOM 352 C GLY A 20 1.465 2.924 -1.085 1.00 0.00 C ATOM 353 O GLY A 20 0.382 2.881 -0.536 1.00 0.00 O ATOM 0 H GLY A 20 0.714 0.295 -1.602 1.00 0.00 H new ATOM 0 HA2 GLY A 20 2.810 2.204 -2.614 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.127 2.225 -3.100 1.00 0.00 H new ATOM 357 N VAL A 21 2.395 3.749 -0.690 1.00 0.00 N ATOM 358 CA VAL A 21 2.148 4.671 0.457 1.00 0.00 C ATOM 359 C VAL A 21 2.771 6.039 0.167 1.00 0.00 C ATOM 360 O VAL A 21 3.882 6.133 -0.316 1.00 0.00 O ATOM 361 CB VAL A 21 2.833 4.006 1.651 1.00 0.00 C ATOM 362 CG1 VAL A 21 2.866 4.977 2.833 1.00 0.00 C ATOM 363 CG2 VAL A 21 2.056 2.749 2.047 1.00 0.00 C ATOM 0 H VAL A 21 3.320 3.825 -1.113 1.00 0.00 H new ATOM 0 HA VAL A 21 1.087 4.837 0.641 1.00 0.00 H new ATOM 0 HB VAL A 21 3.853 3.735 1.378 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.355 4.500 3.682 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.419 5.873 2.552 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.847 5.251 3.108 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.543 2.273 2.898 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.036 3.022 2.318 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.034 2.055 1.207 1.00 0.00 H new ATOM 373 N ALA A 22 2.068 7.098 0.453 1.00 0.00 N ATOM 374 CA ALA A 22 2.629 8.455 0.187 1.00 0.00 C ATOM 375 C ALA A 22 2.863 9.200 1.503 1.00 0.00 C ATOM 376 O ALA A 22 1.999 9.898 1.994 1.00 0.00 O ATOM 377 CB ALA A 22 1.567 9.165 -0.652 1.00 0.00 C ATOM 0 H ALA A 22 1.132 7.085 0.858 1.00 0.00 H new ATOM 0 HA ALA A 22 3.590 8.411 -0.325 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.906 10.173 -0.890 1.00 0.00 H new ATOM 0 HB2 ALA A 22 1.402 8.610 -1.576 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.635 9.219 -0.090 1.00 0.00 H new ATOM 383 N GLY A 23 4.027 9.058 2.078 1.00 0.00 N ATOM 384 CA GLY A 23 4.313 9.758 3.361 1.00 0.00 C ATOM 385 C GLY A 23 5.377 10.833 3.130 1.00 0.00 C ATOM 386 O GLY A 23 6.335 10.628 2.412 1.00 0.00 O ATOM 0 H GLY A 23 4.791 8.488 1.714 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.402 10.211 3.751 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.659 9.044 4.108 1.00 0.00 H new ATOM 390 N ARG A 24 5.219 11.977 3.737 1.00 0.00 N ATOM 391 CA ARG A 24 6.223 13.063 3.553 1.00 0.00 C ATOM 392 C ARG A 24 7.557 12.661 4.191 1.00 0.00 C ATOM 393 O ARG A 24 8.614 13.069 3.753 1.00 0.00 O ATOM 394 CB ARG A 24 5.629 14.274 4.272 1.00 0.00 C ATOM 395 CG ARG A 24 6.393 15.536 3.865 1.00 0.00 C ATOM 396 CD ARG A 24 6.163 16.630 4.910 1.00 0.00 C ATOM 397 NE ARG A 24 7.094 17.727 4.528 1.00 0.00 N ATOM 398 CZ ARG A 24 7.014 18.890 5.120 1.00 0.00 C ATOM 399 NH1 ARG A 24 6.118 19.095 6.048 1.00 0.00 N ATOM 400 NH2 ARG A 24 7.832 19.849 4.781 1.00 0.00 N ATOM 0 H ARG A 24 4.439 12.207 4.352 1.00 0.00 H new ATOM 0 HA ARG A 24 6.423 13.270 2.502 1.00 0.00 H new ATOM 0 HB2 ARG A 24 4.574 14.378 4.020 1.00 0.00 H new ATOM 0 HB3 ARG A 24 5.687 14.134 5.351 1.00 0.00 H new ATOM 0 HG2 ARG A 24 7.458 15.318 3.779 1.00 0.00 H new ATOM 0 HG3 ARG A 24 6.058 15.877 2.886 1.00 0.00 H new ATOM 0 HD2 ARG A 24 5.128 16.971 4.904 1.00 0.00 H new ATOM 0 HD3 ARG A 24 6.373 16.266 5.916 1.00 0.00 H new ATOM 0 HE ARG A 24 7.795 17.571 3.804 1.00 0.00 H new ATOM 0 HH11 ARG A 24 5.478 18.346 6.313 1.00 0.00 H new ATOM 0 HH12 ARG A 24 6.059 20.004 6.508 1.00 0.00 H new ATOM 0 HH21 ARG A 24 8.531 19.690 4.056 1.00 0.00 H new ATOM 0 HH22 ARG A 24 7.772 20.757 5.241 1.00 0.00 H new ATOM 414 N SER A 25 7.511 11.863 5.222 1.00 0.00 N ATOM 415 CA SER A 25 8.772 11.431 5.890 1.00 0.00 C ATOM 416 C SER A 25 9.427 10.293 5.095 1.00 0.00 C ATOM 417 O SER A 25 9.008 9.155 5.157 1.00 0.00 O ATOM 418 CB SER A 25 8.335 10.965 7.276 1.00 0.00 C ATOM 419 OG SER A 25 9.487 10.754 8.084 1.00 0.00 O ATOM 0 H SER A 25 6.654 11.491 5.631 1.00 0.00 H new ATOM 0 HA SER A 25 9.514 12.227 5.951 1.00 0.00 H new ATOM 0 HB2 SER A 25 7.686 11.710 7.735 1.00 0.00 H new ATOM 0 HB3 SER A 25 7.757 10.044 7.198 1.00 0.00 H new ATOM 0 HG SER A 25 9.622 11.528 8.670 1.00 0.00 H new ATOM 425 N CYS A 26 10.446 10.604 4.338 1.00 0.00 N ATOM 426 CA CYS A 26 11.133 9.561 3.519 1.00 0.00 C ATOM 427 C CYS A 26 11.501 8.342 4.370 1.00 0.00 C ATOM 428 O CYS A 26 10.786 7.359 4.395 1.00 0.00 O ATOM 429 CB CYS A 26 12.395 10.243 2.991 1.00 0.00 C ATOM 430 SG CYS A 26 11.933 11.555 1.834 1.00 0.00 S ATOM 0 H CYS A 26 10.835 11.543 4.251 1.00 0.00 H new ATOM 0 HA CYS A 26 10.493 9.193 2.717 1.00 0.00 H new ATOM 0 HB2 CYS A 26 12.970 10.659 3.819 1.00 0.00 H new ATOM 0 HB3 CYS A 26 13.034 9.514 2.494 1.00 0.00 H new ATOM 0 HG CYS A 26 11.430 11.027 0.758 1.00 0.00 H new ATOM 436 N GLN A 27 12.615 8.397 5.056 1.00 0.00 N ATOM 437 CA GLN A 27 13.043 7.239 5.902 1.00 0.00 C ATOM 438 C GLN A 27 11.827 6.595 6.568 1.00 0.00 C ATOM 439 O GLN A 27 11.624 5.399 6.498 1.00 0.00 O ATOM 440 CB GLN A 27 13.975 7.840 6.955 1.00 0.00 C ATOM 441 CG GLN A 27 14.346 6.766 7.979 1.00 0.00 C ATOM 442 CD GLN A 27 15.468 7.286 8.881 1.00 0.00 C ATOM 443 OE1 GLN A 27 15.516 8.458 9.196 1.00 0.00 O ATOM 444 NE2 GLN A 27 16.378 6.456 9.311 1.00 0.00 N ATOM 0 H GLN A 27 13.249 9.196 5.067 1.00 0.00 H new ATOM 0 HA GLN A 27 13.536 6.461 5.319 1.00 0.00 H new ATOM 0 HB2 GLN A 27 14.875 8.231 6.480 1.00 0.00 H new ATOM 0 HB3 GLN A 27 13.487 8.679 7.452 1.00 0.00 H new ATOM 0 HG2 GLN A 27 13.475 6.504 8.579 1.00 0.00 H new ATOM 0 HG3 GLN A 27 14.667 5.858 7.469 1.00 0.00 H new ATOM 0 HE21 GLN A 27 16.337 5.472 9.046 1.00 0.00 H new ATOM 0 HE22 GLN A 27 17.131 6.791 9.912 1.00 0.00 H new ATOM 453 N GLU A 28 11.010 7.386 7.201 1.00 0.00 N ATOM 454 CA GLU A 28 9.794 6.838 7.861 1.00 0.00 C ATOM 455 C GLU A 28 9.036 5.927 6.893 1.00 0.00 C ATOM 456 O GLU A 28 8.856 4.752 7.142 1.00 0.00 O ATOM 457 CB GLU A 28 8.967 8.075 8.193 1.00 0.00 C ATOM 458 CG GLU A 28 9.408 8.640 9.544 1.00 0.00 C ATOM 459 CD GLU A 28 8.305 9.537 10.107 1.00 0.00 C ATOM 460 OE1 GLU A 28 7.164 9.102 10.119 1.00 0.00 O ATOM 461 OE2 GLU A 28 8.617 10.642 10.517 1.00 0.00 O ATOM 0 H GLU A 28 11.132 8.395 7.290 1.00 0.00 H new ATOM 0 HA GLU A 28 10.021 6.238 8.742 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.092 8.828 7.415 1.00 0.00 H new ATOM 0 HB3 GLU A 28 7.908 7.819 8.223 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.620 7.827 10.238 1.00 0.00 H new ATOM 0 HG3 GLU A 28 10.330 9.209 9.428 1.00 0.00 H new ATOM 468 N VAL A 29 8.592 6.462 5.787 1.00 0.00 N ATOM 469 CA VAL A 29 7.848 5.627 4.802 1.00 0.00 C ATOM 470 C VAL A 29 8.570 4.293 4.596 1.00 0.00 C ATOM 471 O VAL A 29 7.996 3.234 4.755 1.00 0.00 O ATOM 472 CB VAL A 29 7.848 6.444 3.510 1.00 0.00 C ATOM 473 CG1 VAL A 29 7.347 5.575 2.356 1.00 0.00 C ATOM 474 CG2 VAL A 29 6.927 7.655 3.673 1.00 0.00 C ATOM 0 H VAL A 29 8.713 7.440 5.524 1.00 0.00 H new ATOM 0 HA VAL A 29 6.836 5.394 5.134 1.00 0.00 H new ATOM 0 HB VAL A 29 8.861 6.783 3.295 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.347 6.158 1.435 1.00 0.00 H new ATOM 0 HG12 VAL A 29 8.002 4.712 2.239 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.334 5.235 2.570 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.926 8.238 2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.914 7.315 3.888 1.00 0.00 H new ATOM 0 HG23 VAL A 29 7.284 8.275 4.495 1.00 0.00 H new ATOM 484 N LEU A 30 9.827 4.335 4.247 1.00 0.00 N ATOM 485 CA LEU A 30 10.581 3.068 4.037 1.00 0.00 C ATOM 486 C LEU A 30 10.489 2.197 5.291 1.00 0.00 C ATOM 487 O LEU A 30 10.032 1.072 5.245 1.00 0.00 O ATOM 488 CB LEU A 30 12.028 3.499 3.788 1.00 0.00 C ATOM 489 CG LEU A 30 12.111 4.286 2.478 1.00 0.00 C ATOM 490 CD1 LEU A 30 13.577 4.445 2.071 1.00 0.00 C ATOM 491 CD2 LEU A 30 11.358 3.532 1.380 1.00 0.00 C ATOM 0 H LEU A 30 10.363 5.190 4.099 1.00 0.00 H new ATOM 0 HA LEU A 30 10.187 2.482 3.207 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.383 4.113 4.616 1.00 0.00 H new ATOM 0 HB3 LEU A 30 12.676 2.624 3.740 1.00 0.00 H new ATOM 0 HG LEU A 30 11.662 5.270 2.617 1.00 0.00 H new ATOM 0 HD11 LEU A 30 13.637 5.005 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.115 4.982 2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.025 3.461 1.933 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.417 4.093 0.447 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.806 2.548 1.241 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.313 3.417 1.668 1.00 0.00 H new ATOM 503 N ARG A 31 10.912 2.711 6.413 1.00 0.00 N ATOM 504 CA ARG A 31 10.842 1.912 7.669 1.00 0.00 C ATOM 505 C ARG A 31 9.490 1.199 7.764 1.00 0.00 C ATOM 506 O ARG A 31 9.416 0.030 8.087 1.00 0.00 O ATOM 507 CB ARG A 31 10.994 2.935 8.797 1.00 0.00 C ATOM 508 CG ARG A 31 11.362 2.215 10.096 1.00 0.00 C ATOM 509 CD ARG A 31 11.293 3.201 11.265 1.00 0.00 C ATOM 510 NE ARG A 31 9.935 3.011 11.847 1.00 0.00 N ATOM 511 CZ ARG A 31 9.662 3.472 13.039 1.00 0.00 C ATOM 512 NH1 ARG A 31 10.577 4.101 13.726 1.00 0.00 N ATOM 513 NH2 ARG A 31 8.470 3.304 13.544 1.00 0.00 N ATOM 0 H ARG A 31 11.302 3.648 6.514 1.00 0.00 H new ATOM 0 HA ARG A 31 11.611 1.141 7.715 1.00 0.00 H new ATOM 0 HB2 ARG A 31 11.765 3.662 8.541 1.00 0.00 H new ATOM 0 HB3 ARG A 31 10.064 3.489 8.927 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.680 1.382 10.268 1.00 0.00 H new ATOM 0 HG3 ARG A 31 12.365 1.795 10.020 1.00 0.00 H new ATOM 0 HD2 ARG A 31 12.070 2.996 12.001 1.00 0.00 H new ATOM 0 HD3 ARG A 31 11.437 4.227 10.926 1.00 0.00 H new ATOM 0 HE ARG A 31 9.217 2.520 11.314 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.509 4.234 13.333 1.00 0.00 H new ATOM 0 HH12 ARG A 31 10.360 4.459 14.656 1.00 0.00 H new ATOM 0 HH21 ARG A 31 7.754 2.814 13.008 1.00 0.00 H new ATOM 0 HH22 ARG A 31 8.255 3.663 14.474 1.00 0.00 H new ATOM 527 N LYS A 32 8.421 1.892 7.480 1.00 0.00 N ATOM 528 CA LYS A 32 7.076 1.250 7.551 1.00 0.00 C ATOM 529 C LYS A 32 6.981 0.109 6.534 1.00 0.00 C ATOM 530 O LYS A 32 7.200 -1.042 6.859 1.00 0.00 O ATOM 531 CB LYS A 32 6.083 2.361 7.202 1.00 0.00 C ATOM 532 CG LYS A 32 5.980 3.341 8.374 1.00 0.00 C ATOM 533 CD LYS A 32 4.691 4.156 8.246 1.00 0.00 C ATOM 534 CE LYS A 32 4.422 4.898 9.557 1.00 0.00 C ATOM 535 NZ LYS A 32 4.424 3.840 10.605 1.00 0.00 N ATOM 0 H LYS A 32 8.420 2.873 7.202 1.00 0.00 H new ATOM 0 HA LYS A 32 6.877 0.820 8.533 1.00 0.00 H new ATOM 0 HB2 LYS A 32 6.409 2.885 6.303 1.00 0.00 H new ATOM 0 HB3 LYS A 32 5.104 1.933 6.985 1.00 0.00 H new ATOM 0 HG2 LYS A 32 5.987 2.797 9.318 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.844 4.006 8.383 1.00 0.00 H new ATOM 0 HD2 LYS A 32 4.778 4.867 7.425 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.854 3.498 8.010 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.189 5.647 9.751 1.00 0.00 H new ATOM 0 HE3 LYS A 32 3.466 5.421 9.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.775 4.109 11.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 4.114 2.939 10.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 5.385 3.732 10.987 1.00 0.00 H new ATOM 549 N GLY A 33 6.655 0.418 5.308 1.00 0.00 N ATOM 550 CA GLY A 33 6.543 -0.650 4.271 1.00 0.00 C ATOM 551 C GLY A 33 7.703 -1.639 4.416 1.00 0.00 C ATOM 552 O GLY A 33 7.504 -2.834 4.505 1.00 0.00 O ATOM 0 H GLY A 33 6.461 1.364 4.979 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.592 -1.173 4.376 1.00 0.00 H new ATOM 0 HA3 GLY A 33 6.554 -0.206 3.276 1.00 0.00 H new ATOM 556 N CYS A 34 8.915 -1.152 4.439 1.00 0.00 N ATOM 557 CA CYS A 34 10.083 -2.069 4.577 1.00 0.00 C ATOM 558 C CYS A 34 9.842 -3.074 5.708 1.00 0.00 C ATOM 559 O CYS A 34 9.960 -4.269 5.525 1.00 0.00 O ATOM 560 CB CYS A 34 11.265 -1.158 4.911 1.00 0.00 C ATOM 561 SG CYS A 34 12.808 -2.096 4.775 1.00 0.00 S ATOM 0 H CYS A 34 9.146 -0.161 4.368 1.00 0.00 H new ATOM 0 HA CYS A 34 10.259 -2.650 3.672 1.00 0.00 H new ATOM 0 HB2 CYS A 34 11.284 -0.306 4.232 1.00 0.00 H new ATOM 0 HB3 CYS A 34 11.157 -0.759 5.920 1.00 0.00 H new ATOM 0 HG CYS A 34 13.813 -1.321 5.057 1.00 0.00 H new ATOM 567 N LEU A 35 9.507 -2.598 6.875 1.00 0.00 N ATOM 568 CA LEU A 35 9.261 -3.526 8.016 1.00 0.00 C ATOM 569 C LEU A 35 8.080 -4.450 7.709 1.00 0.00 C ATOM 570 O LEU A 35 8.000 -5.556 8.204 1.00 0.00 O ATOM 571 CB LEU A 35 8.937 -2.618 9.204 1.00 0.00 C ATOM 572 CG LEU A 35 10.226 -1.972 9.716 1.00 0.00 C ATOM 573 CD1 LEU A 35 9.881 -0.861 10.709 1.00 0.00 C ATOM 574 CD2 LEU A 35 11.082 -3.031 10.415 1.00 0.00 C ATOM 0 H LEU A 35 9.393 -1.607 7.089 1.00 0.00 H new ATOM 0 HA LEU A 35 10.119 -4.168 8.214 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.226 -1.848 8.904 1.00 0.00 H new ATOM 0 HB3 LEU A 35 8.466 -3.195 9.999 1.00 0.00 H new ATOM 0 HG LEU A 35 10.779 -1.550 8.877 1.00 0.00 H new ATOM 0 HD11 LEU A 35 10.799 -0.401 11.074 1.00 0.00 H new ATOM 0 HD12 LEU A 35 9.269 -0.107 10.213 1.00 0.00 H new ATOM 0 HD13 LEU A 35 9.328 -1.282 11.549 1.00 0.00 H new ATOM 0 HD21 LEU A 35 12.001 -2.573 10.781 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.527 -3.451 11.254 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.328 -3.824 9.709 1.00 0.00 H new ATOM 586 N ARG A 36 7.160 -4.007 6.895 1.00 0.00 N ATOM 587 CA ARG A 36 5.987 -4.867 6.560 1.00 0.00 C ATOM 588 C ARG A 36 6.457 -6.155 5.879 1.00 0.00 C ATOM 589 O ARG A 36 5.884 -7.210 6.064 1.00 0.00 O ATOM 590 CB ARG A 36 5.138 -4.031 5.602 1.00 0.00 C ATOM 591 CG ARG A 36 3.830 -4.766 5.305 1.00 0.00 C ATOM 592 CD ARG A 36 2.775 -4.372 6.341 1.00 0.00 C ATOM 593 NE ARG A 36 2.808 -5.461 7.355 1.00 0.00 N ATOM 594 CZ ARG A 36 2.118 -5.354 8.460 1.00 0.00 C ATOM 595 NH1 ARG A 36 1.393 -4.290 8.680 1.00 0.00 N ATOM 596 NH2 ARG A 36 2.152 -6.313 9.343 1.00 0.00 N ATOM 0 H ARG A 36 7.169 -3.090 6.448 1.00 0.00 H new ATOM 0 HA ARG A 36 5.425 -5.162 7.446 1.00 0.00 H new ATOM 0 HB2 ARG A 36 4.928 -3.056 6.042 1.00 0.00 H new ATOM 0 HB3 ARG A 36 5.685 -3.852 4.676 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.481 -4.518 4.303 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.993 -5.844 5.328 1.00 0.00 H new ATOM 0 HD2 ARG A 36 3.005 -3.406 6.791 1.00 0.00 H new ATOM 0 HD3 ARG A 36 1.788 -4.285 5.886 1.00 0.00 H new ATOM 0 HE ARG A 36 3.372 -6.294 7.187 1.00 0.00 H new ATOM 0 HH11 ARG A 36 1.364 -3.540 7.989 1.00 0.00 H new ATOM 0 HH12 ARG A 36 0.855 -4.209 9.543 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.716 -7.145 9.171 1.00 0.00 H new ATOM 0 HH22 ARG A 36 1.614 -6.231 10.206 1.00 0.00 H new ATOM 610 N PHE A 37 7.496 -6.078 5.093 1.00 0.00 N ATOM 611 CA PHE A 37 8.005 -7.290 4.404 1.00 0.00 C ATOM 612 C PHE A 37 8.920 -8.087 5.338 1.00 0.00 C ATOM 613 O PHE A 37 9.376 -9.162 5.006 1.00 0.00 O ATOM 614 CB PHE A 37 8.796 -6.748 3.216 1.00 0.00 C ATOM 615 CG PHE A 37 7.855 -6.387 2.089 1.00 0.00 C ATOM 616 CD1 PHE A 37 6.779 -7.227 1.771 1.00 0.00 C ATOM 617 CD2 PHE A 37 8.062 -5.210 1.358 1.00 0.00 C ATOM 618 CE1 PHE A 37 5.912 -6.888 0.724 1.00 0.00 C ATOM 619 CE2 PHE A 37 7.196 -4.873 0.313 1.00 0.00 C ATOM 620 CZ PHE A 37 6.121 -5.712 -0.005 1.00 0.00 C ATOM 0 H PHE A 37 8.015 -5.221 4.900 1.00 0.00 H new ATOM 0 HA PHE A 37 7.205 -7.964 4.098 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.367 -5.870 3.519 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.514 -7.494 2.876 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.618 -8.135 2.333 1.00 0.00 H new ATOM 0 HD2 PHE A 37 8.891 -4.562 1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.082 -7.534 0.479 1.00 0.00 H new ATOM 0 HE2 PHE A 37 7.356 -3.965 -0.249 1.00 0.00 H new ATOM 0 HZ PHE A 37 5.453 -5.452 -0.813 1.00 0.00 H new ATOM 630 N GLN A 38 9.190 -7.567 6.504 1.00 0.00 N ATOM 631 CA GLN A 38 10.075 -8.294 7.458 1.00 0.00 C ATOM 632 C GLN A 38 11.455 -8.517 6.833 1.00 0.00 C ATOM 633 O GLN A 38 11.838 -9.630 6.532 1.00 0.00 O ATOM 634 CB GLN A 38 9.373 -9.628 7.710 1.00 0.00 C ATOM 635 CG GLN A 38 7.916 -9.372 8.096 1.00 0.00 C ATOM 636 CD GLN A 38 7.858 -8.759 9.496 1.00 0.00 C ATOM 637 OE1 GLN A 38 8.585 -7.833 9.797 1.00 0.00 O ATOM 638 NE2 GLN A 38 7.018 -9.238 10.371 1.00 0.00 N ATOM 0 H GLN A 38 8.836 -6.670 6.837 1.00 0.00 H new ATOM 0 HA GLN A 38 10.234 -7.739 8.382 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.420 -10.250 6.816 1.00 0.00 H new ATOM 0 HB3 GLN A 38 9.881 -10.174 8.505 1.00 0.00 H new ATOM 0 HG2 GLN A 38 7.450 -8.701 7.374 1.00 0.00 H new ATOM 0 HG3 GLN A 38 7.353 -10.305 8.073 1.00 0.00 H new ATOM 0 HE21 GLN A 38 6.407 -10.015 10.119 1.00 0.00 H new ATOM 0 HE22 GLN A 38 6.972 -8.835 11.307 1.00 0.00 H new ATOM 647 N LEU A 39 12.201 -7.466 6.632 1.00 0.00 N ATOM 648 CA LEU A 39 13.552 -7.614 6.024 1.00 0.00 C ATOM 649 C LEU A 39 14.580 -6.806 6.823 1.00 0.00 C ATOM 650 O LEU A 39 14.519 -5.593 6.866 1.00 0.00 O ATOM 651 CB LEU A 39 13.406 -7.050 4.612 1.00 0.00 C ATOM 652 CG LEU A 39 12.642 -8.049 3.743 1.00 0.00 C ATOM 653 CD1 LEU A 39 12.346 -7.421 2.381 1.00 0.00 C ATOM 654 CD2 LEU A 39 13.489 -9.308 3.548 1.00 0.00 C ATOM 0 H LEU A 39 11.932 -6.510 6.863 1.00 0.00 H new ATOM 0 HA LEU A 39 13.897 -8.648 6.018 1.00 0.00 H new ATOM 0 HB2 LEU A 39 12.877 -6.098 4.642 