USER MOD reduce.3.24.130724 H: found=0, std=0, add=829, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 825 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 33 SER OG : rot 170:sc= 0.00239 USER MOD Set 1.2: B 55 THR OG1 : rot -117:sc= 0.691 USER MOD Set 1.3: B 57 SER OG : rot -53:sc= 0.763 USER MOD Set 2.1: B 1 MET CE :methyl -171:sc= -0.242 (180deg=-0.426) USER MOD Set 2.2: B 19 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 7 THR OG1 : rot 111:sc= 1.06 USER MOD Set 3.2: B 9 THR OG1 : rot 180:sc= 0.899 USER MOD Set 4.1: B 6 LYS NZ :NH3+ 173:sc= 0 (180deg=0) USER MOD Set 4.2: B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 5.1: A 23 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: B 48 LYS NZ :NH3+ -157:sc= 0.515 (180deg=0.248) USER MOD Set 6.1: A 16 CYS SG : rot -125:sc= 0.0297 USER MOD Set 6.2: A 18 THR OG1 : rot -172:sc= 1.43 USER MOD Set 6.3: A 20 CYS SG : rot -106:sc= 0.392 USER MOD Set 6.4: A 32 CYS SG : rot -130:sc= 0.431 USER MOD Set 6.5: A 35 CYS SG : rot 87:sc= 0.37 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -2.6! C(o=-2.6!,f=-1.7!) USER MOD Single : A 28 THR OG1 : rot 161:sc= -1.29! USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 HIS : no HD1:sc= -4.1! K(o=-4.1!,f=-1.8) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 GLN : amide:sc= -0.148 K(o=-0.15,f=-1.8!) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.462 K(o=-0.46,f=-1.5!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 179:sc= 1.59 (180deg=1.59) USER MOD Single : B 2 GLN : amide:sc= -2.05 K(o=-2.1,f=-0.0017) USER MOD Single : B 11 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00408) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -77:sc= 0.0777 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00543 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.219 USER MOD Single : B 25 ASN : amide:sc= -4.08! K(o=-4.1!,f=-0.13) USER MOD Single : B 27 LYS NZ :NH3+ -147:sc= 0.0857 (180deg=0) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= -0.709 X(o=-0.71,f=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -1.65! K(o=-1.6!,f=-0.062) USER MOD Single : B 41 GLN : amide:sc= -2.08! C(o=-2.1!,f=-3.8!) USER MOD Single : B 49 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : B 59 TYR OH : rot 130:sc= 0.0326 USER MOD Single : B 60 ASN : amide:sc= -0.111 K(o=-0.11,f=-1.4!) USER MOD Single : B 62 GLN : amide:sc= -0.718 K(o=-0.72,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 89:sc= 0.562 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 13 9.708 -9.841 -1.501 1.00 10.00 N ATOM 9 CA PRO A 13 9.772 -8.913 -2.635 1.00 10.00 C ATOM 10 C PRO A 13 8.501 -8.076 -2.765 1.00 10.00 C ATOM 11 O PRO A 13 7.645 -8.352 -3.610 1.00 10.00 O ATOM 12 CB PRO A 13 9.972 -9.829 -3.853 1.00 10.00 C ATOM 13 CG PRO A 13 9.445 -11.165 -3.435 1.00 10.00 C ATOM 14 CD PRO A 13 9.612 -11.252 -1.934 1.00 10.00 C ATOM 0 HA PRO A 13 10.573 -8.182 -2.523 1.00 10.00 H new ATOM 0 HB2 PRO A 13 9.435 -9.449 -4.723 1.00 10.00 H new ATOM 0 HB3 PRO A 13 11.024 -9.891 -4.130 1.00 10.00 H new ATOM 0 HG2 PRO A 13 8.397 -11.271 -3.714 1.00 10.00 H new ATOM 0 HG3 PRO A 13 9.990 -11.968 -3.932 1.00 10.00 H new ATOM 0 HD2 PRO A 13 8.766 -11.756 -1.467 1.00 10.00 H new ATOM 0 HD3 PRO A 13 10.506 -11.814 -1.664 1.00 10.00 H new ATOM 22 N MET A 14 8.392 -7.042 -1.923 1.00 10.00 N ATOM 23 CA MET A 14 7.228 -6.160 -1.937 1.00 10.00 C ATOM 24 C MET A 14 7.383 -5.096 -3.026 1.00 10.00 C ATOM 25 O MET A 14 7.898 -4.003 -2.777 1.00 10.00 O ATOM 26 CB MET A 14 7.047 -5.499 -0.562 1.00 10.00 C ATOM 27 CG MET A 14 6.519 -6.534 0.437 1.00 10.00 C ATOM 28 SD MET A 14 4.889 -7.115 -0.096 1.00 10.00 S ATOM 29 CE MET A 14 4.499 -8.102 1.368 1.00 10.00 C ATOM 0 H MET A 14 9.096 -6.799 -1.226 1.00 10.00 H new ATOM 0 HA MET A 14 6.340 -6.753 -2.156 1.00 10.00 H new ATOM 0 HB2 MET A 14 7.997 -5.093 -0.214 1.00 10.00 H new ATOM 0 HB3 MET A 14 6.352 -4.663 -0.637 1.00 10.00 H new ATOM 0 HG2 MET A 14 7.211 -7.373 0.506 1.00 10.00 H new ATOM 0 HG3 MET A 14 6.452 -6.093 1.432 1.00 10.00 H new ATOM 0 HE1 MET A 14 3.517 -8.559 1.248 1.00 10.00 H new ATOM 0 HE2 MET A 14 5.250 -8.883 1.491 1.00 10.00 H new ATOM 0 HE3 MET A 14 4.495 -7.460 2.249 1.00 10.00 H new ATOM 39 N LEU A 15 6.936 -5.434 -4.239 1.00 10.00 N ATOM 40 CA LEU A 15 7.028 -4.516 -5.374 1.00 10.00 C ATOM 41 C LEU A 15 5.977 -3.413 -5.252 1.00 10.00 C ATOM 42 O LEU A 15 4.878 -3.651 -4.754 1.00 10.00 O ATOM 43 CB LEU A 15 6.836 -5.304 -6.692 1.00 10.00 C ATOM 44 CG LEU A 15 8.043 -5.110 -7.627 1.00 10.00 C ATOM 45 CD1 LEU A 15 9.301 -5.718 -6.997 1.00 10.00 C ATOM 46 CD2 LEU A 15 7.759 -5.804 -8.961 1.00 10.00 C ATOM 0 H LEU A 15 6.509 -6.334 -4.458 1.00 10.00 H new ATOM 0 HA LEU A 15 8.013 -4.049 -5.379 1.00 10.00 H new ATOM 0 HB2 LEU A 15 6.708 -6.364 -6.472 1.00 10.00 H new ATOM 0 HB3 LEU A 15 5.926 -4.970 -7.191 1.00 10.00 H new ATOM 0 HG LEU A 15 8.206 -4.044 -7.787 1.00 10.00 H new ATOM 0 HD11 LEU A 15 10.149 -5.575 -7.667 1.00 10.00 H new ATOM 0 HD12 LEU A 15 9.504 -5.228 -6.045 1.00 10.00 H new ATOM 0 HD13 LEU A 15 9.146 -6.784 -6.831 1.00 10.00 H new ATOM 0 HD21 LEU A 15 8.610 -5.671 -9.629 1.00 10.00 H new ATOM 0 HD22 LEU A 15 7.595 -6.868 -8.790 1.00 10.00 H new ATOM 0 HD23 LEU A 15 6.869 -5.368 -9.416 1.00 10.00 H new ATOM 58 N CYS A 16 6.334 -2.197 -5.691 1.00 10.00 N ATOM 59 CA CYS A 16 5.436 -1.028 -5.613 1.00 10.00 C ATOM 60 C CYS A 16 3.988 -1.331 -6.040 1.00 10.00 C ATOM 61 O CYS A 16 3.744 -1.953 -7.073 1.00 10.00 O ATOM 62 CB CYS A 16 5.985 0.105 -6.482 1.00 10.00 C ATOM 63 SG CYS A 16 5.237 1.669 -5.967 1.00 10.00 S ATOM 0 H CYS A 16 7.243 -1.994 -6.107 1.00 10.00 H new ATOM 0 HA CYS A 16 5.405 -0.738 -4.563 1.00 10.00 H new ATOM 0 HB2 CYS A 16 7.070 0.159 -6.387 1.00 10.00 H new ATOM 0 HB3 CYS A 16 5.766 -0.088 -7.532 1.00 10.00 H new ATOM 0 HG CYS A 16 4.680 2.242 -6.992 1.00 10.00 H new ATOM 68 N SER A 17 3.046 -0.880 -5.206 1.00 10.00 N ATOM 69 CA SER A 17 1.621 -1.092 -5.461 1.00 10.00 C ATOM 70 C SER A 17 1.162 -0.348 -6.717 1.00 10.00 C ATOM 71 O SER A 17 0.266 -0.816 -7.424 1.00 10.00 O ATOM 72 CB SER A 17 0.800 -0.623 -4.257 1.00 10.00 C ATOM 73 OG SER A 17 1.229 -1.323 -3.098 1.00 10.00 O ATOM 0 H SER A 17 3.247 -0.366 -4.348 1.00 10.00 H new ATOM 0 HA SER A 17 1.464 -2.159 -5.620 1.00 10.00 H new ATOM 0 HB2 SER A 17 0.923 0.451 -4.114 1.00 10.00 H new ATOM 0 HB3 SER A 17 -0.261 -0.802 -4.433 1.00 10.00 H new ATOM 0 HG SER A 17 0.707 -1.025 -2.324 1.00 10.00 H new ATOM 79 N THR A 18 1.768 0.811 -6.985 1.00 10.00 N ATOM 80 CA THR A 18 1.396 1.609 -8.158 1.00 10.00 C ATOM 81 C THR A 18 1.886 0.976 -9.473 1.00 10.00 C ATOM 82 O THR A 18 1.435 1.377 -10.547 1.00 10.00 O ATOM 83 CB THR A 18 1.951 3.030 -8.029 1.00 10.00 C ATOM 84 OG1 THR A 18 3.362 2.976 -7.888 1.00 10.00 O ATOM 85 CG2 THR A 18 1.337 3.717 -6.805 1.00 10.00 C ATOM 0 H THR A 18 2.510 1.215 -6.414 1.00 10.00 H new ATOM 0 HA THR A 18 0.307 1.641 -8.193 1.00 10.00 H new ATOM 0 HB THR A 18 1.697 3.599 -8.923 1.00 10.00 H new ATOM 0 HG1 THR A 18 3.704 3.870 -7.676 1.00 10.00 H new ATOM 0 HG21 THR A 18 1.735 4.728 -6.717 1.00 10.00 H new ATOM 0 HG22 THR A 18 0.254 3.762 -6.918 1.00 10.00 H new ATOM 0 HG23 THR A 18 1.585 3.150 -5.907 1.00 10.00 H new ATOM 93 N GLY A 19 2.790 -0.016 -9.395 1.00 10.00 N ATOM 94 CA GLY A 19 3.294 -0.681 -10.598 1.00 10.00 C ATOM 95 C GLY A 19 4.292 0.192 -11.350 1.00 10.00 C ATOM 96 O GLY A 19 4.233 0.286 -12.578 1.00 10.00 O ATOM 0 H GLY A 19 3.180 -0.368 -8.521 1.00 10.00 H new ATOM 0 HA2 GLY A 19 3.770 -1.622 -10.321 1.00 10.00 H new ATOM 0 HA3 GLY A 19 2.459 -0.927 -11.254 1.00 10.00 H new ATOM 100 N CYS A 20 5.209 0.825 -10.621 1.00 10.00 N ATOM 101 CA CYS A 20 6.207 1.694 -11.242 1.00 10.00 C ATOM 102 C CYS A 20 7.421 0.896 -11.766 1.00 10.00 C ATOM 103 O CYS A 20 8.243 1.438 -12.504 1.00 10.00 O ATOM 104 CB CYS A 20 6.653 2.783 -10.251 1.00 10.00 C ATOM 105 SG CYS A 20 7.649 2.146 -8.892 1.00 10.00 S ATOM 0 H CYS A 20 5.282 0.754 -9.606 1.00 10.00 H new ATOM 0 HA CYS A 20 5.742 2.171 -12.105 1.00 10.00 H new ATOM 0 HB2 CYS A 20 7.225 3.540 -10.787 1.00 10.00 H new ATOM 0 HB3 CYS A 20 5.771 3.278 -9.845 1.00 10.00 H new ATOM 0 HG CYS A 20 6.941 2.138 -7.802 1.00 10.00 H new ATOM 110 N GLY A 21 7.532 -0.392 -11.386 1.00 10.00 N ATOM 111 CA GLY A 21 8.644 -1.230 -11.854 1.00 10.00 C ATOM 112 C GLY A 21 9.814 -1.295 -10.860 1.00 10.00 C ATOM 113 O GLY A 21 10.846 -1.894 -11.170 1.00 10.00 O ATOM 0 H GLY A 21 6.875 -0.865 -10.766 1.00 10.00 H new ATOM 0 HA2 GLY A 21 8.277 -2.239 -12.039 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.006 -0.843 -12.806 1.00 10.00 H new ATOM 117 N PHE A 22 9.655 -0.688 -9.681 1.00 10.00 N ATOM 118 CA PHE A 22 10.712 -0.688 -8.668 1.00 10.00 C ATOM 119 C PHE A 22 10.220 -1.289 -7.362 1.00 10.00 C ATOM 120 O PHE A 22 9.015 -1.441 -7.164 1.00 10.00 O ATOM 121 CB PHE A 22 11.218 0.739 -8.465 1.00 10.00 C ATOM 122 CG PHE A 22 11.986 1.210 -9.670 1.00 10.00 C ATOM 123 CD1 PHE A 22 13.286 0.762 -9.883 1.00 10.00 C ATOM 124 CD2 PHE A 22 11.405 2.055 -10.606 1.00 10.00 C ATOM 125 CE1 PHE A 22 13.994 1.151 -11.007 1.00 10.00 C ATOM 126 CE2 PHE A 22 12.112 2.452 -11.731 1.00 10.00 C ATOM 127 CZ PHE A 22 13.409 1.999 -11.933 1.00 10.00 C ATOM 0 H PHE A 22 8.807 -0.192 -9.406 1.00 10.00 H new ATOM 0 HA PHE A 22 11.537 -1.310 -9.015 1.00 10.00 H new ATOM 0 HB2 PHE A 22 10.375 1.406 -8.282 1.00 10.00 H new ATOM 0 HB3 PHE A 22 11.856 0.781 -7.582 1.00 10.00 H new ATOM 0 HD1 PHE A 22 13.748 0.103 -9.163 1.00 10.00 H new ATOM 0 HD2 PHE A 22 10.395 2.406 -10.457 1.00 10.00 H new ATOM 0 HE1 PHE A 22 15.001 0.794 -11.162 1.00 10.00 H new ATOM 0 HE2 PHE A 22 11.653 3.114 -12.451 1.00 10.00 H new ATOM 0 HZ PHE A 22 13.960 2.307 -12.809 1.00 10.00 H new ATOM 137 N TYR A 23 11.154 -1.632 -6.479 1.00 10.00 N ATOM 138 CA TYR A 23 10.810 -2.226 -5.196 1.00 10.00 C ATOM 139 C TYR A 23 10.230 -1.186 -4.237 1.00 10.00 C ATOM 140 O TYR A 23 10.679 -0.047 -4.207 1.00 10.00 O ATOM 141 CB TYR A 23 12.036 -2.883 -4.566 1.00 10.00 C ATOM 142 CG TYR A 23 12.334 -4.235 -5.165 1.00 10.00 C ATOM 143 CD1 TYR A 23 12.755 -4.331 -6.484 1.00 10.00 C ATOM 144 CD2 TYR A 23 12.173 -5.406 -4.431 1.00 10.00 C ATOM 145 CE1 TYR A 23 13.016 -5.558 -7.063 1.00 10.00 C ATOM 146 CE2 TYR A 23 12.429 -6.641 -5.004 1.00 10.00 C ATOM 147 CZ TYR A 23 12.851 -6.712 -6.322 1.00 10.00 C ATOM 148 OH TYR A 23 13.112 -7.943 -6.892 1.00 10.00 O ATOM 0 H TYR A 23 12.155 -1.508 -6.631 1.00 10.00 H new ATOM 0 HA TYR A 23 10.049 -2.985 -5.378 1.00 10.00 H new ATOM 0 HB2 TYR A 23 12.901 -2.232 -4.696 1.00 10.00 H new ATOM 0 HB3 TYR A 23 11.876 -2.991 -3.493 1.00 10.00 H new ATOM 0 HD1 TYR A 23 12.881 -3.431 -7.068 1.00 10.00 H new ATOM 0 HD2 TYR A 23 11.845 -5.352 -3.403 1.00 10.00 H new ATOM 0 HE1 TYR A 23 13.347 -5.615 -8.089 1.00 10.00 H new ATOM 0 HE2 TYR A 23 12.300 -7.544 -4.426 1.00 10.00 H new ATOM 0 HH TYR A 23 12.947 -8.650 -6.234 1.00 10.00 H new ATOM 158 N GLY A 24 9.222 -1.596 -3.459 1.00 10.00 N ATOM 159 CA GLY A 24 8.591 -0.701 -2.499 1.00 10.00 C ATOM 160 C GLY A 24 9.298 -0.726 -1.156 1.00 10.00 C ATOM 161 O GLY A 24 10.524 -0.631 -1.095 1.00 10.00 O ATOM 0 H GLY A 24 