USER MOD reduce.3.24.130724 H: found=0, std=0, add=1204, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1204 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 25 ASN : amide:sc= 0.571 K(o=2.3,f=-6.8!) USER MOD Set 1.2: B 29 LYS NZ :NH3+ 171:sc= 1.68 (180deg=0.981) USER MOD Set 2.1: B 7 THR OG1 : rot 111:sc= 0.781 USER MOD Set 2.2: B 9 THR OG1 : rot 180:sc= 1.18 USER MOD Set 3.1: B 1 MET CE :methyl -120:sc= -0.35 (180deg=-2.39!) USER MOD Set 3.2: B 19 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 161:sc= -0.069 (180deg=-0.48) USER MOD Single : A 1 MET N :NH3+ -101:sc= 0.13 (180deg=-0.0509) USER MOD Single : A 3 SER OG : rot -38:sc= 0.397 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 150:sc= 1.26 (180deg=1.18) USER MOD Single : A 7 LYS NZ :NH3+ 158:sc= 1.26 (180deg=1.18) USER MOD Single : A 12 GLN :FLIP amide:sc= -2.75 F(o=-6.9!,f=-2.8) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -138:sc= 1.25 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.895 USER MOD Single : A 26 LYS NZ :NH3+ 166:sc= -0.0252 (180deg=-0.2) USER MOD Single : A 27 SER OG : rot -74:sc= 0.411 USER MOD Single : A 30 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0388) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -135:sc= 0.908 (180deg=0.58) USER MOD Single : A 39 SER OG : rot 98:sc= 1.21 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl 158:sc= -0.17 (180deg=-0.733) USER MOD Single : A 45 CYS SG : rot 2:sc= 0.0772 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0.0371 USER MOD Single : A 52 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.07) USER MOD Single : A 53 SER OG : rot 30:sc= 0.702 USER MOD Single : A 59 GLN : amide:sc= -3.29! C(o=-3.3!,f=-3.7!) USER MOD Single : A 67 LYS NZ :NH3+ 168:sc= -0.0293 (180deg=-0.234) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -1.03 X(o=-1,f=-0.55) USER MOD Single : A 70 THR OG1 : rot 81:sc= 0.671 USER MOD Single : B 1 MET N :NH3+ -167:sc= 1.68 (180deg=1.28) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 6 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00448) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -92:sc= 0.263 USER MOD Single : B 20 SER OG : rot -39:sc= 0.57 USER MOD Single : B 22 THR OG1 : rot 180:sc= -0.498 USER MOD Single : B 27 LYS NZ :NH3+ 161:sc= 1.75 (180deg=1.61) USER MOD Single : B 28 SER OG : rot 14:sc= 0.741 USER MOD Single : B 31 GLN : amide:sc= -1.37 X(o=-1.4,f=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN :FLIP amide:sc= -0.796 F(o=-3.4!,f=-0.8) USER MOD Single : B 41 GLN : amide:sc= -0.397 K(o=-0.4,f=-3.9!) USER MOD Single : B 48 LYS NZ :NH3+ -173:sc= -0.0115 (180deg=-0.116) USER MOD Single : B 49 GLN : amide:sc= -0.659 K(o=-0.66,f=-1.9!) USER MOD Single : B 55 THR OG1 : rot -60:sc= 1.19 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot -102:sc= 0.856 USER MOD Single : B 60 ASN :FLIP amide:sc=-0.00264 F(o=-0.93,f=-0.0026) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 63 LYS NZ :NH3+ -127:sc= 0.854 (180deg=-0.186) USER MOD Single : B 65 SER OG : rot 75:sc= 0.433 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -35.096 -3.463 0.796 1.00 0.00 N ATOM 2 CA MET A 1 -34.721 -2.704 -0.420 1.00 0.00 C ATOM 3 C MET A 1 -33.451 -1.901 -0.172 1.00 0.00 C ATOM 4 O MET A 1 -33.015 -1.774 0.972 1.00 0.00 O ATOM 5 CB MET A 1 -35.853 -1.757 -0.835 1.00 0.00 C ATOM 6 CG MET A 1 -36.104 -0.633 0.161 1.00 0.00 C ATOM 7 SD MET A 1 -37.458 0.449 -0.334 1.00 0.00 S ATOM 8 CE MET A 1 -38.852 -0.672 -0.217 1.00 0.00 C ATOM 0 H1 MET A 1 -34.803 -4.455 0.690 1.00 0.00 H new ATOM 0 H2 MET A 1 -34.622 -3.048 1.624 1.00 0.00 H new ATOM 0 H3 MET A 1 -36.127 -3.419 0.929 1.00 0.00 H new ATOM 0 HA MET A 1 -34.543 -3.418 -1.224 1.00 0.00 H new ATOM 0 HB2 MET A 1 -35.615 -1.324 -1.806 1.00 0.00 H new ATOM 0 HB3 MET A 1 -36.770 -2.333 -0.959 1.00 0.00 H new ATOM 0 HG2 MET A 1 -36.326 -1.062 1.138 1.00 0.00 H new ATOM 0 HG3 MET A 1 -35.195 -0.042 0.272 1.00 0.00 H new ATOM 0 HE1 MET A 1 -39.777 -0.098 -0.158 1.00 0.00 H new ATOM 0 HE2 MET A 1 -38.878 -1.313 -1.098 1.00 0.00 H new ATOM 0 HE3 MET A 1 -38.750 -1.288 0.677 1.00 0.00 H new ATOM 20 N ALA A 2 -32.868 -1.375 -1.251 1.00 0.00 N ATOM 21 CA ALA A 2 -31.679 -0.523 -1.181 1.00 0.00 C ATOM 22 C ALA A 2 -30.478 -1.279 -0.619 1.00 0.00 C ATOM 23 O ALA A 2 -30.291 -1.368 0.594 1.00 0.00 O ATOM 24 CB ALA A 2 -31.953 0.737 -0.367 1.00 0.00 C ATOM 0 H ALA A 2 -33.208 -1.528 -2.200 1.00 0.00 H new ATOM 0 HA ALA A 2 -31.435 -0.224 -2.200 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -31.053 1.350 -0.332 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -32.760 1.303 -0.833 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -32.243 0.460 0.647 1.00 0.00 H new ATOM 30 N SER A 3 -29.662 -1.819 -1.511 1.00 0.00 N ATOM 31 CA SER A 3 -28.485 -2.575 -1.102 1.00 0.00 C ATOM 32 C SER A 3 -27.251 -1.676 -1.115 1.00 0.00 C ATOM 33 O SER A 3 -26.131 -2.125 -0.860 1.00 0.00 O ATOM 34 CB SER A 3 -28.280 -3.783 -2.024 1.00 0.00 C ATOM 35 OG SER A 3 -27.258 -4.637 -1.535 1.00 0.00 O ATOM 0 H SER A 3 -29.791 -1.749 -2.520 1.00 0.00 H new ATOM 0 HA SER A 3 -28.638 -2.940 -0.086 1.00 0.00 H new ATOM 0 HB2 SER A 3 -29.213 -4.340 -2.109 1.00 0.00 H new ATOM 0 HB3 SER A 3 -28.021 -3.439 -3.025 1.00 0.00 H new ATOM 0 HG SER A 3 -26.538 -4.097 -1.147 1.00 0.00 H new ATOM 41 N LYS A 4 -27.472 -0.401 -1.400 1.00 0.00 N ATOM 42 CA LYS A 4 -26.398 0.581 -1.436 1.00 0.00 C ATOM 43 C LYS A 4 -26.189 1.180 -0.048 1.00 0.00 C ATOM 44 O LYS A 4 -26.367 2.381 0.158 1.00 0.00 O ATOM 45 CB LYS A 4 -26.734 1.691 -2.432 1.00 0.00 C ATOM 46 CG LYS A 4 -26.993 1.198 -3.844 1.00 0.00 C ATOM 47 CD LYS A 4 -27.580 2.302 -4.707 1.00 0.00 C ATOM 48 CE LYS A 4 -28.897 2.803 -4.135 1.00 0.00 C ATOM 49 NZ LYS A 4 -29.410 3.993 -4.862 1.00 0.00 N ATOM 0 H LYS A 4 -28.394 -0.020 -1.611 1.00 0.00 H new ATOM 0 HA LYS A 4 -25.481 0.085 -1.752 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -27.615 2.227 -2.079 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -25.912 2.407 -2.453 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -26.062 0.843 -4.285 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -27.677 0.350 -3.817 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -26.873 3.128 -4.777 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -27.738 1.931 -5.720 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -29.638 2.005 -4.181 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -28.762 3.053 -3.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -30.309 4.299 -4.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -28.716 4.765 -4.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -29.565 3.749 -5.861 1.00 0.00 H new ATOM 63 N SER A 5 -25.840 0.326 0.903 1.00 0.00 N ATOM 64 CA SER A 5 -25.635 0.746 2.280 1.00 0.00 C ATOM 65 C SER A 5 -24.450 1.700 2.393 1.00 0.00 C ATOM 66 O SER A 5 -24.549 2.763 3.012 1.00 0.00 O ATOM 67 CB SER A 5 -25.398 -0.481 3.159 1.00 0.00 C ATOM 68 OG SER A 5 -26.377 -1.474 2.909 1.00 0.00 O ATOM 0 H SER A 5 -25.692 -0.670 0.743 1.00 0.00 H new ATOM 0 HA SER A 5 -26.528 1.273 2.616 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.405 -0.886 2.966 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.426 -0.192 4.210 1.00 0.00 H new ATOM 0 HG SER A 5 -26.207 -2.252 3.480 1.00 0.00 H new ATOM 74 N LYS A 6 -23.343 1.324 1.777 1.00 0.00 N ATOM 75 CA LYS A 6 -22.115 2.091 1.873 1.00 0.00 C ATOM 76 C LYS A 6 -21.429 2.121 0.512 1.00 0.00 C ATOM 77 O LYS A 6 -21.603 1.197 -0.285 1.00 0.00 O ATOM 78 CB LYS A 6 -21.197 1.452 2.924 1.00 0.00 C ATOM 79 CG LYS A 6 -20.035 2.330 3.370 1.00 0.00 C ATOM 80 CD LYS A 6 -20.521 3.566 4.110 1.00 0.00 C ATOM 81 CE LYS A 6 -19.371 4.340 4.740 1.00 0.00 C ATOM 82 NZ LYS A 6 -18.381 4.804 3.730 1.00 0.00 N ATOM 0 H LYS A 6 -23.270 0.485 1.201 1.00 0.00 H new ATOM 0 HA LYS A 6 -22.338 3.114 2.176 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -21.794 1.191 3.798 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -20.798 0.521 2.521 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -19.371 1.756 4.016 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -19.451 2.632 2.500 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -21.059 4.215 3.419 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -21.227 3.270 4.886 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -19.767 5.201 5.279 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -18.870 3.708 5.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -17.940 5.687 4.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -17.648 4.077 3.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -18.862 4.972 2.824 1.00 0.00 H new ATOM 96 N LYS A 7 -20.687 3.190 0.237 1.00 0.00 N ATOM 97 CA LYS A 7 -19.936 3.301 -1.011 1.00 0.00 C ATOM 98 C LYS A 7 -19.018 2.098 -1.200 1.00 0.00 C ATOM 99 O LYS A 7 -18.300 1.698 -0.281 1.00 0.00 O ATOM 100 CB LYS A 7 -19.107 4.588 -1.038 1.00 0.00 C ATOM 101 CG LYS A 7 -19.939 5.859 -1.003 1.00 0.00 C ATOM 102 CD LYS A 7 -19.071 7.095 -1.177 1.00 0.00 C ATOM 103 CE LYS A 7 -18.035 7.215 -0.070 1.00 0.00 C ATOM 104 NZ LYS A 7 -17.089 8.331 -0.318 1.00 0.00 N ATOM 0 H LYS A 7 -20.589 3.991 0.860 1.00 0.00 H new ATOM 0 HA LYS A 7 -20.657 3.329 -1.828 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -18.426 4.588 -0.187 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.492 4.593 -1.938 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -20.690 5.826 -1.792 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -20.475 5.919 -0.056 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -18.568 7.053 -2.143 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -19.701 7.984 -1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -18.539 7.371 0.884 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -17.481 6.280 0.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.655 8.624 0.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -16.347 8.017 -0.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -17.602 9.135 -0.733 1.00 0.00 H new ATOM 118 N ARG A 8 -19.054 1.521 -2.390 1.00 0.00 N ATOM 119 CA ARG A 8 -18.258 0.341 -2.688 1.00 0.00 C ATOM 120 C ARG A 8 -16.930 0.744 -3.312 1.00 0.00 C ATOM 121 O ARG A 8 -16.743 1.899 -3.694 1.00 0.00 O ATOM 122 CB ARG A 8 -19.012 -0.585 -3.643 1.00 0.00 C ATOM 123 CG ARG A 8 -20.433 -0.893 -3.202 1.00 0.00 C ATOM 124 CD ARG A 8 -21.084 -1.924 -4.106 1.00 0.00 C ATOM 125 NE ARG A 8 -21.113 -1.500 -5.508 1.00 0.00 N ATOM 126 CZ ARG A 8 -21.328 -2.333 -6.527 1.00 0.00 C ATOM 127 NH1 ARG A 8 -21.551 -3.621 -6.299 1.00 0.00 N ATOM 128 NH2 ARG A 8 -21.340 -1.876 -7.775 1.00 0.00 N ATOM 0 H ARG A 8 -19.627 1.851 -3.167 1.00 0.00 H new ATOM 0 HA ARG A 8 -18.069 -0.189 -1.754 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -19.039 -0.128 -4.632 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.460 -1.520 -3.739 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -20.425 -1.260 -2.176 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -21.024 0.023 -3.208 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -20.543 -2.867 -4.026 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -22.102 -2.111 -3.765 1.00 0.00 H new ATOM 0 HE ARG A 8 -20.960 -0.513 -5.716 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -21.558 -3.976 -5.343 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -21.715 -4.256 -7.080 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -21.184 -0.884 -7.957 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -21.505 -2.517 -8.551 1.00 0.00 H new ATOM 142 N GLY A 9 -16.019 -0.211 -3.415 1.00 0.00 N ATOM 143 CA GLY A 9 -14.740 0.039 -4.040 1.00 0.00 C ATOM 144 C GLY A 9 -14.211 -1.186 -4.758 1.00 0.00 C ATOM 145 O GLY A 9 -14.541 -2.321 -4.398 1.00 0.00 O ATOM 0 H GLY A 9 -16.146 -1.163 -3.073 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.837 0.861 -4.749 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.022 0.354 -3.283 1.00 0.00 H new ATOM 149 N ILE A 10 -13.415 -0.960 -5.790 1.00 0.00 N ATOM 150 CA ILE A 10 -12.755 -2.042 -6.505 1.00 0.00 C ATOM 151 C ILE A 10 -11.244 -1.866 -6.413 1.00 0.00 C ATOM 152 O ILE A 10 -10.704 -0.836 -6.825 1.00 0.00 O ATOM 153 CB ILE A 10 -13.174 -2.100 -7.992 1.00 0.00 C ATOM 154 CG1 ILE A 10 -14.698 -2.205 -8.119 1.00 0.00 C ATOM 155 CG2 ILE A 10 -12.505 -3.283 -8.681 1.00 0.00 C ATOM 156 CD1 ILE A 10 -15.194 -2.170 -9.551 1.00 0.00 C ATOM 0 H ILE A 10 -13.209 -0.030 -6.154 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.059 -2.978 -6.037 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.850 -1.180 -8.478 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.030 -3.132 -7.652 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -15.157 -1.386 -7.565 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.808 -3.313 -9.728 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.422 -3.175 -8.620 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.806 -4.208 -8.189 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.281 -2.249 -9.562 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.894 -1.232 -10.017 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -14.764 -3.004 -10.105 1.00 0.00 H new ATOM 168 N VAL A 11 -10.568 -2.859 -5.856 1.00 0.00 N ATOM 169 CA VAL A 11 -9.128 -2.778 -5.644 1.00 0.00 C ATOM 170 C VAL A 11 -8.344 -3.038 -6.937 1.00 0.00 C ATOM 171 O VAL A 11 -8.669 -3.944 -7.708 1.00 0.00 O ATOM 172 CB VAL A 11 -8.678 -3.745 -4.524 1.00 0.00 C ATOM 173 CG1 VAL A 11 -9.151 -5.165 -4.796 1.00 0.00 C ATOM 174 CG2 VAL A 11 -7.170 -3.702 -4.340 1.00 0.00 C ATOM 0 H VAL A 11 -10.992 -3.732 -5.542 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.905 -1.759 -5.328 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.142 -3.413 -3.595 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -8.818 -5.820 -3.991 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -10.239 -5.182 -4.851 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.734 -5.512 -5.741 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.880 -4.391 -3.547 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.682 -3.993 -5.270 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -6.865 -2.691 -4.071 1.00 0.00 H new ATOM 184 N GLN A 12 -7.326 -2.209 -7.168 1.00 0.00 N ATOM 185 CA GLN A 12 -6.482 -2.303 -8.357 1.00 0.00 C ATOM 186 C GLN A 12 -5.521 -3.484 -8.268 1.00 0.00 C ATOM 187 O GLN A 12 -5.620 -4.442 -9.035 1.00 0.00 O ATOM 188 CB GLN A 12 -5.668 -1.017 -8.535 1.00 0.00 C ATOM 189 CG GLN A 12 -6.490 0.212 -8.885 1.00 0.00 C ATOM 190 CD GLN A 12 -7.083 0.153 -10.282 1.00 0.00 C ATOM 191 OE1 GLN A 12 -8.187 0.849 -10.486 1.00 0.00 O flip ATOM 192 NE2 GLN A 12 -6.542 -0.492 -11.177 1.00 0.00 N flip ATOM 0 H GLN A 12 -7.064 -1.453 -6.535 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.142 -2.449 -9.212 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -5.119 -0.820 -7.614 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -4.928 -1.177 -9.319 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.296 0.322 -8.159 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -5.861 1.099 -8.801 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -5.690 -1.018 -10.983 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -6.945 -0.501 -12.114 1.00 0.00 H new ATOM 201 N TYR A 13 -4.590 -3.402 -7.325 1.00 0.00 N ATOM 202 CA TYR A 13 -3.540 -4.405 -7.188 1.00 0.00 C ATOM 203 C TYR A 13 -3.908 -5.434 -6.129 1.00 0.00 C ATOM 204 O TYR A 13 -5.042 -5.475 -5.654 1.00 0.00 O ATOM 205 CB TYR A 13 -2.216 -3.744 -6.789 1.00 0.00 C ATOM 206 CG TYR A 13 -1.713 -2.693 -7.755 1.00 0.00 C ATOM 207 CD1 TYR A 13 -0.939 -3.044 -8.852 1.00 0.00 C ATOM 208 CD2 TYR A 13 -1.992 -1.346 -7.554 1.00 0.00 C ATOM 209 CE1 TYR A 13 -0.461 -2.084 -9.723 1.00 0.00 C ATOM 210 CE2 TYR A 13 -1.521 -0.382 -8.424 1.00 0.00 C ATOM 211 CZ TYR A 13 -0.754 -0.756 -9.505 1.00 0.00 C ATOM 212 OH TYR A 13 -0.272 0.203 -10.369 1.00 0.00 O ATOM 0 H TYR A 13 -4.541 -2.647 -6.641 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.430 -4.900 -8.153 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.336 -3.286 -5.807 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.456 -4.518 -6.689 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -0.707 -4.084 -9.028 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.587 -1.048 -6.703 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.140 -2.374 -10.572 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -1.753 0.660 -8.257 1.00 0.00 H new ATOM 0 HH TYR A 13 -0.570 1.089 -10.074 1.00 0.00 H new ATOM 222 N ASP A 14 -2.944 -6.270 -5.776 1.00 0.00 N ATOM 223 CA ASP A 14 -3.107 -7.219 -4.685 1.00 0.00 C ATOM 224 C ASP A 14 -2.545 -6.605 -3.408 1.00 0.00 C ATOM 225 O ASP A 14 -1.780 -5.641 -3.468 1.00 0.00 O ATOM 226 CB ASP A 14 -2.377 -8.537 -4.988 1.00 0.00 C ATOM 227 CG ASP A 14 -2.768 -9.141 -6.324 1.00 0.00 C ATOM 228 OD1 ASP A 14 -3.860 -9.745 -6.420 1.00 0.00 O ATOM 229 OD2 ASP A 14 -1.981 -9.019 -7.288 1.00 0.00 O ATOM 0 H ASP A 14 -2.033 -6.310 -6.233 1.00 0.00 H new ATOM 0 HA ASP A 14 -4.168 -7.438 -4.564 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.301 -8.360 -4.977 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.591 -9.254 -4.195 1.00 0.00 H new ATOM 234 N PHE A 15 -2.925 -7.143 -2.258 1.00 0.00 N ATOM 235 CA PHE A 15 -2.392 -6.664 -0.989 1.00 0.00 C ATOM 236 C PHE A 15 -2.291 -7.801 0.020 1.00 0.00 C ATOM 237 O PHE A 15 -3.298 -8.282 0.542 1.00 0.00 O ATOM 238 CB PHE A 15 -3.248 -5.521 -0.432 1.00 0.00 C ATOM 239 CG PHE A 15 -2.790 -5.018 0.912 1.00 0.00 C ATOM 240 CD1 PHE A 15 -1.508 -4.521 1.085 1.00 0.00 C ATOM 241 CD2 PHE A 15 -3.639 -5.055 2.007 1.00 0.00 C ATOM 242 CE1 