1.00 0.00 H new ATOM 0 HB3 LEU A 39 14.389 -6.855 4.183 1.00 0.00 H new ATOM 0 HG LEU A 39 11.705 -8.312 4.233 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.801 -8.134 1.762 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.742 -6.524 2.518 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.283 -7.157 1.891 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.944 -10.021 2.928 1.00 0.00 H new ATOM 0 HD22 LEU A 39 14.426 -9.044 3.059 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.700 -9.758 4.518 1.00 0.00 H new ATOM 666 N PRO A 40 15.492 -7.512 7.436 1.00 0.00 N ATOM 667 CA PRO A 40 16.546 -6.855 8.250 1.00 0.00 C ATOM 668 C PRO A 40 17.561 -6.146 7.348 1.00 0.00 C ATOM 669 O PRO A 40 17.517 -6.257 6.138 1.00 0.00 O ATOM 670 CB PRO A 40 17.200 -8.018 8.993 1.00 0.00 C ATOM 671 CG PRO A 40 16.932 -9.219 8.144 1.00 0.00 C ATOM 672 CD PRO A 40 15.630 -8.973 7.429 1.00 0.00 C ATOM 0 HA PRO A 40 16.153 -6.091 8.921 1.00 0.00 H new ATOM 0 HB2 PRO A 40 18.270 -7.854 9.118 1.00 0.00 H new ATOM 0 HB3 PRO A 40 16.777 -8.137 9.990 1.00 0.00 H new ATOM 0 HG2 PRO A 40 17.741 -9.374 7.430 1.00 0.00 H new ATOM 0 HG3 PRO A 40 16.871 -10.118 8.757 1.00 0.00 H new ATOM 0 HD2 PRO A 40 15.652 -9.367 6.413 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.797 -9.455 7.940 1.00 0.00 H new ATOM 680 N GLU A 41 18.475 -5.419 7.930 1.00 0.00 N ATOM 681 CA GLU A 41 19.494 -4.703 7.111 1.00 0.00 C ATOM 682 C GLU A 41 20.515 -5.697 6.553 1.00 0.00 C ATOM 683 O GLU A 41 20.453 -6.087 5.405 1.00 0.00 O ATOM 684 CB GLU A 41 20.167 -3.734 8.082 1.00 0.00 C ATOM 685 CG GLU A 41 21.381 -3.095 7.406 1.00 0.00 C ATOM 686 CD GLU A 41 21.389 -1.590 7.682 1.00 0.00 C ATOM 687 OE1 GLU A 41 20.385 -1.089 8.161 1.00 0.00 O ATOM 688 OE2 GLU A 41 22.400 -0.964 7.410 1.00 0.00 O ATOM 0 H GLU A 41 18.560 -5.290 8.938 1.00 0.00 H new ATOM 0 HA GLU A 41 19.053 -4.187 6.258 1.00 0.00 H new ATOM 0 HB2 GLU A 41 19.461 -2.963 8.390 1.00 0.00 H new ATOM 0 HB3 GLU A 41 20.476 -4.262 8.984 1.00 0.00 H new ATOM 0 HG2 GLU A 41 22.299 -3.548 7.780 1.00 0.00 H new ATOM 0 HG3 GLU A 41 21.350 -3.278 6.332 1.00 0.00 H new ATOM 695 N ARG A 42 21.451 -6.113 7.356 1.00 0.00 N ATOM 696 CA ARG A 42 22.471 -7.083 6.869 1.00 0.00 C ATOM 697 C ARG A 42 21.783 -8.275 6.196 1.00 0.00 C ATOM 698 O ARG A 42 22.190 -8.729 5.146 1.00 0.00 O ATOM 699 CB ARG A 42 23.225 -7.534 8.122 1.00 0.00 C ATOM 700 CG ARG A 42 24.524 -8.231 7.713 1.00 0.00 C ATOM 701 CD ARG A 42 25.251 -8.737 8.962 1.00 0.00 C ATOM 702 NE ARG A 42 26.568 -8.040 8.950 1.00 0.00 N ATOM 703 CZ ARG A 42 27.563 -8.504 9.657 1.00 0.00 C ATOM 704 NH1 ARG A 42 27.409 -9.581 10.380 1.00 0.00 N ATOM 705 NH2 ARG A 42 28.715 -7.891 9.644 1.00 0.00 N ATOM 0 H ARG A 42 21.555 -5.824 8.329 1.00 0.00 H new ATOM 0 HA ARG A 42 23.141 -6.643 6.131 1.00 0.00 H new ATOM 0 HB2 ARG A 42 23.445 -6.675 8.756 1.00 0.00 H new ATOM 0 HB3 ARG A 42 22.605 -8.212 8.708 1.00 0.00 H new ATOM 0 HG2 ARG A 42 24.307 -9.064 7.044 1.00 0.00 H new ATOM 0 HG3 ARG A 42 25.162 -7.539 7.164 1.00 0.00 H new ATOM 0 HD2 ARG A 42 24.690 -8.505 9.867 1.00 0.00 H new ATOM 0 HD3 ARG A 42 25.377 -9.819 8.934 1.00 0.00 H new ATOM 0 HE ARG A 42 26.693 -7.198 8.388 1.00 0.00 H new ATOM 0 HH11 ARG A 42 26.510 -10.062 10.393 1.00 0.00 H new ATOM 0 HH12 ARG A 42 28.188 -9.941 10.931 1.00 0.00 H new ATOM 0 HH21 ARG A 42 28.838 -7.049 9.081 1.00 0.00 H new ATOM 0 HH22 ARG A 42 29.492 -8.254 10.196 1.00 0.00 H new ATOM 719 N GLY A 43 20.744 -8.788 6.799 1.00 0.00 N ATOM 720 CA GLY A 43 20.032 -9.954 6.202 1.00 0.00 C ATOM 721 C GLY A 43 19.371 -9.550 4.881 1.00 0.00 C ATOM 722 O GLY A 43 19.455 -10.255 3.895 1.00 0.00 O ATOM 0 H GLY A 43 20.358 -8.449 7.680 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.734 -10.770 6.031 1.00 0.00 H new ATOM 0 HA3 GLY A 43 19.278 -10.323 6.897 1.00 0.00 H new ATOM 726 N SER A 44 18.710 -8.424 4.848 1.00 0.00 N ATOM 727 CA SER A 44 18.042 -7.992 3.584 1.00 0.00 C ATOM 728 C SER A 44 18.449 -6.561 3.222 1.00 0.00 C ATOM 729 O SER A 44 18.594 -5.710 4.077 1.00 0.00 O ATOM 730 CB SER A 44 16.547 -8.060 3.879 1.00 0.00 C ATOM 731 OG SER A 44 15.831 -7.477 2.797 1.00 0.00 O ATOM 0 H SER A 44 18.603 -7.787 5.637 1.00 0.00 H new ATOM 0 HA SER A 44 18.322 -8.623 2.740 1.00 0.00 H new ATOM 0 HB2 SER A 44 16.238 -9.096 4.019 1.00 0.00 H new ATOM 0 HB3 SER A 44 16.322 -7.532 4.806 1.00 0.00 H new ATOM 0 HG SER A 44 15.820 -6.502 2.900 1.00 0.00 H new ATOM 737 N ARG A 45 18.632 -6.290 1.960 1.00 0.00 N ATOM 738 CA ARG A 45 19.029 -4.915 1.542 1.00 0.00 C ATOM 739 C ARG A 45 17.952 -4.297 0.645 1.00 0.00 C ATOM 740 O ARG A 45 17.440 -4.931 -0.254 1.00 0.00 O ATOM 741 CB ARG A 45 20.331 -5.102 0.762 1.00 0.00 C ATOM 742 CG ARG A 45 21.033 -3.752 0.602 1.00 0.00 C ATOM 743 CD ARG A 45 22.181 -3.890 -0.401 1.00 0.00 C ATOM 744 NE ARG A 45 23.281 -3.056 0.158 1.00 0.00 N ATOM 745 CZ ARG A 45 24.459 -3.060 -0.408 1.00 0.00 C ATOM 746 NH1 ARG A 45 24.675 -3.794 -1.466 1.00 0.00 N ATOM 747 NH2 ARG A 45 25.421 -2.329 0.084 1.00 0.00 N ATOM 0 H ARG A 45 18.524 -6.961 1.199 1.00 0.00 H new ATOM 0 HA ARG A 45 19.152 -4.246 2.393 1.00 0.00 H new ATOM 0 HB2 ARG A 45 20.982 -5.802 1.285 1.00 0.00 H new ATOM 0 HB3 ARG A 45 20.121 -5.532 -0.217 1.00 0.00 H new ATOM 0 HG2 ARG A 45 20.323 -3.000 0.258 1.00 0.00 H new ATOM 0 HG3 ARG A 45 21.416 -3.413 1.565 1.00 0.00 H new ATOM 0 HD2 ARG A 45 22.489 -4.930 -0.508 1.00 0.00 H new ATOM 0 HD3 ARG A 45 21.885 -3.542 -1.391 1.00 0.00 H new ATOM 0 HE ARG A 45 23.115 -2.481 0.984 1.00 0.00 H new ATOM 0 HH11 ARG A 45 23.924 -4.366 -1.852 1.00 0.00 H new ATOM 0 HH12 ARG A 45 25.595 -3.796 -1.906 1.00 0.00 H new ATOM 0 HH21 ARG A 45 25.254 -1.755 0.910 1.00 0.00 H new ATOM 0 HH22 ARG A 45 26.341 -2.332 -0.357 1.00 0.00 H new ATOM 761 N LEU A 46 17.607 -3.061 0.885 1.00 0.00 N ATOM 762 CA LEU A 46 16.565 -2.400 0.046 1.00 0.00 C ATOM 763 C LEU A 46 17.225 -1.657 -1.120 1.00 0.00 C ATOM 764 O LEU A 46 18.207 -0.964 -0.948 1.00 0.00 O ATOM 765 CB LEU A 46 15.867 -1.419 0.989 1.00 0.00 C ATOM 766 CG LEU A 46 14.602 -0.876 0.321 1.00 0.00 C ATOM 767 CD1 LEU A 46 14.991 0.026 -0.850 1.00 0.00 C ATOM 768 CD2 LEU A 46 13.756 -2.044 -0.192 1.00 0.00 C ATOM 0 H LEU A 46 18.001 -2.480 1.625 1.00 0.00 H new ATOM 0 HA LEU A 46 15.864 -3.112 -0.389 1.00 0.00 H new ATOM 0 HB2 LEU A 46 15.611 -1.917 1.924 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.539 -0.598 1.239 1.00 0.00 H new ATOM 0 HG LEU A 46 14.026 -0.301 1.046 1.00 0.00 H new ATOM 0 HD11 LEU A 46 14.090 0.413 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 46 15.594 0.857 -0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.567 -0.548 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.854 -1.659 -0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.332 -2.619 -0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.479 -2.687 0.643 1.00 0.00 H new ATOM 780 N CYS A 47 16.695 -1.797 -2.305 1.00 0.00 N ATOM 781 CA CYS A 47 17.298 -1.099 -3.478 1.00 0.00 C ATOM 782 C CYS A 47 16.198 -0.572 -4.405 1.00 0.00 C ATOM 783 O CYS A 47 15.025 -0.804 -4.185 1.00 0.00 O ATOM 784 CB CYS A 47 18.140 -2.159 -4.189 1.00 0.00 C ATOM 785 SG CYS A 47 19.145 -3.053 -2.976 1.00 0.00 S ATOM 0 H CYS A 47 15.872 -2.363 -2.512 1.00 0.00 H new ATOM 0 HA CYS A 47 17.899 -0.240 -3.179 1.00 0.00 H new ATOM 0 HB2 CYS A 47 17.492 -2.855 -4.722 1.00 0.00 H new ATOM 0 HB3 CYS A 47 18.783 -1.688 -4.933 1.00 0.00 H new ATOM 0 HG CYS A 47 20.235 -3.476 -3.543 1.00 0.00 H new ATOM 791 N LEU A 48 16.567 0.141 -5.434 1.00 0.00 N ATOM 792 CA LEU A 48 15.543 0.690 -6.370 1.00 0.00 C ATOM 793 C LEU A 48 15.070 -0.391 -7.347 1.00 0.00 C ATOM 794 O LEU A 48 15.519 -1.519 -7.309 1.00 0.00 O ATOM 795 CB LEU A 48 16.257 1.812 -7.123 1.00 0.00 C ATOM 796 CG LEU A 48 16.573 2.955 -6.160 1.00 0.00 C ATOM 797 CD1 LEU A 48 17.776 3.741 -6.684 1.00 0.00 C ATOM 798 CD2 LEU A 48 15.361 3.885 -6.059 1.00 0.00 C ATOM 0 H LEU A 48 17.534 0.368 -5.668 1.00 0.00 H new ATOM 0 HA LEU A 48 14.658 1.046 -5.843 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.177 1.435 -7.571 1.00 0.00 H new ATOM 0 HB3 LEU A 48 15.630 2.173 -7.938 1.00 0.00 H new ATOM 0 HG LEU A 48 16.803 2.550 -5.175 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.004 4.557 -5.999 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.639 3.079 -6.759 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.544 4.148 -7.668 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.585 4.701 -5.372 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.132 4.292 -7.044 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.502 3.325 -5.689 1.00 0.00 H new ATOM 810 N TYR A 49 14.162 -0.050 -8.221 1.00 0.00 N ATOM 811 CA TYR A 49 13.650 -1.049 -9.203 1.00 0.00 C ATOM 812 C TYR A 49 14.491 -1.024 -10.483 1.00 0.00 C ATOM 813 O TYR A 49 15.135 -1.993 -10.833 1.00 0.00 O ATOM 814 CB TYR A 49 12.217 -0.608 -9.497 1.00 0.00 C ATOM 815 CG TYR A 49 11.541 -1.637 -10.373 1.00 0.00 C ATOM 816 CD1 TYR A 49 11.931 -1.782 -11.710 1.00 0.00 C ATOM 817 CD2 TYR A 49 10.525 -2.443 -9.849 1.00 0.00 C ATOM 818 CE1 TYR A 49 11.304 -2.735 -12.522 1.00 0.00 C ATOM 819 CE2 TYR A 49 9.898 -3.397 -10.661 1.00 0.00 C ATOM 820 CZ TYR A 49 10.288 -3.542 -11.997 1.00 0.00 C ATOM 821 OH TYR A 49 9.670 -4.481 -12.798 1.00 0.00 O ATOM 0 H TYR A 49 13.751 0.881 -8.298 1.00 0.00 H new ATOM 0 HA TYR A 49 13.698 -2.067 -8.817 1.00 0.00 H new ATOM 0 HB2 TYR A 49 11.664 -0.489 -8.565 1.00 0.00 H new ATOM 0 HB3 TYR A 49 12.219 0.362 -9.993 1.00 0.00 H new ATOM 0 HD1 TYR A 49 12.715 -1.159 -12.115 1.00 0.00 H new ATOM 0 HD2 TYR A 49 10.224 -2.330 -8.818 1.00 0.00 H new ATOM 0 HE1 TYR A 49 11.604 -2.847 -13.553 1.00 0.00 H new ATOM 0 HE2 TYR A 49 9.114 -4.020 -10.256 1.00 0.00 H new ATOM 0 HH TYR A 49 8.989 -4.957 -12.278 1.00 0.00 H new ATOM 831 N GLU A 50 14.484 0.074 -11.191 1.00 0.00 N ATOM 832 CA GLU A 50 15.278 0.154 -12.452 1.00 0.00 C ATOM 833 C GLU A 50 16.735 -0.240 -12.193 1.00 0.00 C ATOM 834 O GLU A 50 17.216 -1.237 -12.693 1.00 0.00 O ATOM 835 CB GLU A 50 15.188 1.619 -12.883 1.00 0.00 C ATOM 836 CG GLU A 50 15.423 1.723 -14.391 1.00 0.00 C ATOM 837 CD GLU A 50 14.308 2.555 -15.027 1.00 0.00 C ATOM 838 OE1 GLU A 50 13.156 2.188 -14.866 1.00 0.00 O ATOM 839 OE2 GLU A 50 14.626 3.546 -15.664 1.00 0.00 O ATOM 0 H GLU A 50 13.964 0.918 -10.951 1.00 0.00 H new ATOM 0 HA GLU A 50 14.901 -0.523 -13.218 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.209 2.025 -12.628 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.928 2.213 -12.347 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.391 2.183 -14.588 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.447 0.728 -14.835 1.00 0.00 H new ATOM 846 N ASP A 51 17.441 0.535 -11.416 1.00 0.00 N ATOM 847 CA ASP A 51 18.862 0.205 -11.128 1.00 0.00 C ATOM 848 C ASP A 51 18.947 -0.795 -9.973 1.00 0.00 C ATOM 849 O ASP A 51 19.663 -1.776 -10.036 1.00 0.00 O ATOM 850 CB ASP A 51 19.496 1.537 -10.733 1.00 0.00 C ATOM 851 CG ASP A 51 19.069 2.624 -11.723 1.00 0.00 C ATOM 852 OD1 ASP A 51 19.510 2.568 -12.859 1.00 0.00 O ATOM 853 OD2 ASP A 51 18.308 3.491 -11.328 1.00 0.00 O ATOM 0 H ASP A 51 17.093 1.383 -10.969 1.00 0.00 H new ATOM 0 HA ASP A 51 19.366 -0.253 -11.979 1.00 0.00 H new ATOM 0 HB2 ASP A 51 19.191 1.811 -9.723 1.00 0.00 H new ATOM 0 HB3 ASP A 51 20.582 1.446 -10.724 1.00 0.00 H new ATOM 858 N GLY A 52 18.219 -0.555 -8.917 1.00 0.00 N ATOM 859 CA GLY A 52 18.251 -1.488 -7.756 1.00 0.00 C ATOM 860 C GLY A 52 19.682 -1.602 -7.224 1.00 0.00 C ATOM 861 O GLY A 52 20.003 -2.497 -6.469 1.00 0.00 O ATOM 0 H GLY A 52 17.602 0.250 -8.808 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.588 -1.128 -6.969 1.00 0.00 H new ATOM 0 HA3 GLY A 52 17.885 -2.470 -8.056 1.00 0.00 H new ATOM 865 N THR A 53 20.546 -0.706 -7.617 1.00 0.00 N ATOM 866 CA THR A 53 21.957 -0.776 -7.132 1.00 0.00 C ATOM 867 C THR A 53 22.022 -0.602 -5.604 1.00 0.00 C ATOM 868 O THR A 53 22.211 -1.560 -4.881 1.00 0.00 O ATOM 869 CB THR A 53 22.707 0.347 -7.868 1.00 0.00 C ATOM 870 OG1 THR A 53 23.936 0.605 -7.205 1.00 0.00 O ATOM 871 CG2 THR A 53 21.867 1.626 -7.919 1.00 0.00 C ATOM 0 H THR A 53 20.339 0.068 -8.249 1.00 0.00 H new ATOM 0 HA THR A 53 22.409 -1.746 -7.338 1.00 0.00 H new ATOM 0 HB THR A 53 22.899 0.025 -8.892 1.00 0.00 H new ATOM 0 HG1 THR A 53 24.417 1.319 -7.673 1.00 0.00 H new ATOM 0 HG21 THR A 53 22.420 2.404 -8.445 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.933 1.427 -8.444 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.649 1.959 -6.904 1.00 0.00 H new ATOM 879 N GLU A 54 21.865 0.593 -5.100 1.00 0.00 N ATOM 880 CA GLU A 54 21.920 0.783 -3.621 1.00 0.00 C ATOM 881 C GLU A 54 20.870 1.806 -3.179 1.00 0.00 C ATOM 882 O GLU A 54 20.685 2.831 -3.805 1.00 0.00 O ATOM 883 CB GLU A 54 23.331 1.303 -3.338 1.00 0.00 C ATOM 884 CG GLU A 54 23.442 2.762 -3.788 1.00 0.00 C ATOM 885 CD GLU A 54 24.895 3.223 -3.669 1.00 0.00 C ATOM 886 OE1 GLU A 54 25.717 2.728 -4.422 1.00 0.00 O ATOM 887 OE2 GLU A 54 25.161 4.064 -2.826 1.00 0.00 O ATOM 0 H GLU A 54 21.702 1.440 -5.644 1.00 0.00 H new ATOM 0 HA GLU A 54 21.711 -0.139 -3.079 1.00 0.00 H new ATOM 0 HB2 GLU A 54 23.552 1.223 -2.274 1.00 0.00 H new ATOM 0 HB3 GLU A 54 24.066 0.693 -3.863 1.00 0.00 H new ATOM 0 HG2 GLU A 54 23.100 2.863 -4.818 1.00 0.00 H new ATOM 0 HG3 GLU A 54 22.798 3.393 -3.175 1.00 0.00 H new ATOM 894 N LEU A 55 20.182 1.537 -2.103 1.00 0.00 N ATOM 895 CA LEU A 55 19.148 2.495 -1.621 1.00 0.00 C ATOM 896 C LEU A 55 19.191 2.589 -0.094 1.00 0.00 C ATOM 897 O LEU A 55 18.903 1.636 0.605 1.00 0.00 O ATOM 898 CB LEU A 55 17.816 1.908 -2.089 1.00 0.00 C ATOM 899 CG LEU A 55 16.720 2.970 -1.988 1.00 0.00 C ATOM 900 CD1 LEU A 55 16.531 3.375 -0.525 1.00 0.00 C ATOM 901 CD2 LEU A 55 17.123 4.198 -2.808 1.00 0.00 C ATOM 0 H LEU A 55 20.292 0.695 -1.537 1.00 0.00 H new ATOM 0 HA LEU A 55 19.304 3.503 -2.005 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.903 1.558 -3.118 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.555 1.043 -1.479 1.00 0.00 H new ATOM 0 HG LEU A 55 15.786 2.563 -2.375 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.750 4.132 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 55 16.244 2.501 0.060 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.465 3.781 -0.136 1.00 0.00 H new ATOM 0 HD21 LEU A 55 16.342 4.955 -2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 55 18.058 4.603 -2.421 1.00 0.00 H new ATOM 0 HD23 LEU A 55 17.256 3.911 -3.851 1.00 0.00 H new ATOM 913 N THR A 56 19.552 3.728 0.429 1.00 0.00 N ATOM 914 CA THR A 56 19.615 3.880 1.911 1.00 0.00 C ATOM 915 C THR A 56 18.281 4.410 2.447 1.00 0.00 C ATOM 916 O THR A 56 17.764 5.404 1.979 1.00 0.00 O ATOM 917 CB THR A 56 20.733 4.894 2.157 1.00 0.00 C ATOM 918 OG1 THR A 56 20.834 5.158 3.550 1.00 0.00 O ATOM 919 CG2 THR A 56 20.421 6.193 1.412 1.00 0.00 C ATOM 0 H THR A 56 19.806 4.560 -0.104 1.00 0.00 H new ATOM 0 HA THR A 56 19.805 2.933 2.416 1.00 0.00 H new ATOM 0 HB THR A 56 21.677 4.488 1.794 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.551 5.806 3.709 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.219 6.914 1.589 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.345 5.990 0.344 1.00 0.00 H new ATOM 0 HG23 THR A 56 19.477 6.601 1.772 1.00 0.00 H new ATOM 927 N GLU A 57 17.722 3.752 3.425 1.00 0.00 N ATOM 928 CA GLU A 57 16.423 4.219 3.988 1.00 0.00 C ATOM 929 C GLU A 57 16.507 5.706 4.342 1.00 0.00 C ATOM 930 O GLU A 57 15.509 6.398 4.394 1.00 0.00 O ATOM 931 CB GLU A 57 16.212 3.380 5.250 1.00 0.00 C ATOM 932 CG GLU A 57 16.103 1.903 4.869 1.00 0.00 C ATOM 933 CD GLU A 57 15.882 1.065 6.130 1.00 0.00 C ATOM 934 OE1 GLU A 57 14.800 1.146 6.688 1.00 0.00 O ATOM 935 OE2 GLU A 57 16.798 0.359 6.516 1.00 0.00 O ATOM 0 H GLU A 57 18.107 2.913 3.858 1.00 0.00 H new ATOM 0 HA GLU A 57 15.601 4.105 3.281 1.00 0.00 H new ATOM 0 HB2 GLU A 57 17.042 3.528 5.941 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.307 3.701 5.766 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.277 1.756 4.173 1.00 0.00 H new ATOM 0 HG3 GLU A 57 17.011 1.580 4.359 1.00 0.00 H new ATOM 942 N ASP A 58 17.689 6.201 4.584 1.00 0.00 N ATOM 943 CA ASP A 58 17.835 7.643 4.934 1.00 0.00 C ATOM 944 C ASP A 58 16.967 8.502 4.010 1.00 0.00 C ATOM 945 O ASP A 58 15.968 9.058 4.421 1.00 0.00 O ATOM 946 CB ASP A 58 19.316 7.957 4.720 1.00 0.00 C ATOM 947 CG ASP A 58 19.622 9.363 5.242 1.00 0.00 C ATOM 948 OD1 ASP A 58 19.379 9.604 6.412 1.00 0.00 O ATOM 949 OD2 ASP A 58 20.092 10.174 4.462 1.00 0.00 O ATOM 0 H ASP A 58 18.560 5.671 4.555 1.00 0.00 H new ATOM 0 HA ASP A 58 17.518 7.853 5.955 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.933 7.223 5.239 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.563 7.889 3.661 1.00 0.00 H new ATOM 954 N TYR A 59 17.342 8.615 2.766 1.00 0.00 N ATOM 955 CA TYR A 59 16.537 9.440 1.819 1.00 0.00 C ATOM 956 C TYR A 59 16.453 8.751 0.453 1.00 0.00 C ATOM 957 O TYR A 59 17.134 7.779 0.195 1.00 0.00 O ATOM 958 