8.832 -2.538 -3.479 1.00 10.00 H new ATOM 0 HA2 GLY A 24 8.595 0.315 -2.893 1.00 10.00 H new ATOM 0 HA3 GLY A 24 7.548 -0.988 -2.366 1.00 10.00 H new ATOM 165 N ASN A 25 8.529 -0.851 -0.075 1.00 10.00 N ATOM 166 CA ASN A 25 9.099 -0.886 1.267 1.00 10.00 C ATOM 167 C ASN A 25 8.022 -1.208 2.306 1.00 10.00 C ATOM 168 O ASN A 25 7.054 -0.479 2.440 1.00 10.00 O ATOM 169 CB ASN A 25 9.724 0.463 1.619 1.00 10.00 C ATOM 170 CG ASN A 25 10.962 0.297 2.494 1.00 10.00 C ATOM 171 OD1 ASN A 25 11.679 -0.688 2.383 1.00 10.00 O ATOM 172 ND2 ASN A 25 11.240 1.261 3.366 1.00 10.00 N ATOM 0 H ASN A 25 7.512 -0.929 -0.104 1.00 10.00 H new ATOM 0 HA ASN A 25 9.863 -1.663 1.279 1.00 10.00 H new ATOM 0 HB2 ASN A 25 9.993 0.990 0.704 1.00 10.00 H new ATOM 0 HB3 ASN A 25 8.991 1.080 2.138 1.00 10.00 H new ATOM 0 HD21 ASN A 25 12.066 1.189 3.960 1.00 10.00 H new ATOM 0 HD22 ASN A 25 10.627 2.073 3.441 1.00 10.00 H new ATOM 179 N PRO A 26 8.151 -2.309 3.069 1.00 10.00 N ATOM 180 CA PRO A 26 7.139 -2.669 4.111 1.00 10.00 C ATOM 181 C PRO A 26 7.119 -1.665 5.270 1.00 10.00 C ATOM 182 O PRO A 26 6.125 -1.576 5.995 1.00 10.00 O ATOM 183 CB PRO A 26 7.562 -4.056 4.579 1.00 10.00 C ATOM 184 CG PRO A 26 9.022 -4.132 4.291 1.00 10.00 C ATOM 185 CD PRO A 26 9.243 -3.309 3.027 1.00 10.00 C ATOM 0 HA PRO A 26 6.124 -2.653 3.715 1.00 10.00 H new ATOM 0 HB2 PRO A 26 7.362 -4.192 5.642 1.00 10.00 H new ATOM 0 HB3 PRO A 26 7.014 -4.835 4.049 1.00 10.00 H new ATOM 0 HG2 PRO A 26 9.605 -3.735 5.122 1.00 10.00 H new ATOM 0 HG3 PRO A 26 9.338 -5.165 4.145 1.00 10.00 H new ATOM 0 HD2 PRO A 26 10.223 -2.833 3.025 1.00 10.00 H new ATOM 0 HD3 PRO A 26 9.187 -3.927 2.131 1.00 10.00 H new ATOM 193 N ARG A 27 8.196 -0.880 5.418 1.00 10.00 N ATOM 194 CA ARG A 27 8.258 0.145 6.465 1.00 10.00 C ATOM 195 C ARG A 27 7.386 1.344 6.067 1.00 10.00 C ATOM 196 O ARG A 27 6.642 1.880 6.890 1.00 10.00 O ATOM 197 CB ARG A 27 9.699 0.619 6.660 1.00 10.00 C ATOM 198 CG ARG A 27 10.560 -0.535 7.178 1.00 10.00 C ATOM 199 CD ARG A 27 11.944 -0.008 7.575 1.00 10.00 C ATOM 200 NE ARG A 27 11.855 0.793 8.805 1.00 10.00 N ATOM 201 CZ ARG A 27 12.942 1.261 9.453 1.00 10.00 C ATOM 202 NH1 ARG A 27 14.163 0.997 9.044 1.00 10.00 N ATOM 203 NH2 ARG A 27 12.777 1.991 10.522 1.00 10.00 N ATOM 0 H ARG A 27 9.028 -0.936 4.831 1.00 10.00 H new ATOM 0 HA ARG A 27 7.892 -0.287 7.397 1.00 10.00 H new ATOM 0 HB2 ARG A 27 10.100 0.989 5.717 1.00 10.00 H new ATOM 0 HB3 ARG A 27 9.726 1.450 7.365 1.00 10.00 H new ATOM 0 HG2 ARG A 27 10.079 -1.004 8.036 1.00 10.00 H new ATOM 0 HG3 ARG A 27 10.659 -1.302 6.409 1.00 10.00 H new ATOM 0 HD2 ARG A 27 12.628 -0.843 7.726 1.00 10.00 H new ATOM 0 HD3 ARG A 27 12.354 0.598 6.768 1.00 10.00 H new ATOM 0 HE ARG A 27 10.932 1.004 9.185 1.00 10.00 H new ATOM 0 HH11 ARG A 27 14.310 0.423 8.214 1.00 10.00 H new ATOM 0 HH12 ARG A 27 14.964 1.366 9.557 1.00 10.00 H new ATOM 0 HH21 ARG A 27 11.836 2.200 10.856 1.00 10.00 H new ATOM 0 HH22 ARG A 27 13.589 2.352 11.023 1.00 10.00 H new ATOM 217 N THR A 28 7.468 1.729 4.785 1.00 10.00 N ATOM 218 CA THR A 28 6.670 2.833 4.264 1.00 10.00 C ATOM 219 C THR A 28 5.243 2.311 3.996 1.00 10.00 C ATOM 220 O THR A 28 4.815 1.353 4.646 1.00 10.00 O ATOM 221 CB THR A 28 7.329 3.399 2.986 1.00 10.00 C ATOM 222 OG1 THR A 28 7.363 2.389 1.988 1.00 10.00 O ATOM 223 CG2 THR A 28 8.758 3.870 3.284 1.00 10.00 C ATOM 0 H THR A 28 8.079 1.289 4.097 1.00 10.00 H new ATOM 0 HA THR A 28 6.615 3.649 4.984 1.00 10.00 H new ATOM 0 HB THR A 28 6.745 4.249 2.634 1.00 10.00 H new ATOM 0 HG1 THR A 28 7.487 2.802 1.108 1.00 10.00 H new ATOM 0 HG21 THR A 28 9.208 4.266 2.374 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.733 4.650 4.045 1.00 10.00 H new ATOM 0 HG23 THR A 28 9.350 3.029 3.646 1.00 10.00 H new ATOM 231 N ASN A 29 4.511 2.924 3.059 1.00 10.00 N ATOM 232 CA ASN A 29 3.147 2.493 2.744 1.00 10.00 C ATOM 233 C ASN A 29 3.119 1.426 1.637 1.00 10.00 C ATOM 234 O ASN A 29 2.129 1.316 0.909 1.00 10.00 O ATOM 235 CB ASN A 29 2.328 3.713 2.312 1.00 10.00 C ATOM 236 CG ASN A 29 1.846 4.474 3.541 1.00 10.00 C ATOM 237 OD1 ASN A 29 2.640 4.791 4.425 1.00 10.00 O ATOM 238 ND2 ASN A 29 0.587 4.788 3.653 1.00 10.00 N ATOM 0 H ASN A 29 4.840 3.717 2.508 1.00 10.00 H new ATOM 0 HA ASN A 29 2.717 2.042 3.638 1.00 10.00 H new ATOM 0 HB2 ASN A 29 2.935 4.365 1.684 1.00 10.00 H new ATOM 0 HB3 ASN A 29 1.475 3.396 1.712 1.00 10.00 H new ATOM 0 HD21 ASN A 29 0.259 5.297 4.474 1.00 10.00 H new ATOM 0 HD22 ASN A 29 -0.071 4.525 2.920 1.00 10.00 H new ATOM 245 N GLY A 30 4.207 0.653 1.494 1.00 10.00 N ATOM 246 CA GLY A 30 4.280 -0.371 0.453 1.00 10.00 C ATOM 247 C GLY A 30 4.755 0.224 -0.881 1.00 10.00 C ATOM 248 O GLY A 30 4.671 -0.439 -1.918 1.00 10.00 O ATOM 0 H GLY A 30 5.038 0.720 2.082 1.00 10.00 H new ATOM 0 HA2 GLY A 30 4.962 -1.162 0.765 1.00 10.00 H new ATOM 0 HA3 GLY A 30 3.300 -0.829 0.321 1.00 10.00 H new ATOM 252 N MET A 31 5.234 1.482 -0.858 1.00 10.00 N ATOM 253 CA MET A 31 5.687 2.154 -2.071 1.00 10.00 C ATOM 254 C MET A 31 7.149 2.590 -1.948 1.00 10.00 C ATOM 255 O MET A 31 7.692 2.677 -0.846 1.00 10.00 O ATOM 256 CB MET A 31 4.815 3.387 -2.318 1.00 10.00 C ATOM 257 CG MET A 31 3.554 2.994 -3.087 1.00 10.00 C ATOM 258 SD MET A 31 2.391 2.154 -1.983 1.00 10.00 S ATOM 259 CE MET A 31 0.893 3.029 -2.510 1.00 10.00 C ATOM 0 H MET A 31 5.314 2.045 -0.011 1.00 10.00 H new ATOM 0 HA MET A 31 5.604 1.455 -2.903 1.00 10.00 H new ATOM 0 HB2 MET A 31 4.542 3.845 -1.367 1.00 10.00 H new ATOM 0 HB3 MET A 31 5.377 4.132 -2.882 1.00 10.00 H new ATOM 0 HG2 MET A 31 3.087 3.882 -3.513 1.00 10.00 H new ATOM 0 HG3 MET A 31 3.815 2.340 -3.919 1.00 10.00 H new ATOM 0 HE1 MET A 31 0.038 2.659 -1.945 1.00 10.00 H new ATOM 0 HE2 MET A 31 1.013 4.097 -2.329 1.00 10.00 H new ATOM 0 HE3 MET A 31 0.727 2.858 -3.574 1.00 10.00 H new ATOM 269 N CYS A 32 7.768 2.858 -3.094 1.00 10.00 N ATOM 270 CA CYS A 32 9.158 3.293 -3.135 1.00 10.00 C ATOM 271 C CYS A 32 9.276 4.721 -2.579 1.00 10.00 C ATOM 272 O CYS A 32 8.301 5.271 -2.079 1.00 10.00 O ATOM 273 CB CYS A 32 9.682 3.187 -4.579 1.00 10.00 C ATOM 274 SG CYS A 32 8.699 4.120 -5.764 1.00 10.00 S ATOM 0 H CYS A 32 7.325 2.781 -4.010 1.00 10.00 H new ATOM 0 HA CYS A 32 9.774 2.649 -2.507 1.00 10.00 H new ATOM 0 HB2 CYS A 32 10.712 3.543 -4.611 1.00 10.00 H new ATOM 0 HB3 CYS A 32 9.698 2.138 -4.876 1.00 10.00 H new ATOM 0 HG CYS A 32 8.403 3.360 -6.776 1.00 10.00 H new ATOM 279 N SER A 33 10.460 5.322 -2.654 1.00 10.00 N ATOM 280 CA SER A 33 10.669 6.677 -2.119 1.00 10.00 C ATOM 281 C SER A 33 10.091 7.773 -3.019 1.00 10.00 C ATOM 282 O SER A 33 10.069 8.946 -2.643 1.00 10.00 O ATOM 283 CB SER A 33 12.164 6.932 -1.914 1.00 10.00 C ATOM 284 OG SER A 33 12.871 6.661 -3.093 1.00 10.00 O ATOM 0 H SER A 33 11.288 4.901 -3.076 1.00 10.00 H new ATOM 0 HA SER A 33 10.137 6.722 -1.169 1.00 10.00 H new ATOM 0 HB2 SER A 33 12.325 7.968 -1.615 1.00 10.00 H new ATOM 0 HB3 SER A 33 12.539 6.305 -1.105 1.00 10.00 H new ATOM 0 HG SER A 33 13.794 6.978 -3.001 1.00 10.00 H new ATOM 290 N VAL A 34 9.616 7.384 -4.198 1.00 10.00 N ATOM 291 CA VAL A 34 9.070 8.333 -5.166 1.00 10.00 C ATOM 292 C VAL A 34 7.545 8.484 -5.053 1.00 10.00 C ATOM 293 O VAL A 34 7.034 9.599 -4.948 1.00 10.00 O ATOM 294 CB VAL A 34 9.438 7.919 -6.607 1.00 10.00 C ATOM 295 CG1 VAL A 34 8.890 8.935 -7.606 1.00 10.00 C ATOM 296 CG2 VAL A 34 10.955 7.795 -6.759 1.00 10.00 C ATOM 0 H VAL A 34 9.598 6.413 -4.509 1.00 10.00 H new ATOM 0 HA VAL A 34 9.518 9.299 -4.933 1.00 10.00 H new ATOM 0 HB VAL A 34 8.989 6.947 -6.812 1.00 10.00 H new ATOM 0 HG11 VAL A 34 9.157 8.631 -8.618 1.00 10.00 H new ATOM 0 HG12 VAL A 34 7.805 8.985 -7.516 1.00 10.00 H new ATOM 0 HG13 VAL A 34 9.316 9.916 -7.398 1.00 10.00 H new ATOM 0 HG21 VAL A 34 11.196 7.502 -7.781 1.00 10.00 H new ATOM 0 HG22 VAL A 34 11.423 8.754 -6.537 1.00 10.00 H new ATOM 0 HG23 VAL A 34 11.329 7.040 -6.068 1.00 10.00 H new ATOM 306 N CYS A 35 6.835 7.365 -5.066 1.00 10.00 N ATOM 307 CA CYS A 35 5.373 7.364 -4.983 1.00 10.00 C ATOM 308 C CYS A 35 4.866 7.659 -3.571 1.00 10.00 C ATOM 309 O CYS A 35 3.752 8.157 -3.405 1.00 10.00 O ATOM 310 CB CYS A 35 4.843 6.017 -5.458 1.00 10.00 C ATOM 311 SG CYS A 35 5.347 5.646 -7.148 1.00 10.00 S ATOM 0 H CYS A 35 7.249 6.435 -5.134 1.00 10.00 H new ATOM 0 HA CYS A 35 5.004 8.163 -5.625 1.00 10.00 H new ATOM 0 HB2 CYS A 35 5.202 5.232 -4.793 1.00 10.00 H new ATOM 0 HB3 CYS A 35 3.755 6.014 -5.396 1.00 10.00 H new ATOM 0 HG CYS A 35 6.508 5.061 -7.136 1.00 10.00 H new ATOM 316 N TYR A 36 5.695 7.374 -2.569 1.00 10.00 N ATOM 317 CA TYR A 36 5.323 7.599 -1.164 1.00 10.00 C ATOM 318 C TYR A 36 4.997 9.074 -0.879 1.00 10.00 C ATOM 319 O TYR A 36 3.970 9.369 -0.268 1.00 10.00 O ATOM 320 CB TYR A 36 6.458 7.098 -0.241 1.00 10.00 C ATOM 321 CG TYR A 36 6.140 7.306 1.238 1.00 10.00 C ATOM 322 CD1 TYR A 36 4.859 7.036 1.750 1.00 10.00 C ATOM 323 CD2 TYR A 36 7.148 7.760 2.098 1.00 10.00 C ATOM 324 CE1 TYR A 36 4.594 7.221 3.112 1.00 10.00 C ATOM 325 CE2 TYR A 36 6.881 7.946 3.459 1.00 10.00 C ATOM 326 CZ TYR A 36 5.606 7.677 3.968 1.00 10.00 C ATOM 327 OH TYR A 36 5.346 7.856 5.309 1.00 10.00 O ATOM 0 H TYR A 36 6.630 6.987 -2.698 1.00 10.00 H new ATOM 0 HA TYR A 36 4.414 7.033 -0.961 1.00 10.00 H new ATOM 0 HB2 TYR A 36 6.633 6.038 -0.427 1.00 10.00 H new ATOM 0 HB3 TYR A 36 7.382 7.621 -0.488 1.00 10.00 H new ATOM 0 HD1 TYR A 36 4.078 6.685 1.092 1.00 10.00 H new ATOM 0 HD2 TYR A 36 8.134 7.967 1.710 1.00 10.00 H new ATOM 0 HE1 TYR A 36 3.609 7.012 3.503 1.00 10.00 H new ATOM 0 HE2 TYR A 36 7.661 8.298 4.118 1.00 10.00 H new ATOM 0 HH TYR A 36 6.156 8.175 5.759 1.00 10.00 H new ATOM 337 N LYS A 37 5.868 9.984 -1.316 1.00 10.00 N ATOM 338 CA LYS A 37 5.645 11.410 -1.079 1.00 10.00 C ATOM 339 C LYS A 37 4.510 11.916 -1.964 1.00 10.00 C ATOM 340 O LYS A 37 3.649 12.673 -1.513 1.00 10.00 O ATOM 341 CB LYS A 37 6.931 12.226 -1.317 1.00 10.00 C ATOM 342 CG LYS A 37 7.426 12.074 -2.759 1.00 10.00 C ATOM 343 CD LYS A 37 8.717 12.870 -2.943 1.00 10.00 C ATOM 344 CE LYS A 37 9.047 12.965 -4.433 1.00 10.00 C ATOM 345 NZ LYS A 37 10.445 13.454 -4.601 1.00 10.00 N ATOM 0 H LYS A 37 6.722 9.764 -1.828 1.00 10.00 H new ATOM 0 HA LYS A 37 5.362 11.543 -0.035 1.00 10.00 H new ATOM 0 HB2 LYS A 37 6.742 13.278 -1.104 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.707 11.896 -0.627 1.00 10.00 H new ATOM 0 HG2 LYS A 37 7.600 11.022 -2.986 1.00 10.00 H new ATOM 0 HG3 LYS A 37 6.666 12.429 -3.455 1.00 10.00 H new ATOM 0 HD2 LYS A 37 8.605 13.868 -2.520 1.00 10.00 H new ATOM 0 HD3 LYS A 37 9.535 12.387 -2.408 1.00 10.00 H new ATOM 0 HE2 LYS A 37 8.932 11.989 -4.905 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.351 13.642 -4.928 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 10.671 13.519 -5.614 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 10.539 14.393 -4.164 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 11.102 12.791 -4.142 1.00 10.00 H new ATOM 359 N GLU A 38 4.533 11.504 -3.234 1.00 10.00 N ATOM 360 CA GLU A 38 3.520 11.923 -4.206 1.00 10.00 C ATOM 361 C GLU A 38 2.098 11.620 -3.725 1.00 10.00 C ATOM 362 O GLU A 38 1.188 12.428 -3.938 1.00 10.00 O ATOM 363 CB GLU A 38 3.761 11.218 -5.545 1.00 10.00 C ATOM 364 CG GLU A 38 4.877 11.934 -6.309 1.00 10.00 C ATOM 365 CD GLU A 38 4.333 13.203 -6.954 1.00 10.00 C ATOM 366 OE1 GLU A 38 3.287 13.126 -7.574 1.00 10.00 O ATOM 367 OE2 GLU A 38 4.971 14.232 -6.816 1.00 10.00 O ATOM 0 H GLU A 38 5.244 10.879 -3.614 1.00 10.00 H new ATOM 0 HA GLU A 38 3.611 13.003 -4.325 1.00 10.00 H new ATOM 0 HB2 GLU A 38 4.033 10.176 -5.375 1.00 10.00 H new ATOM 0 HB3 GLU A 38 2.845 11.216 -6.136 1.00 10.00 H new ATOM 0 HG2 GLU A 38 5.693 12.182 -5.630 1.00 10.00 H new ATOM 0 HG3 GLU A 38 5.287 11.274 -7.074 1.00 10.00 H new ATOM 374 N HIS A 39 1.904 10.457 -3.088 1.00 10.00 N ATOM 375 CA HIS A 39 0.569 10.086 -2.606 1.00 10.00 C ATOM 376 C HIS A 39 0.279 10.676 -1.218 1.00 10.00 C ATOM 377 O HIS A 39 -0.864 11.016 -0.908 1.00 10.00 O ATOM 378 CB HIS A 39 0.365 8.545 -2.656 1.00 10.00 C ATOM 379 CG HIS A 39 0.994 7.799 -1.492 1.00 10.00 C ATOM 380 ND1 HIS A 39 1.816 6.701 -1.693 1.00 10.00 N ATOM 381 CD2 HIS A 39 0.868 7.921 -0.127 1.00 10.00 C ATOM 382 CE1 HIS A 39 2.139 6.207 -0.484 1.00 10.00 C ATOM 383 NE2 HIS A 39 1.589 6.916 0.504 1.00 10.00 N ATOM 0 H HIS A 39 2.636 9.772 -2.898 1.00 10.00 H new ATOM 0 HA HIS A 39 -0.165 10.526 -3.281 1.00 10.00 H new ATOM 0 HB2 HIS A 39 -0.704 8.331 -2.676 1.00 10.00 H new ATOM 0 HB3 HIS A 39 0.784 8.164 -3.587 1.00 10.00 H new ATOM 0 HD2 HIS A 39 0.294 8.684 0.378 1.00 10.00 H new ATOM 0 HE1 HIS A 39 2.767 5.342 -0.331 1.00 10.00 H new ATOM 0 HE2 HIS A 39 1.679 6.754 1.507 1.00 10.00 H new ATOM 392 N LEU A 40 1.323 10.792 -0.393 1.00 10.00 N ATOM 393 CA LEU A 40 1.182 11.338 0.966 1.00 10.00 C ATOM 394 C LEU A 40 0.704 12.796 0.938 1.00 10.00 C ATOM 395 O LEU A 40 0.018 13.246 1.858 1.00 10.00 O ATOM 396 CB LEU A 40 2.527 11.257 1.699 1.00 10.00 C ATOM 397 CG LEU A 40 2.322 11.492 3.196 1.00 10.00 C ATOM 398 CD1 LEU A 40 1.698 10.244 3.830 1.00 10.00 C ATOM 399 CD2 LEU A 40 3.676 11.782 3.859 1.00 10.00 C ATOM 0 H LEU A 40 2.274 10.517 -0.638 1.00 10.00 H new ATOM 0 HA LEU A 40 0.434 10.743 1.491 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.982 10.280 1.535 1.00 10.00 H new ATOM 0 HB3 LEU A 40 3.215 12.000 1.297 1.00 10.00 H new ATOM 0 HG LEU A 40 1.657 12.343 3.342 1.00 10.00 H new ATOM 0 HD11 LEU A 40 1.552 10.412 4.897 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.736 10.039 3.360 1.00 10.00 H new ATOM 0 HD13 LEU A 40 2.361 9.392 3.684 1.00 10.00 H new ATOM 0 HD21 LEU A 40 3.530 11.950 4.926 1.00 10.00 H new ATOM 0 HD22 LEU A 40 4.342 10.932 3.713 1.00 10.00 H new ATOM 0 HD23 LEU A 40 4.118 12.671 3.409 1.00 10.00 H new ATOM 411 N GLN A 41 1.078 13.521 -0.114 1.00 10.00 N ATOM 412 CA GLN A 41 0.694 14.930 -0.253 1.00 10.00 C ATOM 413 C GLN A 41 -0.821 15.081 -0.430 1.00 10.00 C ATOM 414 O GLN A 41 -1.424 16.006 0.121 1.00 10.00 O ATOM 415 CB GLN A 41 1.427 15.539 -1.459 1.00 10.00 C ATOM 416 CG GLN A 41 2.775 16.112 -1.009 1.00 10.00 C ATOM 417 CD GLN A 41 3.552 16.626 -2.215 1.00 10.00 C ATOM 418 OE1 GLN A 41 4.271 15.863 -2.863 1.00 10.00 O ATOM 419 NE2 GLN A 41 3.453 17.882 -2.554 1.00 10.00 N ATOM 0 H GLN A 41 1.645 13.161 -0.882 1.00 10.00 H new ATOM 0 HA GLN A 41 0.977 15.457 0.658 1.00 10.00 H new ATOM 0 HB2 GLN A 41 1.582 14.779 -2.225 1.00 10.00 H new ATOM 0 HB3 GLN A 41 0.819 16.324 -1.908 1.00 10.00 H new ATOM 0 HG2 GLN A 41 2.616 16.922 -0.297 1.00 10.00 H new ATOM 0 HG3 GLN A 41 3.352 15.344 -0.495 1.00 10.00 H new ATOM 0 HE21 GLN A 41 2.857 18.510 -2.015 1.00 10.00 H new ATOM 0 HE22 GLN A 41 3.972 18.236 -3.358 1.00 10.00 H new ATOM 428 N ARG A 42 -1.426 14.172 -1.197 1.00 10.00 N ATOM 429 CA ARG A 42 -2.872 14.216 -1.438 1.00 10.00 C ATOM 430 C ARG A 42 -3.649 13.642 -0.253 1.00 10.00 C ATOM 431 O ARG A 42 -4.773 14.068 0.023 1.00 10.00 O ATOM 432 CB ARG A 42 -3.215 13.421 -2.697 1.00 10.00 C ATOM 433 CG ARG A 42 -2.723 14.187 -3.924 1.00 10.00 C ATOM 434 CD ARG A 42 -2.736 13.261 -5.141 1.00 10.00 C ATOM 435 NE ARG A 42 -2.045 13.897 -6.268 1.00 10.00 N ATOM 436 CZ ARG A 42 -2.559 14.942 -6.943 1.00 10.00 C ATOM 437 NH1 ARG A 42 -3.738 15.445 -6.656 1.00 10.00 N ATOM 438 NH2 ARG A 42 -1.871 15.464 -7.922 1.00 10.00 N ATOM 0 H ARG A 42 -0.943 13.402 -1.659 1.00 10.00 H new ATOM 0 HA ARG A 42 -3.158 15.260 -1.568 1.00 10.00 H new ATOM 0 HB2 ARG A 42 -2.750 12.436 -2.658 1.00 10.00 H new ATOM 0 HB3 ARG A 42 -4.292 13.263 -2.760 1.00 10.00 H new ATOM 0 HG2 ARG A 42 -3.360 15.053 -4.105 1.00 10.00 H new ATOM 0 HG3 ARG A 42 -1.715 14.564 -3.751 1.00 10.00 H new ATOM 0 HD2 ARG A 42 -2.251 12.317 -4.894 1.00 10.00 H new ATOM 0 HD3 ARG A 42 -3.764 13.028 -5.419 1.00 10.00 H new ATOM 0 HE ARG A 42 -1.136 13.532 -6.552 1.00 10.00 H new ATOM 0 HH11 ARG A 42 -4.294 15.043 -5.901 1.00 10.00 H new ATOM 0 HH12 ARG A 42 -4.098 16.238 -7.188 1.00 10.00 H new ATOM 0 HH21 ARG A 42 -0.958 15.080 -8.165 1.00 10.00 H new ATOM 0 HH22 ARG A 42 -2.246 16.256 -8.443 1.00 10.00 H new ATOM 452 N GLN A 43 -3.041 12.683 0.446 1.00 10.00 N ATOM 453 CA GLN A 43 -3.674 12.062 1.603 1.00 10.00 C ATOM 454 C GLN A 43 -3.617 13.010 2.803 1.00 10.00 C ATOM 455 O GLN A 43 -4.562 13.086 3.590 1.00 10.00 O ATOM 456 CB GLN A 43 -2.959 10.750 1.938 1.00 10.00 C ATOM 457 CG GLN A 43 -3.902 9.818 2.704 1.00 10.00 C ATOM 458 CD GLN A 43 -4.740 8.989 1.732 1.00 10.00 C ATOM 459 OE1 GLN A 43 -4.298 8.682 0.624 1.00 10.00 O ATOM 460 NE2 GLN A 43 -5.936 8.604 2.089 1.00 10.00 N ATOM 0 H GLN A 43 -2.112 12.322 0.229 1.00 10.00 H new ATOM 0 HA GLN A 43 -4.718 11.852 1.370 1.00 10.00 H new ATOM 0 HB2 GLN A 43 -2.622 10.266 1.021 1.00 10.00 H new ATOM 0 HB3 GLN A 43 -2.071 10.953 2.536 1.00 10.00 H new ATOM 0 HG2 GLN A 43 -3.324 9.157 3.350 1.00 10.00 H new ATOM 0 HG3 GLN A 43 -4.556 10.404 3.350 1.00 10.00 H new ATOM 0 HE21 GLN A 43 -6.301 8.859 3.007 1.00 10.00 H new ATOM 0 HE22 GLN A 43 -6.505 8.049 1.450 1.00 10.00 H new ATOM 469 N GLN A 44 -2.497 13.726 2.931 1.00 10.00 N ATOM 470 CA GLN A 44 -2.309 14.668 4.035 1.00 10.00 C ATOM 471 C GLN A 44 -3.156 15.925 3.831 1.00 10.00 C ATOM 472 O GLN A 44 -3.737 16.449 4.785 1.00 10.00 O ATOM 473 CB GLN A 44 -0.835 15.064 4.140 1.00 10.00 C ATOM 474 CG GLN A 44 -0.559 15.612 5.540 1.00 10.00 C ATOM 475 CD GLN A 44 0.940 15.749 5.762 1.00 10.00 C ATOM 476 OE1 GLN A 44 1.499 15.107 6.653 1.00 10.00 O ATOM 477 NE2 GLN A 44 1.633 16.551 5.000 1.00 10.00 N ATOM 0 H GLN A 44 -1.709 13.671 2.285 1.00 10.00 H new ATOM 0 HA GLN A 44 -2.625 14.177 4.955 1.00 10.00 H new ATOM 0 HB2 GLN A 44 -0.199 14.201 3.943 1.00 10.00 H new ATOM 0 HB3 GLN A 44 -0.594 15.816 3.388 1.00 10.00 H new ATOM 0 HG2 GLN A 44 -1.042 16.581 5.661 1.00 10.00 H new ATOM 0 HG3 GLN A 44 -0.986 14.947 6.290 1.00 10.00 H new ATOM 0 HE21 GLN A 44 1.169 17.082 4.263 1.00 10.00 H new ATOM 0 HE22 GLN A 44 2.639 16.647 5.142 1.00 10.00 H new ATOM 486 N ASN A 45 -3.213 16.406 2.586 1.00 10.00 N ATOM 487 CA ASN A 45 -3.987 17.610 2.266 1.00 10.00 C ATOM 488 C ASN A 45 -5.483 17.360 2.458 1.00 10.00 C ATOM 489 O ASN A 45 -6.198 18.212 2.991 1.00 10.00 O ATOM 490 CB ASN A 45 -3.718 18.036 0.816 1.00 10.00 C ATOM 491 CG ASN A 45 -2.427 18.850 0.736 1.00 10.00 C ATOM 492 OD1 ASN A 45 -2.111 19.604 1.656 1.00 10.00 O ATOM 493 ND2 ASN A 45 -1.661 18.740 -0.316 1.00 10.00 N ATOM 0 H ASN A 45 -2.737 15.985 1.788 1.00 10.00 H new ATOM 0 HA ASN A 45 -3.677 18.406 2.943 1.00 10.00 H new ATOM 0 HB2 ASN A 45 -3.641 17.155 0.179 1.00 10.00 H new ATOM 0 HB3 ASN A 45 -4.553 18.628 0.442 1.00 10.00 H new ATOM 0 HD21 ASN A 45 -0.798 19.280 -0.377 1.00 10.00 H new ATOM 0 HD22 ASN A 45 -1.926 18.114 -1.077 1.00 10.00 H new ATOM 500 N SER A 46 -5.947 16.189 2.014 1.00 10.00 N ATOM 501 CA SER A 46 -7.360 15.833 2.135 1.00 10.00 C ATOM 502 C SER A 46 -7.709 15.473 3.577 1.00 10.00 C ATOM 503 O SER A 46 -8.517 16.155 4.214 1.00 10.00 O ATOM 504 CB SER A 46 -7.682 14.651 1.220 1.00 10.00 C ATOM 505 OG SER A 46 -9.073 14.650 0.925 1.00 10.00 O ATOM 0 H SER A 46 -5.368 15.476 1.570 1.00 10.00 H new ATOM 0 HA SER A 46 -7.955 16.697 1.838 1.00 10.00 H new ATOM 0 HB2 SER A 46 -7.103 14.721 0.299 1.00 10.00 H new ATOM 0 HB3 SER A 46 -7.400 13.715 1.703 1.00 10.00 H new ATOM 0 HG SER A 46 -9.282 13.894 0.337 1.00 10.00 H new ATOM 512 N MET B 1 22.495 1.109 9.037 1.00 10.00 N ATOM 513 CA MET B 1 22.785 -0.306 8.742 1.00 10.00 C ATOM 514 C MET B 1 24.064 -0.417 7.891 1.00 10.00 C ATOM 515 O MET B 1 24.370 0.445 7.074 1.00 10.00 O ATOM 516 CB MET B 1 21.595 -0.936 8.001 1.00 10.00 C ATOM 517 CG MET B 1 21.376 -0.381 6.586 1.00 10.00 C ATOM 518 SD MET B 1 19.968 -1.124 5.691 1.00 10.00 S ATOM 519 CE MET B 1 20.329 -0.544 4.047 1.00 10.00 C ATOM 0 H1 MET B 1 21.621 1.175 9.597 1.00 10.00 H new ATOM 0 H2 MET B 1 23.284 1.520 9.576 1.00 10.00 H new ATOM 0 H3 MET B 1 22.375 1.632 8.146 1.00 10.00 H new ATOM 0 HA MET B 1 22.943 -0.842 9.678 1.00 10.00 H new ATOM 0 HB2 MET B 1 21.748 -2.013 7.938 1.00 10.00 H new ATOM 0 HB3 MET B 1 20.690 -0.777 8.587 1.00 10.00 H new ATOM 0 HG2 MET B 1 21.221 0.696 6.652 1.00 10.00 H new ATOM 0 HG3 MET B 1 22.284 -0.537 6.003 1.00 10.00 H new ATOM 0 HE1 MET B 1 19.488 -0.767 3.390 1.00 10.00 H new ATOM 0 HE2 MET B 1 20.497 0.533 4.070 1.00 10.00 H new ATOM 0 HE3 MET B 1 21.223 -1.043 3.673 1.00 10.00 H new ATOM 531 N GLN B 2 24.803 -1.508 8.110 1.00 10.00 N ATOM 532 CA GLN B 2 25.981 -1.754 7.282 1.00 10.00 C ATOM 533 C GLN B 2 25.620 -2.711 6.143 1.00 10.00 C ATOM 534 O GLN B 2 24.771 -3.584 6.274 1.00 10.00 O ATOM 535 CB GLN B 2 27.126 -2.309 8.127 1.00 10.00 C ATOM 536 CG GLN B 2 27.005 -3.806 8.444 1.00 10.00 C ATOM 537 CD GLN B 2 28.195 -4.355 9.231 1.00 10.00 C ATOM 538 OE1 GLN B 2 28.121 -5.394 9.863 1.00 10.00 O ATOM 539 NE2 GLN B 2 29.322 -3.684 9.161 1.00 10.00 N ATOM 0 H GLN B 2 24.615 -2.210 8.826 1.00 10.00 H new ATOM 0 HA GLN B 2 26.317 -0.812 6.850 1.00 10.00 H new ATOM 0 HB2 GLN B 2 28.066 -2.135 7.604 1.00 10.00 H new ATOM 0 HB3 GLN B 2 27.174 -1.753 9.064 1.00 10.00 H new ATOM 0 HG2 GLN B 2 26.091 -3.977 9.013 1.00 10.00 H new ATOM 0 HG3 GLN B 2 26.908 -4.361 7.511 1.00 10.00 H new ATOM 0 HE21 GLN B 2 29.366 -2.816 8.627 1.00 10.00 H new ATOM 0 HE22 GLN B 2 30.153 -4.031 9.640 1.00 10.00 H new ATOM 548 N ILE B 3 26.284 -2.460 5.016 1.00 10.00 N ATOM 549 CA ILE B 3 26.214 -3.371 3.868 1.00 10.00 C ATOM 550 C ILE B 3 27.650 -3.525 3.337 1.00 10.00 C ATOM 551 O ILE B 3 28.499 -2.667 3.558 1.00 10.00 O ATOM 552 CB ILE B 3 25.204 -2.930 2.776 1.00 10.00 C ATOM 553 CG1 ILE B 3 25.720 -1.885 1.771 1.00 10.00 C ATOM 554 CG2 ILE B 3 23.828 -2.554 3.354 1.00 10.00 C ATOM 555 CD1 ILE B 3 26.067 -0.512 2.341 1.00 10.00 C ATOM 0 H ILE B 3 26.873 -1.640 4.871 1.00 10.00 H new ATOM 0 HA ILE B 3 25.819 -4.335 4.187 1.00 10.00 H new ATOM 0 HB ILE B 3 25.074 -3.830 2.175 1.00 10.00 H new ATOM 0 HG12 ILE B 3 26.608 -2.288 1.284 1.00 10.00 H new ATOM 0 HG13 ILE B 3 24.964 -1.753 0.997 1.00 10.00 H new ATOM 0 HG21 ILE B 3 23.163 -2.254 2.544 1.00 10.00 H new ATOM 0 HG22 ILE B 3 23.404 -3.414 3.872 1.00 10.00 H new ATOM 0 HG23 ILE B 3 23.942 -1.728 4.056 1.00 10.00 H new ATOM 0 HD11 ILE B 3 26.419 0.137 1.539 1.00 10.00 H new ATOM 0 HD12 ILE B 3 25.181 -0.074 2.800 1.00 10.00 H new ATOM 0 HD13 ILE B 3 26.850 -0.617 3.092 1.00 10.00 H new ATOM 567 