PHE A 15 -1.086 -4.067 2.320 1.00 0.00 C ATOM 243 CE2 PHE A 15 -3.221 -4.605 3.245 1.00 0.00 C ATOM 244 CZ PHE A 15 -1.942 -4.111 3.402 1.00 0.00 C ATOM 0 H PHE A 15 -3.596 -7.907 -2.176 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.389 -6.279 -1.170 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -3.239 -4.694 -1.142 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -4.281 -5.860 -0.350 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.831 -4.488 0.244 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -4.641 -5.441 1.891 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.086 -3.677 2.439 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.894 -4.640 4.089 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.612 -3.760 4.368 1.00 0.00 H new ATOM 254 N MET A 16 -1.065 -8.232 0.282 1.00 0.00 N ATOM 255 CA MET A 16 -0.814 -9.289 1.250 1.00 0.00 C ATOM 256 C MET A 16 -0.511 -8.681 2.613 1.00 0.00 C ATOM 257 O MET A 16 0.574 -8.144 2.839 1.00 0.00 O ATOM 258 CB MET A 16 0.344 -10.176 0.784 1.00 0.00 C ATOM 259 CG MET A 16 0.073 -10.862 -0.546 1.00 0.00 C ATOM 260 SD MET A 16 1.448 -11.886 -1.111 1.00 0.00 S ATOM 261 CE MET A 16 0.788 -12.487 -2.664 1.00 0.00 C ATOM 0 H MET A 16 -0.225 -7.864 -0.165 1.00 0.00 H new ATOM 0 HA MET A 16 -1.705 -9.911 1.335 1.00 0.00 H new ATOM 0 HB2 MET A 16 1.245 -9.570 0.696 1.00 0.00 H new ATOM 0 HB3 MET A 16 0.542 -10.933 1.543 1.00 0.00 H new ATOM 0 HG2 MET A 16 -0.819 -11.482 -0.453 1.00 0.00 H new ATOM 0 HG3 MET A 16 -0.142 -10.105 -1.301 1.00 0.00 H new ATOM 0 HE1 MET A 16 1.519 -13.138 -3.142 1.00 0.00 H new ATOM 0 HE2 MET A 16 -0.129 -13.046 -2.478 1.00 0.00 H new ATOM 0 HE3 MET A 16 0.571 -11.643 -3.318 1.00 0.00 H new ATOM 271 N ALA A 17 -1.480 -8.763 3.512 1.00 0.00 N ATOM 272 CA ALA A 17 -1.384 -8.120 4.819 1.00 0.00 C ATOM 273 C ALA A 17 -0.474 -8.893 5.767 1.00 0.00 C ATOM 274 O ALA A 17 -0.276 -10.099 5.609 1.00 0.00 O ATOM 275 CB ALA A 17 -2.768 -7.978 5.426 1.00 0.00 C ATOM 0 H ALA A 17 -2.350 -9.273 3.360 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.944 -7.133 4.673 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.690 -7.498 6.401 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.392 -7.370 4.771 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.217 -8.964 5.542 1.00 0.00 H new ATOM 281 N GLU A 18 0.067 -8.195 6.754 1.00 0.00 N ATOM 282 CA GLU A 18 0.928 -8.821 7.748 1.00 0.00 C ATOM 283 C GLU A 18 0.370 -8.592 9.150 1.00 0.00 C ATOM 284 O GLU A 18 0.496 -9.443 10.035 1.00 0.00 O ATOM 285 CB GLU A 18 2.354 -8.269 7.648 1.00 0.00 C ATOM 286 CG GLU A 18 3.306 -8.867 8.672 1.00 0.00 C ATOM 287 CD GLU A 18 4.726 -8.359 8.527 1.00 0.00 C ATOM 288 OE1 GLU A 18 4.998 -7.214 8.942 1.00 0.00 O ATOM 289 OE2 GLU A 18 5.581 -9.117 8.024 1.00 0.00 O ATOM 0 H GLU A 18 -0.075 -7.194 6.889 1.00 0.00 H new ATOM 0 HA GLU A 18 0.958 -9.893 7.553 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.741 -8.461 6.647 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.327 -7.187 7.777 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.944 -8.637 9.674 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.302 -9.952 8.573 1.00 0.00 H new ATOM 296 N SER A 19 -0.254 -7.445 9.344 1.00 0.00 N ATOM 297 CA SER A 19 -0.808 -7.090 10.633 1.00 0.00 C ATOM 298 C SER A 19 -2.284 -7.478 10.689 1.00 0.00 C ATOM 299 O SER A 19 -2.953 -7.548 9.659 1.00 0.00 O ATOM 300 CB SER A 19 -0.627 -5.591 10.879 1.00 0.00 C ATOM 301 OG SER A 19 -0.886 -5.252 12.229 1.00 0.00 O ATOM 0 H SER A 19 -0.389 -6.741 8.619 1.00 0.00 H new ATOM 0 HA SER A 19 -0.281 -7.634 11.417 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.390 -5.299 10.618 1.00 0.00 H new ATOM 0 HB3 SER A 19 -1.297 -5.031 10.227 1.00 0.00 H new ATOM 0 HG SER A 19 -1.408 -4.424 12.264 1.00 0.00 H new ATOM 307 N GLN A 20 -2.785 -7.722 11.895 1.00 0.00 N ATOM 308 CA GLN A 20 -4.154 -8.193 12.083 1.00 0.00 C ATOM 309 C GLN A 20 -5.167 -7.093 11.787 1.00 0.00 C ATOM 310 O GLN A 20 -6.353 -7.362 11.592 1.00 0.00 O ATOM 311 CB GLN A 20 -4.338 -8.707 13.513 1.00 0.00 C ATOM 312 CG GLN A 20 -3.445 -9.891 13.849 1.00 0.00 C ATOM 313 CD GLN A 20 -3.501 -10.270 15.314 1.00 0.00 C ATOM 314 OE1 GLN A 20 -4.518 -10.086 15.980 1.00 0.00 O ATOM 315 NE2 GLN A 20 -2.400 -10.789 15.825 1.00 0.00 N ATOM 0 H GLN A 20 -2.261 -7.601 12.762 1.00 0.00 H new ATOM 0 HA GLN A 20 -4.330 -9.007 11.380 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.132 -7.896 14.212 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -5.380 -8.995 13.657 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -3.743 -10.748 13.245 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -2.416 -9.653 13.579 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -1.579 -10.924 15.235 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -2.371 -11.055 16.809 1.00 0.00 H new ATOM 324 N ASP A 21 -4.697 -5.853 11.751 1.00 0.00 N ATOM 325 CA ASP A 21 -5.564 -4.722 11.443 1.00 0.00 C ATOM 326 C ASP A 21 -5.697 -4.535 9.933 1.00 0.00 C ATOM 327 O ASP A 21 -6.598 -3.843 9.465 1.00 0.00 O ATOM 328 CB ASP A 21 -5.041 -3.433 12.095 1.00 0.00 C ATOM 329 CG ASP A 21 -3.617 -3.096 11.694 1.00 0.00 C ATOM 330 OD1 ASP A 21 -3.415 -2.516 10.613 1.00 0.00 O ATOM 331 OD2 ASP A 21 -2.687 -3.415 12.468 1.00 0.00 O ATOM 0 H ASP A 21 -3.724 -5.605 11.930 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.550 -4.938 11.854 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.694 -2.604 11.822 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.092 -3.535 13.179 1.00 0.00 H new ATOM 336 N GLU A 22 -4.820 -5.180 9.176 1.00 0.00 N ATOM 337 CA GLU A 22 -4.828 -5.059 7.724 1.00 0.00 C ATOM 338 C GLU A 22 -5.709 -6.142 7.107 1.00 0.00 C ATOM 339 O GLU A 22 -6.014 -7.147 7.749 1.00 0.00 O ATOM 340 CB GLU A 22 -3.406 -5.179 7.180 1.00 0.00 C ATOM 341 CG GLU A 22 -2.437 -4.172 7.768 1.00 0.00 C ATOM 342 CD GLU A 22 -1.007 -4.414 7.324 1.00 0.00 C ATOM 343 OE1 GLU A 22 -0.496 -5.540 7.529 1.00 0.00 O ATOM 344 OE2 GLU A 22 -0.381 -3.481 6.781 1.00 0.00 O ATOM 0 H GLU A 22 -4.093 -5.793 9.544 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.231 -4.082 7.459 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.035 -6.184 7.379 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.430 -5.056 6.097 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.740 -3.167 7.474 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.489 -4.216 8.856 1.00 0.00 H new ATOM 351 N LEU A 23 -6.110 -5.935 5.859 1.00 0.00 N ATOM 352 CA LEU A 23 -6.967 -6.887 5.162 1.00 0.00 C ATOM 353 C LEU A 23 -6.261 -7.456 3.933 1.00 0.00 C ATOM 354 O LEU A 23 -5.930 -6.725 3.003 1.00 0.00 O ATOM 355 CB LEU A 23 -8.277 -6.209 4.751 1.00 0.00 C ATOM 356 CG LEU A 23 -9.283 -7.109 4.031 1.00 0.00 C ATOM 357 CD1 LEU A 23 -9.691 -8.278 4.916 1.00 0.00 C ATOM 358 CD2 LEU A 23 -10.504 -6.305 3.613 1.00 0.00 C ATOM 0 H LEU A 23 -5.855 -5.115 5.308 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.189 -7.711 5.840 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.752 -5.803 5.644 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.042 -5.364 4.103 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.807 -7.511 3.136 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.407 -8.905 4.384 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.810 -8.868 5.169 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.149 -7.900 5.830 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.212 -6.958 3.102 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.978 -5.877 4.496 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.199 -5.503 2.941 1.00 0.00 H new ATOM 370 N THR A 24 -6.027 -8.763 3.938 1.00 0.00 N ATOM 371 CA THR A 24 -5.396 -9.432 2.807 1.00 0.00 C ATOM 372 C THR A 24 -6.391 -9.580 1.658 1.00 0.00 C ATOM 373 O THR A 24 -7.418 -10.244 1.800 1.00 0.00 O ATOM 374 CB THR A 24 -4.867 -10.820 3.213 1.00 0.00 C ATOM 375 OG1 THR A 24 -4.076 -10.706 4.404 1.00 0.00 O ATOM 376 CG2 THR A 24 -4.023 -11.431 2.104 1.00 0.00 C ATOM 0 H THR A 24 -6.265 -9.381 4.714 1.00 0.00 H new ATOM 0 HA THR A 24 -4.555 -8.820 2.481 1.00 0.00 H new ATOM 0 HB THR A 24 -5.723 -11.470 3.395 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.742 -11.591 4.661 1.00 0.00 H new ATOM 0 HG21 THR A 24 -3.663 -12.411 2.418 1.00 0.00 H new ATOM 0 HG22 THR A 24 -4.628 -11.539 1.204 1.00 0.00 H new ATOM 0 HG23 THR A 24 -3.173 -10.782 1.894 1.00 0.00 H new ATOM 384 N ILE A 25 -6.085 -8.956 0.527 1.00 0.00 N ATOM 385 CA ILE A 25 -6.998 -8.934 -0.612 1.00 0.00 C ATOM 386 C ILE A 25 -6.272 -9.259 -1.915 1.00 0.00 C ATOM 387 O ILE A 25 -5.043 -9.170 -1.989 1.00 0.00 O ATOM 388 CB ILE A 25 -7.679 -7.553 -0.755 1.00 0.00 C ATOM 389 CG1 ILE A 25 -6.627 -6.457 -0.934 1.00 0.00 C ATOM 390 CG2 ILE A 25 -8.542 -7.256 0.460 1.00 0.00 C ATOM 391 CD1 ILE A 25 -7.208 -5.070 -1.116 1.00 0.00 C ATOM 0 H ILE A 25 -5.209 -8.457 0.373 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.754 -9.696 -0.422 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.317 -7.575 -1.638 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.969 -6.453 -0.065 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.010 -6.698 -1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -9.013 -6.280 0.342 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.312 -8.022 0.555 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.921 -7.253 1.356 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.399 -4.350 -1.236 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.842 -5.055 -2.002 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.801 -4.806 -0.240 1.00 0.00 H new ATOM 403 N LYS A 26 -7.033 -9.641 -2.935 1.00 0.00 N ATOM 404 CA LYS A 26 -6.480 -9.868 -4.261 1.00 0.00 C ATOM 405 C LYS A 26 -7.026 -8.841 -5.238 1.00 0.00 C ATOM 406 O LYS A 26 -8.077 -8.238 -5.000 1.00 0.00 O ATOM 407 CB LYS A 26 -6.800 -11.273 -4.779 1.00 0.00 C ATOM 408 CG LYS A 26 -6.087 -12.392 -4.041 1.00 0.00 C ATOM 409 CD LYS A 26 -6.223 -13.710 -4.789 1.00 0.00 C ATOM 410 CE LYS A 26 -5.607 -14.868 -4.019 1.00 0.00 C ATOM 411 NZ LYS A 26 -6.324 -15.128 -2.744 1.00 0.00 N ATOM 0 H LYS A 26 -8.038 -9.800 -2.866 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.397 -9.771 -4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.875 -11.436 -4.710 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.537 -11.326 -5.835 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.032 -12.142 -3.925 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.502 -12.494 -3.038 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.278 -13.916 -4.972 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.741 -13.625 -5.763 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.627 -15.766 -4.636 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.560 -14.649 -3.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.037 -16.054 -2.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.088 -14.385 -2.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -7.350 -15.128 -2.916 1.00 0.00 H new ATOM 425 N SER A 27 -6.314 -8.650 -6.332 1.00 0.00 N ATOM 426 CA SER A 27 -6.737 -7.730 -7.370 1.00 0.00 C ATOM 427 C SER A 27 -8.005 -8.231 -8.057 1.00 0.00 C ATOM 428 O SER A 27 -8.020 -9.308 -8.664 1.00 0.00 O ATOM 429 CB SER A 27 -5.608 -7.535 -8.383 1.00 0.00 C ATOM 430 OG SER A 27 -5.029 -8.777 -8.765 1.00 0.00 O ATOM 0 H SER A 27 -5.432 -9.125 -6.526 1.00 0.00 H new ATOM 0 HA SER A 27 -6.967 -6.768 -6.913 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.994 -7.026 -9.266 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.840 -6.891 -7.954 1.00 0.00 H new ATOM 0 HG SER A 27 -4.472 -9.117 -8.034 1.00 0.00 H new ATOM 436 N GLY A 28 -9.073 -7.454 -7.949 1.00 0.00 N ATOM 437 CA GLY A 28 -10.331 -7.836 -8.555 1.00 0.00 C ATOM 438 C GLY A 28 -11.376 -8.214 -7.529 1.00 0.00 C ATOM 439 O GLY A 28 -12.499 -8.576 -7.882 1.00 0.00 O ATOM 0 H GLY A 28 -9.090 -6.564 -7.451 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -10.704 -7.011 -9.162 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.166 -8.677 -9.228 1.00 0.00 H new ATOM 443 N ASP A 29 -11.010 -8.150 -6.256 1.00 0.00 N ATOM 444 CA ASP A 29 -11.957 -8.418 -5.180 1.00 0.00 C ATOM 445 C ASP A 29 -12.851 -7.207 -4.947 1.00 0.00 C ATOM 446 O ASP A 29 -12.399 -6.063 -5.030 1.00 0.00 O ATOM 447 CB ASP A 29 -11.233 -8.790 -3.879 1.00 0.00 C ATOM 448 CG ASP A 29 -11.387 -10.256 -3.513 1.00 0.00 C ATOM 449 OD1 ASP A 29 -12.528 -10.693 -3.234 1.00 0.00 O ATOM 450 OD2 ASP A 29 -10.365 -10.979 -3.481 1.00 0.00 O ATOM 0 H ASP A 29 -10.068 -7.916 -5.943 1.00 0.00 H new ATOM 0 HA ASP A 29 -12.572 -9.266 -5.483 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.173 -8.556 -3.980 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -11.620 -8.176 -3.066 1.00 0.00 H new ATOM 455 N LYS A 30 -14.125 -7.462 -4.681 1.00 0.00 N ATOM 456 CA LYS A 30 -15.069 -6.392 -4.384 1.00 0.00 C ATOM 457 C LYS A 30 -15.013 -6.045 -2.902 1.00 0.00 C ATOM 458 O LYS A 30 -15.042 -6.938 -2.052 1.00 0.00 O ATOM 459 CB LYS A 30 -16.499 -6.803 -4.745 1.00 0.00 C ATOM 460 CG LYS A 30 -16.715 -7.149 -6.208 1.00 0.00 C ATOM 461 CD LYS A 30 -16.410 -5.975 -7.123 1.00 0.00 C ATOM 462 CE LYS A 30 -16.968 -6.216 -8.516 1.00 0.00 C ATOM 463 NZ LYS A 30 -16.425 -7.454 -9.138 1.00 0.00 N ATOM 0 H LYS A 30 -14.529 -8.399 -4.665 1.00 0.00 H new ATOM 0 HA LYS A 30 -14.790 -5.524 -4.981 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -16.778 -7.664 -4.138 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -17.174 -5.991 -4.475 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -16.081 -7.993 -6.478 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -17.747 -7.466 -6.357 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -16.839 -5.063 -6.707 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -15.332 -5.823 -7.180 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -18.054 -6.286 -8.462 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.735 -5.361 -9.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.769 -7.530 -10.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -15.386 -7.415 -9.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -16.741 -8.283 -8.595 1.00 0.00 H new ATOM 477 N VAL A 31 -14.942 -4.760 -2.589 1.00 0.00 N ATOM 478 CA VAL A 31 -14.912 -4.322 -1.200 1.00 0.00 C ATOM 479 C VAL A 31 -15.885 -3.172 -0.954 1.00 0.00 C ATOM 480 O VAL A 31 -16.194 -2.400 -1.858 1.00 0.00 O ATOM 481 CB VAL A 31 -13.490 -3.890 -0.758 1.00 0.00 C ATOM 482 CG1 VAL A 31 -12.581 -5.097 -0.599 1.00 0.00 C ATOM 483 CG2 VAL A 31 -12.883 -2.905 -1.747 1.00 0.00 C ATOM 0 H VAL A 31 -14.904 -4.005 -3.274 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.217 -5.182 -0.604 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.583 -3.394 0.208 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.590 -4.767 -0.288 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -12.994 -5.766 0.156 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.507 -5.624 -1.550 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.886 -2.620 -1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.815 -3.371 -2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.513 -2.017 -1.809 1.00 0.00 H new ATOM 493 N TYR A 32 -16.401 -3.102 0.264 1.00 0.00 N ATOM 494 CA TYR A 32 -17.150 -1.939 0.719 1.00 0.00 C ATOM 495 C TYR A 32 -16.219 -1.033 1.510 1.00 0.00 C ATOM 496 O TYR A 32 -15.440 -1.517 2.327 1.00 0.00 O ATOM 497 CB TYR A 32 -18.337 -2.348 1.602 1.00 0.00 C ATOM 498 CG TYR A 32 -19.567 -2.791 0.841 1.00 0.00 C ATOM 499 CD1 TYR A 32 -20.543 -1.874 0.470 1.00 0.00 C ATOM 500 CD2 TYR A 32 -19.764 -4.125 0.508 1.00 0.00 C ATOM 501 CE1 TYR A 32 -21.677 -2.271 -0.213 1.00 0.00 C ATOM 502 CE2 TYR A 32 -20.895 -4.531 -0.177 1.00 0.00 C ATOM 503 CZ TYR A 32 -21.848 -3.602 -0.534 1.00 0.00 C ATOM 504 OH TYR A 32 -22.974 -4.002 -1.219 1.00 0.00 O ATOM 0 H TYR A 32 -16.314 -3.843 0.960 1.00 0.00 H new ATOM 0 HA TYR A 32 -17.543 -1.416 -0.153 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -18.021 -3.158 2.259 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -18.605 -1.506 2.240 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -20.413 -0.831 0.720 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -19.022 -4.858 0.789 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -22.425 -1.544 -0.494 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -21.031 -5.572 -0.431 1.00 0.00 H new ATOM 0 HH TYR A 32 -22.940 -4.970 -1.367 1.00 0.00 H new ATOM 514 N ILE A 33 -16.287 0.263 1.266 1.00 0.00 N ATOM 515 CA ILE A 33 -15.403 1.198 1.944 1.00 0.00 C ATOM 516 C ILE A 33 -16.087 1.780 3.177 1.00 0.00 C ATOM 517 O ILE A 33 -17.005 2.591 3.067 1.00 0.00 O ATOM 518 CB ILE A 33 -14.958 2.344 1.012 1.00 0.00 C ATOM 519 CG1 ILE A 33 -14.454 1.784 -0.324 1.00 0.00 C ATOM 520 CG2 ILE A 33 -13.866 3.159 1.686 1.00 0.00 C ATOM 521 CD1 ILE A 33 -14.037 2.852 -1.313 1.00 0.00 C ATOM 0 H ILE A 33 -16.939 0.691 0.609 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.516 0.642 2.247 1.00 0.00 H new ATOM 0 HB ILE A 33 -15.814 2.989 0.813 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -13.606 1.125 -0.135 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.239 1.174 -0.771 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -13.554 3.967 1.024 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -14.247 3.579 2.617 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -13.012 2.516 1.900 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -13.692 2.381 -2.233 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.888 3.497 -1.532 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -13.230 3.448 -0.886 1.00 0.00 H new