CB TYR A 59 17.295 10.762 1.707 1.00 0.00 C ATOM 959 CG TYR A 59 16.594 11.663 0.718 1.00 0.00 C ATOM 960 CD1 TYR A 59 15.326 12.175 1.016 1.00 0.00 C ATOM 961 CD2 TYR A 59 17.212 11.983 -0.496 1.00 0.00 C ATOM 962 CE1 TYR A 59 14.675 13.010 0.099 1.00 0.00 C ATOM 963 CE2 TYR A 59 16.561 12.818 -1.414 1.00 0.00 C ATOM 964 CZ TYR A 59 15.292 13.331 -1.116 1.00 0.00 C ATOM 965 OH TYR A 59 14.651 14.153 -2.019 1.00 0.00 O ATOM 0 H TYR A 59 18.169 8.173 2.364 1.00 0.00 H new ATOM 0 HA TYR A 59 15.513 9.584 2.164 1.00 0.00 H new ATOM 0 HB2 TYR A 59 17.348 11.246 2.682 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.320 10.579 1.385 1.00 0.00 H new ATOM 0 HD1 TYR A 59 14.850 11.926 1.953 1.00 0.00 H new ATOM 0 HD2 TYR A 59 18.190 11.587 -0.725 1.00 0.00 H new ATOM 0 HE1 TYR A 59 13.697 13.406 0.329 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.037 13.066 -2.351 1.00 0.00 H new ATOM 0 HH TYR A 59 15.218 14.276 -2.809 1.00 0.00 H new ATOM 975 N PHE A 60 15.620 9.247 -0.420 1.00 0.00 N ATOM 976 CA PHE A 60 15.491 8.622 -1.768 1.00 0.00 C ATOM 977 C PHE A 60 16.588 9.141 -2.701 1.00 0.00 C ATOM 978 O PHE A 60 17.153 10.192 -2.470 1.00 0.00 O ATOM 979 CB PHE A 60 14.111 9.046 -2.271 1.00 0.00 C ATOM 980 CG PHE A 60 13.069 8.698 -1.236 1.00 0.00 C ATOM 981 CD1 PHE A 60 13.226 7.556 -0.440 1.00 0.00 C ATOM 982 CD2 PHE A 60 11.945 9.517 -1.071 1.00 0.00 C ATOM 983 CE1 PHE A 60 12.261 7.234 0.520 1.00 0.00 C ATOM 984 CE2 PHE A 60 10.979 9.194 -0.109 1.00 0.00 C ATOM 985 CZ PHE A 60 11.137 8.052 0.686 1.00 0.00 C ATOM 0 H PHE A 60 15.023 10.058 -0.259 1.00 0.00 H new ATOM 0 HA PHE A 60 15.595 7.538 -1.732 1.00 0.00 H new ATOM 0 HB2 PHE A 60 14.098 10.118 -2.469 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.886 8.545 -3.212 1.00 0.00 H new ATOM 0 HD1 PHE A 60 14.092 6.924 -0.568 1.00 0.00 H new ATOM 0 HD2 PHE A 60 11.823 10.397 -1.685 1.00 0.00 H new ATOM 0 HE1 PHE A 60 12.383 6.354 1.134 1.00 0.00 H new ATOM 0 HE2 PHE A 60 10.113 9.826 0.019 1.00 0.00 H new ATOM 0 HZ PHE A 60 10.392 7.802 1.427 1.00 0.00 H new ATOM 995 N PRO A 61 16.852 8.380 -3.727 1.00 0.00 N ATOM 996 CA PRO A 61 17.893 8.761 -4.711 1.00 0.00 C ATOM 997 C PRO A 61 17.387 9.884 -5.623 1.00 0.00 C ATOM 998 O PRO A 61 16.959 9.649 -6.735 1.00 0.00 O ATOM 999 CB PRO A 61 18.121 7.479 -5.505 1.00 0.00 C ATOM 1000 CG PRO A 61 16.849 6.703 -5.370 1.00 0.00 C ATOM 1001 CD PRO A 61 16.211 7.106 -4.064 1.00 0.00 C ATOM 0 HA PRO A 61 18.804 9.137 -4.245 1.00 0.00 H new ATOM 0 HB2 PRO A 61 18.340 7.697 -6.550 1.00 0.00 H new ATOM 0 HB3 PRO A 61 18.968 6.918 -5.112 1.00 0.00 H new ATOM 0 HG2 PRO A 61 16.181 6.914 -6.205 1.00 0.00 H new ATOM 0 HG3 PRO A 61 17.050 5.632 -5.385 1.00 0.00 H new ATOM 0 HD2 PRO A 61 15.132 7.218 -4.166 1.00 0.00 H new ATOM 0 HD3 PRO A 61 16.382 6.358 -3.290 1.00 0.00 H new ATOM 1009 N SER A 62 17.435 11.103 -5.158 1.00 0.00 N ATOM 1010 CA SER A 62 16.962 12.245 -5.995 1.00 0.00 C ATOM 1011 C SER A 62 15.672 11.876 -6.733 1.00 0.00 C ATOM 1012 O SER A 62 15.432 12.317 -7.839 1.00 0.00 O ATOM 1013 CB SER A 62 18.093 12.505 -6.991 1.00 0.00 C ATOM 1014 OG SER A 62 18.856 11.319 -7.158 1.00 0.00 O ATOM 0 H SER A 62 17.782 11.359 -4.233 1.00 0.00 H new ATOM 0 HA SER A 62 16.737 13.125 -5.392 1.00 0.00 H new ATOM 0 HB2 SER A 62 17.683 12.825 -7.949 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.730 13.313 -6.632 1.00 0.00 H new ATOM 0 HG SER A 62 19.580 11.483 -7.797 1.00 0.00 H new ATOM 1020 N VAL A 63 14.836 11.074 -6.130 1.00 0.00 N ATOM 1021 CA VAL A 63 13.561 10.686 -6.802 1.00 0.00 C ATOM 1022 C VAL A 63 12.379 10.902 -5.850 1.00 0.00 C ATOM 1023 O VAL A 63 11.888 9.971 -5.244 1.00 0.00 O ATOM 1024 CB VAL A 63 13.725 9.204 -7.139 1.00 0.00 C ATOM 1025 CG1 VAL A 63 13.815 8.389 -5.847 1.00 0.00 C ATOM 1026 CG2 VAL A 63 12.519 8.733 -7.956 1.00 0.00 C ATOM 0 H VAL A 63 14.980 10.671 -5.204 1.00 0.00 H new ATOM 0 HA VAL A 63 13.362 11.281 -7.693 1.00 0.00 H new ATOM 0 HB VAL A 63 14.637 9.063 -7.718 1.00 0.00 H new ATOM 0 HG11 VAL A 63 13.932 7.333 -6.090 1.00 0.00 H new ATOM 0 HG12 VAL A 63 14.673 8.724 -5.264 1.00 0.00 H new ATOM 0 HG13 VAL A 63 12.904 8.528 -5.265 1.00 0.00 H new ATOM 0 HG21 VAL A 63 12.634 7.676 -8.198 1.00 0.00 H new ATOM 0 HG22 VAL A 63 11.608 8.876 -7.375 1.00 0.00 H new ATOM 0 HG23 VAL A 63 12.456 9.311 -8.878 1.00 0.00 H new ATOM 1036 N PRO A 64 11.970 12.136 -5.752 1.00 0.00 N ATOM 1037 CA PRO A 64 10.839 12.499 -4.864 1.00 0.00 C ATOM 1038 C PRO A 64 9.498 12.112 -5.497 1.00 0.00 C ATOM 1039 O PRO A 64 8.656 11.507 -4.862 1.00 0.00 O ATOM 1040 CB PRO A 64 10.955 14.015 -4.744 1.00 0.00 C ATOM 1041 CG PRO A 64 11.675 14.455 -5.981 1.00 0.00 C ATOM 1042 CD PRO A 64 12.522 13.299 -6.451 1.00 0.00 C ATOM 0 HA PRO A 64 10.876 11.987 -3.902 1.00 0.00 H new ATOM 0 HB2 PRO A 64 9.972 14.480 -4.675 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.506 14.298 -3.847 1.00 0.00 H new ATOM 0 HG2 PRO A 64 10.964 14.748 -6.754 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.297 15.326 -5.773 1.00 0.00 H new ATOM 0 HD2 PRO A 64 12.464 13.177 -7.533 1.00 0.00 H new ATOM 0 HD3 PRO A 64 13.573 13.450 -6.204 1.00 0.00 H new ATOM 1050 N ASP A 65 9.289 12.465 -6.737 1.00 0.00 N ATOM 1051 CA ASP A 65 7.998 12.127 -7.406 1.00 0.00 C ATOM 1052 C ASP A 65 7.550 10.712 -7.029 1.00 0.00 C ATOM 1053 O ASP A 65 6.503 10.517 -6.447 1.00 0.00 O ATOM 1054 CB ASP A 65 8.294 12.216 -8.903 1.00 0.00 C ATOM 1055 CG ASP A 65 8.783 13.625 -9.243 1.00 0.00 C ATOM 1056 OD1 ASP A 65 9.591 14.148 -8.493 1.00 0.00 O ATOM 1057 OD2 ASP A 65 8.341 14.157 -10.248 1.00 0.00 O ATOM 0 H ASP A 65 9.957 12.973 -7.317 1.00 0.00 H new ATOM 0 HA ASP A 65 7.193 12.799 -7.107 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.050 11.481 -9.180 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.397 11.982 -9.477 1.00 0.00 H new ATOM 1062 N ASN A 66 8.338 9.721 -7.349 1.00 0.00 N ATOM 1063 CA ASN A 66 7.954 8.324 -7.000 1.00 0.00 C ATOM 1064 C ASN A 66 9.184 7.537 -6.543 1.00 0.00 C ATOM 1065 O ASN A 66 10.291 7.791 -6.974 1.00 0.00 O ATOM 1066 CB ASN A 66 7.384 7.728 -8.288 1.00 0.00 C ATOM 1067 CG ASN A 66 8.313 8.055 -9.459 1.00 0.00 C ATOM 1068 OD1 ASN A 66 8.247 9.231 -10.018 1.00 0.00 O flip ATOM 1069 ND2 ASN A 66 9.105 7.230 -9.868 1.00 0.00 N flip ATOM 0 H ASN A 66 9.229 9.819 -7.836 1.00 0.00 H new ATOM 0 HA ASN A 66 7.232 8.289 -6.184 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.278 6.648 -8.185 1.00 0.00 H new ATOM 0 HB3 ASN A 66 6.388 8.130 -8.477 1.00 0.00 H new ATOM 0 HD21 ASN A 66 9.156 6.310 -9.430 1.00 0.00 H new ATOM 0 HD22 ASN A 66 9.720 7.457 -10.650 1.00 0.00 H new ATOM 1076 N ALA A 67 8.997 6.581 -5.677 1.00 0.00 N ATOM 1077 CA ALA A 67 10.153 5.774 -5.195 1.00 0.00 C ATOM 1078 C ALA A 67 9.804 4.285 -5.238 1.00 0.00 C ATOM 1079 O ALA A 67 9.349 3.715 -4.267 1.00 0.00 O ATOM 1080 CB ALA A 67 10.384 6.231 -3.755 1.00 0.00 C ATOM 0 H ALA A 67 8.093 6.323 -5.282 1.00 0.00 H new ATOM 0 HA ALA A 67 11.042 5.912 -5.811 1.00 0.00 H new ATOM 0 HB1 ALA A 67 11.223 5.681 -3.329 1.00 0.00 H new ATOM 0 HB2 ALA A 67 10.606 7.298 -3.743 1.00 0.00 H new ATOM 0 HB3 ALA A 67 9.488 6.041 -3.165 1.00 0.00 H new ATOM 1086 N GLU A 68 10.012 3.650 -6.360 1.00 0.00 N ATOM 1087 CA GLU A 68 9.690 2.198 -6.464 1.00 0.00 C ATOM 1088 C GLU A 68 10.846 1.362 -5.907 1.00 0.00 C ATOM 1089 O GLU A 68 11.656 0.836 -6.643 1.00 0.00 O ATOM 1090 CB GLU A 68 9.514 1.939 -7.960 1.00 0.00 C ATOM 1091 CG GLU A 68 8.543 2.969 -8.546 1.00 0.00 C ATOM 1092 CD GLU A 68 8.199 2.585 -9.986 1.00 0.00 C ATOM 1093 OE1 GLU A 68 8.948 2.957 -10.874 1.00 0.00 O ATOM 1094 OE2 GLU A 68 7.189 1.925 -10.177 1.00 0.00 O ATOM 0 H GLU A 68 10.390 4.073 -7.207 1.00 0.00 H new ATOM 0 HA GLU A 68 8.799 1.929 -5.896 1.00 0.00 H new ATOM 0 HB2 GLU A 68 10.477 2.002 -8.467 1.00 0.00 H new ATOM 0 HB3 GLU A 68 9.133 0.931 -8.123 1.00 0.00 H new ATOM 0 HG2 GLU A 68 7.636 3.013 -7.944 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.991 3.962 -8.520 1.00 0.00 H new ATOM 1101 N LEU A 69 10.929 1.238 -4.610 1.00 0.00 N ATOM 1102 CA LEU A 69 12.033 0.437 -4.007 1.00 0.00 C ATOM 1103 C LEU A 69 11.654 -1.044 -3.961 1.00 0.00 C ATOM 1104 O LEU A 69 10.676 -1.426 -3.349 1.00 0.00 O ATOM 1105 CB LEU A 69 12.201 0.990 -2.589 1.00 0.00 C ATOM 1106 CG LEU A 69 12.924 2.337 -2.641 1.00 0.00 C ATOM 1107 CD1 LEU A 69 12.103 3.331 -3.463 1.00 0.00 C ATOM 1108 CD2 LEU A 69 13.094 2.875 -1.218 1.00 0.00 C ATOM 0 H LEU A 69 10.281 1.656 -3.942 1.00 0.00 H new ATOM 0 HA LEU A 69 12.954 0.510 -4.585 1.00 0.00 H new ATOM 0 HB2 LEU A 69 11.226 1.108 -2.117 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.767 0.286 -1.979 1.00 0.00 H new ATOM 0 HG LEU A 69 13.902 2.205 -3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 69 12.621 4.289 -3.498 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.977 2.949 -4.476 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.124 3.464 -3.002 1.00 0.00 H new ATOM 0 HD21 LEU A 69 13.609 3.835 -1.251 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.114 3.005 -0.759 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.680 2.169 -0.630 1.00 0.00 H new ATOM 1120 N VAL A 70 12.425 -1.883 -4.598 1.00 0.00 N ATOM 1121 CA VAL A 70 12.112 -3.340 -4.584 1.00 0.00 C ATOM 1122 C VAL A 70 12.925 -4.033 -3.489 1.00 0.00 C ATOM 1123 O VAL A 70 14.139 -3.981 -3.479 1.00 0.00 O ATOM 1124 CB VAL A 70 12.529 -3.851 -5.963 1.00 0.00 C ATOM 1125 CG1 VAL A 70 11.924 -5.236 -6.197 1.00 0.00 C ATOM 1126 CG2 VAL A 70 12.026 -2.888 -7.039 1.00 0.00 C ATOM 0 H VAL A 70 13.257 -1.623 -5.127 1.00 0.00 H new ATOM 0 HA VAL A 70 11.059 -3.538 -4.381 1.00 0.00 H new ATOM 0 HB VAL A 70 13.616 -3.915 -6.013 1.00 0.00 H new ATOM 0 HG11 VAL A 70 12.221 -5.601 -7.180 1.00 0.00 H new ATOM 0 HG12 VAL A 70 12.282 -5.924 -5.431 1.00 0.00 H new ATOM 0 HG13 VAL A 70 10.837 -5.171 -6.147 1.00 0.00 H new ATOM 0 HG21 VAL A 70 12.324 -3.253 -8.022 1.00 0.00 H new ATOM 0 HG22 VAL A 70 10.939 -2.823 -6.990 1.00 0.00 H new ATOM 0 HG23 VAL A 70 12.456 -1.900 -6.873 1.00 0.00 H new ATOM 1136 N LEU A 71 12.270 -4.678 -2.564 1.00 0.00 N ATOM 1137 CA LEU A 71 13.018 -5.364 -1.476 1.00 0.00 C ATOM 1138 C LEU A 71 13.917 -6.452 -2.069 1.00 0.00 C ATOM 1139 O LEU A 71 13.481 -7.273 -2.850 1.00 0.00 O ATOM 1140 CB LEU A 71 11.940 -5.972 -0.574 1.00 0.00 C ATOM 1141 CG LEU A 71 11.356 -7.225 -1.225 1.00 0.00 C ATOM 1142 CD1 LEU A 71 12.260 -8.423 -0.925 1.00 0.00 C ATOM 1143 CD2 LEU A 71 9.963 -7.491 -0.652 1.00 0.00 C ATOM 0 H LEU A 71 11.254 -4.759 -2.515 1.00 0.00 H new ATOM 0 HA LEU A 71 13.667 -4.686 -0.921 1.00 0.00 H new ATOM 0 HB2 LEU A 71 12.366 -6.223 0.397 1.00 0.00 H new ATOM 0 HB3 LEU A 71 11.150 -5.243 -0.397 1.00 0.00 H new ATOM 0 HG LEU A 71 11.289 -7.077 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.844 -9.318 -1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 71 13.256 -8.236 -1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 71 12.324 -8.570 0.153 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.544 -8.384 -1.115 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.035 -7.640 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.316 -6.638 -0.858 1.00 0.00 H new ATOM 1155 N LEU A 72 15.172 -6.459 -1.712 1.00 0.00 N ATOM 1156 CA LEU A 72 16.096 -7.491 -2.263 1.00 0.00 C ATOM 1157 C LEU A 72 17.029 -8.007 -1.165 1.00 0.00 C ATOM 1158 O LEU A 72 17.818 -7.268 -0.612 1.00 0.00 O ATOM 1159 CB LEU A 72 16.899 -6.773 -3.348 1.00 0.00 C ATOM 1160 CG LEU A 72 18.098 -7.636 -3.747 1.00 0.00 C ATOM 1161 CD1 LEU A 72 18.097 -7.847 -5.261 1.00 0.00 C ATOM 1162 CD2 LEU A 72 19.393 -6.933 -3.333 1.00 0.00 C ATOM 0 H LEU A 72 15.597 -5.796 -1.064 1.00 0.00 H new ATOM 0 HA LEU A 72 15.558 -8.353 -2.657 1.00 0.00 H new ATOM 0 HB2 LEU A 72 16.269 -6.583 -4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 72 17.240 -5.804 -2.983 1.00 0.00 H new ATOM 0 HG LEU A 72 18.030 -8.602 -3.246 1.00 0.00 H new ATOM 0 HD11 LEU A 72 18.952 -8.462 -5.543 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.176 -8.348 -5.558 1.00 0.00 H new ATOM 0 HD13 LEU A 72 18.163 -6.882 -5.763 1.00 0.00 H new ATOM 0 HD21 LEU A 72 20.247 -7.547 -3.617 1.00 0.00 H new ATOM 0 HD22 LEU A 72 19.459 -5.967 -3.833 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.397 -6.783 -2.253 1.00 0.00 H new ATOM 1174 N THR A 73 16.949 -9.270 -0.849 1.00 0.00 N ATOM 1175 CA THR A 73 17.839 -9.826 0.209 1.00 0.00 C ATOM 1176 C THR A 73 18.585 -11.052 -0.322 1.00 0.00 C ATOM 1177 O THR A 73 18.210 -12.179 -0.069 1.00 0.00 O ATOM 1178 CB THR A 73 16.898 -10.224 1.348 1.00 0.00 C ATOM 1179 OG1 THR A 73 17.640 -10.888 2.361 1.00 0.00 O ATOM 1180 CG2 THR A 73 15.813 -11.156 0.810 1.00 0.00 C ATOM 0 H THR A 73 16.308 -9.939 -1.276 1.00 0.00 H new ATOM 0 HA THR A 73 18.593 -9.110 0.534 1.00 0.00 H new ATOM 0 HB THR A 73 16.432 -9.332 1.766 1.00 0.00 H new ATOM 0 HG1 THR A 73 18.567 -10.571 2.348 1.00 0.00 H new ATOM 0 HG21 THR A 73 15.142 -11.440 1.621 1.00 0.00 H new ATOM 0 HG22 THR A 73 15.246 -10.644 0.033 1.00 0.00 H new ATOM 0 HG23 THR A 73 16.276 -12.050 0.392 1.00 0.00 H new ATOM 1188 N LEU A 74 19.643 -10.838 -1.056 1.00 0.00 N ATOM 1189 CA LEU A 74 20.421 -11.986 -1.602 1.00 0.00 C ATOM 1190 C LEU A 74 21.908 -11.632 -1.650 1.00 0.00 C ATOM 1191 O LEU A 74 22.296 -10.509 -1.388 1.00 0.00 O ATOM 1192 CB LEU A 74 19.869 -12.205 -3.012 1.00 0.00 C ATOM 1193 CG LEU A 74 20.122 -13.652 -3.444 1.00 0.00 C ATOM 1194 CD1 LEU A 74 19.553 -14.608 -2.394 1.00 0.00 C ATOM 1195 CD2 LEU A 74 19.436 -13.908 -4.788 1.00 0.00 C ATOM 0 H LEU A 74 20.003 -9.916 -1.301 1.00 0.00 H new ATOM 0 HA LEU A 74 20.327 -12.883 -0.989 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.801 -11.990 -3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 74 20.346 -11.518 -3.711 1.00 0.00 H new ATOM 0 HG LEU A 74 21.195 -13.818 -3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 74 19.734 -15.637 -2.703 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.039 -14.426 -1.435 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.480 -14.442 -2.294 1.00 0.00 H new ATOM 0 HD21 LEU A 74 19.615 -14.938 -5.097 1.00 0.00 H new ATOM 0 HD22 LEU A 74 18.364 -13.741 -4.687 1.00 0.00 H new ATOM 0 HD23 LEU A 74 19.840 -13.228 -5.538 1.00 0.00 H new ATOM 1207 N GLY A 75 22.745 -12.573 -1.983 1.00 0.00 N ATOM 1208 CA GLY A 75 24.204 -12.281 -2.048 1.00 0.00 C ATOM 1209 C GLY A 75 24.488 -11.365 -3.240 1.00 0.00 C ATOM 1210 O GLY A 75 25.547 -10.779 -3.346 1.00 0.00 O ATOM 0 H GLY A 75 22.483 -13.531 -2.213 1.00 0.00 H new ATOM 0 HA2 GLY A 75 24.532 -11.805 -1.124 1.00 0.00 H new ATOM 0 HA3 GLY A 75 24.767 -13.209 -2.146 1.00 0.00 H new ATOM 1214 N GLN A 76 23.551 -11.239 -4.141 1.00 0.00 N ATOM 1215 CA GLN A 76 23.770 -10.364 -5.328 1.00 0.00 C ATOM 1216 C GLN A 76 22.850 -9.138 -5.268 1.00 0.00 C ATOM 1217 O GLN A 76 21.834 -9.143 -4.603 1.00 0.00 O ATOM 1218 CB GLN A 76 23.429 -11.242 -6.536 1.00 0.00 C ATOM 1219 CG GLN A 76 21.911 -11.322 -6.709 1.00 0.00 C ATOM 1220 CD GLN A 76 21.554 -12.552 -7.545 1.00 0.00 C ATOM 1221 OE1 GLN A 76 21.689 -13.671 -7.089 1.00 0.00 O ATOM 1222 NE2 GLN A 76 21.102 -12.392 -8.758 1.00 0.00 N ATOM 0 H GLN A 76 22.644 -11.704 -4.106 1.00 0.00 H new ATOM 0 HA GLN A 76 24.790 -9.984 -5.377 1.00 0.00 H new ATOM 0 HB2 GLN A 76 23.885 -10.830 -7.436 1.00 0.00 H new ATOM 0 HB3 GLN A 76 23.841 -12.242 -6.398 1.00 0.00 H new ATOM 0 HG2 GLN A 76 21.426 -11.379 -5.734 1.00 0.00 H new ATOM 0 HG3 GLN A 76 21.542 -10.419 -7.196 1.00 0.00 H new ATOM 0 HE21 GLN A 76 20.989 -11.453 -9.140 1.00 0.00 H new ATOM 0 HE22 GLN A 76 20.862 -13.206 -9.324 1.00 0.00 H new ATOM 1231 N ALA A 77 23.202 -8.090 -5.962 1.00 0.00 N ATOM 1232 CA ALA A 77 22.351 -6.863 -5.950 1.00 0.00 C ATOM 1233 C ALA A 77 21.266 -6.962 -7.026 1.00 0.00 C ATOM 1234 O ALA A 77 21.324 -7.799 -7.905 1.00 0.00 O ATOM 1235 CB ALA A 77 23.309 -5.713 -6.261 1.00 0.00 C ATOM 0 H ALA A 77 24.042 -8.029 -6.537 1.00 0.00 H new ATOM 0 HA ALA A 77 21.842 -6.723 -4.996 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.758 -4.773 -6.270 1.00 0.00 H new ATOM 0 HB2 ALA A 77 24.086 -5.670 -5.498 1.00 0.00 H new ATOM 0 HB3 ALA A 77 23.767 -5.875 -7.237 1.00 0.00 H new ATOM 1241 N TRP A 78 20.273 -6.117 -6.961 1.00 0.00 N ATOM 1242 CA TRP A 78 19.183 -6.168 -7.979 1.00 0.00 C ATOM 1243 C TRP A 78 19.630 -5.481 -9.273 1.00 0.00 C ATOM 1244 O TRP A 78 20.207 -4.414 -9.254 1.00 0.00 O ATOM 1245 CB TRP A 78 18.015 -5.410 -7.347 1.00 0.00 C ATOM 1246 CG TRP A 78 16.801 -5.561 -8.206 1.00 0.00 C ATOM 1247 CD1 TRP A 78 16.085 -4.538 -8.725 1.00 0.00 C ATOM 1248 CD2 TRP A 78 16.150 -6.786 -8.654 1.00 0.00 C ATOM 1249 NE1 TRP A 78 15.036 -5.056 -9.464 1.00 0.00 N ATOM 1250 CE2 TRP A 78 15.035 -6.437 -9.451 1.00 0.00 C ATOM 1251 CE3 TRP A 78 16.418 -8.153 -8.450 1.00 0.00 C ATOM 1252 CZ2 TRP A 78 14.213 -7.408 -10.024 1.00 0.00 C ATOM 1253 CZ3 TRP A 78 15.593 -9.133 -9.026 1.00 0.00 C ATOM 1254 CH2 TRP A 78 14.493 -8.761 -9.812 1.00 0.00 C ATOM 0 H TRP A 78 20.169 -5.394 -6.249 