N PHE B 4 27.850 -4.605 2.592 1.00 10.00 N ATOM 568 CA PHE B 4 29.187 -4.928 2.072 1.00 10.00 C ATOM 569 C PHE B 4 29.204 -4.783 0.550 1.00 10.00 C ATOM 570 O PHE B 4 28.215 -5.038 -0.121 1.00 10.00 O ATOM 571 CB PHE B 4 29.550 -6.358 2.479 1.00 10.00 C ATOM 572 CG PHE B 4 29.322 -6.586 3.976 1.00 10.00 C ATOM 573 CD1 PHE B 4 30.216 -6.072 4.910 1.00 10.00 C ATOM 574 CD2 PHE B 4 28.181 -7.257 4.397 1.00 10.00 C ATOM 575 CE1 PHE B 4 29.964 -6.240 6.264 1.00 10.00 C ATOM 576 CE2 PHE B 4 27.935 -7.429 5.751 1.00 10.00 C ATOM 577 CZ PHE B 4 28.828 -6.921 6.687 1.00 10.00 C ATOM 0 H PHE B 4 27.120 -5.268 2.333 1.00 10.00 H new ATOM 0 HA PHE B 4 29.921 -4.239 2.490 1.00 10.00 H new ATOM 0 HB2 PHE B 4 28.950 -7.065 1.906 1.00 10.00 H new ATOM 0 HB3 PHE B 4 30.594 -6.554 2.234 1.00 10.00 H new ATOM 0 HD1 PHE B 4 31.101 -5.546 4.583 1.00 10.00 H new ATOM 0 HD2 PHE B 4 27.484 -7.645 3.669 1.00 10.00 H new ATOM 0 HE1 PHE B 4 30.653 -5.840 6.993 1.00 10.00 H new ATOM 0 HE2 PHE B 4 27.051 -7.957 6.077 1.00 10.00 H new ATOM 0 HZ PHE B 4 28.640 -7.055 7.742 1.00 10.00 H new ATOM 587 N VAL B 5 30.302 -4.222 0.059 1.00 10.00 N ATOM 588 CA VAL B 5 30.533 -4.040 -1.383 1.00 10.00 C ATOM 589 C VAL B 5 31.829 -4.774 -1.738 1.00 10.00 C ATOM 590 O VAL B 5 32.922 -4.347 -1.394 1.00 10.00 O ATOM 591 CB VAL B 5 30.612 -2.548 -1.770 1.00 10.00 C ATOM 592 CG1 VAL B 5 30.876 -2.364 -3.268 1.00 10.00 C ATOM 593 CG2 VAL B 5 29.319 -1.809 -1.414 1.00 10.00 C ATOM 0 H VAL B 5 31.063 -3.877 0.644 1.00 10.00 H new ATOM 0 HA VAL B 5 29.695 -4.451 -1.946 1.00 10.00 H new ATOM 0 HB VAL B 5 31.443 -2.130 -1.202 1.00 10.00 H new ATOM 0 HG11 VAL B 5 30.925 -1.300 -3.501 1.00 10.00 H new ATOM 0 HG12 VAL B 5 31.822 -2.837 -3.532 1.00 10.00 H new ATOM 0 HG13 VAL B 5 30.069 -2.824 -3.839 1.00 10.00 H new ATOM 0 HG21 VAL B 5 29.408 -0.761 -1.700 1.00 10.00 H new ATOM 0 HG22 VAL B 5 28.483 -2.261 -1.948 1.00 10.00 H new ATOM 0 HG23 VAL B 5 29.144 -1.879 -0.340 1.00 10.00 H new ATOM 603 N LYS B 6 31.636 -5.960 -2.313 1.00 10.00 N ATOM 604 CA LYS B 6 32.757 -6.783 -2.769 1.00 10.00 C ATOM 605 C LYS B 6 33.298 -6.249 -4.096 1.00 10.00 C ATOM 606 O LYS B 6 32.569 -5.969 -5.039 1.00 10.00 O ATOM 607 CB LYS B 6 32.259 -8.201 -3.004 1.00 10.00 C ATOM 608 CG LYS B 6 31.841 -8.924 -1.721 1.00 10.00 C ATOM 609 CD LYS B 6 31.263 -10.301 -2.067 1.00 10.00 C ATOM 610 CE LYS B 6 32.283 -11.169 -2.815 1.00 10.00 C ATOM 611 NZ LYS B 6 31.648 -12.354 -3.402 1.00 10.00 N ATOM 0 H LYS B 6 30.717 -6.372 -2.474 1.00 10.00 H new ATOM 0 HA LYS B 6 33.543 -6.761 -2.014 1.00 10.00 H new ATOM 0 HB2 LYS B 6 31.410 -8.171 -3.687 1.00 10.00 H new ATOM 0 HB3 LYS B 6 33.044 -8.776 -3.496 1.00 10.00 H new ATOM 0 HG2 LYS B 6 32.700 -9.036 -1.059 1.00 10.00 H new ATOM 0 HG3 LYS B 6 31.099 -8.332 -1.184 1.00 10.00 H new ATOM 0 HD2 LYS B 6 30.955 -10.807 -1.152 1.00 10.00 H new ATOM 0 HD3 LYS B 6 30.370 -10.178 -2.680 1.00 10.00 H new ATOM 0 HE2 LYS B 6 32.757 -10.581 -3.601 1.00 10.00 H new ATOM 0 HE3 LYS B 6 33.072 -11.479 -2.129 1.00 10.00 H new ATOM 0 HZ1 LYS B 6 32.336 -12.857 -3.998 1.00 10.00 H new ATOM 0 HZ2 LYS B 6 31.322 -12.985 -2.643 1.00 10.00 H new ATOM 0 HZ3 LYS B 6 30.836 -12.061 -3.982 1.00 10.00 H new ATOM 625 N THR B 7 34.631 -6.160 -4.132 1.00 10.00 N ATOM 626 CA THR B 7 35.332 -5.817 -5.376 1.00 10.00 C ATOM 627 C THR B 7 35.934 -7.113 -5.932 1.00 10.00 C ATOM 628 O THR B 7 36.084 -8.116 -5.236 1.00 10.00 O ATOM 629 CB THR B 7 36.427 -4.761 -5.150 1.00 10.00 C ATOM 630 OG1 THR B 7 37.479 -5.352 -4.398 1.00 10.00 O ATOM 631 CG2 THR B 7 35.911 -3.517 -4.415 1.00 10.00 C ATOM 0 H THR B 7 35.240 -6.318 -3.329 1.00 10.00 H new ATOM 0 HA THR B 7 34.629 -5.378 -6.084 1.00 10.00 H new ATOM 0 HB THR B 7 36.777 -4.430 -6.128 1.00 10.00 H new ATOM 0 HG1 THR B 7 38.274 -5.443 -4.963 1.00 10.00 H new ATOM 0 HG21 THR B 7 36.728 -2.807 -4.284 1.00 10.00 H new ATOM 0 HG22 THR B 7 35.117 -3.053 -4.999 1.00 10.00 H new ATOM 0 HG23 THR B 7 35.522 -3.806 -3.439 1.00 10.00 H new ATOM 639 N LEU B 8 36.350 -7.047 -7.194 1.00 10.00 N ATOM 640 CA LEU B 8 36.833 -8.238 -7.915 1.00 10.00 C ATOM 641 C LEU B 8 38.265 -8.661 -7.556 1.00 10.00 C ATOM 642 O LEU B 8 38.688 -9.774 -7.855 1.00 10.00 O ATOM 643 CB LEU B 8 36.620 -8.046 -9.419 1.00 10.00 C ATOM 644 CG LEU B 8 35.155 -7.689 -9.735 1.00 10.00 C ATOM 645 CD1 LEU B 8 34.972 -7.528 -11.240 1.00 10.00 C ATOM 646 CD2 LEU B 8 34.146 -8.704 -9.174 1.00 10.00 C ATOM 0 H LEU B 8 36.365 -6.188 -7.743 1.00 10.00 H new ATOM 0 HA LEU B 8 36.234 -9.085 -7.581 1.00 10.00 H new ATOM 0 HB2 LEU B 8 37.276 -7.256 -9.784 1.00 10.00 H new ATOM 0 HB3 LEU B 8 36.896 -8.959 -9.947 1.00 10.00 H new ATOM 0 HG LEU B 8 34.945 -6.744 -9.234 1.00 10.00 H new ATOM 0 HD11 LEU B 8 33.934 -7.276 -11.455 1.00 10.00 H new ATOM 0 HD12 LEU B 8 35.622 -6.731 -11.602 1.00 10.00 H new ATOM 0 HD13 LEU B 8 35.230 -8.462 -11.740 1.00 10.00 H new ATOM 0 HD21 LEU B 8 33.134 -8.392 -9.433 1.00 10.00 H new ATOM 0 HD22 LEU B 8 34.343 -9.687 -9.601 1.00 10.00 H new ATOM 0 HD23 LEU B 8 34.244 -8.753 -8.090 1.00 10.00 H new ATOM 658 N THR B 9 38.983 -7.736 -6.926 1.00 10.00 N ATOM 659 CA THR B 9 40.271 -8.042 -6.265 1.00 10.00 C ATOM 660 C THR B 9 40.072 -9.063 -5.135 1.00 10.00 C ATOM 661 O THR B 9 40.934 -9.913 -4.911 1.00 10.00 O ATOM 662 CB THR B 9 40.930 -6.777 -5.699 1.00 10.00 C ATOM 663 OG1 THR B 9 40.004 -6.046 -4.890 1.00 10.00 O ATOM 664 CG2 THR B 9 41.490 -5.890 -6.813 1.00 10.00 C ATOM 0 H THR B 9 38.702 -6.758 -6.853 1.00 10.00 H new ATOM 0 HA THR B 9 40.929 -8.465 -7.024 1.00 10.00 H new ATOM 0 HB THR B 9 41.766 -7.090 -5.074 1.00 10.00 H new ATOM 0 HG1 THR B 9 40.441 -5.243 -4.536 1.00 10.00 H new ATOM 0 HG21 THR B 9 41.949 -5.003 -6.376 1.00 10.00 H new ATOM 0 HG22 THR B 9 42.239 -6.445 -7.378 1.00 10.00 H new ATOM 0 HG23 THR B 9 40.682 -5.589 -7.479 1.00 10.00 H new ATOM 672 N GLY B 10 38.910 -8.972 -4.479 1.00 10.00 N ATOM 673 CA GLY B 10 38.544 -9.857 -3.359 1.00 10.00 C ATOM 674 C GLY B 10 38.243 -9.061 -2.084 1.00 10.00 C ATOM 675 O GLY B 10 37.540 -9.550 -1.199 1.00 10.00 O ATOM 0 H GLY B 10 38.193 -8.283 -4.707 1.00 10.00 H new ATOM 0 HA2 GLY B 10 37.671 -10.449 -3.633 1.00 10.00 H new ATOM 0 HA3 GLY B 10 39.357 -10.557 -3.168 1.00 10.00 H new ATOM 679 N LYS B 11 38.809 -7.861 -1.994 1.00 10.00 N ATOM 680 CA LYS B 11 38.572 -6.952 -0.854 1.00 10.00 C ATOM 681 C LYS B 11 37.070 -6.618 -0.763 1.00 10.00 C ATOM 682 O LYS B 11 36.360 -6.545 -1.764 1.00 10.00 O ATOM 683 CB LYS B 11 39.386 -5.667 -1.024 1.00 10.00 C ATOM 684 CG LYS B 11 39.528 -4.926 0.315 1.00 10.00 C ATOM 685 CD LYS B 11 39.244 -3.427 0.198 1.00 10.00 C ATOM 686 CE LYS B 11 40.298 -2.649 -0.598 1.00 10.00 C ATOM 687 NZ LYS B 11 41.566 -2.533 0.138 1.00 10.00 N ATOM 0 H LYS B 11 39.442 -7.484 -2.699 1.00 10.00 H new ATOM 0 HA LYS B 11 38.887 -7.444 0.066 1.00 10.00 H new ATOM 0 HB2 LYS B 11 40.374 -5.907 -1.418 1.00 10.00 H new ATOM 0 HB3 LYS B 11 38.901 -5.018 -1.753 1.00 10.00 H new ATOM 0 HG2 LYS B 11 38.844 -5.365 1.042 1.00 10.00 H new ATOM 0 HG3 LYS B 11 40.538 -5.071 0.699 1.00 10.00 H new ATOM 0 HD2 LYS B 11 38.272 -3.288 -0.275 1.00 10.00 H new ATOM 0 HD3 LYS B 11 39.174 -3.002 1.199 1.00 10.00 H new ATOM 0 HE2 LYS B 11 40.475 -3.149 -1.550 1.00 10.00 H new ATOM 0 HE3 LYS B 11 39.918 -1.653 -0.826 1.00 10.00 H new ATOM 0 HZ1 LYS B 11 42.241 -1.971 -0.420 1.00 10.00 H new ATOM 0 HZ2 LYS B 11 41.396 -2.064 1.051 1.00 10.00 H new ATOM 0 HZ3 LYS B 11 41.959 -3.481 0.304 1.00 10.00 H new ATOM 701 N THR B 12 36.634 -6.401 0.475 1.00 10.00 N ATOM 702 CA THR B 12 35.236 -6.042 0.773 1.00 10.00 C ATOM 703 C THR B 12 35.219 -4.696 1.501 1.00 10.00 C ATOM 704 O THR B 12 35.842 -4.521 2.536 1.00 10.00 O ATOM 705 CB THR B 12 34.583 -7.134 1.640 1.00 10.00 C ATOM 706 OG1 THR B 12 34.574 -8.359 0.908 1.00 10.00 O ATOM 707 CG2 THR B 12 33.150 -6.795 2.066 1.00 10.00 C ATOM 0 H THR B 12 37.230 -6.467 1.300 1.00 10.00 H new ATOM 0 HA THR B 12 34.668 -5.961 -0.153 1.00 10.00 H new ATOM 0 HB THR B 12 35.174 -7.216 2.552 1.00 10.00 H new ATOM 0 HG1 THR B 12 34.162 -9.062 1.452 1.00 10.00 H new ATOM 0 HG21 THR B 12 32.750 -7.606 2.674 1.00 10.00 H new ATOM 0 HG22 THR B 12 33.152 -5.873 2.647 1.00 10.00 H new ATOM 0 HG23 THR B 12 32.528 -6.665 1.180 1.00 10.00 H new ATOM 715 N ILE B 13 34.379 -3.810 0.964 1.00 10.00 N ATOM 716 CA ILE B 13 34.151 -2.486 1.566 1.00 10.00 C ATOM 717 C ILE B 13 32.922 -2.619 2.476 1.00 10.00 C ATOM 718 O ILE B 13 31.892 -3.136 2.064 1.00 10.00 O ATOM 719 CB ILE B 13 33.843 -1.415 0.493 1.00 10.00 C ATOM 720 CG1 ILE B 13 34.562 -1.615 -0.855 1.00 10.00 C ATOM 721 CG2 ILE B 13 34.108 -0.009 1.054 1.00 10.00 C ATOM 722 CD1 ILE B 13 36.088 -1.752 -0.791 1.00 10.00 C ATOM 0 H ILE B 13 33.843 -3.981 0.113 1.00 10.00 H new ATOM 0 HA ILE B 13 35.046 -2.175 2.106 1.00 10.00 H new ATOM 0 HB ILE B 13 32.784 -1.532 0.261 1.00 10.00 H new ATOM 0 HG12 ILE B 13 34.157 -2.508 -1.331 1.00 10.00 H new ATOM 0 HG13 ILE B 13 34.320 -0.772 -1.502 1.00 10.00 H new ATOM 0 HG21 ILE B 13 33.887 0.735 0.289 1.00 10.00 H new ATOM 0 HG22 ILE B 13 33.471 0.163 1.922 1.00 10.00 H new ATOM 0 HG23 ILE B 13 35.154 0.074 1.350 1.00 10.00 H new ATOM 0 HD11 ILE B 13 36.484 -1.888 -1.798 1.00 10.00 H new ATOM 0 HD12 ILE B 13 36.516 -0.851 -0.352 1.00 10.00 H new ATOM 0 HD13 ILE B 13 36.351 -2.614 -0.178 1.00 10.00 H new ATOM 734 N THR B 14 33.065 -2.119 3.700 1.00 10.00 N ATOM 735 CA THR B 14 31.917 -2.012 4.618 1.00 10.00 C ATOM 736 C THR B 14 31.475 -0.548 4.631 1.00 10.00 C ATOM 737 O THR B 14 32.279 0.358 4.833 1.00 10.00 O ATOM 738 CB THR B 14 32.295 -2.472 6.034 1.00 10.00 C ATOM 739 OG1 THR B 14 32.722 -3.834 5.992 1.00 10.00 O ATOM 740 CG2 THR B 14 31.123 -2.344 7.010 1.00 10.00 C ATOM 0 H THR B 14 33.949 -1.783 4.083 1.00 10.00 H new ATOM 0 HA THR B 14 31.106 -2.657 4.279 1.00 10.00 H new ATOM 0 HB THR B 14 33.100 -1.828 6.388 1.00 10.00 H new ATOM 0 HG1 THR B 14 31.940 -4.419 5.909 1.00 10.00 H new ATOM 0 HG21 THR B 14 31.435 -2.680 7.999 1.00 10.00 H new ATOM 0 HG22 THR B 14 30.806 -1.302 7.064 1.00 10.00 H new ATOM 0 HG23 THR B 14 30.292 -2.958 6.663 1.00 10.00 H new ATOM 748 N LEU B 15 30.168 -0.371 4.453 1.00 10.00 N ATOM 749 CA LEU B 15 29.556 0.966 4.478 1.00 10.00 C ATOM 750 C LEU B 15 28.429 1.047 5.511 1.00 10.00 C ATOM 751 O LEU B 15 27.698 0.086 5.718 1.00 10.00 O ATOM 752 CB LEU B 15 29.000 1.309 3.093 1.00 10.00 C ATOM 753 CG LEU B 15 30.060 1.323 1.986 1.00 10.00 C ATOM 754 CD1 LEU B 15 29.367 1.462 0.632 1.00 10.00 C ATOM 755 CD2 LEU B 15 31.051 2.474 2.181 1.00 10.00 C ATOM 0 H LEU B 15 29.509 -1.132 4.290 1.00 10.00 H new ATOM 0 HA LEU B 15 30.329 1.682 4.757 1.00 10.00 H new ATOM 0 HB2 LEU B 15 28.227 0.586 2.833 1.00 10.00 H new ATOM 0 HB3 LEU B 15 28.521 2.287 3.136 1.00 10.00 H new ATOM 0 HG LEU B 15 30.619 0.388 2.027 1.00 10.00 H new ATOM 0 HD11 LEU B 15 30.115 1.473 -0.160 1.00 10.00 H new ATOM 0 HD12 LEU B 15 28.691 0.620 0.481 1.00 10.00 H new ATOM 0 HD13 LEU B 15 28.799 2.392 0.608 1.00 10.00 H new ATOM 0 HD21 LEU B 15 31.790 2.457 1.380 1.00 10.00 H new ATOM 0 HD22 LEU B 15 30.515 3.423 2.160 1.00 10.00 H new ATOM 0 HD23 LEU B 15 31.554 2.362 3.142 1.00 10.00 H new ATOM 767 N GLU B 16 