ATOM 533 N LEU A 34 -15.632 1.353 4.347 1.00 0.00 N ATOM 534 CA LEU A 34 -16.212 1.780 5.613 1.00 0.00 C ATOM 535 C LEU A 34 -15.757 3.194 5.949 1.00 0.00 C ATOM 536 O LEU A 34 -16.496 4.156 5.755 1.00 0.00 O ATOM 537 CB LEU A 34 -15.819 0.822 6.749 1.00 0.00 C ATOM 538 CG LEU A 34 -16.354 -0.615 6.651 1.00 0.00 C ATOM 539 CD1 LEU A 34 -17.866 -0.628 6.489 1.00 0.00 C ATOM 540 CD2 LEU A 34 -15.694 -1.377 5.520 1.00 0.00 C ATOM 0 H LEU A 34 -14.852 0.703 4.445 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.297 1.766 5.510 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -14.731 0.778 6.797 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -16.163 1.250 7.691 1.00 0.00 H new ATOM 0 HG LEU A 34 -16.105 -1.117 7.586 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -18.216 -1.658 6.422 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -18.328 -0.143 7.349 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.139 -0.092 5.580 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -16.096 -2.389 5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.892 -0.870 4.576 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -14.618 -1.420 5.690 1.00 0.00 H new ATOM 552 N ASP A 35 -14.533 3.323 6.442 1.00 0.00 N ATOM 553 CA ASP A 35 -13.989 4.636 6.741 1.00 0.00 C ATOM 554 C ASP A 35 -13.192 5.143 5.558 1.00 0.00 C ATOM 555 O ASP A 35 -12.107 4.628 5.257 1.00 0.00 O ATOM 556 CB ASP A 35 -13.110 4.623 7.996 1.00 0.00 C ATOM 557 CG ASP A 35 -12.782 6.026 8.483 1.00 0.00 C ATOM 558 OD1 ASP A 35 -13.650 6.642 9.141 1.00 0.00 O ATOM 559 OD2 ASP A 35 -11.659 6.514 8.221 1.00 0.00 O ATOM 0 H ASP A 35 -13.906 2.543 6.641 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.828 5.304 6.936 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -13.620 4.075 8.789 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.184 4.088 7.783 1.00 0.00 H new ATOM 564 N ASP A 36 -13.782 6.112 4.871 1.00 0.00 N ATOM 565 CA ASP A 36 -13.147 6.800 3.755 1.00 0.00 C ATOM 566 C ASP A 36 -13.142 8.290 4.046 1.00 0.00 C ATOM 567 O ASP A 36 -12.730 9.110 3.221 1.00 0.00 O ATOM 568 CB ASP A 36 -13.911 6.529 2.451 1.00 0.00 C ATOM 569 CG ASP A 36 -15.321 7.098 2.459 1.00 0.00 C ATOM 570 OD1 ASP A 36 -16.218 6.487 3.084 1.00 0.00 O ATOM 571 OD2 ASP A 36 -15.546 8.156 1.831 1.00 0.00 O ATOM 0 H ASP A 36 -14.724 6.446 5.075 1.00 0.00 H new ATOM 0 HA ASP A 36 -12.127 6.435 3.636 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.357 6.958 1.616 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.960 5.453 2.282 1.00 0.00 H new ATOM 576 N LYS A 37 -13.600 8.623 5.247 1.00 0.00 N ATOM 577 CA LYS A 37 -13.815 10.004 5.641 1.00 0.00 C ATOM 578 C LYS A 37 -12.603 10.556 6.377 1.00 0.00 C ATOM 579 O LYS A 37 -11.960 11.499 5.914 1.00 0.00 O ATOM 580 CB LYS A 37 -15.047 10.102 6.547 1.00 0.00 C ATOM 581 CG LYS A 37 -16.288 9.443 5.969 1.00 0.00 C ATOM 582 CD LYS A 37 -16.766 10.148 4.714 1.00 0.00 C ATOM 583 CE LYS A 37 -17.949 9.425 4.091 1.00 0.00 C ATOM 584 NZ LYS A 37 -18.511 10.176 2.944 1.00 0.00 N ATOM 0 H LYS A 37 -13.831 7.943 5.971 1.00 0.00 H new ATOM 0 HA LYS A 37 -13.973 10.593 4.738 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.817 9.642 7.508 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.262 11.153 6.740 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.072 8.399 5.740 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.083 9.448 6.714 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.049 11.173 4.955 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -15.951 10.204 3.993 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -17.636 8.435 3.759 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -18.723 9.279 4.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -19.316 9.651 2.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.833 11.111 3.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -17.779 10.294 2.214 1.00 0.00 H new ATOM 598 N LYS A 38 -12.300 9.957 7.521 1.00 0.00 N ATOM 599 CA LYS A 38 -11.247 10.462 8.390 1.00 0.00 C ATOM 600 C LYS A 38 -9.884 10.062 7.856 1.00 0.00 C ATOM 601 O LYS A 38 -8.979 10.891 7.725 1.00 0.00 O ATOM 602 CB LYS A 38 -11.409 9.914 9.810 1.00 0.00 C ATOM 603 CG LYS A 38 -12.852 9.659 10.211 1.00 0.00 C ATOM 604 CD LYS A 38 -12.969 9.389 11.699 1.00 0.00 C ATOM 605 CE LYS A 38 -14.354 8.890 12.064 1.00 0.00 C ATOM 606 NZ LYS A 38 -14.617 7.537 11.505 1.00 0.00 N ATOM 0 H LYS A 38 -12.769 9.121 7.868 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.324 11.549 8.414 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.849 8.983 9.896 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -10.966 10.619 10.514 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -13.463 10.522 9.946 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -13.242 8.808 9.653 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.225 8.650 11.996 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.751 10.302 12.254 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -14.456 8.862 13.149 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -15.103 9.589 11.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -15.567 7.515 11.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -13.908 7.319 10.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -14.561 6.830 12.266 1.00 0.00 H new ATOM 620 N SER A 39 -9.747 8.786 7.539 1.00 0.00 N ATOM 621 CA SER A 39 -8.493 8.253 7.068 1.00 0.00 C ATOM 622 C SER A 39 -8.312 8.566 5.585 1.00 0.00 C ATOM 623 O SER A 39 -9.228 8.381 4.784 1.00 0.00 O ATOM 624 CB SER A 39 -8.467 6.746 7.316 1.00 0.00 C ATOM 625 OG SER A 39 -8.992 6.436 8.597 1.00 0.00 O ATOM 0 H SER A 39 -10.499 8.100 7.602 1.00 0.00 H new ATOM 0 HA SER A 39 -7.668 8.716 7.610 1.00 0.00 H new ATOM 0 HB2 SER A 39 -9.048 6.237 6.547 1.00 0.00 H new ATOM 0 HB3 SER A 39 -7.444 6.378 7.239 1.00 0.00 H new ATOM 0 HG SER A 39 -9.928 6.161 8.509 1.00 0.00 H new ATOM 631 N LYS A 40 -7.147 9.082 5.231 1.00 0.00 N ATOM 632 CA LYS A 40 -6.850 9.411 3.842 1.00 0.00 C ATOM 633 C LYS A 40 -5.712 8.536 3.326 1.00 0.00 C ATOM 634 O LYS A 40 -5.594 8.283 2.125 1.00 0.00 O ATOM 635 CB LYS A 40 -6.497 10.899 3.738 1.00 0.00 C ATOM 636 CG LYS A 40 -6.252 11.411 2.324 1.00 0.00 C ATOM 637 CD LYS A 40 -4.767 11.528 2.012 1.00 0.00 C ATOM 638 CE LYS A 40 -4.533 12.322 0.739 1.00 0.00 C ATOM 639 NZ LYS A 40 -3.088 12.516 0.457 1.00 0.00 N ATOM 0 H LYS A 40 -6.390 9.283 5.884 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.726 9.217 3.223 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.305 11.480 4.182 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -5.604 11.087 4.335 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -6.721 10.737 1.607 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -6.726 12.385 2.203 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -4.255 12.011 2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -4.335 10.533 1.907 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.999 11.806 -0.100 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -5.019 13.294 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -2.976 13.063 -0.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -2.647 13.032 1.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -2.628 11.590 0.349 1.00 0.00 H new ATOM 653 N ASP A 41 -4.886 8.075 4.254 1.00 0.00 N ATOM 654 CA ASP A 41 -3.749 7.220 3.936 1.00 0.00 C ATOM 655 C ASP A 41 -4.217 5.788 3.717 1.00 0.00 C ATOM 656 O ASP A 41 -3.859 5.132 2.735 1.00 0.00 O ATOM 657 CB ASP A 41 -2.740 7.258 5.087 1.00 0.00 C ATOM 658 CG ASP A 41 -2.443 8.668 5.554 1.00 0.00 C ATOM 659 OD1 ASP A 41 -3.273 9.236 6.301 1.00 0.00 O ATOM 660 OD2 ASP A 41 -1.390 9.218 5.174 1.00 0.00 O ATOM 0 H ASP A 41 -4.984 8.282 5.248 1.00 0.00 H new ATOM 0 HA ASP A 41 -3.276 7.584 3.024 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -3.126 6.676 5.924 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -1.813 6.782 4.769 1.00 0.00 H new ATOM 665 N TRP A 42 -5.036 5.322 4.639 1.00 0.00 N ATOM 666 CA TRP A 42 -5.561 3.971 4.604 1.00 0.00 C ATOM 667 C TRP A 42 -7.070 4.044 4.668 1.00 0.00 C ATOM 668 O TRP A 42 -7.609 4.989 5.226 1.00 0.00 O ATOM 669 CB TRP A 42 -5.047 3.150 5.792 1.00 0.00 C ATOM 670 CG TRP A 42 -3.597 2.765 5.724 1.00 0.00 C ATOM 671 CD1 TRP A 42 -2.513 3.598 5.702 1.00 0.00 C ATOM 672 CD2 TRP A 42 -3.073 1.433 5.703 1.00 0.00 C ATOM 673 NE1 TRP A 42 -1.356 2.865 5.668 1.00 0.00 N ATOM 674 CE2 TRP A 42 -1.671 1.535 5.665 1.00 0.00 C ATOM 675 CE3 TRP A 42 -3.655 0.165 5.710 1.00 0.00 C ATOM 676 CZ2 TRP A 42 -0.844 0.417 5.637 1.00 0.00 C ATOM 677 CZ3 TRP A 42 -2.832 -0.944 5.681 1.00 0.00 C ATOM 678 CH2 TRP A 42 -1.440 -0.812 5.645 1.00 0.00 C ATOM 0 H TRP A 42 -5.357 5.871 5.436 1.00 0.00 H new ATOM 0 HA TRP A 42 -5.233 3.486 3.685 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -5.212 3.720 6.706 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -5.644 2.242 5.871 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -2.562 4.677 5.710 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -0.412 3.250 5.648 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.729 0.053 5.738 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 0.231 0.517 5.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -3.271 -1.931 5.686 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -0.824 -1.699 5.623 1.00 0.00 H new ATOM 689 N TRP A 43 -7.748 3.071 4.099 1.00 0.00 N ATOM 690 CA TRP A 43 -9.195 3.029 4.174 1.00 0.00 C ATOM 691 C TRP A 43 -9.651 1.723 4.787 1.00 0.00 C ATOM 692 O TRP A 43 -8.977 0.696 4.660 1.00 0.00 O ATOM 693 CB TRP A 43 -9.829 3.223 2.793 1.00 0.00 C ATOM 694 CG TRP A 43 -9.831 4.651 2.348 1.00 0.00 C ATOM 695 CD1 TRP A 43 -9.646 5.743 3.141 1.00 0.00 C ATOM 696 CD2 TRP A 43 -10.052 5.150 1.024 1.00 0.00 C ATOM 697 NE1 TRP A 43 -9.720 6.888 2.397 1.00 0.00 N ATOM 698 CE2 TRP A 43 -9.973 6.555 1.093 1.00 0.00 C ATOM 699 CE3 TRP A 43 -10.301 4.550 -0.215 1.00 0.00 C ATOM 700 CZ2 TRP A 43 -10.139 7.367 -0.025 1.00 0.00 C ATOM 701 CZ3 TRP A 43 -10.468 5.359 -1.324 1.00 0.00 C ATOM 702 CH2 TRP A 43 -10.383 6.754 -1.222 1.00 0.00 C ATOM 0 H TRP A 43 -7.324 2.301 3.581 1.00 0.00 H new ATOM 0 HA TRP A 43 -9.524 3.851 4.810 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.288 2.621 2.063 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.854 2.853 2.814 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -9.466 5.709 4.205 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.605 7.836 2.755 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.362 3.475 -0.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -10.077 8.443 0.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.667 4.908 -2.285 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -10.513 7.358 -2.108 1.00 0.00 H new ATOM 713 N MET A 44 -10.776 1.760 5.477 1.00 0.00 N ATOM 714 CA MET A 44 -11.343 0.540 6.028 1.00 0.00 C ATOM 715 C MET A 44 -12.238 -0.092 4.985 1.00 0.00 C ATOM 716 O MET A 44 -13.083 0.586 4.409 1.00 0.00 O ATOM 717 CB MET A 44 -12.147 0.813 7.301 1.00 0.00 C ATOM 718 CG MET A 44 -11.361 1.531 8.386 1.00 0.00 C ATOM 719 SD MET A 44 -12.267 1.648 9.941 1.00 0.00 S ATOM 720 CE MET A 44 -12.345 -0.080 10.407 1.00 0.00 C ATOM 0 H MET A 44 -11.310 2.608 5.668 1.00 0.00 H new ATOM 0 HA MET A 44 -10.527 -0.133 6.293 1.00 0.00 H new ATOM 0 HB2 MET A 44 -13.022 1.410 7.045 1.00 0.00 H new ATOM 0 HB3 MET A 44 -12.513 -0.134 7.698 1.00 0.00 H new ATOM 0 HG2 MET A 44 -10.422 1.005 8.556 1.00 0.00 H new ATOM 0 HG3 MET A 44 -11.107 2.534 8.042 1.00 0.00 H new ATOM 0 HE1 MET A 44 -12.508 -0.160 11.482 1.00 0.00 H new ATOM 0 HE2 MET A 44 -13.167 -0.563 9.879 1.00 0.00 H new ATOM 0 HE3 MET A 44 -11.408 -0.570 10.144 1.00 0.00 H new ATOM 730 N CYS A 45 -12.052 -1.367 4.715 1.00 0.00 N ATOM 731 CA CYS A 45 -12.864 -2.031 3.714 1.00 0.00 C ATOM 732 C CYS A 45 -13.282 -3.421 4.161 1.00 0.00 C ATOM 733 O CYS A 45 -12.688 -4.003 5.070 1.00 0.00 O ATOM 734 CB CYS A 45 -12.122 -2.099 2.376 1.00 0.00 C ATOM 735 SG CYS A 45 -11.802 -0.482 1.630 1.00 0.00 S ATOM 0 H CYS A 45 -11.355 -1.959 5.167 1.00 0.00 H new ATOM 0 HA CYS A 45 -13.770 -1.440 3.583 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -11.173 -2.614 2.524 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -12.705 -2.701 1.679 1.00 0.00 H new ATOM 0 HG CYS A 45 -12.245 0.454 2.416 1.00 0.00 H new ATOM 741 N GLN A 46 -14.339 -3.917 3.538 1.00 0.00 N ATOM 742 CA GLN A 46 -14.852 -5.245 3.816 1.00 0.00 C ATOM 743 C GLN A 46 -15.112 -5.982 2.510 1.00 0.00 C ATOM 744 O GLN A 46 -15.827 -5.478 1.642 1.00 0.00 O ATOM 745 CB GLN A 46 -16.140 -5.159 4.638 1.00 0.00 C ATOM 746 CG GLN A 46 -16.662 -6.509 5.100 1.00 0.00 C ATOM 747 CD GLN A 46 -18.014 -6.408 5.774 1.00 0.00 C ATOM 748 OE1 GLN A 46 -18.106 -6.194 6.981 1.00 0.00 O ATOM 749 NE2 GLN A 46 -19.072 -6.569 4.999 1.00 0.00 N ATOM 0 H GLN A 46 -14.864 -3.409 2.826 1.00 0.00 H new ATOM 0 HA GLN A 46 -14.109 -5.795 4.394 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -15.962 -4.530 5.511 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -16.909 -4.667 4.042 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -16.736 -7.179 4.243 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -15.947 -6.954 5.792 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -18.952 -6.745 4.002 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -20.009 -6.517 5.398 1.00 0.00 H new ATOM 758 N LEU A 47 -14.519 -7.160 2.377 1.00 0.00 N ATOM 759 CA LEU A 47 -14.691 -7.990 1.193 1.00 0.00 C ATOM 760 C LEU A 47 -16.155 -8.375 1.019 1.00 0.00 C ATOM 761 O LEU A 47 -16.778 -8.897 1.942 1.00 0.00 O ATOM 762 CB LEU A 47 -13.826 -9.252 1.305 1.00 0.00 C ATOM 763 CG LEU A 47 -12.316 -9.014 1.294 1.00 0.00 C ATOM 764 CD1 LEU A 47 -11.563 -10.301 1.582 1.00 0.00 C ATOM 765 CD2 LEU A 47 -11.879 -8.442 -0.043 1.00 0.00 C ATOM 0 H LEU A 47 -13.907 -7.566 3.084 1.00 0.00 H new ATOM 0 HA LEU A 47 -14.376 -7.419 0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -14.088 -9.771 2.227 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -14.078 -9.919 0.481 1.00 0.00 H new ATOM 0 HG LEU A 47 -12.082 -8.295 2.079 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -10.491 -10.106 1.569 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -11.851 -10.679 2.563 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -11.806 -11.043 0.821 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -10.801 -8.278 -0.034 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.133 -9.142 -0.839 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -12.388 -7.494 -0.217 1.00 0.00 H new ATOM 777 N VAL A 48 -16.698 -8.106 -0.161 1.00 0.00 N ATOM 778 CA VAL A 48 -18.097 -8.410 -0.460 1.00 0.00 C ATOM 779 C VAL A 48 -18.327 -9.918 -0.500 1.00 0.00 C ATOM 780 O VAL A 48 -19.383 -10.412 -0.101 1.00 0.00 O ATOM 781 CB VAL A 48 -18.526 -7.791 -1.811 1.00 0.00 C ATOM 782 CG1 VAL A 48 -19.975 -8.128 -2.144 1.00 0.00 C ATOM 783 CG2 VAL A 48 -18.324 -6.285 -1.792 1.00 0.00 C ATOM 0 H VAL A 48 -16.190 -7.675 -0.933 1.00 0.00 H new ATOM 0 HA VAL A 48 -18.702 -7.975 0.336 1.00 0.00 H new ATOM 0 HB VAL A 48 -17.896 -8.222 -2.589 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.243 -7.677 -3.100 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -20.092 -9.210 -2.208 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -20.628 -7.738 -1.363 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -18.631 -5.865 -2.750 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -18.925 -5.847 -0.995 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -17.272 -6.061 -1.618 1.00 0.00 H new ATOM 793 N ASP A 49 -17.323 -10.643 -0.970 1.00 0.00 N ATOM 794 CA ASP A 49 -17.427 -12.090 -1.125 1.00 0.00 C ATOM 795 C ASP A 49 -17.391 -12.806 0.224 1.00 0.00 C ATOM 796 O ASP A 49 -18.360 -13.455 0.623 1.00 0.00 O ATOM 797 CB ASP A 49 -16.296 -12.610 -2.016 1.00 0.00 C ATOM 798 CG ASP A 49 -16.340 -14.116 -2.198 1.00 0.00 C ATOM 799 OD1 ASP A 49 -15.760 -14.838 -1.360 1.00 0.00 O ATOM 800 OD2 ASP A 49 -16.951 -14.583 -3.180 1.00 0.00 O ATOM 0 H ASP A 49 -16.424 -10.253 -1.252 1.00 0.00 H new ATOM 0 HA ASP A 49 -18.388 -12.301 -1.594 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -16.357 -12.128 -2.992 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -15.337 -12.328 -1.581 1.00 0.00 H new ATOM 805 N SER A 50 -16.274 -12.686 0.923 1.00 0.00 N ATOM 806 CA SER A 50 -16.055 -13.440 2.150 1.00 0.00 C ATOM 807 C SER A 50 -16.627 -12.729 3.377 1.00 0.00 C ATOM 808 O SER A 50 -17.056 -13.376 4.331 1.00 0.00 O ATOM 809 CB SER A 50 -14.561 -13.691 2.324 1.00 0.00 C ATOM 810 OG SER A 50 -13.828 -12.495 2.123 1.00 0.00 O ATOM 0 H SER A 50 -15.502 -12.072 0.662 1.00 0.00 H new ATOM 0 HA SER A 50 -16.583 -14.389 2.064 1.00 0.00 H new ATOM 0 HB2 SER A 50 -14.366 -14.080 3.323 1.00 0.00 H new ATOM 0 HB3 SER A 50 -14.229 -14.451 1.616 1.00 0.00 H new ATOM 0 HG SER A 50 -12.872 -12.674 2.240 1.00 0.00 H new ATOM 816 N GLY A 51 -16.637 -11.404 3.350 1.00 0.00 N ATOM 817 CA GLY A 51 -17.129 -10.651 4.488 1.00 0.00 C ATOM 818 C GLY A 51 -16.024 -10.279 5.457 1.00 0.00 C ATOM 819 O GLY A 51 -16.290 -9.900 6.598 1.00 0.00 O ATOM 0 H GLY A 51 -16.315 -10.838 2.565 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -17.620 -9.744 4.135 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.884 -11.239 5.010 1.00 0.00 H new ATOM 823 N LYS A 52 -14.783 -10.390 5.006 1.00 0.00 N ATOM 824 CA LYS A 52 -13.632 -10.037 5.827 1.00 0.00 C ATOM 825 C LYS A 52 -13.374 -8.537 5.755 1.00 0.00 C ATOM 826 O LYS A 52 -13.366 -7.961 4.669 1.00 0.00 O ATOM 827 CB LYS A 52 -12.393 -10.800 5.354 1.00 0.00 C ATOM 828 CG LYS A 52 -12.521 -12.312 5.467 1.00 0.00 C ATOM 829 CD LYS A 52 -11.299 -13.025 4.904 1.00 0.00 C ATOM 830 CE LYS A 52 -10.028 -12.660 5.659 1.00 0.00 C ATOM 831 NZ LYS A 52 -10.063 -13.118 7.072 1.00 0.00 N ATOM 0 H LYS A 52 -14.546 -10.723 4.072 1.00 0.00 H new ATOM 0 HA LYS A 52 -13.845 -10.311 6.860 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -12.192 -10.539 4.315 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -11.532 -10.473 5.937 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -12.654 -12.589 6.513 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -13.413 -12.642 4.934 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -11.453 -14.103 4.953 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -11.182 -12.768 3.851 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -9.169 -13.104 5.156 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -9.890 -11.579 5.