1.00 0.00 H new ATOM 0 HA TRP A 78 18.913 -7.191 -8.241 1.00 0.00 H new ATOM 0 HB2 TRP A 78 17.816 -5.795 -6.347 1.00 0.00 H new ATOM 0 HB3 TRP A 78 18.268 -4.355 -7.238 1.00 0.00 H new ATOM 0 HD1 TRP A 78 16.297 -3.488 -8.586 1.00 0.00 H new ATOM 0 HE1 TRP A 78 14.348 -4.488 -9.958 1.00 0.00 H new ATOM 0 HE3 TRP A 78 17.263 -8.450 -7.847 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 13.366 -7.116 -10.627 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 15.807 -10.179 -8.863 1.00 0.00 H new ATOM 0 HH2 TRP A 78 13.863 -9.519 -10.253 1.00 0.00 H new ATOM 1265 N GLN A 79 19.365 -6.089 -10.398 1.00 0.00 N ATOM 1266 CA GLN A 79 19.775 -5.474 -11.693 1.00 0.00 C ATOM 1267 C GLN A 79 18.664 -5.647 -12.735 1.00 0.00 C ATOM 1268 O GLN A 79 18.813 -6.367 -13.700 1.00 0.00 O ATOM 1269 CB GLN A 79 21.030 -6.240 -12.115 1.00 0.00 C ATOM 1270 CG GLN A 79 21.637 -5.586 -13.359 1.00 0.00 C ATOM 1271 CD GLN A 79 22.490 -4.387 -12.941 1.00 0.00 C ATOM 1272 OE1 GLN A 79 23.682 -4.515 -12.738 1.00 0.00 O ATOM 1273 NE2 GLN A 79 21.929 -3.217 -12.806 1.00 0.00 N ATOM 0 H GLN A 79 18.883 -6.984 -10.476 1.00 0.00 H new ATOM 0 HA GLN A 79 19.962 -4.404 -11.602 1.00 0.00 H new ATOM 0 HB2 GLN A 79 21.757 -6.243 -11.302 1.00 0.00 H new ATOM 0 HB3 GLN A 79 20.780 -7.280 -12.324 1.00 0.00 H new ATOM 0 HG2 GLN A 79 22.247 -6.308 -13.901 1.00 0.00 H new ATOM 0 HG3 GLN A 79 20.846 -5.264 -14.036 1.00 0.00 H new ATOM 0 HE21 GLN A 79 20.929 -3.108 -12.976 1.00 0.00 H new ATOM 0 HE22 GLN A 79 22.490 -2.411 -12.531 1.00 0.00 H new ATOM 1282 N GLY A 80 17.552 -4.990 -12.545 1.00 0.00 N ATOM 1283 CA GLY A 80 16.434 -5.117 -13.523 1.00 0.00 C ATOM 1284 C GLY A 80 16.061 -3.733 -14.058 1.00 0.00 C ATOM 1285 O GLY A 80 15.193 -3.066 -13.530 1.00 0.00 O ATOM 0 H GLY A 80 17.369 -4.371 -11.755 1.00 0.00 H new ATOM 0 HA2 GLY A 80 16.729 -5.769 -14.345 1.00 0.00 H new ATOM 0 HA3 GLY A 80 15.570 -5.578 -13.045 1.00 0.00 H new ATOM 1289 N HIS A 81 16.714 -3.293 -15.100 1.00 0.00 N ATOM 1290 CA HIS A 81 16.400 -1.950 -15.665 1.00 0.00 C ATOM 1291 C HIS A 81 14.958 -1.913 -16.182 1.00 0.00 C ATOM 1292 O HIS A 81 14.074 -1.640 -15.387 1.00 0.00 O ATOM 1293 CB HIS A 81 17.398 -1.757 -16.812 1.00 0.00 C ATOM 1294 CG HIS A 81 17.180 -2.812 -17.864 1.00 0.00 C ATOM 1295 ND1 HIS A 81 17.441 -4.160 -17.883 1.00 0.00 N flip ATOM 1296 CD2 HIS A 81 16.623 -2.518 -19.099 1.00 0.00 C flip ATOM 1297 CE1 HIS A 81 17.053 -4.695 -19.108 1.00 0.00 C flip ATOM 1298 NE2 HIS A 81 16.568 -3.664 -19.803 1.00 0.00 N flip ATOM 0 H HIS A 81 17.451 -3.806 -15.584 1.00 0.00 H new ATOM 0 HA HIS A 81 16.483 -1.159 -14.920 1.00 0.00 H new ATOM 0 HB2 HIS A 81 17.277 -0.766 -17.248 1.00 0.00 H new ATOM 0 HB3 HIS A 81 18.418 -1.815 -16.432 1.00 0.00 H new ATOM 0 HD2 HIS A 81 16.293 -1.546 -19.435 1.00 0.00 H new ATOM 0 HE1 HIS A 81 17.128 -5.724 -19.428 1.00 0.00 H new ATOM 0 HE2 HIS A 81 16.201 -3.736 -20.752 1.00 0.00 H new TER 1306 HIS A 81 ATOM 1307 N SER B 12 -6.072 28.602 2.388 1.00 0.00 N ATOM 1308 CA SER B 12 -6.334 27.691 3.543 1.00 0.00 C ATOM 1309 C SER B 12 -7.183 26.501 3.091 1.00 0.00 C ATOM 1310 O SER B 12 -8.341 26.382 3.442 1.00 0.00 O ATOM 1311 CB SER B 12 -7.100 28.541 4.557 1.00 0.00 C ATOM 1312 OG SER B 12 -6.335 29.695 4.873 1.00 0.00 O ATOM 0 HA SER B 12 -5.415 27.286 3.966 1.00 0.00 H new ATOM 0 HB2 SER B 12 -8.067 28.832 4.148 1.00 0.00 H new ATOM 0 HB3 SER B 12 -7.297 27.962 5.459 1.00 0.00 H new ATOM 0 HG SER B 12 -5.873 30.011 4.069 1.00 0.00 H new ATOM 1318 N GLY B 13 -6.619 25.616 2.315 1.00 0.00 N ATOM 1319 CA GLY B 13 -7.394 24.435 1.843 1.00 0.00 C ATOM 1320 C GLY B 13 -6.901 23.180 2.568 1.00 0.00 C ATOM 1321 O GLY B 13 -6.952 22.086 2.042 1.00 0.00 O ATOM 0 H GLY B 13 -5.654 25.660 1.988 1.00 0.00 H new ATOM 0 HA2 GLY B 13 -8.457 24.584 2.033 1.00 0.00 H new ATOM 0 HA3 GLY B 13 -7.276 24.316 0.766 1.00 0.00 H new ATOM 1325 N GLU B 14 -6.422 23.333 3.773 1.00 0.00 N ATOM 1326 CA GLU B 14 -5.924 22.151 4.536 1.00 0.00 C ATOM 1327 C GLU B 14 -7.057 21.144 4.757 1.00 0.00 C ATOM 1328 O GLU B 14 -8.222 21.465 4.627 1.00 0.00 O ATOM 1329 CB GLU B 14 -5.442 22.719 5.871 1.00 0.00 C ATOM 1330 CG GLU B 14 -4.989 21.577 6.782 1.00 0.00 C ATOM 1331 CD GLU B 14 -6.176 21.083 7.609 1.00 0.00 C ATOM 1332 OE1 GLU B 14 -7.154 21.807 7.697 1.00 0.00 O ATOM 1333 OE2 GLU B 14 -6.088 19.989 8.141 1.00 0.00 O ATOM 0 H GLU B 14 -6.354 24.225 4.263 1.00 0.00 H new ATOM 0 HA GLU B 14 -5.132 21.622 4.007 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -4.619 23.414 5.706 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -6.244 23.282 6.349 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -4.583 20.760 6.185 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -4.190 21.918 7.440 1.00 0.00 H new ATOM 1340 N ILE B 15 -6.723 19.930 5.094 1.00 0.00 N ATOM 1341 CA ILE B 15 -7.779 18.902 5.326 1.00 0.00 C ATOM 1342 C ILE B 15 -8.373 19.067 6.728 1.00 0.00 C ATOM 1343 O ILE B 15 -7.862 18.538 7.694 1.00 0.00 O ATOM 1344 CB ILE B 15 -7.063 17.558 5.202 1.00 0.00 C ATOM 1345 CG1 ILE B 15 -6.734 17.291 3.733 1.00 0.00 C ATOM 1346 CG2 ILE B 15 -7.970 16.445 5.731 1.00 0.00 C ATOM 1347 CD1 ILE B 15 -8.019 17.340 2.904 1.00 0.00 C ATOM 0 H ILE B 15 -5.765 19.604 5.219 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.603 18.989 4.617 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.141 17.582 5.784 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -6.025 18.034 3.368 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -6.258 16.316 3.628 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -7.459 15.486 5.642 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.206 16.635 6.778 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -8.892 16.420 5.150 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.784 17.150 1.857 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -8.713 16.581 3.264 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.477 18.325 3.000 1.00 0.00 H new ATOM 1359 N ARG B 16 -9.448 19.798 6.845 1.00 0.00 N ATOM 1360 CA ARG B 16 -10.071 19.997 8.185 1.00 0.00 C ATOM 1361 C ARG B 16 -11.180 18.967 8.413 1.00 0.00 C ATOM 1362 O ARG B 16 -11.157 18.215 9.366 1.00 0.00 O ATOM 1363 CB ARG B 16 -10.653 21.409 8.143 1.00 0.00 C ATOM 1364 CG ARG B 16 -10.984 21.870 9.564 1.00 0.00 C ATOM 1365 CD ARG B 16 -12.346 22.567 9.570 1.00 0.00 C ATOM 1366 NE ARG B 16 -12.282 23.527 10.707 1.00 0.00 N ATOM 1367 CZ ARG B 16 -13.150 24.500 10.793 1.00 0.00 C ATOM 1368 NH1 ARG B 16 -14.076 24.635 9.883 1.00 0.00 N ATOM 1369 NH2 ARG B 16 -13.090 25.339 11.790 1.00 0.00 N ATOM 0 H ARG B 16 -9.921 20.266 6.072 1.00 0.00 H new ATOM 0 HA ARG B 16 -9.353 19.874 8.996 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -9.940 22.094 7.685 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -11.552 21.425 7.526 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -10.998 21.016 10.241 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -10.213 22.551 9.926 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -12.530 23.083 8.628 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -13.156 21.850 9.704 1.00 0.00 H new ATOM 0 HE ARG B 16 -11.559 23.425 11.420 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -14.123 23.980 9.102 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -14.752 25.395 9.952 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -12.366 25.235 12.501 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -13.767 26.099 11.858 1.00 0.00 H new ATOM 1383 N THR B 17 -12.153 18.929 7.543 1.00 0.00 N ATOM 1384 CA THR B 17 -13.264 17.948 7.709 1.00 0.00 C ATOM 1385 C THR B 17 -12.830 16.566 7.212 1.00 0.00 C ATOM 1386 O THR B 17 -11.710 16.375 6.779 1.00 0.00 O ATOM 1387 CB THR B 17 -14.406 18.495 6.850 1.00 0.00 C ATOM 1388 OG1 THR B 17 -14.540 19.891 7.077 1.00 0.00 O ATOM 1389 CG2 THR B 17 -15.711 17.790 7.223 1.00 0.00 C ATOM 0 H THR B 17 -12.227 19.534 6.725 1.00 0.00 H new ATOM 0 HA THR B 17 -13.559 17.830 8.752 1.00 0.00 H new ATOM 0 HB THR B 17 -14.187 18.316 5.797 1.00 0.00 H new ATOM 0 HG1 THR B 17 -15.270 20.243 6.526 1.00 0.00 H new ATOM 0 HG21 THR B 17 -16.524 18.181 6.610 1.00 0.00 H new ATOM 0 HG22 THR B 17 -15.608 16.719 7.049 1.00 0.00 H new ATOM 0 HG23 THR B 17 -15.932 17.967 8.275 1.00 0.00 H new ATOM 1397 N LEU B 18 -13.706 15.600 7.272 1.00 0.00 N ATOM 1398 CA LEU B 18 -13.341 14.232 6.806 1.00 0.00 C ATOM 1399 C LEU B 18 -13.425 14.149 5.280 1.00 0.00 C ATOM 1400 O LEU B 18 -14.318 14.700 4.666 1.00 0.00 O ATOM 1401 CB LEU B 18 -14.372 13.305 7.451 1.00 0.00 C ATOM 1402 CG LEU B 18 -14.008 11.850 7.151 1.00 0.00 C ATOM 1403 CD1 LEU B 18 -14.453 10.962 8.315 1.00 0.00 C ATOM 1404 CD2 LEU B 18 -14.715 11.403 5.871 1.00 0.00 C ATOM 0 H LEU B 18 -14.658 15.699 7.624 1.00 0.00 H new ATOM 0 HA LEU B 18 -12.321 13.963 7.081 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -14.401 13.469 8.528 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -15.368 13.528 7.068 1.00 0.00 H new ATOM 0 HG LEU B 18 -12.929 11.764 7.021 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -14.194 9.925 8.101 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -13.951 11.281 9.228 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -15.532 11.047 8.445 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -14.457 10.366 5.656 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -15.794 11.488 6.002 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -14.399 12.035 5.041 1.00 0.00 H new ATOM 1416 N LYS B 19 -12.502 13.464 4.664 1.00 0.00 N ATOM 1417 CA LYS B 19 -12.526 13.344 3.177 1.00 0.00 C ATOM 1418 C LYS B 19 -13.275 12.074 2.762 1.00 0.00 C ATOM 1419 O LYS B 19 -12.783 10.977 2.937 1.00 0.00 O ATOM 1420 CB LYS B 19 -11.055 13.260 2.768 1.00 0.00 C ATOM 1421 CG LYS B 19 -10.938 13.390 1.248 1.00 0.00 C ATOM 1422 CD LYS B 19 -9.471 13.599 0.861 1.00 0.00 C ATOM 1423 CE LYS B 19 -8.594 12.585 1.602 1.00 0.00 C ATOM 1424 NZ LYS B 19 -8.151 13.284 2.842 1.00 0.00 N ATOM 0 H LYS B 19 -11.731 12.981 5.125 1.00 0.00 H new ATOM 0 HA LYS B 19 -13.035 14.181 2.700 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -10.485 14.051 3.256 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -10.629 12.312 3.096 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -11.328 12.494 0.765 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -11.540 14.228 0.897 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -9.348 13.482 -0.216 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -9.160 14.614 1.109 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -9.153 11.680 1.839 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -7.741 12.283 0.994 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -7.118 13.208 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -8.421 14.287 2.790 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -8.605 12.846 3.669 1.00 0.00 H new ATOM 1438 N PRO B 20 -14.450 12.271 2.227 1.00 0.00 N ATOM 1439 CA PRO B 20 -15.287 11.129 1.782 1.00 0.00 C ATOM 1440 C PRO B 20 -14.728 10.522 0.491 1.00 0.00 C ATOM 1441 O PRO B 20 -14.454 11.218 -0.465 1.00 0.00 O ATOM 1442 CB PRO B 20 -16.654 11.761 1.539 1.00 0.00 C ATOM 1443 CG PRO B 20 -16.372 13.203 1.259 1.00 0.00 C ATOM 1444 CD PRO B 20 -15.104 13.562 1.989 1.00 0.00 C ATOM 0 HA PRO B 20 -15.321 10.316 2.507 1.00 0.00 H new ATOM 0 HB2 PRO B 20 -17.163 11.288 0.699 1.00 0.00 H new ATOM 0 HB3 PRO B 20 -17.301 11.647 2.409 1.00 0.00 H new ATOM 0 HG2 PRO B 20 -16.260 13.372 0.188 1.00 0.00 H new ATOM 0 HG3 PRO B 20 -17.199 13.828 1.595 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -14.475 14.224 1.393 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -15.316 14.080 2.924 1.00 0.00 H new ATOM 1452 N CYS B 21 -14.560 9.229 0.458 1.00 0.00 N ATOM 1453 CA CYS B 21 -14.020 8.575 -0.769 1.00 0.00 C ATOM 1454 C CYS B 21 -15.010 7.533 -1.295 1.00 0.00 C ATOM 1455 O CYS B 21 -16.029 7.268 -0.688 1.00 0.00 O ATOM 1456 CB CYS B 21 -12.723 7.900 -0.323 1.00 0.00 C ATOM 1457 SG CYS B 21 -11.715 9.083 0.606 1.00 0.00 S ATOM 0 H CYS B 21 -14.773 8.595 1.228 1.00 0.00 H new ATOM 0 HA CYS B 21 -13.852 9.290 -1.575 1.00 0.00 H new ATOM 0 HB2 CYS B 21 -12.947 7.032 0.296 1.00 0.00 H new ATOM 0 HB3 CYS B 21 -12.171 7.539 -1.191 1.00 0.00 H new ATOM 0 HG CYS B 21 -12.413 9.570 1.589 1.00 0.00 H new ATOM 1463 N LEU B 22 -14.717 6.939 -2.419 1.00 0.00 N ATOM 1464 CA LEU B 22 -15.640 5.913 -2.985 1.00 0.00 C ATOM 1465 C LEU B 22 -14.963 4.539 -2.996 1.00 0.00 C ATOM 1466 O LEU B 22 -13.886 4.371 -3.533 1.00 0.00 O ATOM 1467 CB LEU B 22 -15.928 6.382 -4.412 1.00 0.00 C ATOM 1468 CG LEU B 22 -16.900 7.562 -4.377 1.00 0.00 C ATOM 1469 CD1 LEU B 22 -16.219 8.804 -4.953 1.00 0.00 C ATOM 1470 CD2 LEU B 22 -18.136 7.227 -5.216 1.00 0.00 C ATOM 0 H LEU B 22 -13.878 7.119 -2.971 1.00 0.00 H new ATOM 0 HA LEU B 22 -16.553 5.811 -2.398 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -15.000 6.676 -4.903 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.353 5.565 -4.996 1.00 0.00 H new ATOM 0 HG LEU B 22 -17.198 7.756 -3.346 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -16.913 9.644 -4.927 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -15.337 9.044 -4.359 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -15.921 8.611 -5.984 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -18.830 8.067 -5.192 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -17.835 7.034 -6.246 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -18.624 6.342 -4.808 1.00 0.00 H new ATOM 1482 N LEU B 23 -15.589 3.558 -2.409 1.00 0.00 N ATOM 1483 CA LEU B 23 -14.989 2.192 -2.385 1.00 0.00 C ATOM 1484 C LEU B 23 -15.832 1.239 -3.233 1.00 0.00 C ATOM 1485 O LEU B 23 -16.865 1.609 -3.753 1.00 0.00 O ATOM 1486 CB LEU B 23 -15.017 1.771 -0.915 1.00 0.00 C ATOM 1487 CG LEU B 23 -14.458 2.900 -0.049 1.00 0.00 C ATOM 1488 CD1 LEU B 23 -14.422 2.454 1.414 1.00 0.00 C ATOM 1489 CD2 LEU B 23 -13.040 3.242 -0.512 1.00 0.00 C ATOM 0 H LEU B 23 -16.493 3.642 -1.943 1.00 0.00 H new ATOM 0 HA LEU B 23 -13.978 2.174 -2.791 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -16.038 1.538 -0.612 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -14.428 0.865 -0.774 1.00 0.00 H new ATOM 0 HG LEU B 23 -15.095 3.779 -0.144 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -14.023 3.260 2.030 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -15.431 2.210 1.745 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -13.786 1.574 1.511 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -12.640 4.047 0.105 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -12.404 2.362 -0.417 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -13.064 3.561 -1.554 1.00 0.00 H new ATOM 1501 N ARG B 24 -15.402 0.017 -3.387 1.00 0.00 N ATOM 1502 CA ARG B 24 -16.193 -0.946 -4.203 1.00 0.00 C ATOM 1503 C ARG B 24 -16.162 -2.337 -3.570 1.00 0.00 C ATOM 1504 O ARG B 24 -15.349 -2.626 -2.714 1.00 0.00 O ATOM 1505 CB ARG B 24 -15.514 -0.960 -5.574 1.00 0.00 C ATOM 1506 CG ARG B 24 -16.442 -1.615 -6.600 1.00 0.00 C ATOM 1507 CD ARG B 24 -15.777 -1.592 -7.979 1.00 0.00 C ATOM 1508 NE ARG B 24 -15.645 -0.147 -8.318 1.00 0.00 N ATOM 1509 CZ ARG B 24 -15.243 0.215 -9.507 1.00 0.00 C ATOM 1510 NH1 ARG B 24 -14.954 -0.687 -10.406 1.00 0.00 N ATOM 1511 NH2 ARG B 24 -15.130 1.483 -9.797 1.00 0.00 N ATOM 0 H ARG B 24 -14.541 -0.355 -2.985 1.00 0.00 H new ATOM 0 HA ARG B 24 -17.242 -0.659 -4.272 1.00 0.00 H new ATOM 0 HB2 ARG B 24 -15.274 0.058 -5.883 1.00 0.00 H new ATOM 0 HB3 ARG B 24 -14.572 -1.506 -5.519 1.00 0.00 H new ATOM 0 HG2 ARG B 24 -16.659 -2.642 -6.306 1.00 0.00 H new ATOM 0 HG3 ARG B 24 -17.394 -1.086 -6.635 1.00 0.00 H new ATOM 0 HD2 ARG B 24 -14.804 -2.083 -7.956 1.00 0.00 H new ATOM 0 HD3 ARG B 24 -16.382 -2.117 -8.718 1.00 0.00 H new ATOM 0 HE ARG B 24 -15.869 0.562 -7.619 1.00 0.00 H new ATOM 0 HH11 ARG B 24 -15.042 -1.678 -10.181 1.00 0.00 H new ATOM 0 HH12 ARG B 24 -14.640 -0.401 -11.333 1.00 0.00 H new ATOM 0 HH21 ARG B 24 -15.355 2.189 -9.096 1.00 0.00 H new ATOM 0 HH22 ARG B 24 -14.816 1.768 -10.725 1.00 0.00 H new ATOM 1525 N ARG B 25 -17.042 -3.204 -3.989 1.00 0.00 N ATOM 1526 CA ARG B 25 -17.068 -4.582 -3.420 1.00 0.00 C ATOM 1527 C ARG B 25 -16.455 -5.569 -4.417 1.00 0.00 C ATOM 1528 O ARG B 25 -16.350 -5.289 -5.595 1.00 0.00 O ATOM 1529 CB ARG B 25 -18.549 -4.886 -3.199 1.00 0.00 C ATOM 1530 CG ARG B 25 -18.695 -6.176 -2.390 1.00 0.00 C ATOM 1531 CD ARG B 25 -20.147 -6.657 -2.461 1.00 0.00 C ATOM 1532 NE ARG B 25 -20.193 -7.879 -1.611 1.00 0.00 N ATOM 1533 CZ ARG B 25 -21.200 -8.705 -1.705 1.00 0.00 C ATOM 1534 NH1 ARG B 25 -22.172 -8.464 -2.545 1.00 0.00 N ATOM 1535 NH2 ARG B 25 -21.236 -9.775 -0.959 1.00 0.00 N ATOM 0 H ARG B 25 -17.746 -3.017 -4.703 1.00 0.00 H new ATOM 0 HA ARG B 25 -16.495 -4.666 -2.497 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -19.025 -4.059 -2.672 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -19.057 -4.987 -4.158 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -18.027 -6.942 -2.782 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -18.408 -6.003 -1.353 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -20.833 -5.895 -2.093 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -20.439 -6.879 -3.487 1.00 0.00 H new ATOM 0 HE ARG B 25 -19.437 -8.071 -0.954 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -22.145 -7.629 -3.130 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -22.957 -9.111 -2.616 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -20.478 -9.965 -0.303 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -22.022 -10.421 -1.031 1.00 0.00 H new ATOM 1549 N ASN B 26 -16.046 -6.719 -3.958 1.00 0.00 N ATOM 1550 CA ASN B 26 -15.436 -7.716 -4.885 1.00 0.00 C ATOM 1551 C ASN B 26 -16.528 -8.502 -5.615 1.00 0.00 C ATOM 1552 O ASN B 26 -16.325 -8.992 -6.709 1.00 0.00 O ATOM 1553 CB ASN B 26 -14.618 -8.644 -3.986 1.00 0.00 C ATOM 1554 CG ASN B 26 -13.767 -9.573 -4.855 1.00 0.00 C ATOM 1555 OD1 ASN B 26 -14.114 -10.824 -4.985 1.00 0.00 O flip ATOM 1556 ND2 ASN B 26 -12.777 -9.156 -5.422 1.00 0.00 N flip ATOM 0 H ASN B 26 -16.107 -7.012 -2.983 1.00 0.00 H new ATOM 0 HA ASN B 26 -14.822 -7.243 -5.651 1.00 0.00 H new ATOM 0 HB2 ASN B 26 -13.978 -8.058 -3.326 1.00 0.00 H new ATOM 0 HB3 ASN B 26 -15.281 -9.230 -3.350 1.00 0.00 H new ATOM 0 HD21 ASN B 26 -12.505 -8.178 -5.321 1.00 0.00 H new ATOM 0 HD22 ASN B 26 -12.218 -9.784 -5.999 1.00 0.00 H new ATOM 1563 N TYR B 27 -17.683 -8.629 -5.021 1.00 0.00 N ATOM 1564 CA TYR B 27 -18.781 -9.387 -5.686 1.00 0.00 C ATOM 1565 C TYR B 27 -19.588 -8.464 -6.604 1.00 0.00 C ATOM 1566 O TYR B 27 -19.878 -8.797 -7.736 1.00 0.00 O ATOM 1567 CB TYR B 27 -19.656 -9.901 -4.542 1.00 0.00 C ATOM 1568 CG TYR B 27 -18.800 -10.630 -3.534 1.00 0.00 C ATOM 1569 CD1 TYR B 27 -18.223 -9.930 -2.468 1.00 0.00 C ATOM 1570 CD2 TYR B 27 -18.586 -12.008 -3.664 1.00 0.00 C ATOM 1571 CE1 TYR B 27 -17.433 -10.607 -1.532 1.00 0.00 C ATOM 1572 CE2 TYR B 27 -17.796 -12.685 -2.727 1.00 0.00 C ATOM 1573 CZ TYR B 27 -17.219 -11.983 -1.660 1.00 0.00 C ATOM 1574 OH TYR B 27 -16.441 -12.650 -0.736 1.00 0.00 O ATOM 0 H TYR B 27 -17.914 -8.242 -4.106 1.00 0.00 H new ATOM 0 HA TYR B 27 -18.402 -10.198 -6.308 1.00 0.00 H new ATOM 0 HB2 TYR B 27 -20.170 -9.068 -4.062 1.00 0.00 H new ATOM 0 HB3 TYR B 27 -20.425 -10.569 -4.931 1.00 0.00 H new ATOM 0 HD1 TYR B 27 -18.387 -8.867 -2.368 1.00 0.00 H new ATOM 0 HD2 TYR B 27 -19.030 -12.548 -4.487 1.00 0.00 H new ATOM 0 HE1 TYR B 27 -16.988 -10.066 -0.710 1.00 0.00 H new ATOM 0 HE2 TYR B 27 -17.631 -13.748 -2.826 1.00 0.00 H new ATOM 0 HH TYR B 27 -16.395 -13.600 -0.972 1.00 0.00 H new ATOM 1584 N SER B 28 -19.955 -7.306 -6.126 1.00 0.00 N ATOM 1585 CA SER B 28 -20.744 -6.366 -6.972 1.00 0.00 C ATOM 1586 C SER B 28 -19.809 -5.472 -7.790 1.00 0.00 C ATOM 1587 O SER B 28 -18.825 -4.963 -7.289 1.00 0.00 O ATOM 1588 CB SER B 28 -21.557 -5.530 -5.983 1.00 0.00 C ATOM 1589 OG SER B 28 -22.435 -4.673 -6.703 1.00 0.00 O ATOM 0 H SER B 28 -19.743 -6.970 -5.186 1.00 0.00 H new ATOM 0 HA SER B 28 -21.381 -6.890 -7.684 1.00 0.00 H new ATOM 0 HB2 SER B 28 -22.128 -6.182 -5.321 1.00 0.00 H new ATOM 0 HB3 SER B 28 -20.891 -4.941 -5.353 1.00 0.00 H new ATOM 0 HG SER B 28 -22.959 -4.137 -6.072 1.00 0.00 H new ATOM 1595 N ARG B 29 -20.107 -5.276 -9.046 1.00 0.00 N ATOM 1596 CA ARG B 29 -19.235 -4.415 -9.895 1.00 0.00 C ATOM 1597 C ARG B 29 -19.699 -2.957 -9.827 1.00 0.00 C ATOM 1598 O ARG B 29 -19.183 -2.099 -10.516 1.00 0.00 O ATOM 1599 CB ARG B 29 -19.395 -4.965 -11.313 1.00 0.00 C ATOM 1600 CG ARG B 29 -18.496 -4.179 -12.270 1.00 0.00 C ATOM 1601 CD ARG B 29 -17.083 -4.094 -11.691 1.00 0.00 C ATOM 1602 NE ARG B 29 -16.189 -3.969 -12.875 1.00 0.00 N ATOM 1603 CZ ARG B 29 -16.068 -2.822 -13.490 1.00 0.00 C ATOM 1604 NH1 ARG B 29 -16.730 -1.778 -13.069 1.00 0.00 N ATOM 1605 NH2 ARG B 29 -15.283 -2.719 -14.528 1.00 0.00 N ATOM 0 H ARG B 29 -20.917 -5.675 -9.521 1.00 0.00 H new ATOM 0 HA ARG B 29 -18.196 -4.430 -9.567 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -19.132 -6.023 -11.336 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -20.435 -4.888 -11.629 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -18.472 -4.666 -13.245 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -18.898 -3.178 -12.423 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -16.980 -3.236 -11.026 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -16.842 -4.982 -11.106 1.00 0.00 H new ATOM 0 HE ARG B 29 -15.669 -4.781 -13.207 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -17.344 -1.856 -12.258 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -16.633 -0.884 -13.551 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -14.765 -3.533 -14.858 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -15.188 -1.824 -15.009 1.00 0.00 H new ATOM 1619 N GLU B 30 -20.666 -2.671 -8.999 1.00 0.00 N ATOM 1620 CA GLU B 30 -21.158 -1.268 -8.886 1.00 0.00 C ATOM 1621 C GLU B 30 -20.213 -0.454 -7.998 1.00 0.00 C ATOM 1622 O GLU B 30 -19.432 -1.004 -7.246 1.00 0.00 O ATOM 1623 CB GLU B 30 -22.539 -1.386 -8.238 1.00 0.00 C ATOM 1624 CG GLU B 30 -23.140 0.009 -8.051 1.00 0.00 C ATOM 1625 CD GLU B 30 -24.485 -0.107 -7.334 1.00 0.00 C ATOM 1626 OE1 GLU B 30 -24.507 -0.646 -6.239 1.00 0.00 O ATOM 1627 OE2 GLU B 30 -25.473 0.343 -7.892 1.00 0.00 O ATOM 0 H GLU B 30 -21.136 -3.347 -8.397 1.00 0.00 H new ATOM 0 HA GLU B 30 -21.204 -0.762 -9.850 1.00 0.00 H new ATOM 0 HB2 GLU B 30 -23.194 -1.994 -8.862 1.00 0.00 H new ATOM 0 HB3 GLU B 30 -22.458 -1.890 -7.275 1.00 0.00 H new ATOM 0 HG2 GLU B 30 -22.460 0.635 -7.473 1.00 0.00 H new ATOM 0 HG3 GLU B 30 -23.272 0.492 -9.019 1.00 0.00 H new ATOM 1634 N GLN B 31 -20.273 0.847 -8.076 1.00 0.00 N ATOM 1635 CA GLN B 31 -19.370 1.680 -7.231 1.00 0.00 C ATOM 1636 C GLN B 31 -20.029 1.972 -5.882 1.00 0.00 C ATOM 1637 O GLN B 31 -21.227 2.150 -5.787 1.00 0.00 O ATOM 1638 CB GLN B 31 -19.163 2.973 -8.019 1.00 0.00 C ATOM 1639 CG GLN B 31 -18.017 3.772 -7.396 1.00 0.00 C ATOM 1640 CD GLN B 31 -17.620 4.912 -8.335 1.00 0.00 C ATOM 1641 OE1 GLN B 31 -16.635 4.820 -9.039 1.00 0.00 O ATOM 1642 NE2 GLN B 31 -18.353 5.992 -8.376 1.00 0.00 N ATOM 0 H GLN B 31 -20.905 1.368 -8.685 1.00 0.00 H new ATOM 0 HA GLN B 31 -18.425 1.178 -7.021 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -18.937 2.744 -9.061 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -20.078 3.565 -8.014 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -18.322 4.173 -6.429 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -17.162 3.121 -7.215 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -19.181 6.069 -7.785 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -18.098 6.758 -8.999 1.00 0.00 H new ATOM 1651 N HIS B 32 -19.251 2.015 -4.835 1.00 0.00 N ATOM 1652 CA HIS B 32 -19.821 2.287 -3.489 1.00 0.00 C ATOM 1653 C HIS B 32 -19.250 3.602 -2.949 1.00 0.00 C ATOM 1654 O HIS B 32 -18.271 4.114 -3.454 1.00 0.00 O ATOM 1655 CB HIS B 32 -19.381 1.106 -2.615 1.00 0.00 C ATOM 1656 CG HIS B 32 -19.645 -0.208 -3.315 1.00 0.00 C ATOM 1657 ND1 HIS B 32 -19.485 -0.629 -4.618 1.00 0.00 N flip ATOM 1658 CD2 HIS B 32 -20.149 -1.302 -2.635 1.00 0.00 C flip ATOM 1659 CE1 HIS B 32 -19.892 -1.953 -4.738 1.00 0.00 C flip ATOM 1660 NE2 HIS B 32 -20.282 -2.310 -3.514 1.00 0.00 N flip ATOM 0 H HIS B 32 -18.241 1.873 -4.856 1.00 0.00 H new ATOM 0 HA HIS B 32 -20.906 2.385 -3.507 1.00 0.00 H new ATOM 0 HB2 HIS B 32 -18.319 1.194 -2.385 1.00 0.00 H new ATOM 0 HB3 HIS B 32 -19.916 1.131 -1.666 1.00 0.00 H new ATOM 0 HD2 HIS B 32 -20.393 -1.340 -1.584 1.00 0.00 H new ATOM 0 HE1 HIS B 32 -19.892 -2.561 -5.630 1.00 0.00 H new ATOM 0 HE2 HIS B 32 -20.638 -3.235 -3.274 1.00 0.00 H new ATOM 1668 N GLY B 33 -19.850 4.155 -1.931 1.00 0.00 N ATOM 1669 CA GLY B 33 -19.331 5.439 -1.378 1.00 0.00 C ATOM 1670 C GLY B 33 -19.315 5.377 0.151 1.00 0.00 C ATOM 1671 O GLY B 33 -20.224 4.861 0.772 1.00 0.00 O ATOM 0 H GLY B 33 -20.672 3.777 -1.460 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.325 5.627 -1.754 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -19.956 6.268 -1.711 1.00 0.00 H new ATOM 1675 N VAL B 34 -18.290 5.905 0.761 1.00 0.00 N ATOM 1676 CA VAL B 34 -18.213 5.885 2.250 1.00 0.00 C ATOM 1677 C VAL B 34 -17.656 7.214 2.764 1.00 0.00 C ATOM 1678 O VAL B 34 -17.237 8.060 1.998 1.00 0.00 O ATOM 1679 CB VAL B 34 -17.256 4.740 2.583 1.00 0.00 C ATOM 1680 CG1 VAL B 34 -17.290 4.468 4.087 1.00 0.00 C ATOM 1681 CG2 VAL B 34 -17.687 3.481 1.826 1.00 0.00 C ATOM 0 H VAL B 34 -17.501 6.350 0.292 1.00 0.00 H new ATOM 0 HA VAL B 34 -19.190 5.746 2.713 1.00 0.00 H new ATOM 0 HB VAL B 34 -16.243 5.014 2.287 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -16.608 3.652 4.325 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.984 5.365 4.626 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -18.302 4.193 4.384 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -17.006 2.663 2.062 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -18.699 3.207 2.122 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -17.663 3.675 0.754 1.00 0.00 H new ATOM 1691 N ALA B 35 -17.649 7.407 4.055 1.00 0.00 N ATOM 1692 CA ALA B 35 -17.118 8.684 4.612 1.00 0.00 C ATOM 1693 C ALA B 35 -16.210 8.400 5.812 1.00 0.00 C ATOM 1694 O ALA B 35 -16.673 8.173 6.912 1.00 0.00 O ATOM 1695 CB ALA B 35 -18.356 9.469 5.048 1.00 0.00 C ATOM 0 H ALA B 35 -17.987 6.738 4.747 1.00 0.00 H new ATOM 0 HA ALA B 35 -16.520 9.236 3.887 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -18.050 10.426 5.471 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -18.999 9.643 4.185 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -18.903 8.899 5.799 1.00 0.00 H new ATOM 1701 N ALA B 36 -14.922 8.410 5.608 1.00 0.00 N ATOM 1702 CA ALA B 36 -13.986 8.141 6.739 1.00 0.00 C ATOM 1703 C ALA B 36 -12.773 9.070 6.652 1.00 0.00 C ATOM 1704 O ALA B 36 -12.437 9.573 5.598 1.00 0.00 O ATOM 1705 CB ALA B 36 -13.560 6.683 6.563 1.00 0.00 C ATOM 0 H ALA B 36 -14.476 8.592 4.709 1.00 0.00 H new ATOM 0 HA ALA B 36 -14.450 8.315 7.710 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -12.868 6.407 7.359 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -14.439 6.039 6.607 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -13.069 6.561 5.597 1.00 0.00 H new ATOM 1711 N SER B 37 -12.112 9.303 7.753 1.00 0.00 N ATOM 1712 CA SER B 37 -10.921 10.200 7.732 1.00 0.00 C ATOM 1713 C SER B 37 -9.651 9.390 7.458 1.00 0.00 C ATOM 1714 O SER B 37 -8.720 9.868 6.841 1.00 0.00 O ATOM 1715 CB SER B 37 -10.869 10.822 9.127 1.00 0.00 C ATOM 1716 OG SER B 37 -10.754 9.789 10.098 1.00 0.00 O ATOM 0 H SER B 37 -12.345 8.911 8.666 1.00 0.00 H new ATOM 0 HA SER B 37 -10.989 10.956 6.950 1.00 0.00 H new ATOM 0 HB2 SER B 37 -10.022 11.504 9.202 1.00 0.00 H new ATOM 0 HB3 SER B 37 -11.769 11.410 9.309 1.00 0.00 H new ATOM 0 HG SER B 37 -9.832 9.458 10.116 1.00 0.00 H new ATOM 1722 N CYS B 38 -9.604 8.167 7.913 1.00 0.00 N ATOM 1723 CA CYS B 38 -8.391 7.330 7.676 1.00 0.00 C ATOM 1724 C CYS B 38 -8.793 5.929 7.210 1.00 0.00 C ATOM 1725 O CYS B 38 -9.959 5.587 7.167 1.00 0.00 O ATOM 1726 CB CYS B 38 -7.686 7.263 9.031 1.00 0.00 C ATOM 1727 SG CYS B 38 -7.437 8.940 9.666 1.00 0.00 S ATOM 0 H CYS B 38 -10.351 7.711 8.437 1.00 0.00 H new ATOM 0 HA CYS B 38 -7.748 7.747 6.901 1.00 0.00 H new ATOM 0 HB2 CYS B 38 -8.282 6.681 9.734 1.00 0.00 H new ATOM 0 HB3 CYS B 38 -6.727 6.755 8.929 1.00 0.00 H new ATOM 0 HG CYS B 38 -6.839 8.883 10.819 1.00 0.00 H new ATOM 1733 N LEU B 39 -7.836 5.113 6.860 1.00 0.00 N ATOM 1734 CA LEU B 39 -8.160 3.734 6.396 1.00 0.00 C ATOM 1735 C LEU B 39 -9.065 3.030 7.413 1.00 0.00 C ATOM 1736 O LEU B 39 -10.202 2.709 7.129 1.00 0.00 O ATOM 1737 CB LEU B 39 -6.810 3.022 6.300 1.00 0.00 C ATOM 1738 CG LEU B 39 -6.029 3.567 5.103 1.00 0.00 C ATOM 1739 CD1 LEU B 39 -4.725 2.784 4.945 1.00 0.00 C ATOM 1740 CD2 LEU B 39 -6.870 3.414 3.834 1.00 0.00 C ATOM 0 H LEU B 39 -6.842 5.342 6.875 1.00 0.00 H new ATOM 0 HA LEU B 39 -8.692 3.734 5.444 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -6.241 3.173 7.218 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -6.960 1.948 6.191 1.00 0.00 H new ATOM 0 HG LEU B 39 -5.803 4.621 5.266 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -4.168 3.172 4.092 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -4.125 2.890 5.849 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -4.951 1.730 4.782 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.314 3.802 2.980 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -7.095 2.360 3.672 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -7.800 3.971 3.945 1.00 0.00 H new ATOM 1752 N GLU B 40 -8.567 2.787 8.594 1.00 0.00 N ATOM 1753 CA GLU B 40 -9.395 2.103 9.630 1.00 0.00 C ATOM 1754 C GLU B 40 -10.822 2.658 9.625 1.00 0.00 C ATOM 1755 O GLU B 40 -11.781 1.930 9.463 1.00 0.00 O ATOM 1756 CB GLU B 40 -8.703 2.415 10.957 1.00 0.00 C ATOM 1757 CG GLU B 40 -9.248 1.491 12.048 1.00 0.00 C ATOM 1758 CD GLU B 40 -8.819 2.015 13.420 1.00 0.00 C ATOM 1759 OE1 GLU B 40 -9.520 2.856 13.957 1.00 0.00 O ATOM 1760 OE2 GLU B 40 -7.795 1.566 13.910 1.00 0.00 O ATOM 0 H GLU B 40 -7.622 3.032 8.888 1.00 0.00 H new ATOM 0 HA GLU B 40 -9.474 1.031 9.452 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -7.626 2.281 10.858 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -8.871 3.457 11.231 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -10.335 1.442 11.989 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -8.875 0.477 11.901 1.00 0.00 H new ATOM 1767 N ASP B 41 -10.970 3.942 9.807 1.00 0.00 N ATOM 1768 CA ASP B 41 -12.335 4.542 9.817 1.00 0.00 C ATOM 1769 C ASP B 41 -13.087 4.176 8.535 1.00 0.00 C ATOM 1770 O ASP B 41 -14.285 3.972 8.544 1.00 0.00 O ATOM 1771 CB ASP B 41 -12.103 6.051 9.891 1.00 0.00 C ATOM 1772 CG ASP B 41 -13.446 6.768 10.052 1.00 0.00 C ATOM 1773 OD1 ASP B 41 -14.330 6.196 10.668 1.00 0.00 O ATOM 1774 OD2 ASP B 41 -13.567 7.875 9.555 1.00 0.00 O ATOM 0 H ASP B 41 -10.205 4.602 9.949 1.00 0.00 H new ATOM 0 HA ASP B 41 -12.938 4.180 10.650 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -11.449 6.288 10.730 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -11.600 6.397 8.988 1.00 0.00 H new ATOM 1779 N LEU B 42 -12.395 4.094 7.433 1.00 0.00 N ATOM 1780 CA LEU B 42 -13.073 3.744 6.152 1.00 0.00 C ATOM 1781 C LEU B 42 -13.480 2.267 6.155 1.00 0.00 C ATOM 1782 O LEU B 42 -14.478 1.887 5.574 1.00 0.00 O ATOM 1783 CB LEU B 42 -12.032 4.009 5.065 1.00 0.00 C ATOM 1784 CG LEU B 42 -12.682 3.857 3.688 1.00 0.00 C ATOM 1785 CD1 LEU B 42 -13.436 5.140 3.335 1.00 0.00 C ATOM 1786 CD2 LEU B 42 -11.598 3.598 2.639 1.00 0.00 C ATOM 0 H LEU B 42 -11.390 4.254 7.363 1.00 0.00 H new ATOM 0 HA LEU B 42 -13.982 4.325 5.996 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -11.622 5.013 5.176 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -11.200 3.312 5.165 1.00 0.00 H new ATOM 0 HG LEU B 42 -13.379 3.019 3.706 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -13.899 5.032 2.354 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -14.208 5.326 4.082 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.739 5.978 3.317 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -12.060 3.490 1.658 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -10.901 4.436 2.621 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -11.060 2.684 2.890 1.00 0.00 H new ATOM 1798 N ARG B 43 -12.715 1.432 6.804 1.00 0.00 N ATOM 1799 CA ARG B 43 -13.062 -0.018 6.841 1.00 0.00 C ATOM 1800 C ARG B 43 -14.358 -0.224 7.626 1.00 0.00 C ATOM 1801 O ARG B 43 -15.382 -0.575 7.076 1.00 0.00 O ATOM 1802 CB ARG B 43 -11.893 -0.686 7.563 1.00 0.00 C ATOM 1803 CG ARG B 43 -11.941 -2.196 7.320 1.00 0.00 C ATOM 1804 CD ARG B 43 -10.890 -2.887 8.190 1.00 0.00 C ATOM 1805 NE ARG B 43 -11.563 -4.112 8.705 1.00 0.00 N ATOM 1806 CZ ARG B 43 -10.934 -4.910 9.526 1.00 0.00 C ATOM 1807 NH1 ARG B 43 -9.712 -4.639 9.899 1.00 0.00 N ATOM 1808 NH2 ARG B 43 -11.528 -5.982 9.974 1.00 0.00 N ATOM 0 H ARG B 43 -11.867 1.690 7.309 1.00 0.00 H new ATOM 0 HA ARG B 43 -13.218 -0.433 5.845 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -10.948 -0.279 7.203 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -11.944 -0.477 8.632 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -12.933 -2.581 7.555 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -11.756 -2.412 6.268 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -10.001 -3.138 7.611 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -10.566 -2.241 9.006 1.00 0.00 H new ATOM 0 HE ARG B 43 -12.517 -4.328 8.416 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -9.246 -3.802 9.549 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -9.224 -5.264 10.540 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -12.482 -6.196 9.683 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -11.038 -6.606 10.615 1.00 0.00 H new ATOM 1822 N SER B 44 -14.318 -0.005 8.910 1.00 0.00 N ATOM 1823 CA SER B 44 -15.545 -0.185 9.738 1.00 0.00 C ATOM 1824 C SER B 44 -16.739 0.500 9.067 1.00 0.00 C ATOM 1825 O SER B 44 -17.795 -0.081 8.913 1.00 0.00 O ATOM 1826 CB SER B 44 -15.223 0.486 11.072 1.00 0.00 C ATOM 1827 OG SER B 44 -16.317 0.307 11.963 1.00 0.00 O ATOM 0 H SER B 44 -13.488 0.291 9.424 1.00 0.00 H new ATOM 0 HA SER B 44 -15.810 -1.235 9.863 1.00 0.00 H new ATOM 0 HB2 SER B 44 -14.317 0.056 11.499 1.00 0.00 H new ATOM 0 HB3 SER B 44 -15.032 1.548 10.921 1.00 0.00 H new ATOM 0 HG SER B 44 -16.114 0.735 12.821 1.00 0.00 H new ATOM 1833 N LYS B 45 -16.580 1.732 8.667 1.00 0.00 N ATOM 1834 CA LYS B 45 -17.703 2.454 8.007 1.00 0.00 C ATOM 1835 C LYS B 45 -18.082 1.761 6.695 1.00 0.00 C ATOM 1836 O LYS B 45 -19.243 1.550 6.405 1.00 0.00 O ATOM 1837 CB LYS B 45 -17.159 3.856 7.733 1.00 0.00 C ATOM 1838 CG LYS B 45 -17.230 4.692 9.013 1.00 0.00 C ATOM 1839 CD LYS B 45 -17.030 6.169 8.670 1.00 0.00 C ATOM 1840 CE LYS B 45 -16.990 6.992 9.959 1.00 0.00 C ATOM 1841 NZ LYS B 45 -18.204 7.853 9.903 1.00 0.00 N ATOM 0 H LYS B 45 -15.719 2.270 8.769 1.00 0.00 H new ATOM 0 HA LYS B 45 -18.601 2.475 8.624 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -16.129 3.795 7.383 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -17.737 4.333 6.942 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -18.194 4.548 9.501 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -16.465 4.364 9.717 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -16.103 6.301 8.113 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -17.840 6.517 8.029 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -17.002 6.349 10.839 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -16.082 7.593 10.