28.348 2.222 6.135 1.00 10.00 N ATOM 768 CA GLU B 16 27.233 2.594 7.023 1.00 10.00 C ATOM 769 C GLU B 16 26.272 3.479 6.225 1.00 10.00 C ATOM 770 O GLU B 16 26.603 4.589 5.834 1.00 10.00 O ATOM 771 CB GLU B 16 27.775 3.355 8.241 1.00 10.00 C ATOM 772 CG GLU B 16 26.666 3.824 9.193 1.00 10.00 C ATOM 773 CD GLU B 16 25.829 2.671 9.757 1.00 10.00 C ATOM 774 OE1 GLU B 16 26.419 1.624 10.100 1.00 10.00 O ATOM 775 OE2 GLU B 16 24.599 2.872 9.845 1.00 10.00 O ATOM 0 H GLU B 16 29.055 2.951 6.042 1.00 10.00 H new ATOM 0 HA GLU B 16 26.712 1.706 7.380 1.00 10.00 H new ATOM 0 HB2 GLU B 16 28.467 2.713 8.786 1.00 10.00 H new ATOM 0 HB3 GLU B 16 28.344 4.220 7.899 1.00 10.00 H new ATOM 0 HG2 GLU B 16 27.114 4.377 10.018 1.00 10.00 H new ATOM 0 HG3 GLU B 16 26.010 4.516 8.664 1.00 10.00 H new ATOM 782 N VAL B 17 25.102 2.900 5.941 1.00 10.00 N ATOM 783 CA VAL B 17 24.101 3.549 5.085 1.00 10.00 C ATOM 784 C VAL B 17 22.699 3.526 5.722 1.00 10.00 C ATOM 785 O VAL B 17 22.449 2.924 6.755 1.00 10.00 O ATOM 786 CB VAL B 17 24.071 2.881 3.692 1.00 10.00 C ATOM 787 CG1 VAL B 17 25.418 2.978 2.970 1.00 10.00 C ATOM 788 CG2 VAL B 17 23.578 1.434 3.767 1.00 10.00 C ATOM 0 H VAL B 17 24.823 1.983 6.291 1.00 10.00 H new ATOM 0 HA VAL B 17 24.392 4.593 4.973 1.00 10.00 H new ATOM 0 HB VAL B 17 23.352 3.442 3.095 1.00 10.00 H new ATOM 0 HG11 VAL B 17 25.345 2.494 1.996 1.00 10.00 H new ATOM 0 HG12 VAL B 17 25.684 4.026 2.835 1.00 10.00 H new ATOM 0 HG13 VAL B 17 26.186 2.483 3.564 1.00 10.00 H new ATOM 0 HG21 VAL B 17 23.571 1.000 2.767 1.00 10.00 H new ATOM 0 HG22 VAL B 17 24.242 0.856 4.409 1.00 10.00 H new ATOM 0 HG23 VAL B 17 22.569 1.414 4.178 1.00 10.00 H new ATOM 798 N GLU B 18 21.787 4.164 5.005 1.00 10.00 N ATOM 799 CA GLU B 18 20.340 4.112 5.251 1.00 10.00 C ATOM 800 C GLU B 18 19.659 3.591 3.982 1.00 10.00 C ATOM 801 O GLU B 18 20.108 3.884 2.881 1.00 10.00 O ATOM 802 CB GLU B 18 19.831 5.521 5.581 1.00 10.00 C ATOM 803 CG GLU B 18 20.442 6.084 6.873 1.00 10.00 C ATOM 804 CD GLU B 18 20.204 5.215 8.119 1.00 10.00 C ATOM 805 OE1 GLU B 18 19.210 4.453 8.123 1.00 10.00 O ATOM 806 OE2 GLU B 18 21.020 5.346 9.055 1.00 10.00 O ATOM 0 H GLU B 18 22.033 4.753 4.209 1.00 10.00 H new ATOM 0 HA GLU B 18 20.116 3.453 6.090 1.00 10.00 H new ATOM 0 HB2 GLU B 18 20.063 6.190 4.752 1.00 10.00 H new ATOM 0 HB3 GLU B 18 18.746 5.498 5.677 1.00 10.00 H new ATOM 0 HG2 GLU B 18 21.516 6.206 6.730 1.00 10.00 H new ATOM 0 HG3 GLU B 18 20.030 7.077 7.053 1.00 10.00 H new ATOM 813 N SER B 19 18.494 2.953 4.157 1.00 10.00 N ATOM 814 CA SER B 19 17.683 2.475 3.013 1.00 10.00 C ATOM 815 C SER B 19 17.248 3.617 2.081 1.00 10.00 C ATOM 816 O SER B 19 17.121 3.441 0.871 1.00 10.00 O ATOM 817 CB SER B 19 16.422 1.753 3.488 1.00 10.00 C ATOM 818 OG SER B 19 16.785 0.604 4.254 1.00 10.00 O ATOM 0 H SER B 19 18.088 2.754 5.071 1.00 10.00 H new ATOM 0 HA SER B 19 18.329 1.791 2.464 1.00 10.00 H new ATOM 0 HB2 SER B 19 15.811 2.426 4.090 1.00 10.00 H new ATOM 0 HB3 SER B 19 15.818 1.455 2.631 1.00 10.00 H new ATOM 0 HG SER B 19 15.975 0.144 4.558 1.00 10.00 H new ATOM 824 N SER B 20 17.097 4.801 2.678 1.00 10.00 N ATOM 825 CA SER B 20 16.756 6.048 1.971 1.00 10.00 C ATOM 826 C SER B 20 17.883 6.634 1.105 1.00 10.00 C ATOM 827 O SER B 20 17.627 7.514 0.285 1.00 10.00 O ATOM 828 CB SER B 20 16.259 7.104 2.964 1.00 10.00 C ATOM 829 OG SER B 20 17.199 7.265 4.035 1.00 10.00 O ATOM 0 H SER B 20 17.209 4.928 3.684 1.00 10.00 H new ATOM 0 HA SER B 20 15.965 5.771 1.274 1.00 10.00 H new ATOM 0 HB2 SER B 20 16.116 8.055 2.452 1.00 10.00 H new ATOM 0 HB3 SER B 20 15.289 6.808 3.364 1.00 10.00 H new ATOM 0 HG SER B 20 16.869 7.944 4.660 1.00 10.00 H new ATOM 835 N ASP B 21 19.102 6.122 1.255 1.00 10.00 N ATOM 836 CA ASP B 21 20.246 6.594 0.448 1.00 10.00 C ATOM 837 C ASP B 21 20.046 6.279 -1.032 1.00 10.00 C ATOM 838 O ASP B 21 19.690 5.167 -1.409 1.00 10.00 O ATOM 839 CB ASP B 21 21.562 5.974 0.921 1.00 10.00 C ATOM 840 CG ASP B 21 21.993 6.491 2.297 1.00 10.00 C ATOM 841 OD1 ASP B 21 21.547 7.589 2.695 1.00 10.00 O ATOM 842 OD2 ASP B 21 22.848 5.812 2.896 1.00 10.00 O ATOM 0 H ASP B 21 19.332 5.384 1.921 1.00 10.00 H new ATOM 0 HA ASP B 21 20.298 7.675 0.581 1.00 10.00 H new ATOM 0 HB2 ASP B 21 21.456 4.890 0.961 1.00 10.00 H new ATOM 0 HB3 ASP B 21 22.344 6.191 0.194 1.00 10.00 H new ATOM 847 N THR B 22 20.269 7.322 -1.835 1.00 10.00 N ATOM 848 CA THR B 22 20.265 7.189 -3.301 1.00 10.00 C ATOM 849 C THR B 22 21.508 6.382 -3.709 1.00 10.00 C ATOM 850 O THR B 22 22.526 6.391 -3.030 1.00 10.00 O ATOM 851 CB THR B 22 20.279 8.559 -4.003 1.00 10.00 C ATOM 852 OG1 THR B 22 21.520 9.227 -3.755 1.00 10.00 O ATOM 853 CG2 THR B 22 19.089 9.428 -3.584 1.00 10.00 C ATOM 0 H THR B 22 20.455 8.267 -1.500 1.00 10.00 H new ATOM 0 HA THR B 22 19.350 6.681 -3.607 1.00 10.00 H new ATOM 0 HB THR B 22 20.182 8.388 -5.075 1.00 10.00 H new ATOM 0 HG1 THR B 22 21.520 10.096 -4.207 1.00 10.00 H new ATOM 0 HG21 THR B 22 19.137 10.386 -4.102 1.00 10.00 H new ATOM 0 HG22 THR B 22 18.159 8.921 -3.843 1.00 10.00 H new ATOM 0 HG23 THR B 22 19.122 9.596 -2.508 1.00 10.00 H new ATOM 861 N ILE B 23 21.405 5.709 -4.858 1.00 10.00 N ATOM 862 CA ILE B 23 22.545 4.950 -5.416 1.00 10.00 C ATOM 863 C ILE B 23 23.756 5.859 -5.672 1.00 10.00 C ATOM 864 O ILE B 23 24.883 5.524 -5.305 1.00 10.00 O ATOM 865 CB ILE B 23 22.109 4.209 -6.698 1.00 10.00 C ATOM 866 CG1 ILE B 23 20.978 3.211 -6.403 1.00 10.00 C ATOM 867 CG2 ILE B 23 23.271 3.538 -7.447 1.00 10.00 C ATOM 868 CD1 ILE B 23 21.290 2.155 -5.334 1.00 10.00 C ATOM 0 H ILE B 23 20.556 5.669 -5.421 1.00 10.00 H new ATOM 0 HA ILE B 23 22.859 4.209 -4.681 1.00 10.00 H new ATOM 0 HB ILE B 23 21.727 4.974 -7.374 1.00 10.00 H new ATOM 0 HG12 ILE B 23 20.096 3.770 -6.090 1.00 10.00 H new ATOM 0 HG13 ILE B 23 20.718 2.699 -7.330 1.00 10.00 H new ATOM 0 HG21 ILE B 23 22.889 3.037 -8.337 1.00 10.00 H new ATOM 0 HG22 ILE B 23 23.999 4.294 -7.740 1.00 10.00 H new ATOM 0 HG23 ILE B 23 23.749 2.806 -6.796 1.00 10.00 H new ATOM 0 HD11 ILE B 23 20.426 1.503 -5.204 1.00 10.00 H new ATOM 0 HD12 ILE B 23 22.149 1.562 -5.648 1.00 10.00 H new ATOM 0 HD13 ILE B 23 21.517 2.649 -4.389 1.00 10.00 H new ATOM 880 N ASP B 24 23.460 7.058 -6.164 1.00 10.00 N ATOM 881 CA ASP B 24 24.483 8.098 -6.383 1.00 10.00 C ATOM 882 C ASP B 24 25.219 8.444 -5.077 1.00 10.00 C ATOM 883 O ASP B 24 26.442 8.567 -5.062 1.00 10.00 O ATOM 884 CB ASP B 24 23.816 9.346 -6.973 1.00 10.00 C ATOM 885 CG ASP B 24 24.835 10.463 -7.218 1.00 10.00 C ATOM 886 OD1 ASP B 24 25.745 10.231 -8.039 1.00 10.00 O ATOM 887 OD2 ASP B 24 24.674 11.505 -6.550 1.00 10.00 O ATOM 0 H ASP B 24 22.516 7.343 -6.423 1.00 10.00 H new ATOM 0 HA ASP B 24 25.226 7.716 -7.083 1.00 10.00 H new ATOM 0 HB2 ASP B 24 23.324 9.088 -7.911 1.00 10.00 H new ATOM 0 HB3 ASP B 24 23.041 9.701 -6.294 1.00 10.00 H new ATOM 892 N ASN B 25 24.450 8.521 -3.993 1.00 10.00 N ATOM 893 CA ASN B 25 24.976 8.785 -2.644 1.00 10.00 C ATOM 894 C ASN B 25 25.902 7.657 -2.155 1.00 10.00 C ATOM 895 O ASN B 25 26.955 7.924 -1.580 1.00 10.00 O ATOM 896 CB ASN B 25 23.795 8.967 -1.688 1.00 10.00 C ATOM 897 CG ASN B 25 24.228 9.169 -0.245 1.00 10.00 C ATOM 898 OD1 ASN B 25 25.033 10.023 0.102 1.00 10.00 O ATOM 899 ND2 ASN B 25 23.698 8.337 0.607 1.00 10.00 N ATOM 0 H ASN B 25 23.437 8.402 -4.020 1.00 10.00 H new ATOM 0 HA ASN B 25 25.579 9.692 -2.674 1.00 10.00 H new ATOM 0 HB2 ASN B 25 23.204 9.825 -2.008 1.00 10.00 H new ATOM 0 HB3 ASN B 25 23.147 8.093 -1.749 1.00 10.00 H new ATOM 0 HD21 ASN B 25 23.952 8.387 1.594 1.00 10.00 H new ATOM 0 HD22 ASN B 25 23.030 7.636 0.287 1.00 10.00 H new ATOM 906 N VAL B 26 25.529 6.415 -2.463 1.00 10.00 N ATOM 907 CA VAL B 26 26.352 5.226 -2.152 1.00 10.00 C ATOM 908 C VAL B 26 27.688 5.280 -2.906 1.00 10.00 C ATOM 909 O VAL B 26 28.748 5.105 -2.314 1.00 10.00 O ATOM 910 CB VAL B 26 25.583 3.929 -2.473 1.00 10.00 C ATOM 911 CG1 VAL B 26 26.450 2.665 -2.353 1.00 10.00 C ATOM 912 CG2 VAL B 26 24.396 3.773 -1.520 1.00 10.00 C ATOM 0 H VAL B 26 24.651 6.195 -2.934 1.00 10.00 H new ATOM 0 HA VAL B 26 26.569 5.229 -1.084 1.00 10.00 H new ATOM 0 HB VAL B 26 25.256 4.023 -3.509 1.00 10.00 H new ATOM 0 HG11 VAL B 26 25.849 1.788 -2.592 1.00 10.00 H new ATOM 0 HG12 VAL B 26 27.288 2.731 -3.047 1.00 10.00 H new ATOM 0 HG13 VAL B 26 26.829 2.579 -1.335 1.00 10.00 H new ATOM 0 HG21 VAL B 26 23.859 2.854 -1.755 1.00 10.00 H new ATOM 0 HG22 VAL B 26 24.758 3.730 -0.493 1.00 10.00 H new ATOM 0 HG23 VAL B 26 23.725 4.624 -1.633 1.00 10.00 H new ATOM 922 N LYS B 27 27.614 5.537 -4.212 1.00 10.00 N ATOM 923 CA LYS B 27 28.807 5.621 -5.073 1.00 10.00 C ATOM 924 C LYS B 27 29.791 6.704 -4.600 1.00 10.00 C ATOM 925 O LYS B 27 31.002 6.486 -4.579 1.00 10.00 O ATOM 926 CB LYS B 27 28.397 5.893 -6.523 1.00 10.00 C ATOM 927 CG LYS B 27 27.646 4.700 -7.112 1.00 10.00 C ATOM 928 CD LYS B 27 27.252 4.972 -8.561 1.00 10.00 C ATOM 929 CE LYS B 27 26.559 3.746 -9.153 1.00 10.00 C ATOM 930 NZ LYS B 27 26.131 4.004 -10.532 1.00 10.00 N ATOM 0 H LYS B 27 26.735 5.693 -4.706 1.00 10.00 H new ATOM 0 HA LYS B 27 29.317 4.660 -5.009 1.00 10.00 H new ATOM 0 HB2 LYS B 27 27.767 6.781 -6.566 1.00 10.00 H new ATOM 0 HB3 LYS B 27 29.283 6.101 -7.122 1.00 10.00 H new ATOM 0 HG2 LYS B 27 28.272 3.809 -7.061 1.00 10.00 H new ATOM 0 HG3 LYS B 27 26.754 4.497 -6.519 1.00 10.00 H new ATOM 0 HD2 LYS B 27 26.587 5.835 -8.610 1.00 10.00 H new ATOM 0 HD3 LYS B 27 28.137 5.218 -9.147 1.00 10.00 H new ATOM 0 HE2 LYS B 27 27.238 2.893 -9.132 1.00 10.00 H new ATOM 0 HE3 LYS B 27 25.695 3.481 -8.543 1.00 10.00 H new ATOM 0 HZ1 LYS B 27 25.252 3.483 -10.726 1.00 10.00 H new ATOM 0 HZ2 LYS B 27 25.965 5.023 -10.659 1.00 10.00 H new ATOM 0 HZ3 LYS B 27 26.872 3.689 -11.190 1.00 10.00 H new ATOM 944 N SER B 28 29.224 7.803 -4.098 1.00 10.00 N ATOM 945 CA SER B 28 29.990 8.881 -3.441 1.00 10.00 C ATOM 946 C SER B 28 30.678 8.403 -2.148 1.00 10.00 C ATOM 947 O SER B 28 31.866 8.636 -1.942 1.00 10.00 O ATOM 948 CB SER B 28 29.073 10.065 -3.126 1.00 10.00 C ATOM 949 OG SER B 28 29.862 11.132 -2.599 1.00 10.00 O ATOM 0 H SER B 28 28.220 7.977 -4.132 1.00 10.00 H new ATOM 0 HA SER B 28 30.769 9.190 -4.138 1.00 10.00 H new ATOM 0 HB2 SER B 28 28.553 10.390 -4.027 1.00 10.00 H new ATOM 0 HB3 SER B 28 28.309 9.770 -2.407 1.00 10.00 H new ATOM 0 HG SER B 28 29.284 11.897 -2.395 1.00 10.00 H new ATOM 955 N LYS B 29 29.975 7.554 -1.394 1.00 10.00 N ATOM 956 CA LYS B 29 30.531 6.885 -0.196 1.00 10.00 C ATOM 957 C LYS B 29 31.688 5.930 -0.548 1.00 10.00 C ATOM 958 O LYS B 29 32.667 5.837 0.188 1.00 10.00 O ATOM 959 CB LYS B 29 29.462 6.089 0.559 1.00 10.00 C ATOM 960 CG LYS B 29 28.377 6.969 1.183 1.00 10.00 C ATOM 961 CD LYS B 29 27.353 6.082 1.894 1.00 10.00 C ATOM 962 CE LYS B 29 26.190 6.875 2.495 1.00 10.00 C ATOM 963 NZ LYS B 29 26.598 7.704 3.638 1.00 10.00 N ATOM 0 H LYS B 29 29.005 7.306 -1.589 1.00 10.00 H new ATOM 0 HA LYS B 29 30.907 7.687 0.439 1.00 10.00 H new ATOM 0 HB2 LYS B 29 28.996 5.381 -0.126 1.00 10.00 H new ATOM 0 HB3 LYS B 29 29.942 5.505 1.344 1.00 10.00 H new ATOM 0 HG2 LYS B 29 28.822 7.669 1.890 1.00 10.00 H new ATOM 0 HG3 LYS B 29 27.887 7.564 0.412 1.00 10.00 H new ATOM 0 HD2 LYS