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -9.130 -12.970 7.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -10.780 -12.576 7.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -10.303 -14.129 7.103 1.00 0.00 H new ATOM 845 N SER A 53 -13.165 -7.905 6.901 1.00 0.00 N ATOM 846 CA SER A 53 -12.913 -6.471 6.938 1.00 0.00 C ATOM 847 C SER A 53 -11.522 -6.183 7.495 1.00 0.00 C ATOM 848 O SER A 53 -10.937 -7.015 8.190 1.00 0.00 O ATOM 849 CB SER A 53 -13.986 -5.764 7.775 1.00 0.00 C ATOM 850 OG SER A 53 -13.858 -4.351 7.707 1.00 0.00 O ATOM 0 H SER A 53 -13.165 -8.360 7.814 1.00 0.00 H new ATOM 0 HA SER A 53 -12.958 -6.086 5.919 1.00 0.00 H new ATOM 0 HB2 SER A 53 -14.975 -6.057 7.422 1.00 0.00 H new ATOM 0 HB3 SER A 53 -13.909 -6.087 8.813 1.00 0.00 H new ATOM 0 HG SER A 53 -13.479 -4.098 6.839 1.00 0.00 H new ATOM 856 N GLY A 54 -10.998 -5.008 7.172 1.00 0.00 N ATOM 857 CA GLY A 54 -9.681 -4.616 7.636 1.00 0.00 C ATOM 858 C GLY A 54 -9.206 -3.329 6.990 1.00 0.00 C ATOM 859 O GLY A 54 -9.969 -2.670 6.276 1.00 0.00 O ATOM 0 H GLY A 54 -11.467 -4.313 6.591 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -9.701 -4.491 8.719 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -8.969 -5.413 7.420 1.00 0.00 H new ATOM 863 N LEU A 55 -7.958 -2.966 7.249 1.00 0.00 N ATOM 864 CA LEU A 55 -7.370 -1.759 6.686 1.00 0.00 C ATOM 865 C LEU A 55 -6.639 -2.062 5.386 1.00 0.00 C ATOM 866 O LEU A 55 -5.934 -3.069 5.278 1.00 0.00 O ATOM 867 CB LEU A 55 -6.398 -1.128 7.686 1.00 0.00 C ATOM 868 CG LEU A 55 -7.041 -0.537 8.939 1.00 0.00 C ATOM 869 CD1 LEU A 55 -5.974 -0.127 9.940 1.00 0.00 C ATOM 870 CD2 LEU A 55 -7.903 0.658 8.573 1.00 0.00 C ATOM 0 H LEU A 55 -7.328 -3.496 7.851 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.178 -1.059 6.475 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.675 -1.884 7.991 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.841 -0.341 7.178 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.672 -1.299 9.397 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.449 0.292 10.827 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.385 -1.000 10.222 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.321 0.621 9.490 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -8.356 1.070 9.475 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.286 1.420 8.096 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.687 0.344 7.885 1.00 0.00 H new ATOM 882 N VAL A 56 -6.826 -1.196 4.400 1.00 0.00 N ATOM 883 CA VAL A 56 -6.132 -1.305 3.125 1.00 0.00 C ATOM 884 C VAL A 56 -5.617 0.064 2.681 1.00 0.00 C ATOM 885 O VAL A 56 -6.215 1.090 3.008 1.00 0.00 O ATOM 886 CB VAL A 56 -7.043 -1.889 2.020 1.00 0.00 C ATOM 887 CG1 VAL A 56 -7.401 -3.338 2.316 1.00 0.00 C ATOM 888 CG2 VAL A 56 -8.305 -1.056 1.864 1.00 0.00 C ATOM 0 H VAL A 56 -7.461 -0.400 4.461 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.294 -1.986 3.273 1.00 0.00 H new ATOM 0 HB VAL A 56 -6.489 -1.858 1.082 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.042 -3.724 1.523 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -6.490 -3.934 2.368 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.928 -3.395 3.269 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.930 -1.486 1.081 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.855 -1.049 2.805 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.036 -0.035 1.594 1.00 0.00 H new ATOM 898 N PRO A 57 -4.490 0.105 1.955 1.00 0.00 N ATOM 899 CA PRO A 57 -3.921 1.361 1.455 1.00 0.00 C ATOM 900 C PRO A 57 -4.847 2.044 0.446 1.00 0.00 C ATOM 901 O PRO A 57 -5.320 1.413 -0.502 1.00 0.00 O ATOM 902 CB PRO A 57 -2.609 0.928 0.783 1.00 0.00 C ATOM 903 CG PRO A 57 -2.332 -0.444 1.304 1.00 0.00 C ATOM 904 CD PRO A 57 -3.674 -1.057 1.574 1.00 0.00 C ATOM 0 HA PRO A 57 -3.774 2.090 2.252 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.706 0.924 -0.303 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.797 1.613 1.028 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.772 -1.033 0.577 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.731 -0.403 2.212 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -4.073 -1.561 0.694 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.627 -1.798 2.372 1.00 0.00 H new ATOM 912 N ALA A 58 -5.081 3.340 0.642 1.00 0.00 N ATOM 913 CA ALA A 58 -6.045 4.085 -0.169 1.00 0.00 C ATOM 914 C ALA A 58 -5.603 4.219 -1.625 1.00 0.00 C ATOM 915 O ALA A 58 -6.407 4.558 -2.493 1.00 0.00 O ATOM 916 CB ALA A 58 -6.281 5.460 0.434 1.00 0.00 C ATOM 0 H ALA A 58 -4.615 3.898 1.357 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.976 3.518 -0.166 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -7.000 6.007 -0.177 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.673 5.351 1.445 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.340 6.010 0.466 1.00 0.00 H new ATOM 922 N GLN A 59 -4.332 3.944 -1.894 1.00 0.00 N ATOM 923 CA GLN A 59 -3.797 4.062 -3.248 1.00 0.00 C ATOM 924 C GLN A 59 -4.187 2.857 -4.098 1.00 0.00 C ATOM 925 O GLN A 59 -3.968 2.840 -5.309 1.00 0.00 O ATOM 926 CB GLN A 59 -2.271 4.173 -3.222 1.00 0.00 C ATOM 927 CG GLN A 59 -1.741 5.222 -2.263 1.00 0.00 C ATOM 928 CD GLN A 59 -0.231 5.340 -2.322 1.00 0.00 C ATOM 929 OE1 GLN A 59 0.486 4.613 -1.638 1.00 0.00 O ATOM 930 NE2 GLN A 59 0.263 6.264 -3.131 1.00 0.00 N ATOM 0 H GLN A 59 -3.654 3.639 -1.196 1.00 0.00 H new ATOM 0 HA GLN A 59 -4.222 4.965 -3.686 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.852 3.204 -2.951 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.917 4.404 -4.227 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -2.189 6.187 -2.499 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.045 4.970 -1.247 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.366 6.848 -3.683 1.00 0.00 H new ATOM 0 HE22 GLN A 59 1.272 6.392 -3.203 1.00 0.00 H new ATOM 939 N PHE A 60 -4.755 1.843 -3.457 1.00 0.00 N ATOM 940 CA PHE A 60 -5.067 0.594 -4.139 1.00 0.00 C ATOM 941 C PHE A 60 -6.561 0.460 -4.409 1.00 0.00 C ATOM 942 O PHE A 60 -6.979 -0.385 -5.200 1.00 0.00 O ATOM 943 CB PHE A 60 -4.579 -0.604 -3.312 1.00 0.00 C ATOM 944 CG PHE A 60 -3.080 -0.743 -3.261 1.00 0.00 C ATOM 945 CD1 PHE A 60 -2.306 0.153 -2.542 1.00 0.00 C ATOM 946 CD2 PHE A 60 -2.446 -1.774 -3.934 1.00 0.00 C ATOM 947 CE1 PHE A 60 -0.930 0.025 -2.495 1.00 0.00 C ATOM 948 CE2 PHE A 60 -1.070 -1.907 -3.892 1.00 0.00 C ATOM 949 CZ PHE A 60 -0.311 -1.005 -3.172 1.00 0.00 C ATOM 0 H PHE A 60 -5.008 1.861 -2.469 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.549 0.607 -5.098 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -4.960 -0.510 -2.295 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -5.004 -1.517 -3.728 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.784 0.963 -2.011 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.033 -2.483 -4.499 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.341 0.731 -1.929 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.589 -2.716 -4.422 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.764 -1.106 -3.139 1.00 0.00 H new ATOM 959 N ILE A 61 -7.364 1.298 -3.770 1.00 0.00 N ATOM 960 CA ILE A 61 -8.814 1.166 -3.858 1.00 0.00 C ATOM 961 C ILE A 61 -9.424 2.246 -4.742 1.00 0.00 C ATOM 962 O ILE A 61 -9.140 3.433 -4.576 1.00 0.00 O ATOM 963 CB ILE A 61 -9.478 1.233 -2.465 1.00 0.00 C ATOM 964 CG1 ILE A 61 -8.858 0.199 -1.518 1.00 0.00 C ATOM 965 CG2 ILE A 61 -10.980 1.014 -2.579 1.00 0.00 C ATOM 966 CD1 ILE A 61 -9.033 -1.236 -1.971 1.00 0.00 C ATOM 0 H ILE A 61 -7.041 2.072 -3.189 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.004 0.188 -4.301 1.00 0.00 H new ATOM 0 HB ILE A 61 -9.302 2.226 -2.051 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.793 0.409 -1.414 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.303 0.314 -0.530 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.431 1.065 -1.588 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -11.413 1.786 -3.215 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.173 0.034 -3.016 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.567 -1.905 -1.248 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -10.096 -1.467 -2.047 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -8.562 -1.370 -2.945 1.00 0.00 H new ATOM 978 N GLU A 62 -10.250 1.823 -5.688 1.00 0.00 N ATOM 979 CA GLU A 62 -11.025 2.742 -6.510 1.00 0.00 C ATOM 980 C GLU A 62 -12.500 2.662 -6.135 1.00 0.00 C ATOM 981 O GLU A 62 -13.171 1.683 -6.463 1.00 0.00 O ATOM 982 CB GLU A 62 -10.852 2.413 -7.994 1.00 0.00 C ATOM 983 CG GLU A 62 -9.588 2.988 -8.609 1.00 0.00 C ATOM 984 CD GLU A 62 -9.696 4.475 -8.880 1.00 0.00 C ATOM 985 OE1 GLU A 62 -9.497 5.269 -7.941 1.00 0.00 O ATOM 986 OE2 GLU A 62 -9.987 4.853 -10.036 1.00 0.00 O ATOM 0 H GLU A 62 -10.402 0.838 -5.907 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.662 3.754 -6.330 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.844 1.330 -8.117 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.715 2.790 -8.543 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.747 2.804 -7.940 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.373 2.467 -9.542 1.00 0.00 H new ATOM 993 N PRO A 63 -13.013 3.669 -5.413 1.00 0.00 N ATOM 994 CA PRO A 63 -14.430 3.737 -5.048 1.00 0.00 C ATOM 995 C PRO A 63 -15.330 3.711 -6.280 1.00 0.00 C ATOM 996 O PRO A 63 -15.069 4.400 -7.269 1.00 0.00 O ATOM 997 CB PRO A 63 -14.562 5.071 -4.301 1.00 0.00 C ATOM 998 CG PRO A 63 -13.319 5.832 -4.616 1.00 0.00 C ATOM 999 CD PRO A 63 -12.254 4.813 -4.894 1.00 0.00 C ATOM 0 HA PRO A 63 -14.739 2.883 -4.444 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -15.448 5.616 -4.626 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -14.662 4.911 -3.227 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -13.470 6.481 -5.479 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -13.034 6.473 -3.781 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -11.528 5.177 -5.620 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.700 4.553 -3.992 1.00 0.00 H new ATOM 1007 N VAL A 64 -16.394 2.923 -6.214 1.00 0.00 N ATOM 1008 CA VAL A 64 -17.231 2.671 -7.381 1.00 0.00 C ATOM 1009 C VAL A 64 -18.248 3.795 -7.601 1.00 0.00 C ATOM 1010 O VAL A 64 -19.452 3.560 -7.737 1.00 0.00 O ATOM 1011 CB VAL A 64 -17.955 1.307 -7.281 1.00 0.00 C ATOM 1012 CG1 VAL A 64 -18.522 0.890 -8.633 1.00 0.00 C ATOM 1013 CG2 VAL A 64 -17.015 0.236 -6.754 1.00 0.00 C ATOM 0 H VAL A 64 -16.699 2.447 -5.365 1.00 0.00 H new ATOM 0 HA VAL A 64 -16.565 2.641 -8.243 1.00 0.00 H new ATOM 0 HB VAL A 64 -18.783 1.419 -6.581 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -19.026 -0.072 -8.535 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -19.235 1.640 -8.975 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -17.711 0.803 -9.356 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -17.545 -0.715 -6.692 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -16.165 0.134 -7.428 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -16.660 0.519 -5.763 1.00 0.00 H new ATOM 1023 N ARG A 65 -17.757 5.023 -7.583 1.00 0.00 N ATOM 1024 CA ARG A 65 -18.500 6.146 -8.125 1.00 0.00 C ATOM 1025 C ARG A 65 -17.894 6.486 -9.475 1.00 0.00 C ATOM 1026 O ARG A 65 -18.594 6.831 -10.428 1.00 0.00 O ATOM 1027 CB ARG A 65 -18.458 7.369 -7.205 1.00 0.00 C ATOM 1028 CG ARG A 65 -19.152 8.574 -7.808 1.00 0.00 C ATOM 1029 CD ARG A 65 -19.026 9.810 -6.939 1.00 0.00 C ATOM 1030 NE ARG A 65 -19.851 9.747 -5.737 1.00 0.00 N ATOM 1031 CZ ARG A 65 -20.303 10.828 -5.104 1.00 0.00 C ATOM 1032 NH1 ARG A 65 -20.090 12.036 -5.618 1.00 0.00 N ATOM 1033 NH2 ARG A 65 -20.997 10.704 -3.978 1.00 0.00 N ATOM 0 H ARG A 65 -16.845 5.267 -7.198 1.00 0.00 H new ATOM 0 HA ARG A 65 -19.549 5.867 -8.220 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.929 7.121 -6.254 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.420 7.622 -6.990 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -18.728 8.780 -8.791 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -20.207 8.345 -7.958 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -17.983 9.940 -6.651 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -19.308 10.687 -7.521 1.00 0.00 H new ATOM 0 HE ARG A 65 -20.094 8.830 -5.363 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -19.581 12.134 -6.496 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -20.436 12.864 -5.134 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -21.186 9.778 -3.595 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -21.341 11.535 -3.497 1.00 0.00 H new ATOM 1047 N ASP A 66 -16.573 6.369 -9.540 1.00 0.00 N ATOM 1048 CA ASP A 66 -15.850 6.484 -10.792 1.00 0.00 C ATOM 1049 C ASP A 66 -15.891 5.142 -11.507 1.00 0.00 C ATOM 1050 O ASP A 66 -16.515 4.198 -11.026 1.00 0.00 O ATOM 1051 CB ASP A 66 -14.396 6.904 -10.544 1.00 0.00 C ATOM 1052 CG ASP A 66 -14.280 8.257 -9.869 1.00 0.00 C ATOM 1053 OD1 ASP A 66 -14.278 8.307 -8.624 1.00 0.00 O ATOM 1054 OD2 ASP A 66 -14.185 9.279 -10.582 1.00 0.00 O ATOM 0 H ASP A 66 -15.980 6.193 -8.729 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.320 7.249 -11.410 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -13.906 6.152 -9.926 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -13.864 6.931 -11.495 1.00 0.00 H new ATOM 1059 N LYS A 67 -15.216 5.044 -12.638 1.00 0.00 N ATOM 1060 CA LYS A 67 -15.235 3.814 -13.417 1.00 0.00 C ATOM 1061 C LYS A 67 -13.868 3.139 -13.400 1.00 0.00 C ATOM 1062 O LYS A 67 -13.508 2.428 -14.338 1.00 0.00 O ATOM 1063 CB LYS A 67 -15.691 4.113 -14.851 1.00 0.00 C ATOM 1064 CG LYS A 67 -14.886 5.200 -15.555 1.00 0.00 C ATOM 1065 CD LYS A 67 -13.867 4.619 -16.523 1.00 0.00 C ATOM 1066 CE LYS A 67 -14.544 3.825 -17.630 1.00 0.00 C ATOM 1067 NZ LYS A 67 -15.468 4.670 -18.434 1.00 0.00 N ATOM 0 H LYS A 67 -14.651 5.794 -13.037 1.00 0.00 H new ATOM 0 HA LYS A 67 -15.946 3.121 -12.966 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -15.630 3.196 -15.437 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -16.740 4.410 -14.831 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -15.564 5.860 -16.096 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.373 5.810 -14.811 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -13.277 5.425 -16.960 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -13.175 3.974 -15.982 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -13.786 3.394 -18.283 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -15.099 2.994 -17.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -15.751 4.155 -19.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -16.313 4.894 -17.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -14.987 5.552 -18.703 1.00 0.00 H new ATOM 1081 N LYS A 68 -13.139 3.333 -12.300 1.00 0.00 N ATOM 1082 CA LYS A 68 -11.764 2.847 -12.162 1.00 0.00 C ATOM 1083 C LYS A 68 -10.857 3.515 -13.184 1.00 0.00 C ATOM 1084 O LYS A 68 -10.744 3.060 -14.324 1.00 0.00 O ATOM 1085 CB LYS A 68 -11.670 1.321 -12.306 1.00 0.00 C ATOM 1086 CG LYS A 68 -12.218 0.542 -11.120 1.00 0.00 C ATOM 1087 CD LYS A 68 -11.203 -0.477 -10.615 1.00 0.00 C ATOM 1088 CE LYS A 68 -10.831 -1.492 -11.690 1.00 0.00 C ATOM 1089 NZ LYS A 68 -9.711 -2.378 -11.263 1.00 0.00 N ATOM 0 H LYS A 68 -13.484 3.831 -11.480 1.00 0.00 H new ATOM 0 HA LYS A 68 -11.435 3.108 -11.156 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -12.210 1.019 -13.204 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.626 1.046 -12.454 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -12.476 1.232 -10.316 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -13.137 0.032 -11.410 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -10.305 0.041 -10.279 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -11.612 -0.999 -9.750 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.703 -2.101 -11.930 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -10.549 -0.966 -12.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -9.492 -3.052 -12.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.870 -1.801 -11.