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -18.247 8.448 10.755 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -18.161 8.459 9.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -19.053 7.254 9.856 1.00 0.00 H new ATOM 1855 N ALA B 46 -17.110 1.406 5.900 1.00 0.00 N ATOM 1856 CA ALA B 46 -17.414 0.729 4.606 1.00 0.00 C ATOM 1857 C ALA B 46 -18.027 -0.651 4.857 1.00 0.00 C ATOM 1858 O ALA B 46 -18.648 -1.232 3.989 1.00 0.00 O ATOM 1859 CB ALA B 46 -16.062 0.594 3.904 1.00 0.00 C ATOM 0 H ALA B 46 -16.119 1.555 6.090 1.00 0.00 H new ATOM 0 HA ALA B 46 -18.132 1.289 4.008 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -16.200 0.103 2.940 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -15.632 1.584 3.749 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -15.389 -0.001 4.521 1.00 0.00 H new ATOM 1865 N CYS B 47 -17.856 -1.183 6.036 1.00 0.00 N ATOM 1866 CA CYS B 47 -18.426 -2.527 6.337 1.00 0.00 C ATOM 1867 C CYS B 47 -19.933 -2.426 6.588 1.00 0.00 C ATOM 1868 O CYS B 47 -20.725 -3.081 5.940 1.00 0.00 O ATOM 1869 CB CYS B 47 -17.702 -2.988 7.604 1.00 0.00 C ATOM 1870 SG CYS B 47 -18.063 -4.737 7.903 1.00 0.00 S ATOM 0 H CYS B 47 -17.346 -0.746 6.804 1.00 0.00 H new ATOM 0 HA CYS B 47 -18.291 -3.224 5.510 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -16.627 -2.841 7.496 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -18.021 -2.389 8.457 1.00 0.00 H new ATOM 0 HG CYS B 47 -17.447 -5.130 8.978 1.00 0.00 H new ATOM 1876 N ASP B 48 -20.336 -1.612 7.525 1.00 0.00 N ATOM 1877 CA ASP B 48 -21.792 -1.474 7.819 1.00 0.00 C ATOM 1878 C ASP B 48 -22.529 -0.882 6.613 1.00 0.00 C ATOM 1879 O ASP B 48 -23.626 -1.289 6.285 1.00 0.00 O ATOM 1880 CB ASP B 48 -21.868 -0.525 9.014 1.00 0.00 C ATOM 1881 CG ASP B 48 -21.332 0.850 8.612 1.00 0.00 C ATOM 1882 OD1 ASP B 48 -22.039 1.558 7.914 1.00 0.00 O ATOM 1883 OD2 ASP B 48 -20.223 1.170 9.006 1.00 0.00 O ATOM 0 H ASP B 48 -19.721 -1.036 8.100 1.00 0.00 H new ATOM 0 HA ASP B 48 -22.260 -2.435 8.031 1.00 0.00 H new ATOM 0 HB2 ASP B 48 -22.899 -0.438 9.358 1.00 0.00 H new ATOM 0 HB3 ASP B 48 -21.287 -0.924 9.846 1.00 0.00 H new ATOM 1888 N ILE B 49 -21.939 0.077 5.951 1.00 0.00 N ATOM 1889 CA ILE B 49 -22.616 0.690 4.771 1.00 0.00 C ATOM 1890 C ILE B 49 -22.703 -0.322 3.623 1.00 0.00 C ATOM 1891 O ILE B 49 -23.721 -0.448 2.972 1.00 0.00 O ATOM 1892 CB ILE B 49 -21.737 1.876 4.377 1.00 0.00 C ATOM 1893 CG1 ILE B 49 -22.451 2.706 3.308 1.00 0.00 C ATOM 1894 CG2 ILE B 49 -20.408 1.366 3.818 1.00 0.00 C ATOM 1895 CD1 ILE B 49 -21.657 3.985 3.036 1.00 0.00 C ATOM 0 H ILE B 49 -21.021 0.461 6.175 1.00 0.00 H new ATOM 0 HA ILE B 49 -23.636 0.999 4.998 1.00 0.00 H new ATOM 0 HB ILE B 49 -21.549 2.494 5.255 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -22.552 2.126 2.390 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -23.459 2.955 3.640 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -19.782 2.213 3.537 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -19.897 0.773 4.577 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -20.596 0.747 2.940 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -22.167 4.575 2.274 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -21.579 4.567 3.954 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -20.658 3.726 2.685 1.00 0.00 H new ATOM 1907 N LEU B 50 -21.646 -1.044 3.371 1.00 0.00 N ATOM 1908 CA LEU B 50 -21.674 -2.046 2.267 1.00 0.00 C ATOM 1909 C LEU B 50 -22.731 -3.115 2.555 1.00 0.00 C ATOM 1910 O LEU B 50 -23.124 -3.865 1.683 1.00 0.00 O ATOM 1911 CB LEU B 50 -20.274 -2.661 2.253 1.00 0.00 C ATOM 1912 CG LEU B 50 -20.247 -3.851 1.291 1.00 0.00 C ATOM 1913 CD1 LEU B 50 -20.302 -3.344 -0.151 1.00 0.00 C ATOM 1914 CD2 LEU B 50 -18.956 -4.645 1.501 1.00 0.00 C ATOM 0 H LEU B 50 -20.765 -0.984 3.881 1.00 0.00 H new ATOM 0 HA LEU B 50 -21.929 -1.598 1.306 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -19.541 -1.915 1.946 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -19.998 -2.985 3.256 1.00 0.00 H new ATOM 0 HG LEU B 50 -21.107 -4.493 1.484 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -20.283 -4.192 -0.836 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -21.220 -2.776 -0.302 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -19.442 -2.702 -0.344 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -18.935 -5.493 0.817 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -18.098 -4.002 1.308 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -18.914 -5.007 2.528 1.00 0.00 H new ATOM 1926 N ALA B 51 -23.193 -3.189 3.773 1.00 0.00 N ATOM 1927 CA ALA B 51 -24.227 -4.206 4.121 1.00 0.00 C ATOM 1928 C ALA B 51 -23.777 -5.599 3.671 1.00 0.00 C ATOM 1929 O ALA B 51 -24.540 -6.352 3.100 1.00 0.00 O ATOM 1930 CB ALA B 51 -25.479 -3.773 3.357 1.00 0.00 C ATOM 0 H ALA B 51 -22.899 -2.589 4.544 1.00 0.00 H new ATOM 0 HA ALA B 51 -24.403 -4.264 5.195 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -26.290 -4.473 3.560 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.773 -2.774 3.678 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -25.268 -3.763 2.288 1.00 0.00 H new ATOM 1936 N ILE B 52 -22.546 -5.949 3.926 1.00 0.00 N ATOM 1937 CA ILE B 52 -22.056 -7.296 3.514 1.00 0.00 C ATOM 1938 C ILE B 52 -22.174 -8.279 4.680 1.00 0.00 C ATOM 1939 O ILE B 52 -22.189 -7.891 5.832 1.00 0.00 O ATOM 1940 CB ILE B 52 -20.590 -7.092 3.132 1.00 0.00 C ATOM 1941 CG1 ILE B 52 -20.002 -8.421 2.652 1.00 0.00 C ATOM 1942 CG2 ILE B 52 -19.805 -6.602 4.351 1.00 0.00 C ATOM 1943 CD1 ILE B 52 -19.111 -8.177 1.432 1.00 0.00 C ATOM 0 H ILE B 52 -21.859 -5.363 4.401 1.00 0.00 H new ATOM 0 HA ILE B 52 -22.635 -7.709 2.688 1.00 0.00 H new ATOM 0 HB ILE B 52 -20.523 -6.351 2.335 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -19.423 -8.884 3.451 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -20.804 -9.114 2.397 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -18.760 -6.457 4.077 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -20.224 -5.657 4.698 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -19.872 -7.342 5.148 1.00 0.00 H new ATOM 0 HD11 ILE B 52 -18.693 -9.124 1.091 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -19.703 -7.733 0.632 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -18.301 -7.500 1.703 1.00 0.00 H new ATOM 1955 N ASP B 53 -22.255 -9.549 4.393 1.00 0.00 N ATOM 1956 CA ASP B 53 -22.368 -10.556 5.486 1.00 0.00 C ATOM 1957 C ASP B 53 -21.032 -11.277 5.678 1.00 0.00 C ATOM 1958 O ASP B 53 -20.804 -11.927 6.679 1.00 0.00 O ATOM 1959 CB ASP B 53 -23.447 -11.533 5.013 1.00 0.00 C ATOM 1960 CG ASP B 53 -23.752 -12.536 6.127 1.00 0.00 C ATOM 1961 OD1 ASP B 53 -24.242 -12.113 7.161 1.00 0.00 O ATOM 1962 OD2 ASP B 53 -23.490 -13.711 5.928 1.00 0.00 O ATOM 0 H ASP B 53 -22.248 -9.933 3.448 1.00 0.00 H new ATOM 0 HA ASP B 53 -22.623 -10.103 6.444 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -24.352 -10.989 4.742 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -23.111 -12.058 4.119 1.00 0.00 H new ATOM 1967 N LYS B 54 -20.147 -11.166 4.725 1.00 0.00 N ATOM 1968 CA LYS B 54 -18.825 -11.843 4.853 1.00 0.00 C ATOM 1969 C LYS B 54 -17.820 -10.907 5.531 1.00 0.00 C ATOM 1970 O LYS B 54 -16.632 -10.969 5.284 1.00 0.00 O ATOM 1971 CB LYS B 54 -18.393 -12.143 3.417 1.00 0.00 C ATOM 1972 CG LYS B 54 -17.171 -13.063 3.431 1.00 0.00 C ATOM 1973 CD LYS B 54 -17.629 -14.522 3.412 1.00 0.00 C ATOM 1974 CE LYS B 54 -16.864 -15.285 2.329 1.00 0.00 C ATOM 1975 NZ LYS B 54 -17.811 -16.332 1.854 1.00 0.00 N ATOM 0 H LYS B 54 -20.282 -10.636 3.864 1.00 0.00 H new ATOM 0 HA LYS B 54 -18.879 -12.747 5.459 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -19.210 -12.615 2.872 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -18.156 -11.215 2.896 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -16.539 -12.858 2.567 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -16.569 -12.872 4.319 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -17.456 -14.981 4.385 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -18.701 -14.575 3.220 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -16.566 -14.623 1.515 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -15.952 -15.729 2.728 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -17.358 -16.898 1.108 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -18.071 -16.951 2.648 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -18.666 -15.879 1.473 1.00 0.00 H new ATOM 1989 N SER B 55 -18.291 -10.038 6.386 1.00 0.00 N ATOM 1990 CA SER B 55 -17.368 -9.095 7.081 1.00 0.00 C ATOM 1991 C SER B 55 -16.292 -9.868 7.851 1.00 0.00 C ATOM 1992 O SER B 55 -15.301 -9.309 8.278 1.00 0.00 O ATOM 1993 CB SER B 55 -18.257 -8.309 8.043 1.00 0.00 C ATOM 1994 OG SER B 55 -19.247 -7.607 7.300 1.00 0.00 O ATOM 0 H SER B 55 -19.276 -9.941 6.633 1.00 0.00 H new ATOM 0 HA SER B 55 -16.845 -8.442 6.382 1.00 0.00 H new ATOM 0 HB2 SER B 55 -18.731 -8.986 8.754 1.00 0.00 H new ATOM 0 HB3 SER B 55 -17.656 -7.608 8.622 1.00 0.00 H new ATOM 0 HG SER B 55 -19.072 -6.644 7.350 1.00 0.00 H new ATOM 2000 N LEU B 56 -16.483 -11.147 8.039 1.00 0.00 N ATOM 2001 CA LEU B 56 -15.478 -11.951 8.786 1.00 0.00 C ATOM 2002 C LEU B 56 -14.198 -12.158 7.959 1.00 0.00 C ATOM 2003 O LEU B 56 -13.295 -12.858 8.372 1.00 0.00 O ATOM 2004 CB LEU B 56 -16.188 -13.282 9.080 1.00 0.00 C ATOM 2005 CG LEU B 56 -16.178 -14.224 7.863 1.00 0.00 C ATOM 2006 CD1 LEU B 56 -16.577 -13.468 6.595 1.00 0.00 C ATOM 2007 CD2 LEU B 56 -14.785 -14.835 7.680 1.00 0.00 C ATOM 0 H LEU B 56 -17.294 -11.668 7.706 1.00 0.00 H new ATOM 0 HA LEU B 56 -15.150 -11.455 9.700 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.702 -13.774 9.923 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -17.218 -13.085 9.377 1.00 0.00 H new ATOM 0 HG LEU B 56 -16.900 -15.021 8.041 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -16.564 -14.151 5.745 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -17.580 -13.058 6.716 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -15.872 -12.656 6.419 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.790 -15.500 6.816 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.057 -14.040 7.522 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.516 -15.401 8.572 1.00 0.00 H new ATOM 2019 N THR B 57 -14.105 -11.557 6.802 1.00 0.00 N ATOM 2020 CA THR B 57 -12.878 -11.729 5.971 1.00 0.00 C ATOM 2021 C THR B 57 -12.069 -10.430 5.959 1.00 0.00 C ATOM 2022 O THR B 57 -12.626 -9.351 6.014 1.00 0.00 O ATOM 2023 CB THR B 57 -13.391 -12.056 4.567 1.00 0.00 C ATOM 2024 OG1 THR B 57 -12.286 -12.273 3.700 1.00 0.00 O ATOM 2025 CG2 THR B 57 -14.232 -10.891 4.043 1.00 0.00 C ATOM 0 H THR B 57 -14.823 -10.956 6.398 1.00 0.00 H new ATOM 0 HA THR B 57 -12.223 -12.511 6.355 1.00 0.00 H new ATOM 0 HB THR B 57 -14.006 -12.955 4.605 1.00 0.00 H new ATOM 0 HG1 THR B 57 -11.923 -11.410 3.411 1.00 0.00 H new ATOM 0 HG21 THR B 57 -14.596 -11.126 3.043 1.00 0.00 H new ATOM 0 HG22 THR B 57 -15.079 -10.726 4.708 1.00 0.00 H new ATOM 0 HG23 THR B 57 -13.620 -9.990 4.004 1.00 0.00 H new ATOM 2033 N PRO B 58 -10.775 -10.579 5.890 1.00 0.00 N ATOM 2034 CA PRO B 58 -9.872 -9.403 5.872 1.00 0.00 C ATOM 2035 C PRO B 58 -9.967 -8.675 4.529 1.00 0.00 C ATOM 2036 O PRO B 58 -9.477 -9.142 3.521 1.00 0.00 O ATOM 2037 CB PRO B 58 -8.486 -10.012 6.066 1.00 0.00 C ATOM 2038 CG PRO B 58 -8.612 -11.419 5.576 1.00 0.00 C ATOM 2039 CD PRO B 58 -10.037 -11.845 5.820 1.00 0.00 C ATOM 0 HA PRO B 58 -10.117 -8.663 6.634 1.00 0.00 H new ATOM 0 HB2 PRO B 58 -7.731 -9.464 5.503 1.00 0.00 H new ATOM 0 HB3 PRO B 58 -8.185 -9.984 7.113 1.00 0.00 H new ATOM 0 HG2 PRO B 58 -8.367 -11.481 4.516 1.00 0.00 H new ATOM 0 HG3 PRO B 58 -7.918 -12.074 6.103 1.00 0.00 H new ATOM 0 HD2 PRO B 58 -10.408 -12.480 5.015 1.00 0.00 H new ATOM 0 HD3 PRO B 58 -10.131 -12.414 6.745 1.00 0.00 H new ATOM 2047 N VAL B 59 -10.598 -7.532 4.508 1.00 0.00 N ATOM 2048 CA VAL B 59 -10.728 -6.773 3.231 1.00 0.00 C ATOM 2049 C VAL B 59 -9.505 -5.874 3.025 1.00 0.00 C ATOM 2050 O VAL B 59 -9.214 -5.012 3.830 1.00 0.00 O ATOM 2051 CB VAL B 59 -11.991 -5.930 3.400 1.00 0.00 C ATOM 2052 CG1 VAL B 59 -12.383 -5.318 2.053 1.00 0.00 C ATOM 2053 CG2 VAL B 59 -13.131 -6.817 3.905 1.00 0.00 C ATOM 0 H VAL B 59 -11.029 -7.091 5.320 1.00 0.00 H new ATOM 0 HA VAL B 59 -10.789 -7.429 2.363 1.00 0.00 H new ATOM 0 HB VAL B 59 -11.801 -5.133 4.119 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -13.284 -4.717 2.175 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -11.572 -4.687 1.690 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -12.573 -6.114 1.333 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -14.033 -6.217 4.026 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -13.319 -7.613 3.185 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -12.854 -7.254 4.865 1.00 0.00 H new ATOM 2063 N THR B 60 -8.787 -6.068 1.951 1.00 0.00 N ATOM 2064 CA THR B 60 -7.585 -5.223 1.696 1.00 0.00 C ATOM 2065 C THR B 60 -7.948 -4.055 0.775 1.00 0.00 C ATOM 2066 O THR B 60 -9.017 -4.013 0.201 1.00 0.00 O ATOM 2067 CB THR B 60 -6.582 -6.155 1.014 1.00 0.00 C ATOM 2068 OG1 THR B 60 -5.413 -5.422 0.677 1.00 0.00 O ATOM 2069 CG2 THR B 60 -7.206 -6.738 -0.255 1.00 0.00 C ATOM 0 H THR B 60 -8.981 -6.774 1.241 1.00 0.00 H new ATOM 0 HA THR B 60 -7.180 -4.791 2.611 1.00 0.00 H new ATOM 0 HB THR B 60 -6.319 -6.967 1.692 1.00 0.00 H new ATOM 0 HG1 THR B 60 -4.768 -6.017 0.241 1.00 0.00 H new ATOM 0 HG21 THR B 60 -6.491 -7.402 -0.740 1.00 0.00 H new ATOM 0 HG22 THR B 60 -8.103 -7.299 0.006 1.00 0.00 H new ATOM 0 HG23 THR B 60 -7.469 -5.929 -0.936 1.00 0.00 H new ATOM 2077 N LEU B 61 -7.064 -3.105 0.628 1.00 0.00 N ATOM 2078 CA LEU B 61 -7.361 -1.941 -0.256 1.00 0.00 C ATOM 2079 C LEU B 61 -6.380 -1.902 -1.431 1.00 0.00 C ATOM 2080 O LEU B 61 -5.196 -2.125 -1.271 1.00 0.00 O ATOM 2081 CB LEU B 61 -7.181 -0.712 0.636 1.00 0.00 C ATOM 2082 CG LEU B 61 -8.307 -0.661 1.670 1.00 0.00 C ATOM 2083 CD1 LEU B 61 -8.154 0.592 2.534 1.00 0.00 C ATOM 2084 CD2 LEU B 61 -9.657 -0.620 0.950 1.00 0.00 C ATOM 0 H LEU B 61 -6.150 -3.084 1.081 1.00 0.00 H new ATOM 0 HA LEU B 61 -8.362 -1.992 -0.683 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -6.214 -0.752 1.138 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -7.188 0.194 0.030 1.00 0.00 H new ATOM 0 HG LEU B 61 -8.257 -1.546 2.304 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -8.957 0.627 3.270 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -7.193 0.565 3.047 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -8.203 1.478 1.901 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -10.461 -0.584 1.685 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -9.705 0.266 0.316 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -9.768 -1.513 0.335 1.00 0.00 H new ATOM 2096 N VAL B 62 -6.862 -1.616 -2.609 1.00 0.00 N ATOM 2097 CA VAL B 62 -5.959 -1.558 -3.794 1.00 0.00 C ATOM 2098 C VAL B 62 -6.305 -0.345 -4.661 1.00 0.00 C ATOM 2099 O VAL B 62 -7.253 0.368 -4.397 1.00 0.00 O ATOM 2100 CB VAL B 62 -6.217 -2.854 -4.563 1.00 0.00 C ATOM 2101 CG1 VAL B 62 -5.946 -4.052 -3.651 1.00 0.00 C ATOM 2102 CG2 VAL B 62 -7.674 -2.886 -5.028 1.00 0.00 C ATOM 0 H VAL B 62 -7.844 -1.420 -2.803 1.00 0.00 H new ATOM 0 