B 29 26.960 5.351 1.187 1.00 10.00 H new ATOM 0 HD3 LYS B 29 27.852 5.523 2.686 1.00 10.00 H new ATOM 0 HE2 LYS B 29 25.755 7.513 1.726 1.00 10.00 H new ATOM 0 HE3 LYS B 29 25.410 6.183 2.813 1.00 10.00 H new ATOM 0 HZ1 LYS B 29 25.773 8.219 4.006 1.00 10.00 H new ATOM 0 HZ2 LYS B 29 26.988 7.096 4.386 1.00 10.00 H new ATOM 0 HZ3 LYS B 29 27.322 8.385 3.332 1.00 10.00 H new ATOM 977 N ILE B 30 31.598 5.302 -1.722 1.00 10.00 N ATOM 978 CA ILE B 30 32.666 4.437 -2.275 1.00 10.00 C ATOM 979 C ILE B 30 33.893 5.283 -2.645 1.00 10.00 C ATOM 980 O ILE B 30 35.026 4.903 -2.366 1.00 10.00 O ATOM 981 CB ILE B 30 32.154 3.608 -3.472 1.00 10.00 C ATOM 982 CG1 ILE B 30 31.125 2.582 -2.973 1.00 10.00 C ATOM 983 CG2 ILE B 30 33.296 2.931 -4.260 1.00 10.00 C ATOM 984 CD1 ILE B 30 30.410 1.784 -4.073 1.00 10.00 C ATOM 0 H ILE B 30 30.780 5.374 -2.327 1.00 10.00 H new ATOM 0 HA ILE B 30 32.968 3.724 -1.508 1.00 10.00 H new ATOM 0 HB ILE B 30 31.674 4.288 -4.176 1.00 10.00 H new ATOM 0 HG12 ILE B 30 31.628 1.881 -2.307 1.00 10.00 H new ATOM 0 HG13 ILE B 30 30.375 3.104 -2.379 1.00 10.00 H new ATOM 0 HG21 ILE B 30 32.878 2.362 -5.090 1.00 10.00 H new ATOM 0 HG22 ILE B 30 33.973 3.693 -4.647 1.00 10.00 H new ATOM 0 HG23 ILE B 30 33.845 2.260 -3.600 1.00 10.00 H new ATOM 0 HD11 ILE B 30 29.705 1.088 -3.618 1.00 10.00 H new ATOM 0 HD12 ILE B 30 29.872 2.469 -4.728 1.00 10.00 H new ATOM 0 HD13 ILE B 30 31.145 1.228 -4.655 1.00 10.00 H new ATOM 996 N GLN B 31 33.637 6.415 -3.299 1.00 10.00 N ATOM 997 CA GLN B 31 34.693 7.382 -3.639 1.00 10.00 C ATOM 998 C GLN B 31 35.404 7.882 -2.373 1.00 10.00 C ATOM 999 O GLN B 31 36.629 7.955 -2.348 1.00 10.00 O ATOM 1000 CB GLN B 31 34.061 8.554 -4.390 1.00 10.00 C ATOM 1001 CG GLN B 31 35.118 9.557 -4.855 1.00 10.00 C ATOM 1002 CD GLN B 31 34.498 10.739 -5.590 1.00 10.00 C ATOM 1003 OE1 GLN B 31 33.373 11.169 -5.363 1.00 10.00 O ATOM 1004 NE2 GLN B 31 35.237 11.261 -6.538 1.00 10.00 N ATOM 0 H GLN B 31 32.705 6.691 -3.607 1.00 10.00 H new ATOM 0 HA GLN B 31 35.438 6.896 -4.269 1.00 10.00 H new ATOM 0 HB2 GLN B 31 33.509 8.180 -5.252 1.00 10.00 H new ATOM 0 HB3 GLN B 31 33.341 9.056 -3.744 1.00 10.00 H new ATOM 0 HG2 GLN B 31 35.678 9.919 -3.993 1.00 10.00 H new ATOM 0 HG3 GLN B 31 35.830 9.056 -5.510 1.00 10.00 H new ATOM 0 HE21 GLN B 31 36.172 10.894 -6.717 1.00 10.00 H new ATOM 0 HE22 GLN B 31 34.878 12.035 -7.097 1.00 10.00 H new ATOM 1013 N ASP B 32 34.628 8.037 -1.304 1.00 10.00 N ATOM 1014 CA ASP B 32 35.145 8.444 0.014 1.00 10.00 C ATOM 1015 C ASP B 32 36.049 7.413 0.701 1.00 10.00 C ATOM 1016 O ASP B 32 36.879 7.794 1.526 1.00 10.00 O ATOM 1017 CB ASP B 32 33.997 8.876 0.932 1.00 10.00 C ATOM 1018 CG ASP B 32 33.433 10.246 0.532 1.00 10.00 C ATOM 1019 OD1 ASP B 32 34.229 11.095 0.070 1.00 10.00 O ATOM 1020 OD2 ASP B 32 32.215 10.426 0.740 1.00 10.00 O ATOM 0 H ASP B 32 33.619 7.885 -1.320 1.00 10.00 H new ATOM 0 HA ASP B 32 35.797 9.295 -0.181 1.00 10.00 H new ATOM 0 HB2 ASP B 32 33.202 8.131 0.896 1.00 10.00 H new ATOM 0 HB3 ASP B 32 34.350 8.915 1.962 1.00 10.00 H new ATOM 1025 N LYS B 33 35.886 6.139 0.359 1.00 10.00 N ATOM 1026 CA LYS B 33 36.744 5.076 0.917 1.00 10.00 C ATOM 1027 C LYS B 33 37.849 4.588 -0.027 1.00 10.00 C ATOM 1028 O LYS B 33 38.979 4.371 0.393 1.00 10.00 O ATOM 1029 CB LYS B 33 35.921 3.870 1.374 1.00 10.00 C ATOM 1030 CG LYS B 33 35.146 4.151 2.667 1.00 10.00 C ATOM 1031 CD LYS B 33 34.776 2.854 3.395 1.00 10.00 C ATOM 1032 CE LYS B 33 36.025 2.144 3.934 1.00 10.00 C ATOM 1033 NZ LYS B 33 35.699 0.908 4.654 1.00 10.00 N ATOM 0 H LYS B 33 35.176 5.810 -0.296 1.00 10.00 H new ATOM 0 HA LYS B 33 37.232 5.549 1.769 1.00 10.00 H new ATOM 0 HB2 LYS B 33 35.221 3.591 0.587 1.00 10.00 H new ATOM 0 HB3 LYS B 33 36.583 3.018 1.528 1.00 10.00 H new ATOM 0 HG2 LYS B 33 35.748 4.779 3.324 1.00 10.00 H new ATOM 0 HG3 LYS B 33 34.240 4.710 2.435 1.00 10.00 H new ATOM 0 HD2 LYS B 33 34.098 3.077 4.218 1.00 10.00 H new ATOM 0 HD3 LYS B 33 34.243 2.191 2.714 1.00 10.00 H new ATOM 0 HE2 LYS B 33 36.694 1.913 3.105 1.00 10.00 H new ATOM 0 HE3 LYS B 33 36.564 2.818 4.600 1.00 10.00 H new ATOM 0 HZ1 LYS B 33 36.575 0.466 4.998 1.00 10.00 H new ATOM 0 HZ2 LYS B 33 35.082 1.129 5.462 1.00 10.00 H new ATOM 0 HZ3 LYS B 33 35.209 0.252 4.013 1.00 10.00 H new ATOM 1047 N GLU B 34 37.523 4.481 -1.311 1.00 10.00 N ATOM 1048 CA GLU B 34 38.431 3.885 -2.306 1.00 10.00 C ATOM 1049 C GLU B 34 39.128 4.899 -3.219 1.00 10.00 C ATOM 1050 O GLU B 34 40.220 4.627 -3.720 1.00 10.00 O ATOM 1051 CB GLU B 34 37.665 2.852 -3.135 1.00 10.00 C ATOM 1052 CG GLU B 34 37.282 1.627 -2.299 1.00 10.00 C ATOM 1053 CD GLU B 34 38.495 0.876 -1.729 1.00 10.00 C ATOM 1054 OE1 GLU B 34 39.506 0.764 -2.457 1.00 10.00 O ATOM 1055 OE2 GLU B 34 38.351 0.360 -0.600 1.00 10.00 O ATOM 0 H GLU B 34 36.634 4.799 -1.696 1.00 10.00 H new ATOM 0 HA GLU B 34 39.235 3.410 -1.745 1.00 10.00 H new ATOM 0 HB2 GLU B 34 36.764 3.309 -3.544 1.00 10.00 H new ATOM 0 HB3 GLU B 34 38.276 2.539 -3.981 1.00 10.00 H new ATOM 0 HG2 GLU B 34 36.640 1.943 -1.477 1.00 10.00 H new ATOM 0 HG3 GLU B 34 36.697 0.944 -2.915 1.00 10.00 H new ATOM 1062 N GLY B 35 38.442 6.013 -3.480 1.00 10.00 N ATOM 1063 CA GLY B 35 38.934 7.056 -4.401 1.00 10.00 C ATOM 1064 C GLY B 35 38.407 6.870 -5.834 1.00 10.00 C ATOM 1065 O GLY B 35 38.720 7.654 -6.722 1.00 10.00 O ATOM 0 H GLY B 35 37.534 6.223 -3.065 1.00 10.00 H new ATOM 0 HA2 GLY B 35 38.632 8.036 -4.030 1.00 10.00 H new ATOM 0 HA3 GLY B 35 40.024 7.041 -4.413 1.00 10.00 H new ATOM 1069 N ILE B 36 37.564 5.853 -6.012 1.00 10.00 N ATOM 1070 CA ILE B 36 36.947 5.521 -7.311 1.00 10.00 C ATOM 1071 C ILE B 36 35.914 6.601 -7.677 1.00 10.00 C ATOM 1072 O ILE B 36 34.942 6.798 -6.945 1.00 10.00 O ATOM 1073 CB ILE B 36 36.313 4.115 -7.313 1.00 10.00 C ATOM 1074 CG1 ILE B 36 37.354 3.060 -6.901 1.00 10.00 C ATOM 1075 CG2 ILE B 36 35.745 3.787 -8.707 1.00 10.00 C ATOM 1076 CD1 ILE B 36 36.774 1.657 -6.660 1.00 10.00 C ATOM 0 H ILE B 36 37.283 5.227 -5.257 1.00 10.00 H new ATOM 0 HA ILE B 36 37.731 5.503 -8.068 1.00 10.00 H new ATOM 0 HB ILE B 36 35.496 4.100 -6.591 1.00 10.00 H new ATOM 0 HG12 ILE B 36 38.116 2.996 -7.678 1.00 10.00 H new ATOM 0 HG13 ILE B 36 37.853 3.395 -5.992 1.00 10.00 H new ATOM 0 HG21 ILE B 36 35.301 2.792 -8.694 1.00 10.00 H new ATOM 0 HG22 ILE B 36 34.984 4.521 -8.972 1.00 10.00 H new ATOM 0 HG23 ILE B 36 36.548 3.816 -9.443 1.00 10.00 H new ATOM 0 HD11 ILE B 36 37.576 0.976 -6.374 1.00 10.00 H new ATOM 0 HD12 ILE B 36 36.033 1.702 -5.861 1.00 10.00 H new ATOM 0 HD13 ILE B 36 36.301 1.297 -7.574 1.00 10.00 H new ATOM 1088 N PRO B 37 36.070 7.191 -8.875 1.00 10.00 N ATOM 1089 CA PRO B 37 35.098 8.143 -9.435 1.00 10.00 C ATOM 1090 C PRO B 37 33.719 7.471 -9.582 1.00 10.00 C ATOM 1091 O PRO B 37 33.619 6.392 -10.166 1.00 10.00 O ATOM 1092 CB PRO B 37 35.666 8.520 -10.802 1.00 10.00 C ATOM 1093 CG PRO B 37 37.171 8.377 -10.598 1.00 10.00 C ATOM 1094 CD PRO B 37 37.283 7.137 -9.713 1.00 10.00 C ATOM 0 HA PRO B 37 34.954 9.016 -8.799 1.00 10.00 H new ATOM 0 HB2 PRO B 37 35.300 7.859 -11.588 1.00 10.00 H new ATOM 0 HB3 PRO B 37 35.392 9.536 -11.087 1.00 10.00 H new ATOM 0 HG2 PRO B 37 37.696 8.246 -11.544 1.00 10.00 H new ATOM 0 HG3 PRO B 37 37.598 9.256 -10.116 1.00 10.00 H new ATOM 0 HD2 PRO B 37 37.318 6.224 -10.307 1.00 10.00 H new ATOM 0 HD3 PRO B 37 38.189 7.159 -9.107 1.00 10.00 H new ATOM 1102 N PRO B 38 32.664 8.116 -9.052 1.00 10.00 N ATOM 1103 CA PRO B 38 31.274 7.607 -9.083 1.00 10.00 C ATOM 1104 C PRO B 38 30.747 7.307 -10.489 1.00 10.00 C ATOM 1105 O PRO B 38 30.151 6.276 -10.732 1.00 10.00 O ATOM 1106 CB PRO B 38 30.437 8.719 -8.449 1.00 10.00 C ATOM 1107 CG PRO B 38 31.415 9.374 -7.479 1.00 10.00 C ATOM 1108 CD PRO B 38 32.732 9.350 -8.255 1.00 10.00 C ATOM 0 HA PRO B 38 31.222 6.654 -8.557 1.00 10.00 H new ATOM 0 HB2 PRO B 38 30.074 9.426 -9.195 1.00 10.00 H new ATOM 0 HB3 PRO B 38 29.562 8.322 -7.934 1.00 10.00 H new ATOM 0 HG2 PRO B 38 31.114 10.390 -7.226 1.00 10.00 H new ATOM 0 HG3 PRO B 38 31.487 8.821 -6.543 1.00 10.00 H new ATOM 0 HD2 PRO B 38 32.834 10.229 -8.891 1.00 10.00 H new ATOM 0 HD3 PRO B 38 33.590 9.342 -7.582 1.00 10.00 H new ATOM 1116 N ASP B 39 31.155 8.161 -11.442 1.00 10.00 N ATOM 1117 CA ASP B 39 30.781 8.036 -12.862 1.00 10.00 C ATOM 1118 C ASP B 39 31.566 6.958 -13.634 1.00 10.00 C ATOM 1119 O ASP B 39 31.629 6.975 -14.858 1.00 10.00 O ATOM 1120 CB ASP B 39 30.915 9.419 -13.532 1.00 10.00 C ATOM 1121 CG ASP B 39 32.316 10.050 -13.466 1.00 10.00 C ATOM 1122 OD1 ASP B 39 33.034 9.795 -12.470 1.00 10.00 O ATOM 1123 OD2 ASP B 39 32.610 10.858 -14.367 1.00 10.00 O ATOM 0 H ASP B 39 31.757 8.962 -11.249 1.00 10.00 H new ATOM 0 HA ASP B 39 29.747 7.693 -12.896 1.00 10.00 H new ATOM 0 HB2 ASP B 39 30.625 9.327 -14.579 1.00 10.00 H new ATOM 0 HB3 ASP B 39 30.205 10.101 -13.064 1.00 10.00 H new ATOM 1128 N GLN B 40 32.227 6.075 -12.887 1.00 10.00 N ATOM 1129 CA GLN B 40 32.911 4.895 -13.447 1.00 10.00 C ATOM 1130 C GLN B 40 32.507 3.601 -12.706 1.00 10.00 C ATOM 1131 O GLN B 40 33.048 2.520 -12.932 1.00 10.00 O ATOM 1132 CB GLN B 40 34.416 5.142 -13.349 1.00 10.00 C ATOM 1133 CG GLN B 40 35.205 4.138 -14.200 1.00 10.00 C ATOM 1134 CD GLN B 40 36.681 4.040 -13.805 1.00 10.00 C ATOM 1135 OE1 GLN B 40 37.545 3.740 -14.617 1.00 10.00 O ATOM 1136 NE2 GLN B 40 36.986 4.269 -12.546 1.00 10.00 N ATOM 0 H GLN B 40 32.307 6.152 -11.873 1.00 10.00 H new ATOM 0 HA GLN B 40 32.619 4.755 -14.488 1.00 10.00 H new ATOM 0 HB2 GLN B 40 34.642 6.156 -13.678 1.00 10.00 H new ATOM 0 HB3 GLN B 40 34.732 5.066 -12.308 1.00 10.00 H new ATOM 0 HG2 GLN B 40 34.745 3.154 -14.109 1.00 10.00 H new ATOM 0 HG3 GLN B 40 35.135 4.427 -15.249 1.00 10.00 H new ATOM 0 HE21 GLN B 40 36.254 4.518 -11.881 1.00 10.00 H new ATOM 0 HE22 GLN B 40 37.955 4.197 -12.235 1.00 10.00 H new ATOM 1145 N GLN B 41 31.535 3.734 -11.809 1.00 10.00 N ATOM 1146 CA GLN B 41 31.041 2.613 -10.996 1.00 10.00 C ATOM 1147 C GLN B 41 29.717 2.109 -11.578 1.00 10.00 C ATOM 1148 O GLN B 41 28.832 2.885 -11.922 1.00 10.00 O ATOM 1149 CB GLN B 41 30.767 3.115 -9.579 1.00 10.00 C ATOM 1150 CG GLN B 41 31.995 3.711 -8.890 1.00 10.00 C ATOM 1151 CD GLN B 41 31.637 4.206 -7.488 1.00 10.00 C ATOM 1152 OE1 GLN B 41 30.902 3.592 -6.729 1.00 10.00 O ATOM 1153 NE2 GLN B 41 32.203 5.327 -7.107 1.00 10.00 N ATOM 0 H GLN B 41 31.064 4.619 -11.621 1.00 10.00 H new ATOM 0 HA GLN B 41 31.783 1.814 -10.990 1.00 10.00 H new ATOM 0 HB2 GLN B 41 29.980 3.869 -9.616 1.00 10.00 H new ATOM 0 HB3 GLN B 41 30.389 2.289 -8.977 1.00 10.00 H new ATOM 0 HG2 GLN B 41 32.783 2.961 -8.827 1.00 10.00 H new ATOM 0 HG3 GLN B 41 32.387 4.536 -9.484 1.00 10.00 H new ATOM 0 HE21 GLN B 41 32.815 5.833 -7.747 1.00 10.00 H new ATOM 0 HE22 GLN B 41 32.031 5.693 -6.170 1.00 10.00 H new ATOM 1162 N ARG B 42 29.645 0.783 -11.690 1.00 10.00 N ATOM 1163 CA ARG B 42 28.405 0.074 -12.052 1.00 10.00 C ATOM 1164 C ARG B 42 28.088 -0.936 -10.945 1.00 10.00 C ATOM 1165 O ARG B 42 28.846 -1.875 -10.719 1.00 10.00 O ATOM 1166 CB ARG B 42 28.559 -0.654 -13.393 1.00 10.00 C ATOM 1167 CG ARG B 42 28.727 0.329 -14.553 1.00 10.00 C ATOM 1168 CD ARG B 42 29.091 -0.383 -15.857 1.00 10.00 C ATOM 