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -9.988 -2.900 -10.408 1.00 0.00 H new ATOM 1103 N HIS A 69 -10.211 4.591 -12.774 1.00 0.00 N ATOM 1104 CA HIS A 69 -9.349 5.346 -13.670 1.00 0.00 C ATOM 1105 C HIS A 69 -8.433 6.260 -12.869 1.00 0.00 C ATOM 1106 O HIS A 69 -7.272 5.925 -12.641 1.00 0.00 O ATOM 1107 CB HIS A 69 -10.189 6.156 -14.669 1.00 0.00 C ATOM 1108 CG HIS A 69 -9.383 6.855 -15.721 1.00 0.00 C ATOM 1109 ND1 HIS A 69 -9.409 8.220 -15.902 1.00 0.00 N ATOM 1110 CD2 HIS A 69 -8.539 6.370 -16.661 1.00 0.00 C ATOM 1111 CE1 HIS A 69 -8.615 8.544 -16.907 1.00 0.00 C ATOM 1112 NE2 HIS A 69 -8.078 7.439 -17.384 1.00 0.00 N ATOM 0 H HIS A 69 -10.266 4.963 -11.826 1.00 0.00 H new ATOM 0 HA HIS A 69 -8.732 4.647 -14.235 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -10.900 5.488 -15.155 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -10.771 6.897 -14.121 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -8.277 5.333 -16.813 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -8.436 9.544 -17.275 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -7.424 7.388 -18.165 1.00 0.00 H new ATOM 1121 N THR A 70 -8.976 7.393 -12.435 1.00 0.00 N ATOM 1122 CA THR A 70 -8.231 8.378 -11.658 1.00 0.00 C ATOM 1123 C THR A 70 -6.880 8.707 -12.308 1.00 0.00 C ATOM 1124 O THR A 70 -5.822 8.242 -11.877 1.00 0.00 O ATOM 1125 CB THR A 70 -8.043 7.905 -10.205 1.00 0.00 C ATOM 1126 OG1 THR A 70 -9.321 7.543 -9.657 1.00 0.00 O ATOM 1127 CG2 THR A 70 -7.417 8.997 -9.348 1.00 0.00 C ATOM 0 H THR A 70 -9.946 7.654 -12.612 1.00 0.00 H new ATOM 0 HA THR A 70 -8.819 9.296 -11.643 1.00 0.00 H new ATOM 0 HB THR A 70 -7.374 7.044 -10.205 1.00 0.00 H new ATOM 0 HG1 THR A 70 -9.557 6.637 -9.947 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.296 8.634 -8.327 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.442 9.265 -9.755 1.00 0.00 H new ATOM 0 HG23 THR A 70 -8.064 9.874 -9.347 1.00 0.00 H new ATOM 1135 N GLU A 71 -6.942 9.501 -13.364 1.00 0.00 N ATOM 1136 CA GLU A 71 -5.766 9.880 -14.126 1.00 0.00 C ATOM 1137 C GLU A 71 -6.010 11.234 -14.775 1.00 0.00 C ATOM 1138 O GLU A 71 -5.470 12.240 -14.283 1.00 0.00 O ATOM 1139 CB GLU A 71 -5.460 8.828 -15.198 1.00 0.00 C ATOM 1140 CG GLU A 71 -4.180 9.097 -15.972 1.00 0.00 C ATOM 1141 CD GLU A 71 -3.997 8.153 -17.140 1.00 0.00 C ATOM 1142 OE1 GLU A 71 -3.725 6.956 -16.910 1.00 0.00 O ATOM 1143 OE2 GLU A 71 -4.110 8.605 -18.298 1.00 0.00 O ATOM 1144 OXT GLU A 71 -6.798 11.292 -15.741 1.00 0.00 O ATOM 0 H GLU A 71 -7.811 9.901 -13.717 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.908 9.944 -13.457 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.388 7.849 -14.724 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.294 8.782 -15.898 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.190 10.124 -16.338 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.327 9.006 -15.299 1.00 0.00 H new TER 1151 GLU A 71 ATOM 1152 N MET B 1 21.073 0.379 -9.139 1.00 0.00 N ATOM 1153 CA MET B 1 20.044 0.883 -10.071 1.00 0.00 C ATOM 1154 C MET B 1 19.135 1.862 -9.381 1.00 0.00 C ATOM 1155 O MET B 1 19.207 2.066 -8.172 1.00 0.00 O ATOM 1156 CB MET B 1 19.178 -0.235 -10.655 1.00 0.00 C ATOM 1157 CG MET B 1 18.405 -1.054 -9.628 1.00 0.00 C ATOM 1158 SD MET B 1 19.453 -2.031 -8.536 1.00 0.00 S ATOM 1159 CE MET B 1 18.202 -2.873 -7.567 1.00 0.00 C ATOM 0 H1 MET B 1 21.814 -0.116 -9.675 1.00 0.00 H new ATOM 0 H2 MET B 1 21.494 1.177 -8.622 1.00 0.00 H new ATOM 0 H3 MET B 1 20.636 -0.280 -8.463 1.00 0.00 H new ATOM 0 HA MET B 1 20.587 1.366 -10.883 1.00 0.00 H new ATOM 0 HB2 MET B 1 18.468 0.204 -11.356 1.00 0.00 H new ATOM 0 HB3 MET B 1 19.817 -0.908 -11.228 1.00 0.00 H new ATOM 0 HG2 MET B 1 17.796 -0.381 -9.025 1.00 0.00 H new ATOM 0 HG3 MET B 1 17.720 -1.721 -10.151 1.00 0.00 H new ATOM 0 HE1 MET B 1 18.324 -2.617 -6.515 1.00 0.00 H new ATOM 0 HE2 MET B 1 17.212 -2.564 -7.904 1.00 0.00 H new ATOM 0 HE3 MET B 1 18.308 -3.950 -7.693 1.00 0.00 H new ATOM 1171 N GLN B 2 18.254 2.425 -10.165 1.00 0.00 N ATOM 1172 CA GLN B 2 17.317 3.416 -9.669 1.00 0.00 C ATOM 1173 C GLN B 2 15.939 2.801 -9.507 1.00 0.00 C ATOM 1174 O GLN B 2 15.437 2.141 -10.414 1.00 0.00 O ATOM 1175 CB GLN B 2 17.248 4.618 -10.611 1.00 0.00 C ATOM 1176 CG GLN B 2 18.583 5.309 -10.820 1.00 0.00 C ATOM 1177 CD GLN B 2 18.446 6.635 -11.540 1.00 0.00 C ATOM 1178 OE1 GLN B 2 18.314 7.683 -10.910 1.00 0.00 O ATOM 1179 NE2 GLN B 2 18.454 6.599 -12.862 1.00 0.00 N ATOM 0 H GLN B 2 18.160 2.216 -11.159 1.00 0.00 H new ATOM 0 HA GLN B 2 17.668 3.761 -8.696 1.00 0.00 H new ATOM 0 HB2 GLN B 2 16.864 4.289 -11.577 1.00 0.00 H new ATOM 0 HB3 GLN B 2 16.534 5.339 -10.213 1.00 0.00 H new ATOM 0 HG2 GLN B 2 19.059 5.472 -9.853 1.00 0.00 H new ATOM 0 HG3 GLN B 2 19.241 4.655 -11.393 1.00 0.00 H new ATOM 0 HE21 GLN B 2 18.566 5.709 -13.347 1.00 0.00 H new ATOM 0 HE22 GLN B 2 18.348 7.461 -13.396 1.00 0.00 H new ATOM 1188 N ILE B 3 15.343 2.999 -8.347 1.00 0.00 N ATOM 1189 CA ILE B 3 13.998 2.513 -8.086 1.00 0.00 C ATOM 1190 C ILE B 3 13.067 3.684 -7.820 1.00 0.00 C ATOM 1191 O ILE B 3 13.492 4.718 -7.299 1.00 0.00 O ATOM 1192 CB ILE B 3 13.952 1.535 -6.889 1.00 0.00 C ATOM 1193 CG1 ILE B 3 14.548 2.184 -5.631 1.00 0.00 C ATOM 1194 CG2 ILE B 3 14.683 0.242 -7.230 1.00 0.00 C ATOM 1195 CD1 ILE B 3 14.467 1.313 -4.393 1.00 0.00 C ATOM 0 H ILE B 3 15.770 3.496 -7.565 1.00 0.00 H new ATOM 0 HA ILE B 3 13.672 1.969 -8.972 1.00 0.00 H new ATOM 0 HB ILE B 3 12.909 1.295 -6.681 1.00 0.00 H new ATOM 0 HG12 ILE B 3 15.592 2.431 -5.822 1.00 0.00 H new ATOM 0 HG13 ILE B 3 14.029 3.123 -5.438 1.00 0.00 H new ATOM 0 HG21 ILE B 3 14.641 -0.435 -6.377 1.00 0.00 H new ATOM 0 HG22 ILE B 3 14.208 -0.229 -8.091 1.00 0.00 H new ATOM 0 HG23 ILE B 3 15.724 0.464 -7.467 1.00 0.00 H new ATOM 0 HD11 ILE B 3 14.908 1.841 -3.547 1.00 0.00 H new ATOM 0 HD12 ILE B 3 13.423 1.087 -4.175 1.00 0.00 H new ATOM 0 HD13 ILE B 3 15.011 0.384 -4.565 1.00 0.00 H new ATOM 1207 N PHE B 4 11.806 3.530 -8.191 1.00 0.00 N ATOM 1208 CA PHE B 4 10.830 4.586 -7.998 1.00 0.00 C ATOM 1209 C PHE B 4 10.040 4.351 -6.725 1.00 0.00 C ATOM 1210 O PHE B 4 9.125 3.527 -6.691 1.00 0.00 O ATOM 1211 CB PHE B 4 9.872 4.680 -9.188 1.00 0.00 C ATOM 1212 CG PHE B 4 10.526 5.136 -10.461 1.00 0.00 C ATOM 1213 CD1 PHE B 4 10.950 6.447 -10.604 1.00 0.00 C ATOM 1214 CD2 PHE B 4 10.714 4.256 -11.514 1.00 0.00 C ATOM 1215 CE1 PHE B 4 11.549 6.872 -11.773 1.00 0.00 C ATOM 1216 CE2 PHE B 4 11.310 4.676 -12.686 1.00 0.00 C ATOM 1217 CZ PHE B 4 11.729 5.985 -12.816 1.00 0.00 C ATOM 0 H PHE B 4 11.436 2.685 -8.627 1.00 0.00 H new ATOM 0 HA PHE B 4 11.373 5.527 -7.917 1.00 0.00 H new ATOM 0 HB2 PHE B 4 9.418 3.703 -9.354 1.00 0.00 H new ATOM 0 HB3 PHE B 4 9.065 5.369 -8.939 1.00 0.00 H new ATOM 0 HD1 PHE B 4 10.810 7.145 -9.792 1.00 0.00 H new ATOM 0 HD2 PHE B 4 10.391 3.230 -11.417 1.00 0.00 H new ATOM 0 HE1 PHE B 4 11.876 7.896 -11.872 1.00 0.00 H new ATOM 0 HE2 PHE B 4 11.448 3.981 -13.501 1.00 0.00 H new ATOM 0 HZ PHE B 4 12.197 6.315 -13.732 1.00 0.00 H new ATOM 1227 N VAL B 5 10.416 5.057 -5.678 1.00 0.00 N ATOM 1228 CA VAL B 5 9.701 4.982 -4.421 1.00 0.00 C ATOM 1229 C VAL B 5 8.501 5.915 -4.465 1.00 0.00 C ATOM 1230 O VAL B 5 8.631 7.125 -4.275 1.00 0.00 O ATOM 1231 CB VAL B 5 10.601 5.348 -3.222 1.00 0.00 C ATOM 1232 CG1 VAL B 5 9.842 5.189 -1.912 1.00 0.00 C ATOM 1233 CG2 VAL B 5 11.863 4.494 -3.217 1.00 0.00 C ATOM 0 H VAL B 5 11.215 5.691 -5.673 1.00 0.00 H new ATOM 0 HA VAL B 5 9.372 3.952 -4.284 1.00 0.00 H new ATOM 0 HB VAL B 5 10.895 6.393 -3.323 1.00 0.00 H new ATOM 0 HG11 VAL B 5 10.494 5.452 -1.079 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.972 5.846 -1.913 1.00 0.00 H new ATOM 0 HG13 VAL B 5 9.515 4.155 -1.804 1.00 0.00 H new ATOM 0 HG21 VAL B 5 12.484 4.768 -2.364 1.00 0.00 H new ATOM 0 HG22 VAL B 5 11.590 3.441 -3.144 1.00 0.00 H new ATOM 0 HG23 VAL B 5 12.419 4.661 -4.139 1.00 0.00 H new ATOM 1243 N LYS B 6 7.344 5.349 -4.758 1.00 0.00 N ATOM 1244 CA LYS B 6 6.119 6.117 -4.836 1.00 0.00 C ATOM 1245 C LYS B 6 5.430 6.092 -3.485 1.00 0.00 C ATOM 1246 O LYS B 6 4.814 5.092 -3.108 1.00 0.00 O ATOM 1247 CB LYS B 6 5.195 5.553 -5.917 1.00 0.00 C ATOM 1248 CG LYS B 6 4.013 6.453 -6.246 1.00 0.00 C ATOM 1249 CD LYS B 6 3.119 5.827 -7.303 1.00 0.00 C ATOM 1250 CE LYS B 6 2.101 6.820 -7.850 1.00 0.00 C ATOM 1251 NZ LYS B 6 1.155 7.302 -6.806 1.00 0.00 N ATOM 0 H LYS B 6 7.229 4.353 -4.947 1.00 0.00 H new ATOM 0 HA LYS B 6 6.358 7.146 -5.104 1.00 0.00 H new ATOM 0 HB2 LYS B 6 5.774 5.384 -6.825 1.00 0.00 H new ATOM 0 HB3 LYS B 6 4.821 4.582 -5.592 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.434 6.641 -5.342 1.00 0.00 H new ATOM 0 HG3 LYS B 6 4.376 7.418 -6.599 1.00 0.00 H new ATOM 0 HD2 LYS B 6 3.733 5.450 -8.121 1.00 0.00 H new ATOM 0 HD3 LYS B 6 2.597 4.971 -6.876 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.626 7.672 -8.281 1.00 0.00 H new ATOM 0 HE3 LYS B 6 1.538 6.351 -8.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 0.463 7.948 -7.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 0.657 6.491 -6.387 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 1.683 7.804 -6.064 1.00 0.00 H new ATOM 1265 N THR B 7 5.567 7.179 -2.750 1.00 0.00 N ATOM 1266 CA THR B 7 5.027 7.265 -1.410 1.00 0.00 C ATOM 1267 C THR B 7 3.509 7.346 -1.435 1.00 0.00 C ATOM 1268 O THR B 7 2.902 7.598 -2.482 1.00 0.00 O ATOM 1269 CB THR B 7 5.584 8.491 -0.664 1.00 0.00 C ATOM 1270 OG1 THR B 7 5.191 9.689 -1.340 1.00 0.00 O ATOM 1271 CG2 THR B 7 7.101 8.432 -0.573 1.00 0.00 C ATOM 0 H THR B 7 6.052 8.020 -3.063 1.00 0.00 H new ATOM 0 HA THR B 7 5.329 6.359 -0.885 1.00 0.00 H new ATOM 0 HB THR B 7 5.177 8.489 0.347 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.546 10.179 -0.789 1.00 0.00 H new ATOM 0 HG21 THR B 7 7.468 9.310 -0.041 1.00 0.00 H new ATOM 0 HG22 THR B 7 7.399 7.532 -0.035 1.00 0.00 H new ATOM 0 HG23 THR B 7 7.525 8.412 -1.577 1.00 0.00 H new ATOM 1279 N LEU B 8 2.904 7.122 -0.281 1.00 0.00 N ATOM 1280 CA LEU B 8 1.465 7.245 -0.129 1.00 0.00 C ATOM 1281 C LEU B 8 1.036 8.687 -0.396 1.00 0.00 C ATOM 1282 O LEU B 8 -0.045 8.938 -0.921 1.00 0.00 O ATOM 1283 CB LEU B 8 1.064 6.799 1.284 1.00 0.00 C ATOM 1284 CG LEU B 8 -0.408 6.423 1.486 1.00 0.00 C ATOM 1285 CD1 LEU B 8 -0.555 5.591 2.747 1.00 0.00 C ATOM 1286 CD2 LEU B 8 -1.289 7.662 1.577 1.00 0.00 C ATOM 0 H LEU B 8 3.393 6.851 0.572 1.00 0.00 H new ATOM 0 HA LEU B 8 0.959 6.604 -0.851 1.00 0.00 H new ATOM 0 HB2 LEU B 8 1.677 5.941 1.559 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.310 7.602 1.979 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.732 5.842 0.623 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.603 5.325 2.888 1.00 0.00 H new ATOM 0 HD12 LEU B 8 0.040 4.683 2.655 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.208 6.167 3.605 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -2.327 7.361 1.720 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -0.969 8.275 2.420 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.202 8.239 0.656 1.00 0.00 H new ATOM 1298 N THR B 9 1.914 9.627 -0.067 1.00 0.00 N ATOM 1299 CA THR B 9 1.621 11.043 -0.224 1.00 0.00 C ATOM 1300 C THR B 9 1.574 11.453 -1.699 1.00 0.00 C ATOM 1301 O THR B 9 0.874 12.401 -2.065 1.00 0.00 O ATOM 1302 CB THR B 9 2.663 11.894 0.522 1.00 0.00 C ATOM 1303 OG1 THR B 9 3.979 11.388 0.262 1.00 0.00 O ATOM 1304 CG2 THR B 9 2.399 11.882 2.021 1.00 0.00 C ATOM 0 H THR B 9 2.840 9.430 0.312 1.00 0.00 H new ATOM 0 HA THR B 9 0.635 11.220 0.206 1.00 0.00 H new ATOM 0 HB THR B 9 2.588 12.921 0.164 1.00 0.00 H new ATOM 0 HG1 THR B 9 4.639 11.934 0.738 1.00 0.00 H new ATOM 0 HG21 THR B 9 3.148 12.490 2.527 1.00 0.00 H new ATOM 0 HG22 THR B 9 1.407 12.289 2.219 1.00 0.00 H new ATOM 0 HG23 THR B 9 2.452 10.858 2.392 1.00 0.00 H new ATOM 1312 N GLY B 10 2.309 10.735 -2.541 1.00 0.00 N ATOM 1313 CA GLY B 10 2.319 11.044 -3.959 1.00 0.00 C ATOM 1314 C GLY B 10 3.708 11.357 -4.479 1.00 0.00 C ATOM 1315 O GLY B 10 3.897 11.590 -5.673 1.00 0.00 O ATOM 0 H GLY B 10 2.896 9.947 -2.268 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.909 10.200 -4.514 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.665 11.896 -4.146 1.00 0.00 H new ATOM 1319 N LYS B 11 4.683 11.359 -3.587 1.00 0.00 N ATOM 1320 CA LYS B 11 6.062 11.620 -3.968 1.00 0.00 C ATOM 1321 C LYS B 11 6.674 10.396 -4.634 1.00 0.00 C ATOM 1322 O LYS B 11 6.689 9.309 -4.063 1.00 0.00 O ATOM 1323 CB LYS B 11 6.896 12.012 -2.744 1.00 0.00 C ATOM 1324 CG LYS B 11 6.697 13.450 -2.290 1.00 0.00 C ATOM 1325 CD LYS B 11 7.289 14.427 -3.292 1.00 0.00 C ATOM 1326 CE LYS B 11 7.263 15.855 -2.771 1.00 0.00 C ATOM 1327 NZ LYS B 11 7.964 16.790 -3.692 1.00 0.00 N ATOM 0 H LYS B 11 4.546 11.183 -2.592 1.00 0.00 H new ATOM 0 HA LYS B 11 6.064 12.448 -4.677 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.647 11.344 -1.919 1.00 0.00 H new ATOM 0 HB3 LYS B 11 7.951 11.857 -2.972 1.00 0.00 H new ATOM 0 HG2 LYS B 11 5.633 13.652 -2.166 1.00 0.00 H new ATOM 0 HG3 LYS B 11 7.165 13.595 -1.316 1.00 0.00 H new ATOM 0 HD2 LYS B 11 8.317 14.140 -3.516 1.00 0.00 H new ATOM 0 HD3 LYS B 11 6.732 14.371 -4.227 1.00 0.00 H new ATOM 0 HE2 LYS B 11 6.229 16.177 -2.643 1.00 0.00 H new ATOM 0 HE3 LYS B 11 7.732 15.892 -1.788 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 7.926 17.754 -3.304 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 8.957 16.497 -3.794 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 7.500 16.773 -4.623 1.00 0.00 H new ATOM 1341 N THR B 12 7.151 10.567 -5.854 1.00 0.00 N ATOM 1342 CA THR B 12 7.851 9.502 -6.545 1.00 0.00 C ATOM 1343 C THR B 12 9.352 9.776 -6.522 1.00 0.00 C ATOM 1344 O THR B 12 9.880 10.501 -7.366 1.00 0.00 O ATOM 1345 CB THR B 12 7.355 9.358 -7.996 1.00 0.00 C ATOM 1346 OG1 THR B 12 5.923 9.280 -8.003 1.00 0.00 O ATOM 1347 CG2 THR B 12 7.936 8.113 -8.651 1.00 0.00 C ATOM 0 H THR B 12 7.066 11.433 -6.386 1.00 0.00 H new ATOM 0 HA THR B 12 7.647 8.563 -6.030 1.00 0.00 H new ATOM 0 HB THR B 12 7.685 10.229 -8.563 1.00 0.00 H new ATOM 0 HG1 THR B 12 5.605 9.190 -8.926 1.00 0.00 H new ATOM 0 HG21 THR B 12 7.569 8.036 -9.675 1.00 0.00 H new ATOM 0 HG22 THR B 12 9.024 8.180 -8.659 1.00 0.00 H new ATOM 0 HG23 THR B 12 7.631 7.230 -8.089 1.00 0.00 H new ATOM 1355 N ILE B 13 10.025 9.221 -5.527 1.00 0.00 N ATOM 1356 CA ILE B 13 11.441 9.481 -5.322 1.00 0.00 C ATOM 1357 C ILE B 13 12.286 8.413 -6.004 1.00 0.00 C ATOM 1358 O ILE B 13 12.101 7.220 -5.768 1.00 0.00 O ATOM 1359 CB ILE B 13 11.786 9.530 -3.817 1.00 0.00 C ATOM 1360 CG1 ILE B 13 10.869 10.523 -3.099 1.00 0.00 C ATOM 1361 CG2 ILE B 13 13.247 9.910 -3.617 1.00 0.00 C ATOM 1362 CD1 ILE B 13 11.071 10.574 -1.599 1.00 0.00 C ATOM 0 H ILE B 13 9.611 8.585 -4.846 1.00 0.00 H new ATOM 0 HA ILE B 13 11.665 10.452 -5.763 1.00 0.00 H new ATOM 0 HB ILE B 13 11.629 8.539 -3.390 1.00 0.00 H new ATOM 0 HG12 ILE B 13 11.034 11.518 -3.512 1.00 0.00 H new ATOM 0 HG13 ILE B 13 9.832 10.260 -3.307 1.00 0.00 H new ATOM 0 HG21 ILE B 13 13.473 9.940 -2.551 1.00 0.00 H new ATOM 0 HG22 ILE B 13 13.885 9.171 -4.102 1.00 0.00 H new ATOM 0 HG23 ILE B 13 13.431 10.891 -4.054 1.00 0.00 H new ATOM 0 HD11 ILE B 13 10.385 11.301 -1.164 1.00 0.00 H new ATOM 0 HD12 ILE B 13 10.876 9.590 -1.172 1.00 0.00 H new ATOM 0 HD13 ILE B 13 12.097 10.868 -1.380 1.00 0.00 H new ATOM 1374 N THR B 14 13.202 8.839 -6.859 1.00 0.00 N ATOM 1375 CA THR B 14 14.076 7.912 -7.552 1.00 0.00 C ATOM 1376 C THR B 14 15.337 7.666 -6.725 1.00 0.00 C ATOM 1377 O THR B 14 16.161 8.567 -6.542 1.00 0.00 O ATOM 1378 CB THR B 14 14.456 8.458 -8.940 1.00 0.00 C ATOM 1379 OG1 THR B 14 13.276 8.921 -9.611 1.00 0.00 O ATOM 1380 CG2 THR B 14 15.127 7.387 -9.780 1.00 0.00 C ATOM 0 H THR B 14 13.358 9.821 -7.088 1.00 0.00 H new ATOM 0 HA THR B 14 13.545 6.970 -7.685 1.00 0.00 H new ATOM 0 HB THR B 14 15.157 9.282 -8.806 1.00 0.00 H new ATOM 0 HG1 THR B 14 12.905 8.197 -10.157 1.00 0.00 H new ATOM 0 HG21 THR B 14 15.385 7.799 -10.756 1.00 0.00 H new ATOM 0 HG22 THR B 14 16.033 7.046 -9.279 1.00 0.00 H new ATOM 0 HG23 THR B 14 14.445 6.546 -9.910 1.00 0.00 H new ATOM 1388 N LEU B 15 15.476 6.449 -6.218 1.00 0.00 N ATOM 1389 CA LEU B 15 16.581 6.109 -5.332 1.00 0.00 C ATOM 1390 C LEU B 15 17.593 5.203 -6.026 1.00 0.00 C ATOM 1391 O LEU B 15 17.230 4.179 -6.607 1.00 0.00 O ATOM 1392 CB LEU B 15 16.056 5.412 -4.071 1.00 0.00 C ATOM 1393 CG LEU B 15 16.388 6.102 -2.742 1.00 0.00 C ATOM 1394 CD1 LEU B 15 17.888 6.292 -2.594 1.00 0.00 C ATOM 1395 CD2 LEU B 15 15.667 7.436 -2.633 1.00 0.00 C ATOM 0 H LEU B 15 14.835 5.678 -6.406 1.00 0.00 H new ATOM 0 HA LEU B 15 17.080 7.038 -5.057 1.00 0.00 H new ATOM 0 HB2 LEU B 15 14.973 5.323 -4.152 1.00 0.00 H new ATOM 0 HB3 LEU B 15 16.458 4.399 -4.044 1.00 0.00 H new ATOM 0 HG LEU B 15 16.043 5.460 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU B 15 18.101 6.783 -1.644 1.00 0.00 H new ATOM 0 HD12 LEU B 15 18.382 5.321 -2.619 1.00 0.00 H new ATOM 0 HD13 LEU B 15 18.259 6.909 -3.413 1.00 0.00 H new ATOM 0 HD21 LEU B 15 15.917 7.908 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU B 15 15.976 8.085 -3.453 1.00 0.00 H new ATOM 0 HD23 LEU B 15 14.591 7.273 -2.685 1.00 0.00 H new ATOM 1407 N GLU B 16 18.858 5.595 -5.966 1.00 0.00 N ATOM 1408 CA GLU B 16 19.947 4.764 -6.458 1.00 0.00 C ATOM 1409 C GLU B 16 20.344 3.748 -5.384 1.00 0.00 C ATOM 1410 O GLU B 16 20.958 4.097 -4.371 1.00 0.00 O ATOM 1411 CB GLU B 16 21.145 5.637 -6.852 1.00 0.00 C ATOM 1412 CG GLU B 16 22.360 4.859 -7.338 1.00 0.00 C ATOM 1413 CD GLU B 16 22.087 4.034 -8.581 1.00 0.00 C ATOM 1414 OE1 GLU B 16 21.903 4.628 -9.666 1.00 0.00 O ATOM 1415 OE2 GLU B 16 22.086 2.788 -8.482 1.00 0.00 O ATOM 0 H GLU B 16 19.156 6.490 -5.578 1.00 0.00 H new ATOM 0 HA GLU B 16 19.616 4.224 -7.345 1.00 0.00 H new ATOM 0 HB2 GLU B 16 20.833 6.327 -7.636 1.00 0.00 H new ATOM 0 HB3 GLU B 16 21.436 6.242 -5.993 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.171 5.557 -7.545 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.703 4.199 -6.541 1.00 0.00 H new ATOM 1422 N VAL B 17 19.971 2.501 -5.610 1.00 0.00 N ATOM 1423 CA VAL B 17 20.180 1.430 -4.642 1.00 0.00 C ATOM 1424 C VAL B 17 20.862 0.234 -5.307 1.00 0.00 C ATOM 1425 O VAL B 17 21.238 0.298 -6.476 1.00 0.00 O ATOM 1426 CB VAL B 17 18.835 0.977 -4.027 1.00 0.00 C ATOM 1427 CG1 VAL B 17 18.199 2.104 -3.227 1.00 0.00 C ATOM 1428 CG2 VAL B 17 17.894 0.503 -5.123 1.00 0.00 C ATOM 0 H VAL B 17 19.514 2.198 -6.470 1.00 0.00 