HA VAL B 62 -4.912 -1.460 -3.507 1.00 0.00 H new ATOM 0 HB VAL B 62 -5.557 -2.902 -5.429 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -6.130 -4.976 -4.199 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -4.908 -4.028 -3.318 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -6.606 -4.007 -2.785 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -7.861 -3.809 -5.577 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -8.334 -2.839 -4.161 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -7.867 -2.032 -5.678 1.00 0.00 H new ATOM 2112 N LEU B 63 -5.541 -0.103 -5.690 1.00 0.00 N ATOM 2113 CA LEU B 63 -5.824 1.066 -6.571 1.00 0.00 C ATOM 2114 C LEU B 63 -6.230 0.593 -7.970 1.00 0.00 C ATOM 2115 O LEU B 63 -5.509 -0.129 -8.626 1.00 0.00 O ATOM 2116 CB LEU B 63 -4.506 1.838 -6.625 1.00 0.00 C ATOM 2117 CG LEU B 63 -4.242 2.491 -5.267 1.00 0.00 C ATOM 2118 CD1 LEU B 63 -2.996 3.375 -5.356 1.00 0.00 C ATOM 2119 CD2 LEU B 63 -5.446 3.349 -4.873 1.00 0.00 C ATOM 0 H LEU B 63 -4.733 -0.664 -5.959 1.00 0.00 H new ATOM 0 HA LEU B 63 -6.645 1.679 -6.198 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -3.688 1.165 -6.882 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -4.549 2.599 -7.404 1.00 0.00 H new ATOM 0 HG LEU B 63 -4.084 1.716 -4.517 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -2.809 3.839 -4.388 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -2.137 2.766 -5.638 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -3.153 4.150 -6.106 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.260 3.815 -3.905 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -5.603 4.123 -5.624 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.335 2.721 -4.808 1.00 0.00 H new ATOM 2131 N ALA B 64 -7.382 0.996 -8.434 1.00 0.00 N ATOM 2132 CA ALA B 64 -7.826 0.568 -9.792 1.00 0.00 C ATOM 2133 C ALA B 64 -6.820 1.037 -10.847 1.00 0.00 C ATOM 2134 O ALA B 64 -6.754 0.504 -11.937 1.00 0.00 O ATOM 2135 CB ALA B 64 -9.177 1.253 -10.001 1.00 0.00 C ATOM 0 H ALA B 64 -8.033 1.601 -7.934 1.00 0.00 H new ATOM 0 HA ALA B 64 -7.900 -0.516 -9.880 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -9.572 0.987 -10.982 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -9.874 0.927 -9.229 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.050 2.334 -9.942 1.00 0.00 H new ATOM 2141 N GLU B 65 -6.036 2.031 -10.529 1.00 0.00 N ATOM 2142 CA GLU B 65 -5.034 2.537 -11.511 1.00 0.00 C ATOM 2143 C GLU B 65 -3.719 1.763 -11.374 1.00 0.00 C ATOM 2144 O GLU B 65 -3.302 1.065 -12.277 1.00 0.00 O ATOM 2145 CB GLU B 65 -4.831 4.007 -11.144 1.00 0.00 C ATOM 2146 CG GLU B 65 -4.108 4.725 -12.286 1.00 0.00 C ATOM 2147 CD GLU B 65 -5.112 5.070 -13.388 1.00 0.00 C ATOM 2148 OE1 GLU B 65 -6.217 5.462 -13.054 1.00 0.00 O ATOM 2149 OE2 GLU B 65 -4.757 4.937 -14.548 1.00 0.00 O ATOM 0 H GLU B 65 -6.046 2.515 -9.631 1.00 0.00 H new ATOM 0 HA GLU B 65 -5.367 2.415 -12.542 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -5.794 4.481 -10.954 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -4.250 4.086 -10.225 1.00 0.00 H new ATOM 0 HG2 GLU B 65 -3.632 5.633 -11.916 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -3.317 4.091 -12.686 1.00 0.00 H new ATOM 2156 N ASP B 66 -3.064 1.880 -10.252 1.00 0.00 N ATOM 2157 CA ASP B 66 -1.777 1.150 -10.060 1.00 0.00 C ATOM 2158 C ASP B 66 -2.046 -0.242 -9.483 1.00 0.00 C ATOM 2159 O ASP B 66 -1.307 -1.177 -9.717 1.00 0.00 O ATOM 2160 CB ASP B 66 -0.984 2.002 -9.068 1.00 0.00 C ATOM 2161 CG ASP B 66 0.484 1.573 -9.086 1.00 0.00 C ATOM 2162 OD1 ASP B 66 1.167 1.910 -10.039 1.00 0.00 O ATOM 2163 OD2 ASP B 66 0.900 0.916 -8.147 1.00 0.00 O ATOM 0 H ASP B 66 -3.363 2.449 -9.460 1.00 0.00 H new ATOM 0 HA ASP B 66 -1.235 1.007 -10.995 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -1.069 3.057 -9.329 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -1.395 1.888 -8.065 1.00 0.00 H new ATOM 2168 N GLY B 67 -3.105 -0.386 -8.736 1.00 0.00 N ATOM 2169 CA GLY B 67 -3.432 -1.715 -8.147 1.00 0.00 C ATOM 2170 C GLY B 67 -2.439 -2.050 -7.035 1.00 0.00 C ATOM 2171 O GLY B 67 -2.161 -3.202 -6.769 1.00 0.00 O ATOM 0 H GLY B 67 -3.760 0.362 -8.507 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -4.447 -1.707 -7.750 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -3.399 -2.483 -8.920 1.00 0.00 H new ATOM 2175 N THR B 68 -1.908 -1.059 -6.373 1.00 0.00 N ATOM 2176 CA THR B 68 -0.949 -1.348 -5.271 1.00 0.00 C ATOM 2177 C THR B 68 -1.685 -1.274 -3.933 1.00 0.00 C ATOM 2178 O THR B 68 -2.532 -0.428 -3.729 1.00 0.00 O ATOM 2179 CB THR B 68 0.129 -0.262 -5.364 1.00 0.00 C ATOM 2180 OG1 THR B 68 1.260 -0.660 -4.602 1.00 0.00 O ATOM 2181 CG2 THR B 68 -0.410 1.058 -4.812 1.00 0.00 C ATOM 0 H THR B 68 -2.094 -0.071 -6.545 1.00 0.00 H new ATOM 0 HA THR B 68 -0.508 -2.342 -5.349 1.00 0.00 H new ATOM 0 HB THR B 68 0.412 -0.126 -6.408 1.00 0.00 H new ATOM 0 HG1 THR B 68 1.004 -1.379 -3.987 1.00 0.00 H new ATOM 0 HG21 THR B 68 0.362 1.824 -4.882 1.00 0.00 H new ATOM 0 HG22 THR B 68 -1.280 1.366 -5.391 1.00 0.00 H new ATOM 0 HG23 THR B 68 -0.697 0.926 -3.769 1.00 0.00 H new ATOM 2189 N ILE B 69 -1.382 -2.155 -3.023 1.00 0.00 N ATOM 2190 CA ILE B 69 -2.082 -2.126 -1.709 1.00 0.00 C ATOM 2191 C ILE B 69 -1.484 -1.040 -0.815 1.00 0.00 C ATOM 2192 O ILE B 69 -0.283 -0.938 -0.660 1.00 0.00 O ATOM 2193 CB ILE B 69 -1.857 -3.510 -1.105 1.00 0.00 C ATOM 2194 CG1 ILE B 69 -0.371 -3.694 -0.793 1.00 0.00 C ATOM 2195 CG2 ILE B 69 -2.306 -4.580 -2.101 1.00 0.00 C ATOM 2196 CD1 ILE B 69 -0.145 -5.084 -0.198 1.00 0.00 C ATOM 0 H ILE B 69 -0.684 -2.891 -3.130 1.00 0.00 H new ATOM 0 HA ILE B 69 -3.143 -1.899 -1.812 1.00 0.00 H new ATOM 0 HB ILE B 69 -2.435 -3.604 -0.186 1.00 0.00 H new ATOM 0 HG12 ILE B 69 0.220 -3.575 -1.701 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -0.038 -2.928 -0.093 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -2.146 -5.568 -1.670 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -3.365 -4.449 -2.323 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -1.728 -4.487 -3.020 1.00 0.00 H new ATOM 0 HD11 ILE B 69 0.914 -5.217 0.025 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -0.725 -5.186 0.720 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -0.463 -5.842 -0.914 1.00 0.00 H new ATOM 2208 N VAL B 70 -2.316 -0.229 -0.228 1.00 0.00 N ATOM 2209 CA VAL B 70 -1.805 0.854 0.656 1.00 0.00 C ATOM 2210 C VAL B 70 -2.108 0.519 2.118 1.00 0.00 C ATOM 2211 O VAL B 70 -3.210 0.714 2.594 1.00 0.00 O ATOM 2212 CB VAL B 70 -2.567 2.107 0.222 1.00 0.00 C ATOM 2213 CG1 VAL B 70 -2.283 3.246 1.202 1.00 0.00 C ATOM 2214 CG2 VAL B 70 -2.114 2.516 -1.180 1.00 0.00 C ATOM 0 H VAL B 70 -3.331 -0.269 -0.322 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.726 0.986 0.575 1.00 0.00 H new ATOM 0 HB VAL B 70 -3.636 1.896 0.214 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -2.827 4.138 0.891 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -2.605 2.955 2.202 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -1.214 3.458 1.213 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -2.656 3.409 -1.491 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -1.044 2.726 -1.170 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.318 1.705 -1.879 1.00 0.00 H new ATOM 2224 N ASP B 71 -1.142 0.014 2.835 1.00 0.00 N ATOM 2225 CA ASP B 71 -1.380 -0.336 4.264 1.00 0.00 C ATOM 2226 C ASP B 71 -1.312 0.921 5.136 1.00 0.00 C ATOM 2227 O ASP B 71 -1.345 0.849 6.349 1.00 0.00 O ATOM 2228 CB ASP B 71 -0.255 -1.304 4.628 1.00 0.00 C ATOM 2229 CG ASP B 71 -0.855 -2.609 5.154 1.00 0.00 C ATOM 2230 OD1 ASP B 71 -1.887 -3.011 4.644 1.00 0.00 O ATOM 2231 OD2 ASP B 71 -0.271 -3.184 6.058 1.00 0.00 O ATOM 0 H ASP B 71 -0.199 -0.171 2.494 1.00 0.00 H new ATOM 0 HA ASP B 71 -2.364 -0.778 4.422 1.00 0.00 H new ATOM 0 HB2 ASP B 71 0.365 -1.503 3.754 1.00 0.00 H new ATOM 0 HB3 ASP B 71 0.392 -0.858 5.383 1.00 0.00 H new ATOM 2236 N ASP B 72 -1.216 2.073 4.530 1.00 0.00 N ATOM 2237 CA ASP B 72 -1.146 3.331 5.327 1.00 0.00 C ATOM 2238 C ASP B 72 -2.141 4.362 4.783 1.00 0.00 C ATOM 2239 O ASP B 72 -2.426 4.401 3.603 1.00 0.00 O ATOM 2240 CB ASP B 72 0.289 3.829 5.154 1.00 0.00 C ATOM 2241 CG ASP B 72 1.264 2.746 5.621 1.00 0.00 C ATOM 2242 OD1 ASP B 72 1.472 1.803 4.876 1.00 0.00 O ATOM 2243 OD2 ASP B 72 1.787 2.880 6.715 1.00 0.00 O ATOM 0 H ASP B 72 -1.183 2.198 3.518 1.00 0.00 H new ATOM 0 HA ASP B 72 -1.399 3.169 6.375 1.00 0.00 H new ATOM 0 HB2 ASP B 72 0.476 4.076 4.109 1.00 0.00 H new ATOM 0 HB3 ASP B 72 0.440 4.742 5.729 1.00 0.00 H new ATOM 2248 N ASP B 73 -2.668 5.198 5.636 1.00 0.00 N ATOM 2249 CA ASP B 73 -3.640 6.227 5.170 1.00 0.00 C ATOM 2250 C ASP B 73 -2.928 7.272 4.306 1.00 0.00 C ATOM 2251 O ASP B 73 -3.549 8.144 3.729 1.00 0.00 O ATOM 2252 CB ASP B 73 -4.182 6.867 6.449 1.00 0.00 C ATOM 2253 CG ASP B 73 -3.044 7.578 7.184 1.00 0.00 C ATOM 2254 OD1 ASP B 73 -1.919 7.492 6.720 1.00 0.00 O ATOM 2255 OD2 ASP B 73 -3.318 8.199 8.199 1.00 0.00 O ATOM 0 H ASP B 73 -2.467 5.213 6.636 1.00 0.00 H new ATOM 0 HA ASP B 73 -4.436 5.799 4.560 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -4.973 7.577 6.206 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -4.624 6.105 7.091 1.00 0.00 H new ATOM 2260 N ASP B 74 -1.630 7.189 4.213 1.00 0.00 N ATOM 2261 CA ASP B 74 -0.871 8.173 3.390 1.00 0.00 C ATOM 2262 C ASP B 74 -1.595 8.434 2.066 1.00 0.00 C ATOM 2263 O ASP B 74 -2.284 9.423 1.907 1.00 0.00 O ATOM 2264 CB ASP B 74 0.481 7.508 3.136 1.00 0.00 C ATOM 2265 CG ASP B 74 1.279 7.460 4.440 1.00 0.00 C ATOM 2266 OD1 ASP B 74 1.454 8.505 5.044 1.00 0.00 O ATOM 2267 OD2 ASP B 74 1.702 6.378 4.813 1.00 0.00 O ATOM 0 H ASP B 74 -1.060 6.479 4.673 1.00 0.00 H new ATOM 0 HA ASP B 74 -0.770 9.137 3.889 1.00 0.00 H new ATOM 0 HB2 ASP B 74 0.335 6.499 2.749 1.00 0.00 H new ATOM 0 HB3 ASP B 74 1.035 8.063 2.379 1.00 0.00 H new ATOM 2272 N TYR B 75 -1.444 7.554 1.115 1.00 0.00 N ATOM 2273 CA TYR B 75 -2.118 7.740 -0.194 1.00 0.00 C ATOM 2274 C TYR B 75 -3.633 7.855 -0.003 1.00 0.00 C ATOM 2275 O TYR B 75 -4.309 8.550 -0.735 1.00 0.00 O ATOM 2276 CB TYR B 75 -1.761 6.479 -0.976 1.00 0.00 C ATOM 2277 CG TYR B 75 -0.574 6.750 -1.868 1.00 0.00 C ATOM 2278 CD1 TYR B 75 -0.577 7.856 -2.726 1.00 0.00 C ATOM 2279 CD2 TYR B 75 0.526 5.890 -1.839 1.00 0.00 C ATOM 2280 CE1 TYR B 75 0.524 8.100 -3.556 1.00 0.00 C ATOM 2281 CE2 TYR B 75 1.628 6.132 -2.667 1.00 0.00 C ATOM 2282 CZ TYR B 75 1.627 7.237 -3.526 1.00 0.00 C ATOM 2283 OH TYR B 75 2.713 7.475 -4.343 1.00 0.00 O ATOM 0 H TYR B 75 -0.878 6.709 1.192 1.00 0.00 H new ATOM 0 HA TYR B 75 -1.805 8.650 -0.707 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -1.532 5.666 -0.287 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -2.613 6.159 -1.576 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -1.428 8.521 -2.748 1.00 0.00 H new ATOM 0 HD2 TYR B 75 0.526 5.037 -1.177 1.00 0.00 H new ATOM 0 HE1 TYR B 75 0.523 8.953 -4.219 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.478 5.467 -2.643 1.00 0.00 H new ATOM 0 HH TYR B 75 3.233 6.651 -4.444 1.00 0.00 H new ATOM 2293 N PHE B 76 -4.171 7.180 0.975 1.00 0.00 N ATOM 2294 CA PHE B 76 -5.641 7.254 1.212 1.00 0.00 C ATOM 2295 C PHE B 76 -6.058 8.701 1.489 1.00 0.00 C ATOM 2296 O PHE B 76 -7.175 9.098 1.220 1.00 0.00 O ATOM 2297 CB PHE B 76 -5.888 6.381 2.443 1.00 0.00 C ATOM 2298 CG PHE B 76 -7.367 6.332 2.736 1.00 0.00 C ATOM 2299 CD1 PHE B 76 -8.258 5.853 1.767 1.00 0.00 C ATOM 2300 CD2 PHE B 76 -7.850 6.765 3.976 1.00 0.00 C ATOM 2301 CE1 PHE B 76 -9.629 5.807 2.038 1.00 0.00 C ATOM 2302 CE2 PHE B 76 -9.223 6.719 4.249 1.00 0.00 C ATOM 2303 CZ PHE B 76 -10.112 6.239 3.279 1.00 0.00 C ATOM 0 H PHE B 76 -3.657 6.580 1.620 1.00 0.00 H new ATOM 0 HA PHE B 76 -6.216 6.916 0.350 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -5.507 5.374 2.271 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -5.349 6.783 3.301 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.886 5.519 0.810 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.163 7.135 4.723 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.315 5.438 1.290 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.596 7.053 5.206 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.171 6.202 3.489 1.00 0.00 H new ATOM 2313 N LEU B 77 -5.168 9.492 2.022 1.00 0.00 N ATOM 2314 CA LEU B 77 -5.513 10.913 2.315 1.00 0.00 C ATOM 2315 C LEU B 77 -4.852 11.838 1.289 1.00 0.00 C ATOM 2316 O LEU B 77 -5.332 12.920 1.016 1.00 0.00 O ATOM 2317 CB LEU B 77 -4.956 11.176 3.714 1.00 0.00 C ATOM 2318 CG LEU B 77 -5.684 10.293 4.730 1.00 0.00 C ATOM 2319 CD1 LEU B 77 -5.040 10.459 6.107 1.00 0.00 C ATOM 2320 CD2 LEU B 77 -7.156 10.708 4.803 1.00 0.00 C ATOM 0 H LEU B 77 -4.217 9.217 2.267 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.586 11.098 2.264 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.886 10.967 3.736 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.081 12.227 3.975 1.00 0.00 H new ATOM 0 HG LEU B 77 -5.614 9.250 4.420 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -5.559 9.830 6.830 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.992 10.164 6.056 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.109 11.501 6.418 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.676 10.080 5.526 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -7.225 11.751 5.112 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.617 10.589 3.822 1.00 0.00 H new ATOM 2332 N CYS B 78 -3.756 11.420 0.717 1.00 0.00 N ATOM 2333 CA CYS B 78 -3.069 12.276 -0.294 1.00 0.00 C ATOM 2334 C CYS B 78 -3.963 12.463 -1.522 1.00 0.00 C ATOM 2335 O CYS B 78 -3.825 13.413 -2.265 1.00 0.00 O ATOM 2336 CB CYS B 78 -1.799 11.511 -0.666 1.00 0.00 C ATOM 2337 SG CYS B 78 -0.730 12.570 -1.670 1.00 0.00 S ATOM 0 H CYS B 78 -3.306 10.524 0.905 1.00 0.00 H new ATOM 0 HA CYS B 78 -2.846 13.271 0.091 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -1.274 11.196 0.236 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -2.055 10.607 -1.218 1.00 0.00 H new ATOM 0 HG CYS B 78 -1.460 13.402 -2.352 1.00 0.00 H new ATOM 2343 N LEU B 79 -4.883 11.562 -1.739 1.00 0.00 N ATOM 2344 CA LEU B 79 -5.787 11.688 -2.917 1.00 0.00 C ATOM 2345 C LEU B 79 -6.907 12.689 -2.617 1.00 0.00 C ATOM 2346 O LEU B 79 -7.125 13.051 -1.478 1.00 0.00 O ATOM 2347 CB LEU B 79 -6.360 10.286 -3.128 1.00 0.00 C ATOM 2348 CG LEU B 79 -5.257 9.357 -3.638 1.00 0.00 C ATOM 2349 CD1 LEU B 79 -5.817 7.943 -3.805 1.00 0.00 C ATOM 2350 CD2 LEU B 79 -4.748 9.865 -4.989 1.00 0.00 C ATOM 0 H LEU B 79 -5.047 10.745 -1.151 1.00 0.00 H new ATOM 0 HA LEU B 79 -5.266 12.051 -3.803 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -6.769 9.904 -2.193 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -7.181 10.321 -3.844 1.00 0.00 H new ATOM 0 HG LEU B 79 -4.436 9.341 -2.921 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -5.031 7.281 -4.168 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -6.181 7.580 -2.844 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -6.638 7.959 -4.522 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -3.962 9.204 -5.354 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -5.570 9.881 -5.705 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.349 10.873 -4.872 1.00 0.00 H new ATOM 2362 N PRO B 80 -7.577 13.104 -3.656 1.00 0.00 N ATOM 2363 CA PRO B 80 -8.686 14.078 -3.507 1.00 0.00 C ATOM 2364 C PRO B 80 -9.901 13.410 -2.857 1.00 0.00 C ATOM 2365 O PRO B 80 -9.914 12.219 -2.617 1.00 0.00 O ATOM 2366 CB PRO B 80 -8.995 14.491 -4.942 1.00 0.00 C ATOM 2367 CG PRO B 80 -8.525 13.347 -5.783 1.00 0.00 C ATOM 2368 CD PRO B 80 -7.369 12.713 -5.054 1.00 0.00 C ATOM 0 HA PRO B 80 -8.430 14.925 -2.871 1.00 0.00 H new ATOM 0 HB2 PRO B 80 -10.061 14.671 -5.080 1.00 0.00 H new ATOM 0 HB3 PRO B 80 -8.479 15.414 -5.207 1.00 0.00 H new ATOM 0 HG2 PRO B 80 -9.327 12.625 -5.936 1.00 0.00 H new ATOM 0 HG3 PRO B 80 -8.216 13.694 -6.769 1.00 0.00 H new ATOM 0 HD2 PRO B 80 -7.369 11.629 -5.170 1.00 0.00 H new ATOM 0 HD3 PRO B 80 -6.412 13.074 -5.432 1.00 0.00 H new ATOM 2376 N SER B 81 -10.922 14.170 -2.571 1.00 0.00 N ATOM 2377 CA SER B 81 -12.138 13.581 -1.936 1.00 0.00 C ATOM 2378 C SER B 81 -12.724 12.506 -2.846 1.00 0.00 C ATOM 2379 O SER B 81 -12.994 11.397 -2.431 1.00 0.00 O ATOM 2380 CB SER B 81 -13.114 14.747 -1.821 1.00 0.00 C ATOM 2381 OG SER B 81 -14.148 14.408 -0.906 1.00 0.00 O ATOM 0 H SER B 81 -10.968 15.173 -2.749 1.00 0.00 H new ATOM 0 HA SER B 81 -11.925 13.118 -0.972 1.00 0.00 H new ATOM 0 HB2 SER B 81 -12.591 15.641 -1.481 1.00 0.00 H new ATOM 0 HB3 SER B 81 -13.539 14.978 -2.798 1.00 0.00 H new ATOM 0 HG SER B 81 -14.196 13.434 -0.813 1.00 0.00 H new ATOM 2387 N ASN B 82 -12.922 12.840 -4.087 1.00 0.00 N ATOM 2388 CA ASN B 82 -13.496 11.853 -5.046 1.00 0.00 C ATOM 2389 C ASN B 82 -12.410 10.885 -5.527 1.00 0.00 C ATOM 2390 O ASN B 82 -11.625 11.199 -6.399 1.00 0.00 O ATOM 2391 CB ASN B 82 -14.017 12.693 -6.212 1.00 0.00 C ATOM 2392 CG ASN B 82 -14.649 