1169 NE ARG B 42 27.976 -1.165 -16.416 1.00 10.00 N ATOM 1170 CZ ARG B 42 28.063 -1.928 -17.517 1.00 10.00 C ATOM 1171 NH1 ARG B 42 29.204 -2.049 -18.175 1.00 10.00 N ATOM 1172 NH2 ARG B 42 26.992 -2.532 -17.992 1.00 10.00 N ATOM 0 H ARG B 42 30.441 0.165 -11.534 1.00 10.00 H new ATOM 0 HA ARG B 42 27.594 0.795 -12.156 1.00 10.00 H new ATOM 0 HB2 ARG B 42 29.423 -1.318 -13.350 1.00 10.00 H new ATOM 0 HB3 ARG B 42 27.684 -1.280 -13.570 1.00 10.00 H new ATOM 0 HG2 ARG B 42 27.802 0.889 -14.691 1.00 10.00 H new ATOM 0 HG3 ARG B 42 29.504 1.053 -14.306 1.00 10.00 H new ATOM 0 HD2 ARG B 42 29.413 0.356 -16.591 1.00 10.00 H new ATOM 0 HD3 ARG B 42 29.938 -1.045 -15.679 1.00 10.00 H new ATOM 0 HE ARG B 42 27.078 -1.124 -15.935 1.00 10.00 H new ATOM 0 HH11 ARG B 42 30.036 -1.558 -17.848 1.00 10.00 H new ATOM 0 HH12 ARG B 42 29.252 -2.633 -19.010 1.00 10.00 H new ATOM 0 HH21 ARG B 42 26.093 -2.420 -17.523 1.00 10.00 H new ATOM 0 HH22 ARG B 42 27.062 -3.111 -18.829 1.00 10.00 H new ATOM 1186 N LEU B 43 27.045 -0.618 -10.179 1.00 10.00 N ATOM 1187 CA LEU B 43 26.645 -1.444 -9.025 1.00 10.00 C ATOM 1188 C LEU B 43 25.524 -2.420 -9.390 1.00 10.00 C ATOM 1189 O LEU B 43 24.567 -2.061 -10.061 1.00 10.00 O ATOM 1190 CB LEU B 43 26.178 -0.577 -7.854 1.00 10.00 C ATOM 1191 CG LEU B 43 27.261 0.345 -7.281 1.00 10.00 C ATOM 1192 CD1 LEU B 43 26.673 1.141 -6.119 1.00 10.00 C ATOM 1193 CD2 LEU B 43 28.480 -0.443 -6.793 1.00 10.00 C ATOM 0 H LEU B 43 26.459 0.203 -10.331 1.00 10.00 H new ATOM 0 HA LEU B 43 27.529 -2.009 -8.730 1.00 10.00 H new ATOM 0 HB2 LEU B 43 25.335 0.032 -8.181 1.00 10.00 H new ATOM 0 HB3 LEU B 43 25.813 -1.227 -7.059 1.00 10.00 H new ATOM 0 HG LEU B 43 27.593 1.013 -8.075 1.00 10.00 H new ATOM 0 HD11 LEU B 43 27.437 1.799 -5.706 1.00 10.00 H new ATOM 0 HD12 LEU B 43 25.833 1.738 -6.475 1.00 10.00 H new ATOM 0 HD13 LEU B 43 26.328 0.455 -5.345 1.00 10.00 H new ATOM 0 HD21 LEU B 43 29.224 0.247 -6.395 1.00 10.00 H new ATOM 0 HD22 LEU B 43 28.175 -1.138 -6.011 1.00 10.00 H new ATOM 0 HD23 LEU B 43 28.911 -1.000 -7.625 1.00 10.00 H new ATOM 1205 N ILE B 44 25.697 -3.648 -8.905 1.00 10.00 N ATOM 1206 CA ILE B 44 24.754 -4.751 -9.168 1.00 10.00 C ATOM 1207 C ILE B 44 24.209 -5.260 -7.830 1.00 10.00 C ATOM 1208 O ILE B 44 24.964 -5.469 -6.880 1.00 10.00 O ATOM 1209 CB ILE B 44 25.430 -5.889 -9.978 1.00 10.00 C ATOM 1210 CG1 ILE B 44 25.745 -5.476 -11.423 1.00 10.00 C ATOM 1211 CG2 ILE B 44 24.601 -7.182 -10.053 1.00 10.00 C ATOM 1212 CD1 ILE B 44 26.924 -4.512 -11.599 1.00 10.00 C ATOM 0 H ILE B 44 26.489 -3.913 -8.320 1.00 10.00 H new ATOM 0 HA ILE B 44 23.927 -4.386 -9.777 1.00 10.00 H new ATOM 0 HB ILE B 44 26.347 -6.081 -9.421 1.00 10.00 H new ATOM 0 HG12 ILE B 44 25.947 -6.377 -12.003 1.00 10.00 H new ATOM 0 HG13 ILE B 44 24.855 -5.014 -11.851 1.00 10.00 H new ATOM 0 HG21 ILE B 44 25.142 -7.928 -10.636 1.00 10.00 H new ATOM 0 HG22 ILE B 44 24.429 -7.563 -9.046 1.00 10.00 H new ATOM 0 HG23 ILE B 44 23.644 -6.973 -10.530 1.00 10.00 H new ATOM 0 HD11 ILE B 44 27.056 -4.288 -12.658 1.00 10.00 H new ATOM 0 HD12 ILE B 44 26.723 -3.589 -11.055 1.00 10.00 H new ATOM 0 HD13 ILE B 44 27.832 -4.973 -11.209 1.00 10.00 H new ATOM 1224 N PHE B 45 22.920 -5.568 -7.867 1.00 10.00 N ATOM 1225 CA PHE B 45 22.236 -6.290 -6.784 1.00 10.00 C ATOM 1226 C PHE B 45 21.000 -6.995 -7.348 1.00 10.00 C ATOM 1227 O PHE B 45 20.231 -6.398 -8.096 1.00 10.00 O ATOM 1228 CB PHE B 45 21.833 -5.319 -5.670 1.00 10.00 C ATOM 1229 CG PHE B 45 21.159 -6.060 -4.516 1.00 10.00 C ATOM 1230 CD1 PHE B 45 21.930 -6.800 -3.629 1.00 10.00 C ATOM 1231 CD2 PHE B 45 19.778 -6.008 -4.373 1.00 10.00 C ATOM 1232 CE1 PHE B 45 21.316 -7.493 -2.594 1.00 10.00 C ATOM 1233 CE2 PHE B 45 19.163 -6.693 -3.333 1.00 10.00 C ATOM 1234 CZ PHE B 45 19.933 -7.435 -2.444 1.00 10.00 C ATOM 0 H PHE B 45 22.310 -5.327 -8.648 1.00 10.00 H new ATOM 0 HA PHE B 45 22.913 -7.033 -6.362 1.00 10.00 H new ATOM 0 HB2 PHE B 45 22.715 -4.794 -5.304 1.00 10.00 H new ATOM 0 HB3 PHE B 45 21.155 -4.564 -6.068 1.00 10.00 H new ATOM 0 HD1 PHE B 45 23.003 -6.836 -3.744 1.00 10.00 H new ATOM 0 HD2 PHE B 45 19.183 -5.436 -5.070 1.00 10.00 H new ATOM 0 HE1 PHE B 45 21.910 -8.076 -1.906 1.00 10.00 H new ATOM 0 HE2 PHE B 45 18.090 -6.650 -3.215 1.00 10.00 H new ATOM 0 HZ PHE B 45 19.457 -7.968 -1.634 1.00 10.00 H new ATOM 1244 N ALA B 46 20.922 -8.294 -7.063 1.00 10.00 N ATOM 1245 CA ALA B 46 19.794 -9.161 -7.492 1.00 10.00 C ATOM 1246 C ALA B 46 19.528 -9.065 -9.008 1.00 10.00 C ATOM 1247 O ALA B 46 18.383 -8.976 -9.483 1.00 10.00 O ATOM 1248 CB ALA B 46 18.558 -8.858 -6.623 1.00 10.00 C ATOM 0 H ALA B 46 21.635 -8.789 -6.527 1.00 10.00 H new ATOM 0 HA ALA B 46 20.061 -10.205 -7.330 1.00 10.00 H new ATOM 0 HB1 ALA B 46 17.729 -9.493 -6.936 1.00 10.00 H new ATOM 0 HB2 ALA B 46 18.792 -9.055 -5.577 1.00 10.00 H new ATOM 0 HB3 ALA B 46 18.278 -7.811 -6.741 1.00 10.00 H new ATOM 1254 N GLY B 47 20.618 -9.062 -9.770 1.00 10.00 N ATOM 1255 CA GLY B 47 20.599 -8.992 -11.252 1.00 10.00 C ATOM 1256 C GLY B 47 20.037 -7.670 -11.802 1.00 10.00 C ATOM 1257 O GLY B 47 19.481 -7.629 -12.899 1.00 10.00 O ATOM 0 H GLY B 47 21.560 -9.108 -9.382 1.00 10.00 H new ATOM 0 HA2 GLY B 47 21.614 -9.129 -11.626 1.00 10.00 H new ATOM 0 HA3 GLY B 47 20.003 -9.819 -11.638 1.00 10.00 H new ATOM 1261 N LYS B 48 20.249 -6.599 -11.046 1.00 10.00 N ATOM 1262 CA LYS B 48 19.782 -5.246 -11.397 1.00 10.00 C ATOM 1263 C LYS B 48 20.948 -4.258 -11.299 1.00 10.00 C ATOM 1264 O LYS B 48 21.730 -4.301 -10.357 1.00 10.00 O ATOM 1265 CB LYS B 48 18.683 -4.817 -10.420 1.00 10.00 C ATOM 1266 CG LYS B 48 17.369 -5.574 -10.647 1.00 10.00 C ATOM 1267 CD LYS B 48 16.309 -5.194 -9.609 1.00 10.00 C ATOM 1268 CE LYS B 48 16.499 -5.894 -8.259 1.00 10.00 C ATOM 1269 NZ LYS B 48 16.108 -7.309 -8.334 1.00 10.00 N ATOM 0 H LYS B 48 20.755 -6.637 -10.161 1.00 10.00 H new ATOM 0 HA LYS B 48 19.391 -5.254 -12.415 1.00 10.00 H new ATOM 0 HB2 LYS B 48 19.024 -4.985 -9.398 1.00 10.00 H new ATOM 0 HB3 LYS B 48 18.505 -3.747 -10.525 1.00 10.00 H new ATOM 0 HG2 LYS B 48 16.993 -5.358 -11.647 1.00 10.00 H new ATOM 0 HG3 LYS B 48 17.555 -6.647 -10.601 1.00 10.00 H new ATOM 0 HD2 LYS B 48 16.331 -4.115 -9.456 1.00 10.00 H new ATOM 0 HD3 LYS B 48 15.322 -5.440 -10.002 1.00 10.00 H new ATOM 0 HE2 LYS B 48 17.542 -5.818 -7.951 1.00 10.00 H new ATOM 0 HE3 LYS B 48 15.904 -5.389 -7.498 1.00 10.00 H new ATOM 0 HZ1 LYS B 48 15.871 -7.655 -7.382 1.00 10.00 H new ATOM 0 HZ2 LYS B 48 15.279 -7.408 -8.955 1.00 10.00 H new ATOM 0 HZ3 LYS B 48 16.897 -7.867 -8.718 1.00 10.00 H new ATOM 1283 N GLN B 49 21.070 -3.433 -12.343 1.00 10.00 N ATOM 1284 CA GLN B 49 22.020 -2.308 -12.329 1.00 10.00 C ATOM 1285 C GLN B 49 21.361 -1.129 -11.606 1.00 10.00 C ATOM 1286 O GLN B 49 20.222 -0.763 -11.874 1.00 10.00 O ATOM 1287 CB GLN B 49 22.397 -1.874 -13.748 1.00 10.00 C ATOM 1288 CG GLN B 49 22.979 -3.033 -14.559 1.00 10.00 C ATOM 1289 CD GLN B 49 23.729 -2.544 -15.797 1.00 10.00 C ATOM 1290 OE1 GLN B 49 24.488 -1.582 -15.778 1.00 10.00 O ATOM 1291 NE2 GLN B 49 23.581 -3.268 -16.882 1.00 10.00 N ATOM 0 H GLN B 49 20.529 -3.518 -13.204 1.00 10.00 H new ATOM 0 HA GLN B 49 22.930 -2.625 -11.819 1.00 10.00 H new ATOM 0 HB2 GLN B 49 21.515 -1.482 -14.255 1.00 10.00 H new ATOM 0 HB3 GLN B 49 23.124 -1.063 -13.699 1.00 10.00 H new ATOM 0 HG2 GLN B 49 23.655 -3.612 -13.930 1.00 10.00 H new ATOM 0 HG3 GLN B 49 22.175 -3.703 -14.863 1.00 10.00 H new ATOM 0 HE21 GLN B 49 22.945 -4.065 -16.880 1.00 10.00 H new ATOM 0 HE22 GLN B 49 24.102 -3.033 -17.727 1.00 10.00 H new ATOM 1300 N LEU B 50 22.114 -0.572 -10.662 1.00 10.00 N ATOM 1301 CA LEU B 50 21.586 0.488 -9.794 1.00 10.00 C ATOM 1302 C LEU B 50 21.637 1.853 -10.487 1.00 10.00 C ATOM 1303 O LEU B 50 22.621 2.236 -11.101 1.00 10.00 O ATOM 1304 CB LEU B 50 22.334 0.467 -8.459 1.00 10.00 C ATOM 1305 CG LEU B 50 22.355 -0.921 -7.803 1.00 10.00 C ATOM 1306 CD1 LEU B 50 23.021 -0.836 -6.436 1.00 10.00 C ATOM 1307 CD2 LEU B 50 20.967 -1.564 -7.673 1.00 10.00 C ATOM 0 H LEU B 50 23.083 -0.830 -10.476 1.00 10.00 H new ATOM 0 HA LEU B 50 20.532 0.302 -9.589 1.00 10.00 H new ATOM 0 HB2 LEU B 50 23.359 0.803 -8.618 1.00 10.00 H new ATOM 0 HB3 LEU B 50 21.868 1.178 -7.777 1.00 10.00 H new ATOM 0 HG LEU B 50 22.929 -1.568 -8.466 1.00 10.00 H new ATOM 0 HD11 LEU B 50 23.033 -1.824 -5.975 1.00 10.00 H new ATOM 0 HD12 LEU B 50 24.044 -0.477 -6.551 1.00 10.00 H new ATOM 0 HD13 LEU B 50 22.464 -0.147 -5.802 1.00 10.00 H new ATOM 0 HD21 LEU B 50 21.062 -2.542 -7.201 1.00 10.00 H new ATOM 0 HD22 LEU B 50 20.327 -0.927 -7.063 1.00 10.00 H new ATOM 0 HD23 LEU B 50 20.526 -1.680 -8.663 1.00 10.00 H new ATOM 1319 N GLU B 51 20.523 2.570 -10.351 1.00 10.00 N ATOM 1320 CA GLU B 51 20.301 3.863 -11.000 1.00 10.00 C ATOM 1321 C GLU B 51 20.492 5.005 -10.010 1.00 10.00 C ATOM 1322 O GLU B 51 19.934 4.976 -8.918 1.00 10.00 O ATOM 1323 CB GLU B 51 18.882 3.886 -11.556 1.00 10.00 C ATOM 1324 CG GLU B 51 18.589 2.787 -12.573 1.00 10.00 C ATOM 1325 CD GLU B 51 19.363 2.972 -13.860 1.00 10.00 C ATOM 1326 OE1 GLU B 51 18.860 3.680 -14.759 1.00 10.00 O ATOM 1327 OE2 GLU B 51 20.460 2.394 -13.989 1.00 10.00 O ATOM 0 H GLU B 51 19.736 2.265 -9.778 1.00 10.00 H new ATOM 0 HA GLU B 51 21.024 3.994 -11.805 1.00 10.00 H new ATOM 0 HB2 GLU B 51 18.178 3.796 -10.728 1.00 10.00 H new ATOM 0 HB3 GLU B 51 18.703 4.854 -12.023 1.00 10.00 H new ATOM 0 HG2 GLU B 51 18.837 1.818 -12.139 1.00 10.00 H new ATOM 0 HG3 GLU B 51 17.521 2.774 -12.793 1.00 10.00 H new ATOM 1334 N ASP B 52 21.206 6.033 -10.446 1.00 10.00 N ATOM 1335 CA ASP B 52 21.603 7.158 -9.564 1.00 10.00 C ATOM 1336 C ASP B 52 20.453 7.800 -8.779 1.00 10.00 C ATOM 1337 O ASP B 52 20.571 7.966 -7.561 1.00 10.00 O ATOM 1338 CB ASP B 52 22.336 8.239 -10.367 1.00 10.00 C ATOM 1339 CG ASP B 52 23.748 7.815 -10.771 1.00 10.00 C ATOM 1340 OD1 ASP B 52 24.424 7.195 -9.921 1.00 10.00 O ATOM 1341 OD2 ASP B 52 24.088 8.078 -11.942 1.00 10.00 O ATOM 0 H ASP B 52 21.531 6.125 -11.408 1.00 10.00 H new ATOM 0 HA ASP B 52 22.264 6.710 -8.822 1.00 10.00 H new ATOM 0 HB2 ASP B 52 21.761 8.474 -11.263 1.00 10.00 H new ATOM 0 HB3 ASP B 52 22.390 9.152 -9.775 1.00 10.00 H new ATOM 1346 N GLY B 53 19.340 8.061 -9.499 1.00 10.00 N ATOM 1347 CA GLY B 53 18.144 8.692 -8.926 1.00 10.00 C ATOM 1348 C GLY B 53 17.227 7.756 -8.136 1.00 10.00 C ATOM 1349 O GLY B 53 16.111 8.149 -7.768 1.00 10.00 O ATOM 0 H GLY B 53 19.251 7.839 -10.491 1.00 10.00 H new ATOM 0 HA2 GLY B 53 18.460 9.503 -8.270 1.00 10.00 H new ATOM 0 HA3 GLY B 53 17.568 9.142 -9.735 1.00 10.00 H new ATOM 1353 N ARG B 54 17.662 6.515 -7.914 1.00 10.00 N ATOM 1354 CA ARG B 54 16.899 5.546 -7.111 1.00 10.00 C ATOM 1355 C ARG B 54 17.625 5.344 -5.783 1.00 10.00 C ATOM 1356 O ARG B 54 18.800 5.696 -5.654 1.00 10.00 O ATOM 1357 CB ARG B 54 16.747 4.198 -7.839 1.00 10.00 C ATOM 1358 CG ARG B 54 16.082 4.263 -9.227 1.00 10.00 C ATOM 1359 CD ARG B 54 14.740 5.002 -9.255 1.00 10.00 C ATOM 1360 NE ARG B 54 13.746 4.391 -8.375 1.00 10.00 N ATOM 1361 CZ ARG B 54 12.426 4.604 -8.426 1.00 10.00 C ATOM 1362 NH1 ARG B 54 11.866 5.312 -9.402 1.00 10.00 N ATOM 1363 NH2 ARG B 54 11.663 4.128 -7.460 1.00 10.00 N ATOM 0 H ARG B 