H new ATOM 0 HA VAL B 17 20.821 1.816 -3.849 1.00 0.00 H new ATOM 0 HB VAL B 17 19.027 0.148 -3.346 1.00 0.00 H new ATOM 0 HG11 VAL B 17 17.254 1.762 -2.804 1.00 0.00 H new ATOM 0 HG12 VAL B 17 18.870 2.402 -2.422 1.00 0.00 H new ATOM 0 HG13 VAL B 17 18.016 2.956 -3.881 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.950 0.186 -4.680 1.00 0.00 H new ATOM 0 HG22 VAL B 17 17.711 1.318 -5.823 1.00 0.00 H new ATOM 0 HG23 VAL B 17 18.346 -0.336 -5.653 1.00 0.00 H new ATOM 1438 N GLU B 18 21.024 -0.851 -4.567 1.00 0.00 N ATOM 1439 CA GLU B 18 21.623 -2.062 -5.111 1.00 0.00 C ATOM 1440 C GLU B 18 20.661 -3.232 -4.942 1.00 0.00 C ATOM 1441 O GLU B 18 19.794 -3.202 -4.075 1.00 0.00 O ATOM 1442 CB GLU B 18 22.953 -2.360 -4.415 1.00 0.00 C ATOM 1443 CG GLU B 18 23.757 -3.460 -5.088 1.00 0.00 C ATOM 1444 CD GLU B 18 25.071 -3.738 -4.393 1.00 0.00 C ATOM 1445 OE1 GLU B 18 25.949 -2.849 -4.396 1.00 0.00 O ATOM 1446 OE2 GLU B 18 25.234 -4.847 -3.851 1.00 0.00 O ATOM 0 H GLU B 18 20.749 -0.919 -3.587 1.00 0.00 H new ATOM 0 HA GLU B 18 21.819 -1.914 -6.173 1.00 0.00 H new ATOM 0 HB2 GLU B 18 23.551 -1.449 -4.387 1.00 0.00 H new ATOM 0 HB3 GLU B 18 22.757 -2.645 -3.381 1.00 0.00 H new ATOM 0 HG2 GLU B 18 23.164 -4.374 -5.112 1.00 0.00 H new ATOM 0 HG3 GLU B 18 23.952 -3.179 -6.123 1.00 0.00 H new ATOM 1453 N SER B 19 20.806 -4.255 -5.772 1.00 0.00 N ATOM 1454 CA SER B 19 19.935 -5.423 -5.705 1.00 0.00 C ATOM 1455 C SER B 19 20.147 -6.179 -4.391 1.00 0.00 C ATOM 1456 O SER B 19 19.206 -6.725 -3.811 1.00 0.00 O ATOM 1457 CB SER B 19 20.210 -6.341 -6.896 1.00 0.00 C ATOM 1458 OG SER B 19 20.309 -5.593 -8.100 1.00 0.00 O ATOM 0 H SER B 19 21.518 -4.301 -6.500 1.00 0.00 H new ATOM 0 HA SER B 19 18.898 -5.090 -5.743 1.00 0.00 H new ATOM 0 HB2 SER B 19 21.135 -6.893 -6.729 1.00 0.00 H new ATOM 0 HB3 SER B 19 19.411 -7.077 -6.985 1.00 0.00 H new ATOM 0 HG SER B 19 20.487 -6.200 -8.849 1.00 0.00 H new ATOM 1464 N SER B 20 21.391 -6.192 -3.923 1.00 0.00 N ATOM 1465 CA SER B 20 21.740 -6.857 -2.677 1.00 0.00 C ATOM 1466 C SER B 20 21.592 -5.899 -1.491 1.00 0.00 C ATOM 1467 O SER B 20 21.975 -6.225 -0.367 1.00 0.00 O ATOM 1468 CB SER B 20 23.174 -7.395 -2.753 1.00 0.00 C ATOM 1469 OG SER B 20 23.488 -8.199 -1.627 1.00 0.00 O ATOM 0 H SER B 20 22.178 -5.745 -4.394 1.00 0.00 H new ATOM 0 HA SER B 20 21.056 -7.693 -2.527 1.00 0.00 H new ATOM 0 HB2 SER B 20 23.296 -7.980 -3.665 1.00 0.00 H new ATOM 0 HB3 SER B 20 23.874 -6.561 -2.813 1.00 0.00 H new ATOM 0 HG SER B 20 23.101 -7.798 -0.821 1.00 0.00 H new ATOM 1475 N ASP B 21 21.031 -4.723 -1.746 1.00 0.00 N ATOM 1476 CA ASP B 21 20.800 -3.741 -0.691 1.00 0.00 C ATOM 1477 C ASP B 21 19.537 -4.130 0.062 1.00 0.00 C ATOM 1478 O ASP B 21 18.545 -4.536 -0.552 1.00 0.00 O ATOM 1479 CB ASP B 21 20.660 -2.336 -1.291 1.00 0.00 C ATOM 1480 CG ASP B 21 20.850 -1.225 -0.278 1.00 0.00 C ATOM 1481 OD1 ASP B 21 22.013 -0.821 -0.048 1.00 0.00 O ATOM 1482 OD2 ASP B 21 19.849 -0.713 0.257 1.00 0.00 O ATOM 0 H ASP B 21 20.727 -4.425 -2.673 1.00 0.00 H new ATOM 0 HA ASP B 21 21.647 -3.727 -0.005 1.00 0.00 H new ATOM 0 HB2 ASP B 21 21.391 -2.217 -2.091 1.00 0.00 H new ATOM 0 HB3 ASP B 21 19.673 -2.239 -1.744 1.00 0.00 H new ATOM 1487 N THR B 22 19.574 -4.041 1.382 1.00 0.00 N ATOM 1488 CA THR B 22 18.471 -4.518 2.196 1.00 0.00 C ATOM 1489 C THR B 22 17.341 -3.500 2.267 1.00 0.00 C ATOM 1490 O THR B 22 17.569 -2.296 2.168 1.00 0.00 O ATOM 1491 CB THR B 22 18.931 -4.873 3.622 1.00 0.00 C ATOM 1492 OG1 THR B 22 19.556 -3.740 4.239 1.00 0.00 O ATOM 1493 CG2 THR B 22 19.895 -6.047 3.599 1.00 0.00 C ATOM 0 H THR B 22 20.352 -3.645 1.909 1.00 0.00 H new ATOM 0 HA THR B 22 18.098 -5.420 1.711 1.00 0.00 H new ATOM 0 HB THR B 22 18.053 -5.155 4.203 1.00 0.00 H new ATOM 0 HG1 THR B 22 19.842 -3.978 5.146 1.00 0.00 H new ATOM 0 HG21 THR B 22 20.208 -6.281 4.617 1.00 0.00 H new ATOM 0 HG22 THR B 22 19.401 -6.915 3.162 1.00 0.00 H new ATOM 0 HG23 THR B 22 20.769 -5.788 3.001 1.00 0.00 H new ATOM 1501 N ILE B 23 16.122 -3.999 2.443 1.00 0.00 N ATOM 1502 CA ILE B 23 14.944 -3.148 2.580 1.00 0.00 C ATOM 1503 C ILE B 23 15.136 -2.150 3.719 1.00 0.00 C ATOM 1504 O ILE B 23 14.680 -1.012 3.648 1.00 0.00 O ATOM 1505 CB ILE B 23 13.675 -3.988 2.850 1.00 0.00 C ATOM 1506 CG1 ILE B 23 13.518 -5.087 1.793 1.00 0.00 C ATOM 1507 CG2 ILE B 23 12.434 -3.103 2.888 1.00 0.00 C ATOM 1508 CD1 ILE B 23 13.420 -4.570 0.374 1.00 0.00 C ATOM 0 H ILE B 23 15.923 -4.998 2.495 1.00 0.00 H new ATOM 0 HA ILE B 23 14.817 -2.611 1.640 1.00 0.00 H new ATOM 0 HB ILE B 23 13.786 -4.461 3.826 1.00 0.00 H new ATOM 0 HG12 ILE B 23 14.367 -5.767 1.863 1.00 0.00 H new ATOM 0 HG13 ILE B 23 12.624 -5.669 2.019 1.00 0.00 H new ATOM 0 HG21 ILE B 23 11.554 -3.718 3.079 1.00 0.00 H new ATOM 0 HG22 ILE B 23 12.539 -2.363 3.681 1.00 0.00 H new ATOM 0 HG23 ILE B 23 12.320 -2.595 1.930 1.00 0.00 H new ATOM 0 HD11 ILE B 23 13.311 -5.410 -0.312 1.00 0.00 H new ATOM 0 HD12 ILE B 23 12.554 -3.914 0.285 1.00 0.00 H new ATOM 0 HD13 ILE B 23 14.324 -4.014 0.126 1.00 0.00 H new ATOM 1520 N ASP B 24 15.834 -2.588 4.759 1.00 0.00 N ATOM 1521 CA ASP B 24 16.121 -1.739 5.909 1.00 0.00 C ATOM 1522 C ASP B 24 17.067 -0.611 5.516 1.00 0.00 C ATOM 1523 O ASP B 24 16.904 0.534 5.945 1.00 0.00 O ATOM 1524 CB ASP B 24 16.738 -2.570 7.035 1.00 0.00 C ATOM 1525 CG ASP B 24 17.098 -1.734 8.246 1.00 0.00 C ATOM 1526 OD1 ASP B 24 16.213 -1.496 9.092 1.00 0.00 O ATOM 1527 OD2 ASP B 24 18.269 -1.328 8.363 1.00 0.00 O ATOM 0 H ASP B 24 16.214 -3.532 4.830 1.00 0.00 H new ATOM 0 HA ASP B 24 15.186 -1.303 6.260 1.00 0.00 H new ATOM 0 HB2 ASP B 24 16.037 -3.350 7.332 1.00 0.00 H new ATOM 0 HB3 ASP B 24 17.633 -3.070 6.664 1.00 0.00 H new ATOM 1532 N ASN B 25 18.043 -0.939 4.681 1.00 0.00 N ATOM 1533 CA ASN B 25 19.013 0.038 4.205 1.00 0.00 C ATOM 1534 C ASN B 25 18.337 1.014 3.241 1.00 0.00 C ATOM 1535 O ASN B 25 18.667 2.197 3.205 1.00 0.00 O ATOM 1536 CB ASN B 25 20.178 -0.679 3.514 1.00 0.00 C ATOM 1537 CG ASN B 25 21.427 0.173 3.393 1.00 0.00 C ATOM 1538 OD1 ASN B 25 21.371 1.402 3.369 1.00 0.00 O ATOM 1539 ND2 ASN B 25 22.569 -0.481 3.289 1.00 0.00 N ATOM 0 H ASN B 25 18.185 -1.881 4.317 1.00 0.00 H new ATOM 0 HA ASN B 25 19.404 0.600 5.053 1.00 0.00 H new ATOM 0 HB2 ASN B 25 20.418 -1.585 4.071 1.00 0.00 H new ATOM 0 HB3 ASN B 25 19.863 -0.991 2.518 1.00 0.00 H new ATOM 0 HD21 ASN B 25 23.444 0.033 3.185 1.00 0.00 H new ATOM 0 HD22 ASN B 25 22.577 -1.501 3.313 1.00 0.00 H new ATOM 1546 N VAL B 26 17.384 0.519 2.461 1.00 0.00 N ATOM 1547 CA VAL B 26 16.592 1.381 1.603 1.00 0.00 C ATOM 1548 C VAL B 26 15.697 2.290 2.453 1.00 0.00 C ATOM 1549 O VAL B 26 15.528 3.467 2.141 1.00 0.00 O ATOM 1550 CB VAL B 26 15.726 0.568 0.614 1.00 0.00 C ATOM 1551 CG1 VAL B 26 15.043 1.486 -0.376 1.00 0.00 C ATOM 1552 CG2 VAL B 26 16.563 -0.457 -0.133 1.00 0.00 C ATOM 0 H VAL B 26 17.144 -0.471 2.407 1.00 0.00 H new ATOM 0 HA VAL B 26 17.283 1.989 1.019 1.00 0.00 H new ATOM 0 HB VAL B 26 14.969 0.042 1.195 1.00 0.00 H new ATOM 0 HG11 VAL B 26 14.438 0.894 -1.063 1.00 0.00 H new ATOM 0 HG12 VAL B 26 14.403 2.187 0.160 1.00 0.00 H new ATOM 0 HG13 VAL B 26 15.795 2.039 -0.938 1.00 0.00 H new ATOM 0 HG21 VAL B 26 15.927 -1.014 -0.821 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.347 0.052 -0.694 1.00 0.00 H new ATOM 0 HG23 VAL B 26 17.016 -1.146 0.580 1.00 0.00 H new ATOM 1562 N LYS B 27 15.149 1.743 3.544 1.00 0.00 N ATOM 1563 CA LYS B 27 14.332 2.526 4.474 1.00 0.00 C ATOM 1564 C LYS B 27 15.114 3.715 5.025 1.00 0.00 C ATOM 1565 O LYS B 27 14.603 4.835 5.086 1.00 0.00 O ATOM 1566 CB LYS B 27 13.855 1.669 5.650 1.00 0.00 C ATOM 1567 CG LYS B 27 12.686 0.745 5.345 1.00 0.00 C ATOM 1568 CD LYS B 27 12.192 0.070 6.618 1.00 0.00 C ATOM 1569 CE LYS B 27 10.915 -0.725 6.387 1.00 0.00 C ATOM 1570 NZ LYS B 27 10.327 -1.212 7.667 1.00 0.00 N ATOM 0 H LYS B 27 15.257 0.762 3.803 1.00 0.00 H new ATOM 0 HA LYS B 27 13.469 2.884 3.912 1.00 0.00 H new ATOM 0 HB2 LYS B 27 14.692 1.066 6.002 1.00 0.00 H new ATOM 0 HB3 LYS B 27 13.571 2.330 6.469 1.00 0.00 H new ATOM 0 HG2 LYS B 27 11.875 1.313 4.890 1.00 0.00 H new ATOM 0 HG3 LYS B 27 12.991 -0.010 4.621 1.00 0.00 H new ATOM 0 HD2 LYS B 27 12.968 -0.594 7.000 1.00 0.00 H new ATOM 0 HD3 LYS B 27 12.014 0.826 7.383 1.00 0.00 H new ATOM 0 HE2 LYS B 27 10.188 -0.102 5.867 1.00 0.00 H new ATOM 0 HE3 LYS B 27 11.128 -1.575 5.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 9.327 -1.457 7.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 10.846 -2.054 7.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 10.397 -0.465 8.387 1.00 0.00 H new ATOM 1584 N SER B 28 16.352 3.463 5.433 1.00 0.00 N ATOM 1585 CA SER B 28 17.193 4.509 5.988 1.00 0.00 C ATOM 1586 C SER B 28 17.577 5.522 4.907 1.00 0.00 C ATOM 1587 O SER B 28 17.691 6.721 5.180 1.00 0.00 O ATOM 1588 CB SER B 28 18.431 3.894 6.649 1.00 0.00 C ATOM 1589 OG SER B 28 19.040 2.936 5.808 1.00 0.00 O ATOM 0 H SER B 28 16.793 2.544 5.389 1.00 0.00 H new ATOM 0 HA SER B 28 16.633 5.045 6.754 1.00 0.00 H new ATOM 0 HB2 SER B 28 19.148 4.680 6.886 1.00 0.00 H new ATOM 0 HB3 SER B 28 18.148 3.426 7.592 1.00 0.00 H new ATOM 0 HG SER B 28 18.680 3.021 4.901 1.00 0.00 H new ATOM 1595 N LYS B 29 17.750 5.039 3.676 1.00 0.00 N ATOM 1596 CA LYS B 29 17.999 5.920 2.538 1.00 0.00 C ATOM 1597 C LYS B 29 16.846 6.901 2.356 1.00 0.00 C ATOM 1598 O LYS B 29 17.063 8.092 2.156 1.00 0.00 O ATOM 1599 CB LYS B 29 18.192 5.121 1.245 1.00 0.00 C ATOM 1600 CG LYS B 29 19.491 4.335 1.182 1.00 0.00 C ATOM 1601 CD LYS B 29 19.636 3.623 -0.154 1.00 0.00 C ATOM 1602 CE LYS B 29 20.925 2.822 -0.237 1.00 0.00 C ATOM 1603 NZ LYS B 29 20.943 1.682 0.715 1.00 0.00 N ATOM 0 H LYS B 29 17.722 4.046 3.444 1.00 0.00 H new ATOM 0 HA LYS B 29 18.916 6.471 2.749 1.00 0.00 H new ATOM 0 HB2 LYS B 29 17.357 4.430 1.131 1.00 0.00 H new ATOM 0 HB3 LYS B 29 18.155 5.807 0.399 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.335 5.008 1.332 1.00 0.00 H new ATOM 0 HG3 LYS B 29 19.518 3.605 1.991 1.00 0.00 H new ATOM 0 HD2 LYS B 29 18.786 2.958 -0.304 1.00 0.00 H new ATOM 0 HD3 LYS B 29 19.613 4.357 -0.960 1.00 0.00 H new ATOM 0 HE2 LYS B 29 21.052 2.446 -1.252 1.00 0.00 H new ATOM 0 HE3 LYS B 29 21.771 3.477 -0.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 21.767 1.079 0.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 21.002 2.043 1.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 20.072 1.124 0.605 1.00 0.00 H new ATOM 1617 N ILE B 30 15.622 6.394 2.434 1.00 0.00 N ATOM 1618 CA ILE B 30 14.436 7.232 2.283 1.00 0.00 C ATOM 1619 C ILE B 30 14.303 8.194 3.463 1.00 0.00 C ATOM 1620 O ILE B 30 13.950 9.365 3.290 1.00 0.00 O ATOM 1621 CB ILE B 30 13.153 6.382 2.160 1.00 0.00 C ATOM 1622 CG1 ILE B 30 13.289 5.384 1.005 1.00 0.00 C ATOM 1623 CG2 ILE B 30 11.941 7.281 1.944 1.00 0.00 C ATOM 1624 CD1 ILE B 30 12.144 4.395 0.910 1.00 0.00 C ATOM 0 H ILE B 30 15.423 5.408 2.601 1.00 0.00 H new ATOM 0 HA ILE B 30 14.558 7.804 1.363 1.00 0.00 H new ATOM 0 HB ILE B 30 13.011 5.826 3.087 1.00 0.00 H new ATOM 0 HG12 ILE B 30 13.359 5.936 0.067 1.00 0.00 H new ATOM 0 HG13 ILE B 30 14.223 4.834 1.121 1.00 0.00 H new ATOM 0 HG21 ILE B 30 11.044 6.668 1.859 1.00 0.00 H new ATOM 0 HG22 ILE B 30 11.837 7.961 2.789 1.00 0.00 H new ATOM 0 HG23 ILE B 30 12.074 7.858 1.029 1.00 0.00 H new ATOM 0 HD11 ILE B 30 12.313 3.723 0.069 1.00 0.00 H new ATOM 0 HD12 ILE B 30 12.086 3.816 1.831 1.00 0.00 H new ATOM 0 HD13 ILE B 30 11.209 4.934 0.761 1.00 0.00 H new ATOM 1636 N GLN B 31 14.615 7.703 4.659 1.00 0.00 N ATOM 1637 CA GLN B 31 14.552 8.519 5.868 1.00 0.00 C ATOM 1638 C GLN B 31 15.504 9.708 5.768 1.00 0.00 C ATOM 1639 O GLN B 31 15.240 10.775 6.321 1.00 0.00 O ATOM 1640 CB GLN B 31 14.890 7.686 7.107 1.00 0.00 C ATOM 1641 CG GLN B 31 14.717 8.451 8.411 1.00 0.00 C ATOM 1642 CD GLN B 31 15.119 7.647 9.630 1.00 0.00 C ATOM 1643 OE1 GLN B 31 14.540 7.803 10.705 1.00 0.00 O ATOM 1644 NE2 GLN B 31 16.128 6.803 9.481 1.00 0.00 N ATOM 0 H GLN B 31 14.915 6.741 4.817 1.00 0.00 H new ATOM 0 HA GLN B 31 13.532 8.891 5.965 1.00 0.00 H new ATOM 0 HB2 GLN B 31 14.254 6.801 7.126 1.00 0.00 H new ATOM 0 HB3 GLN B 31 15.920 7.337 7.032 1.00 0.00 H new ATOM 0 HG2 GLN B 31 15.313 9.363 8.372 1.00 0.00 H new ATOM 0 HG3 GLN B 31 13.675 8.755 8.511 1.00 0.00 H new ATOM 0 HE21 GLN B 31 16.580 6.704 8.572 1.00 0.00 H new ATOM 0 HE22 GLN B 31 16.453 6.252 10.275 1.00 0.00 H new ATOM 1653 N ASP B 32 16.602 9.519 5.048 1.00 0.00 N ATOM 1654 CA ASP B 32 17.586 10.580 4.846 1.00 0.00 C ATOM 1655 C ASP B 32 16.969 11.791 4.143 1.00 0.00 C ATOM 1656 O ASP B 32 17.450 12.913 4.283 1.00 0.00 O ATOM 1657 CB ASP B 32 18.771 10.048 4.035 1.00 0.00 C ATOM 1658 CG ASP B 32 19.868 11.079 3.842 1.00 0.00 C ATOM 1659 OD1 ASP B 32 20.669 11.279 4.778 1.00 0.00 O ATOM 1660 OD2 ASP B 32 19.941 11.678 2.747 1.00 0.00 O ATOM 0 H ASP B 32 16.836 8.638 4.591 1.00 0.00 H new ATOM 0 HA ASP B 32 17.935 10.905 5.826 1.00 0.00 H new ATOM 0 HB2 ASP B 32 19.185 9.174 4.538 1.00 0.00 H new ATOM 0 HB3 ASP B 32 18.417 9.716 3.059 1.00 0.00 H new ATOM 1665 N LYS B 33 15.888 11.567 3.402 1.00 0.00 N ATOM 1666 CA LYS B 33 15.242 12.647 2.663 1.00 0.00 C ATOM 1667 C LYS B 33 14.213 13.390 3.517 1.00 0.00 C ATOM 1668 O LYS B 33 14.420 14.545 3.886 1.00 0.00 O ATOM 1669 CB LYS B 33 14.559 12.129 1.391 1.00 0.00 C ATOM 1670 CG LYS B 33 15.514 11.776 0.258 1.00 0.00 C ATOM 1671 CD LYS B 33 16.199 10.439 0.484 1.00 0.00 C ATOM 1672 CE LYS B 33 17.106 10.073 -0.680 1.00 0.00 C ATOM 1673 NZ LYS B 33 18.347 10.890 -0.707 1.00 0.00 N ATOM 0 H LYS B 33 15.444 10.655 3.297 1.00 0.00 H new ATOM 0 HA LYS B 33 16.035 13.342 2.387 1.00 0.00 H new ATOM 0 HB2 LYS B 33 13.973 11.245 1.643 1.00 0.00 H new ATOM 0 HB3 LYS B 33 13.859 12.885 1.036 1.00 0.00 H new ATOM 0 HG2 LYS B 33 14.965 11.747 -0.683 1.00 0.00 H new ATOM 0 HG3 LYS B 33 16.268 12.558 0.163 1.00 0.00 H new ATOM 0 HD2 LYS B 33 16.784 10.479 1.403 1.00 0.00 H new ATOM 0 HD3 LYS B 33 15.447 9.662 0.619 1.00 0.00 H new ATOM 0 HE2 LYS B 33 17.370 9.018 -0.614 1.00 0.00 H new ATOM 0 HE3 LYS B 33 16.564 10.208 -1.616 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 18.933 10.604 -1.517 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 18.099 11.896 -0.797 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 18.879 10.742 0.174 1.00 0.00 H new ATOM 1687 N GLU B 34 13.101 12.728 3.829 1.00 0.00 N ATOM 1688 CA GLU B 34 11.980 13.402 4.484 1.00 0.00 C ATOM 1689 C GLU B 34 11.894 13.059 5.972 1.00 0.00 C ATOM 1690 O GLU B 34 10.944 13.448 6.650 1.00 0.00 O ATOM 1691 CB GLU B 34 10.663 13.051 3.784 1.00 0.00 C ATOM 1692 CG GLU B 34 10.663 13.367 2.295 1.00 0.00 C ATOM 1693 CD GLU B 34 9.286 13.260 1.668 1.00 0.00 C ATOM 1694 OE1 GLU B 34 8.486 12.410 2.111 1.00 0.00 O ATOM 1695 OE2 GLU B 34 8.993 14.042 0.736 1.00 0.00 O ATOM 0 H GLU B 34 12.952 11.737 3.642 1.00 0.00 H new ATOM 0 HA GLU B 34 12.155 14.475 4.404 1.00 0.00 H new ATOM 0 HB2 GLU B 34 10.459 11.989 3.922 1.00 0.00 H new ATOM 0 HB3 GLU B 34 9.850 13.596 4.263 1.00 0.00 H new ATOM 0 HG2 GLU B 34 11.048 14.375 2.143 1.00 0.00 H new ATOM 0 HG3 GLU B 34 11.343 12.685 1.784 1.00 0.00 H new ATOM 1702 N GLY B 35 12.884 12.331 6.472 1.00 0.00 N ATOM 1703 CA GLY B 35 12.932 12.005 7.889 1.00 0.00 C ATOM 1704 C GLY B 35 11.867 11.009 8.303 1.00 0.00 C ATOM 1705 O GLY B 35 11.448 10.981 9.462 1.00 0.00 O ATOM 0 H GLY B 35 13.658 11.958 5.922 1.00 0.00 H new ATOM 0 HA2 GLY B 35 13.915 11.599 8.130 1.00 0.00 H new ATOM 0 HA3 GLY B 35 12.813 12.919 8.471 1.00 0.00 H new ATOM 1709 N ILE B 36 11.435 10.183 7.363 1.00 0.00 N ATOM 1710 CA ILE B 36 10.378 9.219 7.620 1.00 0.00 C ATOM 1711 C ILE B 36 10.911 8.027 8.414 1.00 0.00 C ATOM 1712 O ILE B 36 11.800 7.316 7.947 1.00 0.00 O ATOM 1713 CB ILE B 36 9.753 8.711 6.304 1.00 0.00 C ATOM 1714 CG1 ILE B 36 9.341 9.887 5.411 1.00 0.00 C ATOM 1715 CG2 ILE B 36 8.555 7.823 6.603 1.00 0.00 C ATOM 1716 CD1 ILE B 36 8.786 9.467 4.064 1.00 0.00 C ATOM 0 H ILE B 36 11.802 10.162 6.412 1.00 0.00 H new ATOM 0 HA ILE B 36 9.611 9.729 8.203 1.00 0.00 H new ATOM 0 HB ILE B 36 10.499 8.124 5.769 1.00 0.00 H new ATOM 0 HG12 ILE B 36 8.592 10.482 5.933 1.00 0.00 H new ATOM 0 HG13 ILE B 36 10.206 10.531 5.252 1.00 0.00 H new ATOM 0 HG21 ILE B 36 8.121 7.470 5.667 1.00 0.00 H new ATOM 0 HG22 ILE B 36 8.875 6.969 7.200 1.00 0.00 H new ATOM 0 HG23 ILE B 36 7.809 8.393 7.156 1.00 0.00 H new ATOM 0 HD11 ILE B 36 8.517 10.353 3.489 1.00 0.00 H new ATOM 0 HD12 ILE B 36 9.540 8.898 3.521 1.00 0.00 H new ATOM 0 HD13 ILE B 36 7.901 8.848 4.212 1.00 0.00 H new ATOM 1728 N PRO B 37 10.381 7.804 9.629 1.00 0.00 N ATOM 1729 CA PRO B 37 10.792 6.685 10.489 1.00 0.00 C ATOM 1730 C PRO B 37 10.677 5.333 9.783 1.00 0.00 C ATOM 1731 O PRO B 37 9.667 5.046 9.135 1.00 0.00 O ATOM 1732 CB PRO B 37 9.815 6.760 11.667 1.00 0.00 C ATOM 1733 CG PRO B 37 9.367 8.179 11.697 1.00 0.00 C ATOM 1734 CD PRO B 37 9.347 8.636 10.267 1.00 0.00 C ATOM 0 HA PRO B 37 11.839 6.763 10.782 1.00 0.00 H new ATOM 0 HB2 PRO B 37 8.973 6.082 11.527 1.00 0.00 H new ATOM 0 HB3 PRO B 37 10.299 6.478 12.602 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.379 8.267 12.149 1.00 0.00 H new ATOM 0 HG3 PRO B 37 10.045 8.790 12.293 1.00 0.00 H new ATOM 0 HD2 PRO B 37 8.369 8.483 9.810 1.00 0.00 H new ATOM 0 HD3 PRO B 37 9.576 9.698 10.181 1.00 0.00 H new ATOM 1742 N PRO B 38 11.717 4.491 9.902 1.00 0.00 N ATOM 1743 CA PRO B 38 11.777 3.178 9.239 1.00 0.00 C ATOM 1744 C PRO B 38 10.629 2.250 9.633 1.00 0.00 C ATOM 1745 O PRO B 38 10.127 1.491 8.804 1.00 0.00 O ATOM 1746 CB PRO B 38 13.119 2.601 9.707 1.00 0.00 C ATOM 1747 CG PRO B 38 13.922 3.785 10.115 1.00 0.00 C ATOM 1748 CD PRO B 38 12.935 4.761 10.683 1.00 0.00 C ATOM 0 HA PRO