11.776 -7.261 1.00 0.00 C ATOM 2393 OD1 ASN B 82 -15.525 10.993 -6.951 1.00 0.00 O ATOM 2394 ND2 ASN B 82 -14.238 11.839 -8.497 1.00 0.00 N ATOM 0 H ASN B 82 -12.711 13.756 -4.483 1.00 0.00 H new ATOM 0 HA ASN B 82 -14.282 11.248 -4.594 1.00 0.00 H new ATOM 0 HB2 ASN B 82 -14.752 13.414 -5.854 1.00 0.00 H new ATOM 0 HB3 ASN B 82 -13.201 13.263 -6.656 1.00 0.00 H new ATOM 0 HD21 ASN B 82 -14.652 11.231 -9.204 1.00 0.00 H new ATOM 0 HD22 ASN B 82 -13.503 12.496 -8.757 1.00 0.00 H new ATOM 2401 N THR B 83 -12.363 9.708 -4.963 1.00 0.00 N ATOM 2402 CA THR B 83 -11.333 8.717 -5.386 1.00 0.00 C ATOM 2403 C THR B 83 -11.957 7.320 -5.474 1.00 0.00 C ATOM 2404 O THR B 83 -12.818 6.967 -4.694 1.00 0.00 O ATOM 2405 CB THR B 83 -10.264 8.763 -4.293 1.00 0.00 C ATOM 2406 OG1 THR B 83 -9.260 7.798 -4.573 1.00 0.00 O ATOM 2407 CG2 THR B 83 -10.904 8.458 -2.938 1.00 0.00 C ATOM 0 H THR B 83 -12.994 9.390 -4.227 1.00 0.00 H new ATOM 0 HA THR B 83 -10.916 8.943 -6.368 1.00 0.00 H new ATOM 0 HB THR B 83 -9.815 9.756 -4.265 1.00 0.00 H new ATOM 0 HG1 THR B 83 -9.549 6.921 -4.245 1.00 0.00 H new ATOM 0 HG21 THR B 83 -10.142 8.491 -2.160 1.00 0.00 H new ATOM 0 HG22 THR B 83 -11.673 9.200 -2.724 1.00 0.00 H new ATOM 0 HG23 THR B 83 -11.354 7.466 -2.963 1.00 0.00 H new ATOM 2415 N LYS B 84 -11.532 6.527 -6.419 1.00 0.00 N ATOM 2416 CA LYS B 84 -12.108 5.159 -6.558 1.00 0.00 C ATOM 2417 C LYS B 84 -11.176 4.118 -5.931 1.00 0.00 C ATOM 2418 O LYS B 84 -9.974 4.164 -6.101 1.00 0.00 O ATOM 2419 CB LYS B 84 -12.225 4.934 -8.064 1.00 0.00 C ATOM 2420 CG LYS B 84 -13.365 5.787 -8.621 1.00 0.00 C ATOM 2421 CD LYS B 84 -13.148 6.014 -10.118 1.00 0.00 C ATOM 2422 CE LYS B 84 -13.155 7.516 -10.414 1.00 0.00 C ATOM 2423 NZ LYS B 84 -13.693 7.631 -11.798 1.00 0.00 N ATOM 0 H LYS B 84 -10.812 6.767 -7.100 1.00 0.00 H new ATOM 0 HA LYS B 84 -13.069 5.064 -6.052 1.00 0.00 H new ATOM 0 HB2 LYS B 84 -11.288 5.195 -8.555 1.00 0.00 H new ATOM 0 HB3 LYS B 84 -12.410 3.880 -8.271 1.00 0.00 H new ATOM 0 HG2 LYS B 84 -14.321 5.291 -8.452 1.00 0.00 H new ATOM 0 HG3 LYS B 84 -13.406 6.743 -8.100 1.00 0.00 H new ATOM 0 HD2 LYS B 84 -12.200 5.576 -10.429 1.00 0.00 H new ATOM 0 HD3 LYS B 84 -13.932 5.516 -10.689 1.00 0.00 H new ATOM 0 HE2 LYS B 84 -13.778 8.056 -9.702 1.00 0.00 H new ATOM 0 HE3 LYS B 84 -12.152 7.937 -10.344 1.00 0.00 H new ATOM 0 HZ1 LYS B 84 -13.729 8.633 -12.074 1.00 0.00 H new ATOM 0 HZ2 LYS B 84 -13.075 7.113 -12.455 1.00 0.00 H new ATOM 0 HZ3 LYS B 84 -14.651 7.228 -11.833 1.00 0.00 H new ATOM 2437 N PHE B 85 -11.725 3.178 -5.210 1.00 0.00 N ATOM 2438 CA PHE B 85 -10.878 2.133 -4.574 1.00 0.00 C ATOM 2439 C PHE B 85 -11.542 0.759 -4.708 1.00 0.00 C ATOM 2440 O PHE B 85 -12.679 0.647 -5.123 1.00 0.00 O ATOM 2441 CB PHE B 85 -10.795 2.543 -3.106 1.00 0.00 C ATOM 2442 CG PHE B 85 -9.670 3.533 -2.921 1.00 0.00 C ATOM 2443 CD1 PHE B 85 -8.348 3.080 -2.826 1.00 0.00 C ATOM 2444 CD2 PHE B 85 -9.947 4.903 -2.845 1.00 0.00 C ATOM 2445 CE1 PHE B 85 -7.304 3.996 -2.654 1.00 0.00 C ATOM 2446 CE2 PHE B 85 -8.903 5.820 -2.672 1.00 0.00 C ATOM 2447 CZ PHE B 85 -7.581 5.366 -2.577 1.00 0.00 C ATOM 0 H PHE B 85 -12.726 3.090 -5.035 1.00 0.00 H new ATOM 0 HA PHE B 85 -9.894 2.056 -5.037 1.00 0.00 H new ATOM 0 HB2 PHE B 85 -11.739 2.986 -2.787 1.00 0.00 H new ATOM 0 HB3 PHE B 85 -10.627 1.665 -2.481 1.00 0.00 H new ATOM 0 HD1 PHE B 85 -8.134 2.023 -2.886 1.00 0.00 H new ATOM 0 HD2 PHE B 85 -10.966 5.253 -2.920 1.00 0.00 H new ATOM 0 HE1 PHE B 85 -6.285 3.646 -2.581 1.00 0.00 H new ATOM 0 HE2 PHE B 85 -9.117 6.877 -2.612 1.00 0.00 H new ATOM 0 HZ PHE B 85 -6.776 6.073 -2.444 1.00 0.00 H new ATOM 2457 N VAL B 86 -10.844 -0.285 -4.358 1.00 0.00 N ATOM 2458 CA VAL B 86 -11.435 -1.650 -4.463 1.00 0.00 C ATOM 2459 C VAL B 86 -11.030 -2.493 -3.250 1.00 0.00 C ATOM 2460 O VAL B 86 -9.910 -2.428 -2.784 1.00 0.00 O ATOM 2461 CB VAL B 86 -10.853 -2.238 -5.748 1.00 0.00 C ATOM 2462 CG1 VAL B 86 -11.239 -3.714 -5.854 1.00 0.00 C ATOM 2463 CG2 VAL B 86 -11.410 -1.477 -6.954 1.00 0.00 C ATOM 0 H VAL B 86 -9.888 -0.253 -4.003 1.00 0.00 H new ATOM 0 HA VAL B 86 -12.525 -1.629 -4.486 1.00 0.00 H new ATOM 0 HB VAL B 86 -9.767 -2.147 -5.730 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -10.824 -4.134 -6.770 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -10.843 -4.256 -4.995 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -12.325 -3.806 -5.872 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -10.996 -1.895 -7.871 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -12.496 -1.568 -6.972 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -11.135 -0.425 -6.879 1.00 0.00 H new ATOM 2473 N ALA B 87 -11.935 -3.280 -2.732 1.00 0.00 N ATOM 2474 CA ALA B 87 -11.599 -4.120 -1.544 1.00 0.00 C ATOM 2475 C ALA B 87 -11.786 -5.605 -1.868 1.00 0.00 C ATOM 2476 O ALA B 87 -12.771 -6.004 -2.457 1.00 0.00 O ATOM 2477 CB ALA B 87 -12.588 -3.681 -0.464 1.00 0.00 C ATOM 0 H ALA B 87 -12.889 -3.378 -3.078 1.00 0.00 H new ATOM 0 HA ALA B 87 -10.563 -3.995 -1.230 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -12.409 -4.252 0.447 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -12.455 -2.619 -0.259 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -13.606 -3.859 -0.809 1.00 0.00 H new ATOM 2483 N LEU B 88 -10.848 -6.429 -1.482 1.00 0.00 N ATOM 2484 CA LEU B 88 -10.978 -7.888 -1.762 1.00 0.00 C ATOM 2485 C LEU B 88 -11.534 -8.614 -0.540 1.00 0.00 C ATOM 2486 O LEU B 88 -10.896 -8.711 0.490 1.00 0.00 O ATOM 2487 CB LEU B 88 -9.565 -8.374 -2.052 1.00 0.00 C ATOM 2488 CG LEU B 88 -9.136 -7.920 -3.448 1.00 0.00 C ATOM 2489 CD1 LEU B 88 -10.209 -8.316 -4.464 1.00 0.00 C ATOM 2490 CD2 LEU B 88 -8.959 -6.401 -3.460 1.00 0.00 C ATOM 0 H LEU B 88 -10.000 -6.155 -0.986 1.00 0.00 H new ATOM 0 HA LEU B 88 -11.657 -8.079 -2.593 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -8.875 -7.982 -1.304 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -9.524 -9.461 -1.985 1.00 0.00 H new ATOM 0 HG LEU B 88 -8.192 -8.397 -3.711 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -9.904 -7.993 -5.459 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -10.335 -9.399 -4.457 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -11.153 -7.839 -4.201 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -8.653 -6.078 -4.455 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -9.903 -5.923 -3.197 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -8.195 -6.118 -2.736 1.00 0.00 H new ATOM 2502 N ALA B 89 -12.712 -9.136 -0.663 1.00 0.00 N ATOM 2503 CA ALA B 89 -13.329 -9.883 0.469 1.00 0.00 C ATOM 2504 C ALA B 89 -12.759 -11.299 0.500 1.00 0.00 C ATOM 2505 O ALA B 89 -11.831 -11.605 -0.221 1.00 0.00 O ATOM 2506 CB ALA B 89 -14.829 -9.908 0.168 1.00 0.00 C ATOM 0 H ALA B 89 -13.285 -9.080 -1.505 1.00 0.00 H new ATOM 0 HA ALA B 89 -13.129 -9.425 1.438 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -15.350 -10.444 0.961 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -15.206 -8.887 0.111 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -15.001 -10.412 -0.783 1.00 0.00 H new ATOM 2512 N SER B 90 -13.296 -12.158 1.331 1.00 0.00 N ATOM 2513 CA SER B 90 -12.782 -13.561 1.406 1.00 0.00 C ATOM 2514 C SER B 90 -12.344 -14.039 0.017 1.00 0.00 C ATOM 2515 O SER B 90 -11.420 -14.815 -0.122 1.00 0.00 O ATOM 2516 CB SER B 90 -13.962 -14.390 1.910 1.00 0.00 C ATOM 2517 OG SER B 90 -13.490 -15.658 2.347 1.00 0.00 O ATOM 0 H SER B 90 -14.070 -11.948 1.962 1.00 0.00 H new ATOM 0 HA SER B 90 -11.915 -13.648 2.060 1.00 0.00 H new ATOM 0 HB2 SER B 90 -14.462 -13.873 2.729 1.00 0.00 H new ATOM 0 HB3 SER B 90 -14.698 -14.517 1.116 1.00 0.00 H new ATOM 0 HG SER B 90 -14.032 -16.366 1.941 1.00 0.00 H new ATOM 2523 N ASN B 91 -12.990 -13.560 -1.013 1.00 0.00 N ATOM 2524 CA ASN B 91 -12.599 -13.964 -2.393 1.00 0.00 C ATOM 2525 C ASN B 91 -11.382 -13.145 -2.838 1.00 0.00 C ATOM 2526 O ASN B 91 -11.499 -12.004 -3.240 1.00 0.00 O ATOM 2527 CB ASN B 91 -13.815 -13.640 -3.263 1.00 0.00 C ATOM 2528 CG ASN B 91 -13.517 -14.007 -4.718 1.00 0.00 C ATOM 2529 OD1 ASN B 91 -12.659 -14.956 -4.979 1.00 0.00 O flip ATOM 2530 ND2 ASN B 91 -14.070 -13.423 -5.630 1.00 0.00 N flip ATOM 0 H ASN B 91 -13.771 -12.907 -0.957 1.00 0.00 H new ATOM 0 HA ASN B 91 -12.326 -15.017 -2.462 1.00 0.00 H new ATOM 0 HB2 ASN B 91 -14.686 -14.192 -2.909 1.00 0.00 H new ATOM 0 HB3 ASN B 91 -14.057 -12.580 -3.187 1.00 0.00 H new ATOM 0 HD21 ASN B 91 -14.741 -12.681 -5.428 1.00 0.00 H new ATOM 0 HD22 ASN B 91 -13.863 -13.675 -6.597 1.00 0.00 H new ATOM 2537 N GLU B 92 -10.212 -13.719 -2.758 1.00 0.00 N ATOM 2538 CA GLU B 92 -8.971 -12.991 -3.159 1.00 0.00 C ATOM 2539 C GLU B 92 -8.980 -12.586 -4.643 1.00 0.00 C ATOM 2540 O GLU B 92 -8.028 -12.009 -5.130 1.00 0.00 O ATOM 2541 CB GLU B 92 -7.848 -13.985 -2.886 1.00 0.00 C ATOM 2542 CG GLU B 92 -7.901 -14.426 -1.422 1.00 0.00 C ATOM 2543 CD GLU B 92 -6.544 -15.001 -1.011 1.00 0.00 C ATOM 2544 OE1 GLU B 92 -5.586 -14.246 -0.988 1.00 0.00 O ATOM 2545 OE2 GLU B 92 -6.487 -16.185 -0.726 1.00 0.00 O ATOM 0 H GLU B 92 -10.060 -14.672 -2.428 1.00 0.00 H new ATOM 0 HA GLU B 92 -8.864 -12.057 -2.608 1.00 0.00 H new ATOM 0 HB2 GLU B 92 -7.947 -14.850 -3.541 1.00 0.00 H new ATOM 0 HB3 GLU B 92 -6.883 -13.528 -3.105 1.00 0.00 H new ATOM 0 HG2 GLU B 92 -8.157 -13.579 -0.785 1.00 0.00 H new ATOM 0 HG3 GLU B 92 -8.681 -15.175 -1.285 1.00 0.00 H new ATOM 2552 N LYS B 93 -10.023 -12.882 -5.374 1.00 0.00 N ATOM 2553 CA LYS B 93 -10.036 -12.505 -6.818 1.00 0.00 C ATOM 2554 C LYS B 93 -9.717 -11.015 -6.972 1.00 0.00 C ATOM 2555 O LYS B 93 -10.588 -10.170 -6.921 1.00 0.00 O ATOM 2556 CB LYS B 93 -11.460 -12.803 -7.291 1.00 0.00 C ATOM 2557 CG LYS B 93 -11.505 -12.776 -8.820 1.00 0.00 C ATOM 2558 CD LYS B 93 -12.958 -12.872 -9.290 1.00 0.00 C ATOM 2559 CE LYS B 93 -13.027 -13.715 -10.565 1.00 0.00 C ATOM 2560 NZ LYS B 93 -14.258 -13.254 -11.265 1.00 0.00 N ATOM 0 H LYS B 93 -10.857 -13.363 -5.038 1.00 0.00 H new ATOM 0 HA LYS B 93 -9.293 -13.052 -7.399 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -11.780 -13.778 -6.924 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -12.152 -12.066 -6.883 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -11.052 -11.857 -9.192 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -10.925 -13.605 -9.226 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -13.575 -13.320 -8.511 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -13.357 -11.875 -9.478 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -12.142 -13.568 -11.184 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -13.080 -14.779 -10.333 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -14.374 -13.787 -12.151 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -15.085 -13.413 -10.654 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -14.176 -12.240 -11.480 1.00 0.00 H new ATOM 2574 N TRP B 94 -8.464 -10.696 -7.148 1.00 0.00 N ATOM 2575 CA TRP B 94 -8.058 -9.269 -7.294 1.00 0.00 C ATOM 2576 C TRP B 94 -7.678 -8.965 -8.747 1.00 0.00 C ATOM 2577 O TRP B 94 -7.312 -9.844 -9.502 1.00 0.00 O ATOM 2578 CB TRP B 94 -6.842 -9.133 -6.376 1.00 0.00 C ATOM 2579 CG TRP B 94 -6.385 -7.712 -6.330 1.00 0.00 C ATOM 2580 CD1 TRP B 94 -7.194 -6.629 -6.400 1.00 0.00 C ATOM 2581 CD2 TRP B 94 -5.028 -7.200 -6.195 1.00 0.00 C ATOM 2582 NE1 TRP B 94 -6.417 -5.487 -6.322 1.00 0.00 N ATOM 2583 CE2 TRP B 94 -5.077 -5.788 -6.193 1.00 0.00 C ATOM 2584 CE3 TRP B 94 -3.772 -7.821 -6.077 1.00 0.00 C ATOM 2585 CZ2 TRP B 94 -3.920 -5.016 -6.077 1.00 0.00 C ATOM 2586 CZ3 TRP B 94 -2.605 -7.049 -5.959 1.00 0.00 C ATOM 2587 CH2 TRP B 94 -2.679 -5.649 -5.959 1.00 0.00 C ATOM 0 H TRP B 94 -7.698 -11.368 -7.197 1.00 0.00 H new ATOM 0 HA TRP B 94 -8.857 -8.574 -7.035 1.00 0.00 H new ATOM 0 HB2 TRP B 94 -7.096 -9.473 -5.372 1.00 0.00 H new ATOM 0 HB3 TRP B 94 -6.034 -9.771 -6.734 1.00 0.00 H new ATOM 0 HD1 TRP B 94 -8.269 -6.653 -6.500 1.00 0.00 H new ATOM 0 HE1 TRP B 94 -6.790 -4.538 -6.356 1.00 0.00 H new ATOM 0 HE3 TRP B 94 -3.704 -8.899 -6.077 1.00 0.00 H new ATOM 0 HZ2 TRP B 94 -3.983 -3.938 -6.078 1.00 0.00 H new ATOM 0 HZ3 TRP B 94 -1.645 -7.536 -5.868 1.00 0.00 H new ATOM 0 HH2 TRP B 94 -1.778 -5.060 -5.868 1.00 0.00 H new ATOM 2598 N ALA B 95 -7.761 -7.722 -9.142 1.00 0.00 N ATOM 2599 CA ALA B 95 -7.406 -7.354 -10.544 1.00 0.00 C ATOM 2600 C ALA B 95 -5.944 -6.899 -10.614 1.00 0.00 C ATOM 2601 O ALA B 95 -5.576 -5.881 -10.063 1.00 0.00 O ATOM 2602 CB ALA B 95 -8.341 -6.196 -10.894 1.00 0.00 C ATOM 0 H ALA B 95 -8.060 -6.945 -8.553 1.00 0.00 H new ATOM 0 HA ALA B 95 -7.514 -8.191 -11.233 1.00 0.00 H new ATOM 0 HB1 ALA B 95 -8.144 -5.865 -11.914 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -9.376 -6.527 -10.814 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -8.170 -5.369 -10.204 1.00 0.00 H new ATOM 2608 N TYR B 96 -5.109 -7.645 -11.286 1.00 0.00 N ATOM 2609 CA TYR B 96 -3.673 -7.250 -11.387 1.00 0.00 C ATOM 2610 C TYR B 96 -3.350 -6.787 -12.811 1.00 0.00 C ATOM 2611 O TYR B 96 -3.359 -7.565 -13.744 1.00 0.00 O ATOM 2612 CB TYR B 96 -2.887 -8.516 -11.040 1.00 0.00 C ATOM 2613 CG TYR B 96 -1.412 -8.196 -10.980 1.00 0.00 C ATOM 2614 CD1 TYR B 96 -0.869 -7.606 -9.832 1.00 0.00 C ATOM 2615 CD2 TYR B 96 -0.586 -8.492 -12.071 1.00 0.00 C ATOM 2616 CE1 TYR B 96 0.499 -7.312 -9.776 1.00 0.00 C ATOM 2617 CE2 TYR B 96 0.782 -8.198 -12.015 1.00 0.00 C ATOM 2618 CZ TYR B 96 1.324 -7.608 -10.868 1.00 0.00 C ATOM 2619 OH TYR B 96 2.672 -7.319 -10.812 1.00 0.00 O ATOM 0 H TYR B 96 -5.357 -8.509 -11.768 1.00 0.00 H new ATOM 0 HA TYR B 96 -3.424 -6.423 -10.722 1.00 0.00 H new ATOM 0 HB2 TYR B 96 -3.222 -8.913 -10.082 1.00 0.00 H new ATOM 0 HB3 TYR B 96 -3.072 -9.287 -11.788 1.00 0.00 H new ATOM 0 HD1 TYR B 96 -1.505 -7.378 -8.990 1.00 0.00 H new ATOM 0 HD2 TYR B 96 -1.004 -8.947 -12.956 1.00 0.00 H new ATOM 0 HE1 TYR B 96 0.918 -6.857 -8.891 1.00 0.00 H new ATOM 0 HE2 TYR B 96 1.419 -8.427 -12.857 1.00 0.00 H new ATOM 0 HH TYR B 96 3.100 -7.589 -11.652 1.00 0.00 H new ATOM 2629 N ASN B 97 -3.063 -5.525 -12.982 1.00 0.00 N ATOM 2630 CA ASN B 97 -2.739 -5.011 -14.344 1.00 0.00 C ATOM 2631 C ASN B 97 -1.222 -4.910 -14.525 1.00 0.00 C ATOM 2632 O ASN B 97 -0.468 -4.987 -13.576 1.00 0.00 O ATOM 2633 CB ASN B 97 -3.379 -3.624 -14.408 1.00 0.00 C ATOM 2634 CG ASN B 97 -3.351 -3.115 -15.850 1.00 0.00 C ATOM 2635 OD1 ASN B 97 -4.102 -3.577 -16.686 1.00 0.00 O ATOM 2636 ND2 ASN B 97 -2.509 -2.174 -16.181 1.00 0.00 N ATOM 0 H ASN B 97 -3.039 -4.828 -12.238 1.00 0.00 H new ATOM 0 HA ASN B 97 -3.110 -5.668 -15.131 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -4.406 -3.669 -14.047 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -2.842 -2.934 -13.757 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -2.482 -1.828 -17.140 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -1.878 -1.785 -15.481 1.00 0.00 H new ATOM 2643 N ASN B 98 -0.771 -4.738 -15.737 1.00 0.00 N ATOM 2644 CA ASN B 98 0.697 -4.633 -15.977 1.00 0.00 C ATOM 2645 C ASN B 98 1.051 -3.241 -16.510 1.00 0.00 C ATOM 2646 O ASN B 98 0.635 -2.851 -17.583 1.00 0.00 O ATOM 2647 CB ASN B 98 1.001 -5.701 -17.026 1.00 0.00 C ATOM 2648 CG ASN B 98 2.513 -5.814 -17.215 1.00 0.00 C ATOM 2649 OD1 ASN B 98 3.275 -5.433 -16.348 1.00 0.00 O ATOM 2650 ND2 ASN B 98 2.984 -6.325 -18.318 1.00 0.00 N ATOM 0 H ASN B 98 -1.354 -4.666 -16.571 1.00 0.00 H new ATOM 0 HA ASN B 98 1.276 -4.778 -15.065 1.00 0.00 H new ATOM 0 HB2 ASN B 98 0.590 -6.661 -16.713 1.00 0.00 H new ATOM 0 HB3 ASN B 98 0.524 -5.443 -17.972 1.00 0.00 H new ATOM 0 HD21 ASN B 98 3.992 -6.405 -18.453 1.00 0.00 H new ATOM 0 HD22 ASN B 98 2.345 -6.645 -19.046 1.00 0.00 H new ATOM 2657 N SER B 99 1.816 -2.491 -15.767 1.00 0.00 N ATOM 2658 CA SER B 99 2.198 -1.126 -16.228 1.00 0.00 C ATOM 2659 C SER B 99 3.409 -1.206 -17.159 1.00 0.00 C ATOM 2660 O SER B 99 4.539 -1.294 -16.719 1.00 0.00 O ATOM 2661 CB SER B 99 2.551 -0.364 -14.951 1.00 0.00 C ATOM 2662 OG SER B 99 2.803 0.999 -15.270 1.00 0.00 O ATOM 0 H SER B 99 2.194 -2.764 -14.860 1.00 0.00 H new ATOM 0 HA SER B 99 1.400 -0.637 -16.786 1.00 0.00 H new ATOM 0 HB2 SER B 99 1.734 -0.436 -14.233 1.00 0.00 H new ATOM 0 HB3 SER B 99 3.429 -0.807 -14.480 1.00 0.00 H new ATOM 0 HG SER B 99 3.028 1.490 -14.452 1.00 0.00 H new ATOM 2668 N ASP B 100 3.184 -1.175 -18.443 1.00 0.00 N ATOM 2669 CA ASP B 100 4.323 -1.250 -19.403 1.00 0.00 C ATOM 2670 C ASP B 100 5.216 -0.015 -19.261 1.00 0.00 C ATOM 2671 O ASP B 100 6.422 -0.165 -19.369 1.00 0.00 O ATOM 2672 CB ASP B 100 3.674 -1.290 -20.786 1.00 0.00 C ATOM 2673 CG ASP B 100 4.619 -1.970 -21.776 1.00 0.00 C ATOM 2674 OD1 ASP B 100 5.749 -1.524 -21.890 1.00 0.00 O ATOM 2675 OD2 ASP B 100 4.201 -2.929 -22.403 1.00 0.00 O ATOM 2676 OXT ASP B 100 4.679 1.059 -19.046 1.00 0.00 O ATOM 0 H ASP B 100 2.261 -1.101 -18.870 1.00 0.00 H new ATOM 0 HA ASP B 100 4.956 -2.120 -19.227 1.00 0.00 H new ATOM 0 HB2 ASP B 100 2.729 -1.831 -20.740 1.00 0.00 H new ATOM 0 HB3 ASP B 100 3.446 -0.278 -21.121 1.00 0.00 H new TER 2681 ASP B 100