B 38 11.689 3.276 8.157 1.00 0.00 H new ATOM 0 HB2 PRO B 38 12.983 1.910 10.539 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.611 2.046 8.908 1.00 0.00 H new ATOM 0 HG2 PRO B 38 14.675 3.513 10.855 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.451 4.213 9.264 1.00 0.00 H new ATOM 0 HD2 PRO B 38 12.775 4.599 11.749 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.271 5.791 10.564 1.00 0.00 H new ATOM 1756 N ASP B 39 10.214 2.319 10.893 1.00 0.00 N ATOM 1757 CA ASP B 39 9.137 1.463 11.396 1.00 0.00 C ATOM 1758 C ASP B 39 7.806 1.816 10.738 1.00 0.00 C ATOM 1759 O ASP B 39 6.969 0.949 10.486 1.00 0.00 O ATOM 1760 CB ASP B 39 9.019 1.603 12.914 1.00 0.00 C ATOM 1761 CG ASP B 39 7.998 0.652 13.515 1.00 0.00 C ATOM 1762 OD1 ASP B 39 8.354 -0.515 13.783 1.00 0.00 O ATOM 1763 OD2 ASP B 39 6.843 1.072 13.739 1.00 0.00 O ATOM 0 H ASP B 39 10.604 2.957 11.587 1.00 0.00 H new ATOM 0 HA ASP B 39 9.381 0.430 11.147 1.00 0.00 H new ATOM 0 HB2 ASP B 39 9.992 1.418 13.368 1.00 0.00 H new ATOM 0 HB3 ASP B 39 8.742 2.628 13.159 1.00 0.00 H new ATOM 1768 N GLN B 40 7.635 3.096 10.437 1.00 0.00 N ATOM 1769 CA GLN B 40 6.413 3.585 9.812 1.00 0.00 C ATOM 1770 C GLN B 40 6.373 3.188 8.337 1.00 0.00 C ATOM 1771 O GLN B 40 5.301 3.029 7.748 1.00 0.00 O ATOM 1772 CB GLN B 40 6.340 5.109 9.944 1.00 0.00 C ATOM 1773 CG GLN B 40 5.073 5.720 9.364 1.00 0.00 C ATOM 1774 CD GLN B 40 5.109 7.236 9.327 1.00 0.00 C ATOM 1775 OE1 GLN B 40 6.294 7.800 9.154 1.00 0.00 O flip ATOM 1776 NE2 GLN B 40 4.079 7.897 9.439 1.00 0.00 N flip ATOM 0 H GLN B 40 8.332 3.819 10.617 1.00 0.00 H new ATOM 0 HA GLN B 40 5.556 3.137 10.316 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.410 5.376 10.998 1.00 0.00 H new ATOM 0 HB3 GLN B 40 7.204 5.548 9.446 1.00 0.00 H new ATOM 0 HG2 GLN B 40 4.923 5.341 8.353 1.00 0.00 H new ATOM 0 HG3 GLN B 40 4.217 5.397 9.956 1.00 0.00 H new ATOM 0 HE21 GLN B 40 3.183 7.427 9.571 1.00 0.00 H new ATOM 0 HE22 GLN B 40 4.120 8.915 9.400 1.00 0.00 H new ATOM 1785 N GLN B 41 7.554 3.014 7.758 1.00 0.00 N ATOM 1786 CA GLN B 41 7.686 2.726 6.337 1.00 0.00 C ATOM 1787 C GLN B 41 7.376 1.269 6.020 1.00 0.00 C ATOM 1788 O GLN B 41 8.027 0.359 6.531 1.00 0.00 O ATOM 1789 CB GLN B 41 9.101 3.056 5.859 1.00 0.00 C ATOM 1790 CG GLN B 41 9.405 4.543 5.791 1.00 0.00 C ATOM 1791 CD GLN B 41 10.796 4.817 5.259 1.00 0.00 C ATOM 1792 OE1 GLN B 41 11.000 4.909 4.053 1.00 0.00 O ATOM 1793 NE2 GLN B 41 11.757 4.981 6.153 1.00 0.00 N ATOM 0 H GLN B 41 8.442 3.068 8.257 1.00 0.00 H new ATOM 0 HA GLN B 41 6.961 3.350 5.814 1.00 0.00 H new ATOM 0 HB2 GLN B 41 9.818 2.580 6.528 1.00 0.00 H new ATOM 0 HB3 GLN B 41 9.249 2.621 4.871 1.00 0.00 H new ATOM 0 HG2 GLN B 41 8.670 5.034 5.153 1.00 0.00 H new ATOM 0 HG3 GLN B 41 9.305 4.979 6.785 1.00 0.00 H new ATOM 0 HE21 GLN B 41 11.548 4.897 7.148 1.00 0.00 H new ATOM 0 HE22 GLN B 41 12.707 5.192 5.848 1.00 0.00 H new ATOM 1802 N ARG B 42 6.373 1.056 5.180 1.00 0.00 N ATOM 1803 CA ARG B 42 6.101 -0.266 4.635 1.00 0.00 C ATOM 1804 C ARG B 42 6.069 -0.209 3.115 1.00 0.00 C ATOM 1805 O ARG B 42 5.207 0.440 2.523 1.00 0.00 O ATOM 1806 CB ARG B 42 4.789 -0.840 5.173 1.00 0.00 C ATOM 1807 CG ARG B 42 4.920 -1.415 6.570 1.00 0.00 C ATOM 1808 CD ARG B 42 3.663 -2.152 6.994 1.00 0.00 C ATOM 1809 NE ARG B 42 3.869 -2.913 8.223 1.00 0.00 N ATOM 1810 CZ ARG B 42 3.088 -3.921 8.617 1.00 0.00 C ATOM 1811 NH1 ARG B 42 1.987 -4.218 7.934 1.00 0.00 N ATOM 1812 NH2 ARG B 42 3.395 -4.620 9.703 1.00 0.00 N ATOM 0 H ARG B 42 5.733 1.783 4.861 1.00 0.00 H new ATOM 0 HA ARG B 42 6.905 -0.929 4.952 1.00 0.00 H new ATOM 0 HB2 ARG B 42 4.032 -0.056 5.179 1.00 0.00 H new ATOM 0 HB3 ARG B 42 4.436 -1.619 4.497 1.00 0.00 H new ATOM 0 HG2 ARG B 42 5.770 -2.096 6.605 1.00 0.00 H new ATOM 0 HG3 ARG B 42 5.126 -0.611 7.277 1.00 0.00 H new ATOM 0 HD2 ARG B 42 2.854 -1.436 7.141 1.00 0.00 H new ATOM 0 HD3 ARG B 42 3.351 -2.827 6.197 1.00 0.00 H new ATOM 0 HE ARG B 42 4.658 -2.659 8.817 1.00 0.00 H new ATOM 0 HH11 ARG B 42 1.738 -3.675 7.107 1.00 0.00 H new ATOM 0 HH12 ARG B 42 1.391 -4.989 8.237 1.00 0.00 H new ATOM 0 HH21 ARG B 42 4.231 -4.387 10.240 1.00 0.00 H new ATOM 0 HH22 ARG B 42 2.795 -5.390 10.001 1.00 0.00 H new ATOM 1826 N LEU B 43 7.028 -0.875 2.493 1.00 0.00 N ATOM 1827 CA LEU B 43 7.125 -0.891 1.043 1.00 0.00 C ATOM 1828 C LEU B 43 6.298 -2.031 0.464 1.00 0.00 C ATOM 1829 O LEU B 43 6.424 -3.181 0.887 1.00 0.00 O ATOM 1830 CB LEU B 43 8.584 -1.026 0.604 1.00 0.00 C ATOM 1831 CG LEU B 43 9.479 0.173 0.924 1.00 0.00 C ATOM 1832 CD1 LEU B 43 10.932 -0.146 0.618 1.00 0.00 C ATOM 1833 CD2 LEU B 43 9.035 1.391 0.133 1.00 0.00 C ATOM 0 H LEU B 43 7.751 -1.412 2.971 1.00 0.00 H new ATOM 0 HA LEU B 43 6.732 0.053 0.665 1.00 0.00 H new ATOM 0 HB2 LEU B 43 9.008 -1.911 1.078 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.608 -1.199 -0.472 1.00 0.00 H new ATOM 0 HG LEU B 43 9.388 0.392 1.988 1.00 0.00 H new ATOM 0 HD11 LEU B 43 11.552 0.720 0.852 1.00 0.00 H new ATOM 0 HD12 LEU B 43 11.253 -0.996 1.221 1.00 0.00 H new ATOM 0 HD13 LEU B 43 11.036 -0.391 -0.439 1.00 0.00 H new ATOM 0 HD21 LEU B 43 9.682 2.235 0.372 1.00 0.00 H new ATOM 0 HD22 LEU B 43 9.099 1.175 -0.934 1.00 0.00 H new ATOM 0 HD23 LEU B 43 8.005 1.638 0.392 1.00 0.00 H new ATOM 1845 N ILE B 44 5.439 -1.700 -0.485 1.00 0.00 N ATOM 1846 CA ILE B 44 4.622 -2.698 -1.154 1.00 0.00 C ATOM 1847 C ILE B 44 4.953 -2.746 -2.641 1.00 0.00 C ATOM 1848 O ILE B 44 4.802 -1.751 -3.360 1.00 0.00 O ATOM 1849 CB ILE B 44 3.115 -2.414 -0.967 1.00 0.00 C ATOM 1850 CG1 ILE B 44 2.758 -2.407 0.523 1.00 0.00 C ATOM 1851 CG2 ILE B 44 2.279 -3.446 -1.712 1.00 0.00 C ATOM 1852 CD1 ILE B 44 1.313 -2.053 0.802 1.00 0.00 C ATOM 0 H ILE B 44 5.289 -0.745 -0.810 1.00 0.00 H new ATOM 0 HA ILE B 44 4.847 -3.663 -0.701 1.00 0.00 H new ATOM 0 HB ILE B 44 2.893 -1.431 -1.382 1.00 0.00 H new ATOM 0 HG12 ILE B 44 2.969 -3.391 0.943 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.403 -1.695 1.039 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.220 -3.229 -1.568 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.516 -3.408 -2.775 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.501 -4.441 -1.327 1.00 0.00 H new ATOM 0 HD11 ILE B 44 1.136 -2.069 1.877 1.00 0.00 H new ATOM 0 HD12 ILE B 44 1.101 -1.057 0.414 1.00 0.00 H new ATOM 0 HD13 ILE B 44 0.660 -2.778 0.316 1.00 0.00 H new ATOM 1864 N PHE B 45 5.414 -3.900 -3.097 1.00 0.00 N ATOM 1865 CA PHE B 45 5.765 -4.084 -4.496 1.00 0.00 C ATOM 1866 C PHE B 45 4.731 -4.964 -5.185 1.00 0.00 C ATOM 1867 O PHE B 45 4.766 -6.186 -5.059 1.00 0.00 O ATOM 1868 CB PHE B 45 7.162 -4.702 -4.622 1.00 0.00 C ATOM 1869 CG PHE B 45 7.585 -4.972 -6.040 1.00 0.00 C ATOM 1870 CD1 PHE B 45 7.762 -3.931 -6.936 1.00 0.00 C ATOM 1871 CD2 PHE B 45 7.799 -6.271 -6.479 1.00 0.00 C ATOM 1872 CE1 PHE B 45 8.147 -4.176 -8.240 1.00 0.00 C ATOM 1873 CE2 PHE B 45 8.184 -6.523 -7.781 1.00 0.00 C ATOM 1874 CZ PHE B 45 8.358 -5.474 -8.662 1.00 0.00 C ATOM 0 H PHE B 45 5.554 -4.726 -2.516 1.00 0.00 H new ATOM 0 HA PHE B 45 5.775 -3.109 -4.984 1.00 0.00 H new ATOM 0 HB2 PHE B 45 7.887 -4.033 -4.158 1.00 0.00 H new ATOM 0 HB3 PHE B 45 7.187 -5.637 -4.062 1.00 0.00 H new ATOM 0 HD1 PHE B 45 7.597 -2.914 -6.611 1.00 0.00 H new ATOM 0 HD2 PHE B 45 7.663 -7.095 -5.794 1.00 0.00 H new ATOM 0 HE1 PHE B 45 8.283 -3.354 -8.928 1.00 0.00 H new ATOM 0 HE2 PHE B 45 8.349 -7.539 -8.110 1.00 0.00 H new ATOM 0 HZ PHE B 45 8.659 -5.669 -9.681 1.00 0.00 H new ATOM 1884 N ALA B 46 3.783 -4.323 -5.868 1.00 0.00 N ATOM 1885 CA ALA B 46 2.749 -5.027 -6.633 1.00 0.00 C ATOM 1886 C ALA B 46 1.910 -5.950 -5.747 1.00 0.00 C ATOM 1887 O ALA B 46 1.242 -6.857 -6.239 1.00 0.00 O ATOM 1888 CB ALA B 46 3.383 -5.815 -7.770 1.00 0.00 C ATOM 0 H ALA B 46 3.708 -3.307 -5.908 1.00 0.00 H new ATOM 0 HA ALA B 46 2.077 -4.276 -7.048 1.00 0.00 H new ATOM 0 HB1 ALA B 46 2.606 -6.334 -8.331 1.00 0.00 H new ATOM 0 HB2 ALA B 46 3.915 -5.133 -8.433 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.083 -6.544 -7.362 1.00 0.00 H new ATOM 1894 N GLY B 47 1.937 -5.702 -4.445 1.00 0.00 N ATOM 1895 CA GLY B 47 1.182 -6.522 -3.519 1.00 0.00 C ATOM 1896 C GLY B 47 2.076 -7.243 -2.536 1.00 0.00 C ATOM 1897 O GLY B 47 1.620 -7.698 -1.486 1.00 0.00 O ATOM 0 H GLY B 47 2.469 -4.947 -4.013 1.00 0.00 H new ATOM 0 HA2 GLY B 47 0.476 -5.896 -2.974 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.596 -7.252 -4.077 1.00 0.00 H new ATOM 1901 N LYS B 48 3.355 -7.345 -2.880 1.00 0.00 N ATOM 1902 CA LYS B 48 4.328 -8.010 -2.023 1.00 0.00 C ATOM 1903 C LYS B 48 4.699 -7.122 -0.841 1.00 0.00 C ATOM 1904 O LYS B 48 4.963 -5.928 -1.009 1.00 0.00 O ATOM 1905 CB LYS B 48 5.591 -8.356 -2.817 1.00 0.00 C ATOM 1906 CG LYS B 48 5.328 -9.156 -4.081 1.00 0.00 C ATOM 1907 CD LYS B 48 6.621 -9.451 -4.825 1.00 0.00 C ATOM 1908 CE LYS B 48 6.358 -10.098 -6.176 1.00 0.00 C ATOM 1909 NZ LYS B 48 5.556 -11.343 -6.055 1.00 0.00 N ATOM 0 H LYS B 48 3.742 -6.975 -3.748 1.00 0.00 H new ATOM 0 HA LYS B 48 3.876 -8.928 -1.649 1.00 0.00 H new ATOM 0 HB2 LYS B 48 6.104 -7.432 -3.085 1.00 0.00 H new ATOM 0 HB3 LYS B 48 6.267 -8.922 -2.176 1.00 0.00 H new ATOM 0 HG2 LYS B 48 4.831 -10.092 -3.825 1.00 0.00 H new ATOM 0 HG3 LYS B 48 4.650 -8.602 -4.730 1.00 0.00 H new ATOM 0 HD2 LYS B 48 7.178 -8.525 -4.967 1.00 0.00 H new ATOM 0 HD3 LYS B 48 7.246 -10.110 -4.222 1.00 0.00 H new ATOM 0 HE2 LYS B 48 5.834 -9.391 -6.820 1.00 0.00 H new ATOM 0 HE3 LYS B 48 7.308 -10.325 -6.659 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 5.502 -11.812 -6.981 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 6.008 -11.982 -5.369 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 4.597 -11.108 -5.729 1.00 0.00 H new ATOM 1923 N GLN B 49 4.713 -7.710 0.345 1.00 0.00 N ATOM 1924 CA GLN B 49 5.081 -6.995 1.558 1.00 0.00 C ATOM 1925 C GLN B 49 6.592 -7.069 1.777 1.00 0.00 C ATOM 1926 O GLN B 49 7.153 -8.151 1.951 1.00 0.00 O ATOM 1927 CB GLN B 49 4.303 -7.576 2.752 1.00 0.00 C ATOM 1928 CG GLN B 49 4.728 -7.050 4.118 1.00 0.00 C ATOM 1929 CD GLN B 49 5.783 -7.920 4.775 1.00 0.00 C ATOM 1930 OE1 GLN B 49 5.837 -9.129 4.551 1.00 0.00 O ATOM 1931 NE2 GLN B 49 6.618 -7.317 5.600 1.00 0.00 N ATOM 0 H GLN B 49 4.471 -8.690 0.494 1.00 0.00 H new ATOM 0 HA GLN B 49 4.817 -5.942 1.460 1.00 0.00 H new ATOM 0 HB2 GLN B 49 3.243 -7.365 2.612 1.00 0.00 H new ATOM 0 HB3 GLN B 49 4.416 -8.660 2.746 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.114 -6.037 4.009 1.00 0.00 H new ATOM 0 HG3 GLN B 49 3.855 -6.990 4.768 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.541 -6.312 5.759 1.00 0.00 H new ATOM 0 HE22 GLN B 49 7.340 -7.855 6.078 1.00 0.00 H new ATOM 1940 N LEU B 50 7.247 -5.918 1.738 1.00 0.00 N ATOM 1941 CA LEU B 50 8.693 -5.854 1.900 1.00 0.00 C ATOM 1942 C LEU B 50 9.083 -5.747 3.371 1.00 0.00 C ATOM 1943 O LEU B 50 8.840 -4.728 4.019 1.00 0.00 O ATOM 1944 CB LEU B 50 9.278 -4.669 1.122 1.00 0.00 C ATOM 1945 CG LEU B 50 9.502 -4.893 -0.381 1.00 0.00 C ATOM 1946 CD1 LEU B 50 8.197 -5.194 -1.104 1.00 0.00 C ATOM 1947 CD2 LEU B 50 10.171 -3.674 -0.992 1.00 0.00 C ATOM 0 H LEU B 50 6.799 -5.013 1.595 1.00 0.00 H new ATOM 0 HA LEU B 50 9.105 -6.780 1.499 1.00 0.00 H new ATOM 0 HB2 LEU B 50 8.613 -3.815 1.246 1.00 0.00 H new ATOM 0 HB3 LEU B 50 10.232 -4.399 1.575 1.00 0.00 H new ATOM 0 HG LEU B 50 10.152 -5.760 -0.498 1.00 0.00 H new ATOM 0 HD11 LEU B 50 8.396 -5.347 -2.165 1.00 0.00 H new ATOM 0 HD12 LEU B 50 7.749 -6.095 -0.686 1.00 0.00 H new ATOM 0 HD13 LEU B 50 7.511 -4.356 -0.980 1.00 0.00 H new ATOM 0 HD21 LEU B 50 10.327 -3.840 -2.058 1.00 0.00 H new ATOM 0 HD22 LEU B 50 9.535 -2.800 -0.850 1.00 0.00 H new ATOM 0 HD23 LEU B 50 11.132 -3.505 -0.507 1.00 0.00 H new ATOM 1959 N GLU B 51 9.681 -6.812 3.886 1.00 0.00 N ATOM 1960 CA GLU B 51 10.169 -6.837 5.254 1.00 0.00 C ATOM 1961 C GLU B 51 11.571 -6.256 5.326 1.00 0.00 C ATOM 1962 O GLU B 51 12.403 -6.492 4.445 1.00 0.00 O ATOM 1963 CB GLU B 51 10.173 -8.272 5.778 1.00 0.00 C ATOM 1964 CG GLU B 51 10.796 -8.434 7.155 1.00 0.00 C ATOM 1965 CD GLU B 51 9.926 -7.877 8.261 1.00 0.00 C ATOM 1966 OE1 GLU B 51 9.867 -6.642 8.414 1.00 0.00 O ATOM 1967 OE2 GLU B 51 9.297 -8.679 8.988 1.00 0.00 O ATOM 0 H GLU B 51 9.840 -7.677 3.370 1.00 0.00 H new ATOM 0 HA GLU B 51 9.507 -6.231 5.873 1.00 0.00 H new ATOM 0 HB2 GLU B 51 9.146 -8.637 5.811 1.00 0.00 H new ATOM 0 HB3 GLU B 51 10.713 -8.903 5.072 1.00 0.00 H new ATOM 0 HG2 GLU B 51 10.982 -9.492 7.343 1.00 0.00 H new ATOM 0 HG3 GLU B 51 11.764 -7.932 7.172 1.00 0.00 H new ATOM 1974 N ASP B 52 11.839 -5.511 6.381 1.00 0.00 N ATOM 1975 CA ASP B 52 13.152 -4.910 6.559 1.00 0.00 C ATOM 1976 C ASP B 52 14.128 -5.937 7.113 1.00 0.00 C ATOM 1977 O ASP B 52 13.942 -6.479 8.199 1.00 0.00 O ATOM 1978 CB ASP B 52 13.103 -3.654 7.444 1.00 0.00 C ATOM 1979 CG ASP B 52 12.372 -3.849 8.758 1.00 0.00 C ATOM 1980 OD1 ASP B 52 13.003 -4.273 9.745 1.00 0.00 O ATOM 1981 OD2 ASP B 52 11.164 -3.537 8.810 1.00 0.00 O ATOM 0 H ASP B 52 11.172 -5.307 7.125 1.00 0.00 H new ATOM 0 HA ASP B 52 13.503 -4.585 5.579 1.00 0.00 H new ATOM 0 HB2 ASP B 52 14.123 -3.330 7.653 1.00 0.00 H new ATOM 0 HB3 ASP B 52 12.621 -2.850 6.888 1.00 0.00 H new ATOM 1986 N GLY B 53 15.149 -6.225 6.328 1.00 0.00 N ATOM 1987 CA GLY B 53 16.106 -7.249 6.685 1.00 0.00 C ATOM 1988 C GLY B 53 16.519 -8.039 5.468 1.00 0.00 C ATOM 1989 O GLY B 53 17.667 -8.459 5.344 1.00 0.00 O ATOM 0 H GLY B 53 15.335 -5.762 5.438 1.00 0.00 H new ATOM 0 HA2 GLY B 53 16.983 -6.791 7.142 1.00 0.00 H new ATOM 0 HA3 GLY B 53 15.671 -7.917 7.428 1.00 0.00 H new ATOM 1993 N ARG B 54 15.570 -8.225 4.559 1.00 0.00 N ATOM 1994 CA ARG B 54 15.841 -8.889 3.293 1.00 0.00 C ATOM 1995 C ARG B 54 16.319 -7.870 2.270 1.00 0.00 C ATOM 1996 O ARG B 54 16.364 -6.674 2.561 1.00 0.00 O ATOM 1997 CB ARG B 54 14.588 -9.600 2.779 1.00 0.00 C ATOM 1998 CG ARG B 54 14.078 -10.674 3.719 1.00 0.00 C ATOM 1999 CD ARG B 54 15.153 -11.707 4.008 1.00 0.00 C ATOM 2000 NE ARG B 54 14.681 -12.747 4.919 1.00 0.00 N ATOM 2001 CZ ARG B 54 15.463 -13.685 5.447 1.00 0.00 C ATOM 2002 NH1 ARG B 54 16.771 -13.689 5.199 1.00 0.00 N ATOM 2003 NH2 ARG B 54 14.939 -14.614 6.233 1.00 0.00 N ATOM 0 H ARG B 54 14.603 -7.924 4.677 1.00 0.00 H new ATOM 0 HA ARG B 54 16.620 -9.635 3.449 1.00 0.00 H new ATOM 0 HB2 ARG B 54 13.801 -8.863 2.619 1.00 0.00 H new ATOM 0 HB3 ARG B 54 14.806 -10.049 1.810 1.00 0.00 H new ATOM 0 HG2 ARG B 54 13.748 -10.217 4.652 1.00 0.00 H new ATOM 0 HG3 ARG B 54 13.209 -11.163 3.279 1.00 0.00 H new ATOM 0 HD2 ARG B 54 15.478 -12.164 3.073 1.00 0.00 H new ATOM 0 HD3 ARG B 54 16.023 -11.213 4.441 1.00 0.00 H new ATOM 0 HE ARG B 54 13.691 -12.754 5.165 1.00 0.00 H new ATOM 0 HH11 ARG B 54 17.179 -12.970 4.601 1.00 0.00 H new ATOM 0 HH12 ARG B 54 17.365 -14.411 5.607 1.00 0.00 H new ATOM 0 HH21 ARG B 54 13.939 -14.609 6.432 1.00 0.00 H new ATOM 0 HH22 ARG B 54 15.536 -15.334 6.639 1.00 0.00 H new ATOM 2017 N THR B 55 16.662 -8.335 1.081 1.00 0.00 N ATOM 2018 CA THR B 55 17.177 -7.459 0.043 1.00 0.00 C ATOM 2019 C THR B 55 16.115 -7.197 -1.020 1.00 0.00 C ATOM 2020 O THR B 55 15.003 -7.726 -0.945 1.00 0.00 O ATOM 2021 CB THR B 55 18.427 -8.065 -0.631 1.00 0.00 C ATOM 2022 OG1 THR B 55 18.092 -9.293 -1.295 1.00 0.00 O ATOM 2023 CG2 THR B 55 19.521 -8.324 0.394 1.00 0.00 C ATOM 0 H THR B 55 16.593 -9.316 0.810 1.00 0.00 H new ATOM 0 HA THR B 55 17.452 -6.519 0.521 1.00 0.00 H new ATOM 0 HB THR B 55 18.794 -7.348 -1.365 1.00 0.00 H new ATOM 0 HG1 THR B 55 17.740 -9.933 -0.641 1.00 0.00 H new ATOM 0 HG21 THR B 55 20.392 -8.751 -0.103 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.800 -7.386 0.873 1.00 0.00 H new ATOM 0 HG23 THR B 55 19.156 -9.021 1.148 1.00 0.00 H new ATOM 2031 N LEU B 56 16.459 -6.386 -2.010 1.00 0.00 N ATOM 2032 CA LEU B 56 15.561 -6.117 -3.124 1.00 0.00 C ATOM 2033 C LEU B 56 15.441 -7.347 -4.019 1.00 0.00 C ATOM 2034 O LEU B 56 14.411 -7.573 -4.660 1.00 0.00 O ATOM 2035 CB LEU B 56 16.067 -4.930 -3.944 1.00 0.00 C ATOM 2036 CG LEU B 56 16.189 -3.609 -3.180 1.00 0.00 C ATOM 2037 CD1 LEU B 56 16.693 -2.513 -4.099 1.00 0.00 C ATOM 2038 CD2 LEU B 56 14.855 -3.212 -2.567 1.00 0.00 C ATOM 0 H LEU B 56 17.355 -5.902 -2.065 1.00 0.00 H new ATOM 0 HA LEU B 56 14.578 -5.875 -2.719 1.00 0.00 H new ATOM 0 HB2 LEU B 56 17.044 -5.184 -4.355 1.00 0.00 H new ATOM 0 HB3 LEU B 56 15.395 -4.781 -4.789 1.00 0.00 H new ATOM 0 HG LEU B 56 16.908 -3.748 -2.372 1.00 0.00 H new ATOM 0 HD11 LEU B 56 16.775 -1.580 -3.542 1.00 0.00 H new ATOM 0 HD12 LEU B 56 17.672 -2.788 -4.491 1.00 0.00 H new ATOM 0 HD13 LEU B 56 15.995 -2.382 -4.926 1.00 0.00 H new ATOM 0 HD21 LEU B 56 14.967 -2.270 -2.030 1.00 0.00 H new ATOM 0 HD22 LEU B 56 14.113 -3.093 -3.356 1.00 0.00 H new ATOM 0 HD23 LEU B 56 14.527 -3.988 -1.875 1.00 0.00 H new ATOM 2050 N SER B 57 16.499 -8.149 -4.040 1.00 0.00 N ATOM 2051 CA SER B 57 16.549 -9.345 -4.869 1.00 0.00 C ATOM 2052 C SER B 57 15.531 -10.379 -4.388 1.00 0.00 C ATOM 2053 O SER B 57 15.023 -11.179 -5.179 1.00 0.00 O ATOM 2054 CB SER B 57 17.965 -9.935 -4.851 1.00 0.00 C ATOM 2055 OG SER B 57 18.099 -10.997 -5.780 1.00 0.00 O ATOM 0 H SER B 57 17.341 -7.989 -3.486 1.00 0.00 H new ATOM 0 HA SER B 57 16.294 -9.071 -5.893 1.00 0.00 H new ATOM 0 HB2 SER B 57 18.688 -9.154 -5.084 1.00 0.00 H new ATOM 0 HB3 SER B 57 18.197 -10.296 -3.849 1.00 0.00 H new ATOM 0 HG SER B 57 19.013 -11.349 -5.744 1.00 0.00 H new ATOM 2061 N ASP B 58 15.208 -10.332 -3.098 1.00 0.00 N ATOM 2062 CA ASP B 58 14.266 -11.278 -2.499 1.00 0.00 C ATOM 2063 C ASP B 58 12.866 -11.115 -3.081 1.00 0.00 C ATOM 2064 O ASP B 58 12.057 -12.046 -3.047 1.00 0.00 O ATOM 2065 CB ASP B 58 14.208 -11.105 -0.978 1.00 0.00 C ATOM 2066 CG ASP B 58 15.465 -11.585 -0.282 1.00 0.00 C ATOM 2067 OD1 ASP B 58 15.571 -12.801 -0.017 1.00 0.00 O ATOM 2068 OD2 ASP B 58 16.347 -10.752 0.009 1.00 0.00 O ATOM 0 H ASP B 58 15.586 -9.647 -2.444 1.00 0.00 H new ATOM 0 HA ASP B 58 14.627 -12.280 -2.732 1.00 0.00 H new ATOM 0 HB2 ASP B 58 14.048 -10.053 -0.743 1.00 0.00 H new ATOM 0 HB3 ASP B 58 13.351 -11.653 -0.587 1.00 0.00 H new ATOM 2073 N TYR B 59 12.581 -9.934 -3.616 1.00 0.00 N ATOM 2074 CA TYR B 59 11.268 -9.655 -4.185 1.00 0.00 C ATOM 2075 C TYR B 59 11.364 -9.252 -5.653 1.00 0.00 C ATOM 2076 O TYR B 59 10.428 -8.671 -6.201 1.00 0.00 O ATOM 2077 CB TYR B 59 10.550 -8.572 -3.376 1.00 0.00 C ATOM 2078 CG TYR B 59 10.064 -9.060 -2.030 1.00 0.00 C ATOM 2079 CD1 TYR B 59 9.068 -10.023 -1.950 1.00 0.00 C ATOM 2080 CD2 TYR B 59 10.600 -8.570 -0.845 1.00 0.00 C ATOM 2081 CE1 TYR B 59 8.617 -10.484 -0.731 1.00 0.00 C ATOM 2082 CE2 TYR B 59 10.153 -9.028 0.381 1.00 0.00 C ATOM 2083 CZ TYR B 59 9.160 -9.986 0.431 1.00 0.00 C ATOM 2084 OH TYR B 59 8.708 -10.446 1.647 1.00 0.00 O ATOM 0 H TYR B 59 13.239 -9.156 -3.668 1.00 0.00 H new ATOM 0 HA TYR B 59 10.685 -10.575 -4.134 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.226 -7.730 -3.228 1.00 0.00 H new ATOM 0 HB3 TYR B 59 9.700 -8.202 -3.950 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.638 -10.418 -2.859 1.00 0.00 H new ATOM 0 HD2 TYR B 59 11.377 -7.821 -0.882 1.00 0.00 H new ATOM 0 HE1 TYR B 59 7.840 -11.233 -0.689 1.00 0.00 H new ATOM 0 HE2 TYR B 59 10.578 -8.638 1.294 1.00 0.00 H new ATOM 0 HH TYR B 59 8.100 -9.786 2.041 1.00 0.00 H new ATOM 2094 N ASN B 60 12.494 -9.585 -6.284 1.00 0.00 N ATOM 2095 CA ASN B 60 12.687 -9.353 -7.724 1.00 0.00 C ATOM 2096 C ASN B 60 12.624 -7.869 -8.071 1.00 0.00 C ATOM 2097 O ASN B 60 12.232 -7.496 -9.179 1.00 0.00 O ATOM 2098 CB ASN B 60 11.630 -10.113 -8.533 1.00 0.00 C ATOM 2099 CG ASN B 60 11.795 -11.621 -8.469 1.00 0.00 C ATOM 2100 OD1 ASN B 60 13.033 -12.091 -8.462 1.00 0.00 O flip ATOM 2101 ND2 ASN B 60 10.812 -12.361 -8.442 1.00 0.00 N flip ATOM 0 H ASN B 60 13.293 -10.018 -5.821 1.00 0.00 H new ATOM 0 HA ASN B 60 13.680 -9.721 -7.981 1.00 0.00 H new ATOM 0 HB2 ASN B 60 10.639 -9.847 -8.164 1.00 0.00 H new ATOM 0 HB3 ASN B 60 11.679 -9.793 -9.574 1.00 0.00 H new ATOM 0 HD21 ASN B 60 9.873 -11.962 -8.449 1.00 0.00 H new ATOM 0 HD22 ASN B 60 10.936 -13.373 -8.413 1.00 0.00 H new ATOM 2108 N ILE B 61 13.036 -7.025 -7.137 1.00 0.00 N ATOM 2109 CA ILE B 61 12.978 -5.585 -7.333 1.00 0.00 C ATOM 2110 C ILE B 61 14.131 -5.117 -8.217 1.00 0.00 C ATOM 2111 O ILE B 61 15.279 -5.031 -7.779 1.00 0.00 O ATOM 2112 CB ILE B 61 13.004 -4.839 -5.987 1.00 0.00 C ATOM 2113 CG1 ILE B 61 11.855 -5.336 -5.106 1.00 0.00 C ATOM 2114 CG2 ILE B 61 12.904 -3.334 -6.203 1.00 0.00 C ATOM 2115 CD1 ILE B 61 11.897 -4.804 -3.693 1.00 0.00 C ATOM 0 H ILE B 61 13.415 -7.313 -6.235 1.00 0.00 H new ATOM 0 HA ILE B 61 12.037 -5.355 -7.832 1.00 0.00 H new ATOM 0 HB ILE B 61 13.951 -5.042 -5.486 1.00 0.00 H new ATOM 0 HG12 ILE B 61 10.908 -5.050 -5.564 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.878 -6.425 -5.075 1.00 0.00 H new ATOM 0 HG21 ILE B 61 12.924 -2.826 -5.239 1.00 0.00 H new ATOM 0 HG22 ILE B 61 13.745 -2.997 -6.809 1.00 0.00 H new ATOM 0 HG23 ILE B 61 11.971 -3.101 -6.716 1.00 0.00 H new ATOM 0 HD11 ILE B 61 11.052 -5.200 -3.130 1.00 0.00 H new ATOM 0 HD12 ILE B 61 12.827 -5.112 -3.216 1.00 0.00 H new ATOM 0 HD13 ILE B 61 11.842 -3.716 -3.712 1.00 0.00 H new ATOM 2127 N GLN B 62 13.807 -4.848 -9.473 1.00 0.00 N ATOM 2128 CA GLN B 62 14.788 -4.432 -10.464 1.00 0.00 C ATOM 2129 C GLN B 62 14.755 -2.916 -10.642 1.00 0.00 C ATOM 2130 O GLN B 62 14.069 -2.217 -9.893 1.00 0.00 O ATOM 2131 CB GLN B 62 14.488 -5.132 -11.788 1.00 0.00 C ATOM 2132 CG GLN B 62 14.481 -6.645 -11.676 1.00 0.00 C ATOM 2133 CD GLN B 62 14.025 -7.319 -12.950 1.00 0.00 C ATOM 2134 OE1 GLN B 62 14.829 -7.631 -13.824 1.00 0.00 O ATOM 2135 NE2 GLN B 62 12.727 -7.544 -13.064 1.00 0.00 N ATOM 0 H GLN B 62 12.855 -4.912 -9.834 1.00 0.00 H new ATOM 0 HA GLN B 62 15.786 -4.710 -10.126 1.00 0.00 H new ATOM 0 HB2 GLN B 62 13.519 -4.797 -12.157 1.00 0.00 H new ATOM 0 HB3 GLN B 62 15.231 -4.832 -12.527 1.00 0.00 H new ATOM 0 HG2 GLN B 62 15.483 -6.992 -11.424 1.00 0.00 H new ATOM 0 HG3 GLN B 62 13.826 -6.942 -10.857 1.00 0.00 H new ATOM 0 HE21 GLN B 62 12.094 -7.269 -12.313 1.00 0.00 H new ATOM 0 HE22 GLN B 62 12.359 -7.993 -13.903 1.00 0.00 H new ATOM 2144 N LYS B 63 15.480 -2.402 -11.629 1.00 0.00 N ATOM 2145 CA LYS B 63 15.509 -0.963 -11.861 1.00 0.00 C ATOM 2146 C LYS B 63 14.189 -0.471 -12.436 1.00 0.00 C ATOM 2147 O LYS B 63 13.526 -1.176 -13.199 1.00 0.00 O ATOM 2148 CB LYS B 63 16.669 -0.557 -12.777 1.00 0.00 C ATOM 2149 CG LYS B 63 16.695 -1.262 -14.121 1.00 0.00 C ATOM 2150 CD LYS B 63 17.885 -0.809 -14.953 1.00 0.00 C ATOM 2151 CE LYS B 63 17.708 0.612 -15.472 1.00 0.00 C ATOM 2152 NZ LYS B 63 16.726 0.683 -16.586 1.00 0.00 N ATOM 0 H LYS B 63 16.048 -2.952 -12.273 1.00 0.00 H new ATOM 0 HA LYS B 63 15.664 -0.489 -10.892 1.00 0.00 H new ATOM 0 HB2 LYS B 63 16.620 0.518 -12.947 1.00 0.00 H new ATOM 0 HB3 LYS B 63 17.608 -0.755 -12.260 1.00 0.00 H new ATOM 0 HG2 LYS B 63 16.743 -2.340 -13.969 1.00 0.00 H new ATOM 0 HG3 LYS B 63 15.771 -1.057 -14.661 1.00 0.00 H new ATOM 0 HD2 LYS B 63 18.792 -0.865 -14.350 1.00 0.00 H new ATOM 0 HD3 LYS B 63 18.019 -1.489 -15.795 1.00 0.00 H new ATOM 0 HE2 LYS B 63 17.378 1.256 -14.657 1.00 0.00 H new ATOM 0 HE3 LYS B 63 18.670 0.995 -15.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 17.158 1.166 -17.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 16.445 -0.279 -16.863 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 15.886 1.212 -16.275 1.00 0.00 H new ATOM 2166 N GLU B 64 13.817 0.740 -12.030 1.00 0.00 N ATOM 2167 CA GLU B 64 12.593 1.397 -12.476 1.00 0.00 C ATOM 2168 C GLU B 64 11.347 0.680 -11.961 1.00 0.00 C ATOM 2169 O GLU B 64 10.241 0.895 -12.462 1.00 0.00 O ATOM 2170 CB GLU B 64 12.570 1.527 -14.000 1.00 0.00 C ATOM 2171 CG GLU B 64 13.683 2.414 -14.533 1.00 0.00 C ATOM 2172 CD GLU B 64 13.581 2.648 -16.020 1.00 0.00 C ATOM 2173 OE1 GLU B 64 12.886 3.598 -16.429 1.00 0.00 O ATOM 2174 OE2 GLU B 64 14.197 1.886 -16.789 1.00 0.00 O ATOM 0 H GLU B 64 14.364 1.299 -11.375 1.00 0.00 H new ATOM 0 HA GLU B 64 12.583 2.401 -12.051 1.00 0.00 H new ATOM 0 HB2 GLU B 64 12.657 0.536 -14.446 1.00 0.00 H new ATOM 0 HB3 GLU B 64 11.608 1.933 -14.311 1.00 0.00 H new ATOM 0 HG2 GLU B 64 13.656 3.373 -14.016 1.00 0.00 H new ATOM 0 HG3 GLU B 64 14.646 1.957 -14.307 1.00 0.00 H new ATOM 2181 N SER B 65 11.527 -0.151 -10.944 1.00 0.00 N ATOM 2182 CA SER B 65 10.403 -0.790 -10.279 1.00 0.00 C ATOM 2183 C SER B 65 9.739 0.202 -9.331 1.00 0.00 C ATOM 2184 O SER B 65 10.422 0.981 -8.665 1.00 0.00 O ATOM 2185 CB SER B 65 10.867 -2.027 -9.512 1.00 0.00 C ATOM 2186 OG SER B 65 11.554 -2.922 -10.367 1.00 0.00 O ATOM 0 H SER B 65 12.440 -0.398 -10.563 1.00 0.00 H new ATOM 0 HA SER B 65 9.680 -1.106 -11.031 1.00 0.00 H new ATOM 0 HB2 SER B 65 11.520 -1.728 -8.692 1.00 0.00 H new ATOM 0 HB3 SER B 65 10.007 -2.529 -9.069 1.00 0.00 H new ATOM 0 HG SER B 65 12.449 -2.571 -10.557 1.00 0.00 H new ATOM 2192 N THR B 66 8.417 0.185 -9.288 1.00 0.00 N ATOM 2193 CA THR B 66 7.677 1.127 -8.469 1.00 0.00 C ATOM 2194 C THR B 66 7.358 0.539 -7.097 1.00 0.00 C ATOM 2195 O THR B 66 6.454 -0.286 -6.953 1.00 0.00 O ATOM 2196 CB THR B 66 6.371 1.553 -9.164 1.00 0.00 C ATOM 2197 OG1 THR B 66 6.645 1.920 -10.526 1.00 0.00 O ATOM 2198 CG2 THR B 66 5.727 2.727 -8.438 1.00 0.00 C ATOM 0 H THR B 66 7.836 -0.471 -9.811 1.00 0.00 H new ATOM 0 HA THR B 66 8.310 2.004 -8.334 1.00 0.00 H new ATOM 0 HB THR B 66 5.679 0.711 -9.142 1.00 0.00 H new ATOM 0 HG1 THR B 66 5.812 2.189 -10.966 1.00 0.00 H new ATOM 0 HG21 THR B 66 4.806 3.009 -8.948 1.00 0.00 H new ATOM 0 HG22 THR B 66 5.500 2.440 -7.411 1.00 0.00 H new ATOM 0 HG23 THR B 66 6.414 3.573 -8.434 1.00 0.00 H new ATOM 2206 N LEU B 67 8.113 0.960 -6.098 1.00 0.00 N ATOM 2207 CA LEU B 67 7.876 0.534 -4.730 1.00 0.00 C ATOM 2208 C LEU B 67 6.955 1.527 -4.043 1.00 0.00 C ATOM 2209 O LEU B 67 7.288 2.703 -3.915 1.00 0.00 O ATOM 2210 CB LEU B 67 9.194 0.423 -3.957 1.00 0.00 C ATOM 2211 CG LEU B 67 10.193 -0.599 -4.505 1.00 0.00 C ATOM 2212 CD1 LEU B 67 11.443 -0.636 -3.640 1.00 0.00 C ATOM 2213 CD2 LEU B 67 9.554 -1.976 -4.583 1.00 0.00 C ATOM 0 H LEU B 67 8.899 1.600 -6.209 1.00 0.00 H new ATOM 0 HA LEU B 67 7.407 -0.450 -4.747 1.00 0.00 H new ATOM 0 HB2 LEU B 67 9.672 1.403 -3.945 1.00 0.00 H new ATOM 0 HB3 LEU B 67 8.968 0.166 -2.922 1.00 0.00 H new ATOM 0 HG LEU B 67 10.482 -0.297 -5.512 1.00 0.00 H new ATOM 0 HD11 LEU B 67 12.143 -1.368 -4.043 1.00 0.00 H new ATOM 0 HD12 LEU B 67 11.911 0.349 -3.634 1.00 0.00 H new ATOM 0 HD13 LEU B 67 11.173 -0.916 -2.622 1.00 0.00 H new ATOM 0 HD21 LEU B 67 10.277 -2.691 -4.975 1.00 0.00 H new ATOM 0 HD22 LEU B 67 9.238 -2.288 -3.587 1.00 0.00 H new ATOM 0 HD23 LEU B 67 8.687 -1.938 -5.243 1.00 0.00 H new ATOM 2225 N HIS B 68 5.789 1.064 -3.625 1.00 0.00 N ATOM 2226 CA HIS B 68 4.840 1.928 -2.939 1.00 0.00 C ATOM 2227 C HIS B 68 5.208 2.049 -1.474 1.00 0.00 C ATOM 2228 O HIS B 68 5.186 1.061 -0.741 1.00 0.00 O ATOM 2229 CB HIS B 68 3.411 1.393 -3.067 1.00 0.00 C ATOM 2230 CG HIS B 68 2.838 1.517 -4.445 1.00 0.00 C ATOM 2231 ND1 HIS B 68 1.907 2.475 -4.789 1.00 0.00 N ATOM 2232 CD2 HIS B 68 3.060 0.791 -5.567 1.00 0.00 C ATOM 2233 CE1 HIS B 68 1.583 2.332 -6.061 1.00 0.00 C ATOM 2234 NE2 HIS B 68 2.269 1.320 -6.555 1.00 0.00 N ATOM 0 H HIS B 68 5.477 0.101 -3.747 1.00 0.00 H new ATOM 0 HA HIS B 68 4.884 2.911 -3.408 1.00 0.00 H new ATOM 0 HB2 HIS B 68 3.399 0.344 -2.772 1.00 0.00 H new ATOM 0 HB3 HIS B 68 2.769 1.928 -2.368 1.00 0.00 H new ATOM 0 HD2 HIS B 68 3.734 -0.047 -5.665 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.876 2.941 -6.605 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.219 0.985 -7.517 1.00 0.00 H new ATOM 2243 N LEU B 69 5.562 3.251 -1.052 1.00 0.00 N ATOM 2244 CA LEU B 69 5.879 3.491 0.341 1.00 0.00 C ATOM 2245 C LEU B 69 4.614 3.860 1.101 1.00 0.00 C ATOM 2246 O LEU B 69 4.191 5.018 1.114 1.00 0.00 O ATOM 2247 CB LEU B 69 6.933 4.592 0.487 1.00 0.00 C ATOM 2248 CG LEU B 69 7.337 4.905 1.928 1.00 0.00 C ATOM 2249 CD1 LEU B 69 7.923 3.673 2.594 1.00 0.00 C ATOM 2250 CD2 LEU B 69 8.330 6.053 1.967 1.00 0.00 C ATOM 0 H LEU B 69 5.636 4.072 -1.653 1.00 0.00 H new ATOM 0 HA LEU B 69 6.295 2.576 0.762 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.823 4.300 -0.070 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.553 5.503 0.025 1.00 0.00 H new ATOM 0 HG LEU B 69 6.445 5.204 2.478 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.205 3.913 3.619 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.181 2.875 2.600 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.804 3.345 2.042 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.605 6.261 3.001 1.00 0.00 H new ATOM 0 HD22 LEU B 69 9.222 5.782 1.401 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.877 6.941 1.527 1.00 0.00 H new ATOM 2262 N VAL B 70 4.010 2.858 1.710 1.00 0.00 N ATOM 2263 CA VAL B 70 2.793 3.041 2.472 1.00 0.00 C ATOM 2264 C VAL B 70 3.140 3.218 3.939 1.00 0.00 C ATOM 2265 O VAL B 70 3.776 2.355 4.549 1.00 0.00 O ATOM 2266 CB VAL B 70 1.842 1.840 2.294 1.00 0.00 C ATOM 2267 CG1 VAL B 70 0.511 2.102 2.972 1.00 0.00 C ATOM 2268 CG2 VAL B 70 1.641 1.538 0.817 1.00 0.00 C ATOM 0 H VAL B 70 4.349 1.896 1.690 1.00 0.00 H new ATOM 0 HA VAL B 70 2.282 3.931 2.105 1.00 0.00 H new ATOM 0 HB VAL B 70 2.297 0.969 2.767 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.144 1.242 2.833 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.672 2.268 4.037 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.047 2.985 2.533 1.00 0.00 H new ATOM 0 HG21 VAL B 70 0.967 0.688 0.708 1.00 0.00 H new ATOM 0 HG22 VAL B 70 1.210 2.409 0.323 1.00 0.00 H new ATOM 0 HG23 VAL B 70 2.602 1.301 0.360 1.00 0.00 H new ATOM 2278 N LEU B 71 2.752 4.351 4.495 1.00 0.00 N ATOM 2279 CA LEU B 71 3.097 4.674 5.864 1.00 0.00 C ATOM 2280 C LEU B 71 2.038 4.158 6.827 1.00 0.00 C ATOM 2281 O LEU B 71 0.839 4.319 6.596 1.00 0.00 O ATOM 2282 CB LEU B 71 3.277 6.191 6.045 1.00 0.00 C ATOM 2283 CG LEU B 71 4.470 6.820 5.309 1.00 0.00 C ATOM 2284 CD1 LEU B 71 5.716 5.966 5.484 1.00 0.00 C ATOM 2285 CD2 LEU B 71 4.161 7.038 3.833 1.00 0.00 C ATOM 0 H LEU B 71 2.198 5.062 4.018 1.00 0.00 H new ATOM 0 HA LEU B 71 4.044 4.183 6.090 1.00 0.00 H new ATOM 0 HB2 LEU B 71 2.366 6.687 5.710 1.00 0.00 H new ATOM 0 HB3 LEU B 71 3.381 6.400 7.110 1.00 0.00 H new ATOM 0 HG LEU B 71 4.659 7.798 5.752 1.00 0.00 H new ATOM 0 HD11 LEU B 71 6.550 6.427 4.956 1.00 0.00 H new ATOM 0 HD12 LEU B 71 5.957 5.887 6.544 1.00 0.00 H new ATOM 0 HD13 LEU B 71 5.535 4.971 5.078 1.00 0.00 H new ATOM 0 HD21 LEU B 71 5.026 7.484 3.342 1.00 0.00 H new ATOM 0 HD22 LEU B 71 3.931 6.081 3.364 1.00 0.00 H new ATOM 0 HD23 LEU B 71 3.304 7.705 3.735 1.00 0.00 H new ATOM 2297 N ARG B 72 2.493 3.504 7.886 1.00 0.00 N ATOM 2298 CA ARG B 72 1.616 3.086 8.969 1.00 0.00 C ATOM 2299 C ARG B 72 1.267 4.298 9.822 1.00 0.00 C ATOM 2300 O ARG B 72 2.062 5.226 9.941 1.00 0.00 O ATOM 2301 CB ARG B 72 2.300 2.010 9.821 1.00 0.00 C ATOM 2302 CG ARG B 72 2.500 0.688 9.094 1.00 0.00 C ATOM 2303 CD ARG B 72 1.209 -0.116 9.012 1.00 0.00 C ATOM 2304 NE ARG B 72 0.804 -0.630 10.322 1.00 0.00 N ATOM 2305 CZ ARG B 72 -0.349 -1.258 10.564 1.00 0.00 C ATOM 2306 NH1 ARG B 72 -1.225 -1.471 9.590 1.00 0.00 N ATOM 2307 NH2 ARG B 72 -0.616 -1.689 11.790 1.00 0.00 N ATOM 0 H ARG B 72 3.472 3.250 8.018 1.00 0.00 H new ATOM 0 HA ARG B 72 0.702 2.660 8.555 1.00 0.00 H new ATOM 0 HB2 ARG B 72 3.270 2.383 10.151 1.00 0.00 H new ATOM 0 HB3 ARG B 72 1.704 1.835 10.717 1.00 0.00 H new ATOM 0 HG2 ARG B 72 2.873 0.880 8.088 1.00 0.00 H new ATOM 0 HG3 ARG B 72 3.261 0.102 9.609 1.00 0.00 H new ATOM 0 HD2 ARG B 72 0.415 0.511 8.607 1.00 0.00 H new ATOM 0 HD3 ARG B 72 1.342 -0.948 8.321 1.00 0.00 H new ATOM 0 HE ARG B 72 1.447 -0.499 11.103 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -1.021 -1.154 8.642 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -2.102 -1.952 9.789 1.00 0.00 H new ATOM 0 HH21 ARG B 72 0.058 -1.540 12.541 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -1.495 -2.170 11.982 1.00 0.00 H new ATOM 2321 N LEU B 73 0.090 4.287 10.427 1.00 0.00 N ATOM 2322 CA LEU B 73 -0.380 5.435 11.202 1.00 0.00 C ATOM 2323 C LEU B 73 0.265 5.475 12.589 1.00 0.00 C ATOM 2324 O LEU B 73 -0.238 6.146 13.490 1.00 0.00 O ATOM 2325 CB LEU B 73 -1.909 5.411 11.342 1.00 0.00 C ATOM 2326 CG LEU B 73 -2.709 5.685 10.060 1.00 0.00 C ATOM 2327 CD1 LEU B 73 -2.181 6.922 9.349 1.00 0.00 C ATOM 2328 CD2 LEU B 73 -2.697 4.478 9.134 1.00 0.00 C ATOM 0 H LEU B 73 -0.559 3.501 10.399 1.00 0.00 H new ATOM 0 HA LEU B 73 -0.087 6.334 10.659 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -2.203 4.435 11.728 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -2.197 6.149 12.090 1.00 0.00 H new ATOM 0 HG LEU B 73 -3.744 5.873 10.345 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -2.762 7.097 8.444 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -2.267 7.785 10.009 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -1.134 6.771 9.085 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -3.272 4.703 8.235 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -1.669 4.241 8.858 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -3.141 3.623 9.644 1.00 0.00 H new ATOM 2340 N ARG B 74 1.389 4.767 12.730 1.00 0.00 N ATOM 2341 CA ARG B 74 2.132 4.666 13.990 1.00 0.00 C ATOM 2342 C ARG B 74 1.340 3.889 15.042 1.00 0.00 C ATOM 2343 O ARG B 74 1.731 2.791 15.436 1.00 0.00 O ATOM 2344 CB ARG B 74 2.523 6.055 14.510 1.00 0.00 C ATOM 2345 CG ARG B 74 3.302 6.020 15.810 1.00 0.00 C ATOM 2346 CD ARG B 74 3.745 7.410 16.233 1.00 0.00 C ATOM 2347 NE ARG B 74 4.389 7.392 17.545 1.00 0.00 N ATOM 2348 CZ ARG B 74 5.440 8.135 17.879 1.00 0.00 C ATOM 2349 NH1 ARG B 74 5.987 8.963 16.997 1.00 0.00 N ATOM 2350 NH2 ARG B 74 5.943 8.057 19.104 1.00 0.00 N ATOM 0 H ARG B 74 1.813 4.242 11.965 1.00 0.00 H new ATOM 0 HA ARG B 74 3.049 4.111 13.790 1.00 0.00 H new ATOM 0 HB2 ARG B 74 3.120 6.563 13.752 1.00 0.00 H new ATOM 0 HB3 ARG B 74 1.619 6.647 14.654 1.00 0.00 H new ATOM 0 HG2 ARG B 74 2.685 5.580 16.593 1.00 0.00 H new ATOM 0 HG3 ARG B 74 4.176 5.378 15.694 1.00 0.00 H new ATOM 0 HD2 ARG B 74 4.436 7.813 15.493 1.00 0.00 H new ATOM 0 HD3 ARG B 74 2.882 8.076 16.259 1.00 0.00 H new ATOM 0 HE ARG B 74 4.006 6.766 18.253 1.00 0.00 H new ATOM 0 HH11 ARG B 74 5.601 9.033 16.055 1.00 0.00 H new ATOM 0 HH12 ARG B 74 6.793 9.530 17.261 1.00 0.00 H new ATOM 0 HH21 ARG B 74 5.524 7.428 19.788 1.00 0.00 H new ATOM 0 HH22 ARG B 74 6.749 8.626 19.361 1.00 0.00 H new ATOM 2364 N GLY B 75 0.230 4.457 15.480 1.00 0.00 N ATOM 2365 CA GLY B 75 -0.609 3.804 16.457 1.00 0.00 C ATOM 2366 C GLY B 75 -2.050 3.758 16.005 1.00 0.00 C ATOM 2367 O GLY B 75 -2.480 4.595 15.206 1.00 0.00 O ATOM 0 H GLY B 75 -0.107 5.369 15.172 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -0.248 2.790 16.629 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -0.541 4.332 17.408 1.00 0.00 H new ATOM 2371 N GLY B 76 -2.789 2.781 16.497 1.00 0.00 N ATOM 2372 CA GLY B 76 -4.176 2.636 16.120 1.00 0.00 C ATOM 2373 C GLY B 76 -4.872 1.592 16.962 1.00 0.00 C ATOM 2374 O GLY B 76 -6.091 1.730 17.198 1.00 0.00 O ATOM 2375 OXT GLY B 76 -4.198 0.637 17.401 1.00 0.00 O ATOM 0 H GLY B 76 -2.450 2.080 17.156 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -4.686 3.593 16.230 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -4.241 2.359 15.068 1.00 0.00 H new TER 2379 GLY B 76