54 18.542 6.152 -8.279 1.00 10.00 H new ATOM 0 HA ARG B 54 15.896 5.938 -6.944 1.00 10.00 H new ATOM 0 HB2 ARG B 54 17.735 3.752 -7.950 1.00 10.00 H new ATOM 0 HB3 ARG B 54 16.164 3.528 -7.207 1.00 10.00 H new ATOM 0 HG2 ARG B 54 16.766 4.752 -9.921 1.00 10.00 H new ATOM 0 HG3 ARG B 54 15.930 3.247 -9.591 1.00 10.00 H new ATOM 0 HD2 ARG B 54 14.894 6.040 -8.959 1.00 10.00 H new ATOM 0 HD3 ARG B 54 14.358 5.015 -10.276 1.00 10.00 H new ATOM 0 HE ARG B 54 14.088 3.747 -7.661 1.00 10.00 H new ATOM 0 HH11 ARG B 54 12.446 5.711 -10.140 1.00 10.00 H new ATOM 0 HH12 ARG B 54 10.856 5.456 -9.413 1.00 10.00 H new ATOM 0 HH21 ARG B 54 12.081 3.607 -6.690 1.00 10.00 H new ATOM 0 HH22 ARG B 54 10.655 4.282 -7.484 1.00 10.00 H new ATOM 1377 N THR B 55 16.934 4.764 -4.812 1.00 10.00 N ATOM 1378 CA THR B 55 17.502 4.542 -3.477 1.00 10.00 C ATOM 1379 C THR B 55 17.602 3.054 -3.154 1.00 10.00 C ATOM 1380 O THR B 55 17.097 2.215 -3.897 1.00 10.00 O ATOM 1381 CB THR B 55 16.647 5.203 -2.376 1.00 10.00 C ATOM 1382 OG1 THR B 55 15.373 4.556 -2.312 1.00 10.00 O ATOM 1383 CG2 THR B 55 16.461 6.706 -2.622 1.00 10.00 C ATOM 0 H THR B 55 15.974 4.435 -4.918 1.00 10.00 H new ATOM 0 HA THR B 55 18.495 4.991 -3.495 1.00 10.00 H new ATOM 0 HB THR B 55 17.171 5.090 -1.427 1.00 10.00 H new ATOM 0 HG1 THR B 55 14.669 5.197 -2.544 1.00 10.00 H new ATOM 0 HG21 THR B 55 15.853 7.133 -1.824 1.00 10.00 H new ATOM 0 HG22 THR B 55 17.435 7.195 -2.638 1.00 10.00 H new ATOM 0 HG23 THR B 55 15.963 6.859 -3.579 1.00 10.00 H new ATOM 1391 N LEU B 56 18.263 2.742 -2.039 1.00 10.00 N ATOM 1392 CA LEU B 56 18.433 1.341 -1.595 1.00 10.00 C ATOM 1393 C LEU B 56 17.100 0.626 -1.328 1.00 10.00 C ATOM 1394 O LEU B 56 16.873 -0.489 -1.794 1.00 10.00 O ATOM 1395 CB LEU B 56 19.295 1.273 -0.332 1.00 10.00 C ATOM 1396 CG LEU B 56 20.731 1.746 -0.562 1.00 10.00 C ATOM 1397 CD1 LEU B 56 21.479 1.701 0.764 1.00 10.00 C ATOM 1398 CD2 LEU B 56 21.477 0.879 -1.578 1.00 10.00 C ATOM 0 H LEU B 56 18.692 3.432 -1.422 1.00 10.00 H new ATOM 0 HA LEU B 56 18.927 0.826 -2.419 1.00 10.00 H new ATOM 0 HB2 LEU B 56 18.838 1.883 0.447 1.00 10.00 H new ATOM 0 HB3 LEU B 56 19.311 0.247 0.036 1.00 10.00 H new ATOM 0 HG LEU B 56 20.687 2.759 -0.961 1.00 10.00 H new ATOM 0 HD11 LEU B 56 22.505 2.036 0.614 1.00 10.00 H new ATOM 0 HD12 LEU B 56 20.985 2.355 1.483 1.00 10.00 H new ATOM 0 HD13 LEU B 56 21.483 0.680 1.145 1.00 10.00 H new ATOM 0 HD21 LEU B 56 22.491 1.258 -1.704 1.00 10.00 H new ATOM 0 HD22 LEU B 56 21.516 -0.150 -1.220 1.00 10.00 H new ATOM 0 HD23 LEU B 56 20.956 0.910 -2.535 1.00 10.00 H new ATOM 1410 N SER B 57 16.162 1.394 -0.751 1.00 10.00 N ATOM 1411 CA SER B 57 14.803 0.915 -0.456 1.00 10.00 C ATOM 1412 C SER B 57 14.080 0.466 -1.730 1.00 10.00 C ATOM 1413 O SER B 57 13.225 -0.417 -1.682 1.00 10.00 O ATOM 1414 CB SER B 57 13.989 2.022 0.249 1.00 10.00 C ATOM 1415 OG SER B 57 13.664 3.072 -0.642 1.00 10.00 O ATOM 0 H SER B 57 16.324 2.363 -0.476 1.00 10.00 H new ATOM 0 HA SER B 57 14.889 0.053 0.206 1.00 10.00 H new ATOM 0 HB2 SER B 57 13.074 1.596 0.661 1.00 10.00 H new ATOM 0 HB3 SER B 57 14.562 2.419 1.087 1.00 10.00 H new ATOM 0 HG SER B 57 14.479 3.391 -1.083 1.00 10.00 H new ATOM 1421 N ASP B 58 14.423 1.091 -2.862 1.00 10.00 N ATOM 1422 CA ASP B 58 13.787 0.792 -4.160 1.00 10.00 C ATOM 1423 C ASP B 58 14.326 -0.496 -4.793 1.00 10.00 C ATOM 1424 O ASP B 58 14.005 -0.816 -5.941 1.00 10.00 O ATOM 1425 CB ASP B 58 13.987 1.958 -5.135 1.00 10.00 C ATOM 1426 CG ASP B 58 13.463 3.269 -4.606 1.00 10.00 C ATOM 1427 OD1 ASP B 58 12.617 3.264 -3.675 1.00 10.00 O ATOM 1428 OD2 ASP B 58 13.897 4.312 -5.127 1.00 10.00 O ATOM 0 H ASP B 58 15.142 1.813 -2.910 1.00 10.00 H new ATOM 0 HA ASP B 58 12.725 0.649 -3.963 1.00 10.00 H new ATOM 0 HB2 ASP B 58 15.049 2.061 -5.356 1.00 10.00 H new ATOM 0 HB3 ASP B 58 13.487 1.727 -6.076 1.00 10.00 H new ATOM 1433 N TYR B 59 15.156 -1.222 -4.047 1.00 10.00 N ATOM 1434 CA TYR B 59 15.747 -2.481 -4.517 1.00 10.00 C ATOM 1435 C TYR B 59 15.650 -3.577 -3.447 1.00 10.00 C ATOM 1436 O TYR B 59 15.927 -4.752 -3.716 1.00 10.00 O ATOM 1437 CB TYR B 59 17.210 -2.250 -4.873 1.00 10.00 C ATOM 1438 CG TYR B 59 17.425 -1.403 -6.094 1.00 10.00 C ATOM 1439 CD1 TYR B 59 17.287 -1.946 -7.365 1.00 10.00 C ATOM 1440 CD2 TYR B 59 17.821 -0.078 -5.981 1.00 10.00 C ATOM 1441 CE1 TYR B 59 17.542 -1.192 -8.492 1.00 10.00 C ATOM 1442 CE2 TYR B 59 18.067 0.686 -7.103 1.00 10.00 C ATOM 1443 CZ TYR B 59 17.934 0.120 -8.356 1.00 10.00 C ATOM 1444 OH TYR B 59 18.203 0.869 -9.470 1.00 10.00 O ATOM 0 H TYR B 59 15.439 -0.959 -3.103 1.00 10.00 H new ATOM 0 HA TYR B 59 15.193 -2.812 -5.395 1.00 10.00 H new ATOM 0 HB2 TYR B 59 17.707 -1.778 -4.026 1.00 10.00 H new ATOM 0 HB3 TYR B 59 17.691 -3.216 -5.027 1.00 10.00 H new ATOM 0 HD1 TYR B 59 16.975 -2.974 -7.473 1.00 10.00 H new ATOM 0 HD2 TYR B 59 17.938 0.361 -5.001 1.00 10.00 H new ATOM 0 HE1 TYR B 59 17.435 -1.628 -9.474 1.00 10.00 H new ATOM 0 HE2 TYR B 59 18.362 1.720 -7.002 1.00 10.00 H new ATOM 0 HH TYR B 59 17.718 1.719 -9.418 1.00 10.00 H new ATOM 1454 N ASN B 60 15.243 -3.170 -2.240 1.00 10.00 N ATOM 1455 CA ASN B 60 15.096 -4.067 -1.083 1.00 10.00 C ATOM 1456 C ASN B 60 16.462 -4.497 -0.505 1.00 10.00 C ATOM 1457 O ASN B 60 16.619 -5.576 0.069 1.00 10.00 O ATOM 1458 CB ASN B 60 14.208 -5.266 -1.435 1.00 10.00 C ATOM 1459 CG ASN B 60 13.469 -5.828 -0.231 1.00 10.00 C ATOM 1460 OD1 ASN B 60 13.126 -5.102 0.707 1.00 10.00 O ATOM 1461 ND2 ASN B 60 13.228 -7.124 -0.248 1.00 10.00 N ATOM 0 H ASN B 60 15.004 -2.200 -2.034 1.00 10.00 H new ATOM 0 HA ASN B 60 14.596 -3.510 -0.291 1.00 10.00 H new ATOM 0 HB2 ASN B 60 13.484 -4.965 -2.192 1.00 10.00 H new ATOM 0 HB3 ASN B 60 14.823 -6.050 -1.876 1.00 10.00 H new ATOM 0 HD21 ASN B 60 12.741 -7.562 0.534 1.00 10.00 H new ATOM 0 HD22 ASN B 60 13.528 -7.688 -1.043 1.00 10.00 H new ATOM 1468 N ILE B 61 17.445 -3.632 -0.700 1.00 10.00 N ATOM 1469 CA ILE B 61 18.800 -3.794 -0.137 1.00 10.00 C ATOM 1470 C ILE B 61 18.711 -3.477 1.359 1.00 10.00 C ATOM 1471 O ILE B 61 18.581 -2.322 1.758 1.00 10.00 O ATOM 1472 CB ILE B 61 19.817 -2.893 -0.866 1.00 10.00 C ATOM 1473 CG1 ILE B 61 19.861 -3.283 -2.352 1.00 10.00 C ATOM 1474 CG2 ILE B 61 21.210 -2.968 -0.214 1.00 10.00 C ATOM 1475 CD1 ILE B 61 20.742 -2.402 -3.245 1.00 10.00 C ATOM 0 H ILE B 61 17.336 -2.785 -1.258 1.00 10.00 H new ATOM 0 HA ILE B 61 19.158 -4.814 -0.276 1.00 10.00 H new ATOM 0 HB ILE B 61 19.496 -1.854 -0.783 1.00 10.00 H new ATOM 0 HG12 ILE B 61 20.212 -4.312 -2.428 1.00 10.00 H new ATOM 0 HG13 ILE B 61 18.844 -3.264 -2.744 1.00 10.00 H new ATOM 0 HG21 ILE B 61 21.900 -2.320 -0.755 1.00 10.00 H new ATOM 0 HG22 ILE B 61 21.144 -2.642 0.824 1.00 10.00 H new ATOM 0 HG23 ILE B 61 21.573 -3.995 -0.249 1.00 10.00 H new ATOM 0 HD11 ILE B 61 20.699 -2.767 -4.271 1.00 10.00 H new ATOM 0 HD12 ILE B 61 20.382 -1.374 -3.210 1.00 10.00 H new ATOM 0 HD13 ILE B 61 21.772 -2.438 -2.890 1.00 10.00 H new ATOM 1487 N GLN B 62 18.794 -4.524 2.165 1.00 10.00 N ATOM 1488 CA GLN B 62 18.696 -4.394 3.609 1.00 10.00 C ATOM 1489 C GLN B 62 20.063 -4.575 4.272 1.00 10.00 C ATOM 1490 O GLN B 62 21.091 -4.618 3.595 1.00 10.00 O ATOM 1491 CB GLN B 62 17.693 -5.426 4.142 1.00 10.00 C ATOM 1492 CG GLN B 62 16.286 -5.286 3.556 1.00 10.00 C ATOM 1493 CD GLN B 62 15.260 -6.184 4.242 1.00 10.00 C ATOM 1494 OE1 GLN B 62 14.064 -5.895 4.235 1.00 10.00 O ATOM 1495 NE2 GLN B 62 15.721 -7.265 4.854 1.00 10.00 N ATOM 0 H GLN B 62 18.930 -5.481 1.839 1.00 10.00 H new ATOM 0 HA GLN B 62 18.346 -3.391 3.852 1.00 10.00 H new ATOM 0 HB2 GLN B 62 18.068 -6.427 3.926 1.00 10.00 H new ATOM 0 HB3 GLN B 62 17.635 -5.334 5.227 1.00 10.00 H new ATOM 0 HG2 GLN B 62 15.965 -4.248 3.640 1.00 10.00 H new ATOM 0 HG3 GLN B 62 16.316 -5.525 2.493 1.00 10.00 H new ATOM 0 HE21 GLN B 62 16.719 -7.473 4.839 1.00 10.00 H new ATOM 0 HE22 GLN B 62 15.077 -7.889 5.340 1.00 10.00 H new ATOM 1504 N LYS B 63 20.071 -4.660 5.602 1.00 10.00 N ATOM 1505 CA LYS B 63 21.327 -4.843 6.352 1.00 10.00 C ATOM 1506 C LYS B 63 21.947 -6.193 5.972 1.00 10.00 C ATOM 1507 O LYS B 63 21.225 -7.151 5.720 1.00 10.00 O ATOM 1508 CB LYS B 63 21.077 -4.770 7.866 1.00 10.00 C ATOM 1509 CG LYS B 63 20.248 -5.929 8.432 1.00 10.00 C ATOM 1510 CD LYS B 63 20.004 -5.720 9.922 1.00 10.00 C ATOM 1511 CE LYS B 63 19.230 -6.898 10.509 1.00 10.00 C ATOM 1512 NZ LYS B 63 18.830 -6.582 11.887 1.00 10.00 N ATOM 0 H LYS B 63 19.235 -4.606 6.183 1.00 10.00 H new ATOM 0 HA LYS B 63 22.018 -4.041 6.093 1.00 10.00 H new ATOM 0 HB2 LYS B 63 22.038 -4.744 8.379 1.00 10.00 H new ATOM 0 HB3 LYS B 63 20.569 -3.833 8.092 1.00 10.00 H new ATOM 0 HG2 LYS B 63 19.296 -5.996 7.906 1.00 10.00 H new ATOM 0 HG3 LYS B 63 20.769 -6.872 8.270 1.00 10.00 H new ATOM 0 HD2 LYS B 63 20.957 -5.609 10.440 1.00 10.00 H new ATOM 0 HD3 LYS B 63 19.446 -4.797 10.079 1.00 10.00 H new ATOM 0 HE2 LYS B 63 18.349 -7.107 9.902 1.00 10.00 H new ATOM 0 HE3 LYS B 63 19.847 -7.796 10.495 1.00 10.00 H new ATOM 0 HZ1 LYS B 63 18.303 -7.384 12.288 1.00 10.00 H new ATOM 0 HZ2 LYS B 63 19.678 -6.403 12.462 1.00 10.00 H new ATOM 0 HZ3 LYS B 63 18.226 -5.735 11.888 1.00 10.00 H new ATOM 1526 N GLU B 64 23.281 -6.185 5.861 1.00 10.00 N ATOM 1527 CA GLU B 64 24.078 -7.396 5.560 1.00 10.00 C ATOM 1528 C GLU B 64 23.995 -7.855 4.093 1.00 10.00 C ATOM 1529 O GLU B 64 24.553 -8.892 3.740 1.00 10.00 O ATOM 1530 CB GLU B 64 23.656 -8.581 6.450 1.00 10.00 C ATOM 1531 CG GLU B 64 24.735 -9.038 7.427 1.00 10.00 C ATOM 1532 CD GLU B 64 25.259 -7.921 8.334 1.00 10.00 C ATOM 1533 OE1 GLU B 64 24.495 -6.979 8.650 1.00 10.00 O ATOM 1534 OE2 GLU B 64 26.453 -8.039 8.682 1.00 10.00 O ATOM 0 H GLU B 64 23.845 -5.343 5.976 1.00 10.00 H new ATOM 0 HA GLU B 64 25.107 -7.100 5.764 1.00 10.00 H new ATOM 0 HB2 GLU B 64 22.766 -8.300 7.013 1.00 10.00 H new ATOM 0 HB3 GLU B 64 23.379 -9.420 5.812 1.00 10.00 H new ATOM 0 HG2 GLU B 64 24.334 -9.840 8.048 1.00 10.00 H new ATOM 0 HG3 GLU B 64 25.569 -9.457 6.864 1.00 10.00 H new ATOM 1541 N SER B 65 23.362 -7.044 3.249 1.00 10.00 N ATOM 1542 CA SER B 65 23.292 -7.327 1.803 1.00 10.00 C ATOM 1543 C SER B 65 24.669 -7.099 1.184 1.00 10.00 C ATOM 1544 O SER B 65 25.426 -6.235 1.606 1.00 10.00 O ATOM 1545 CB SER B 65 22.313 -6.398 1.094 1.00 10.00 C ATOM 1546 OG SER B 65 20.977 -6.637 1.529 1.00 10.00 O ATOM 0 H SER B 65 22.889 -6.186 3.532 1.00 10.00 H new ATOM 0 HA SER B 65 22.959 -8.358 1.684 1.00 10.00 H new ATOM 0 HB2 SER B 65 22.583 -5.360 1.290 1.00 10.00 H new ATOM 0 HB3 SER B 65 22.381 -6.546 0.016 1.00 10.00 H new ATOM 0 HG SER B 65 20.784 -6.082 2.314 1.00 10.00 H new ATOM 1552 N THR B 66 25.000 -7.960 0.218 1.00 10.00 N ATOM 1553 CA THR B 66 26.254 -7.781 -0.525 1.00 10.00 C ATOM 1554 C THR B 66 25.937 -7.580 -2.013 1.00 10.00 C ATOM 1555 O THR B 66 25.066 -8.215 -2.588 1.00 10.00 O ATOM 1556 CB THR B 66 27.319 -8.883 -0.294 1.00 10.00 C ATOM 1557 OG1 THR B 66 27.378 -9.796 -1.388 1.00 10.00 O ATOM 1558 CG2 THR B 66 27.131 -9.688 0.998 1.00 10.00 C ATOM 0 H THR B 66 24.439 -8.764 -0.063 1.00 10.00 H new ATOM 0 HA THR B 66 26.730 -6.886 -0.124 1.00 10.00 H new ATOM 0 HB THR B 66 28.254 -8.330 -0.204 1.00 10.00 H new ATOM 0 HG1 THR B 66 28.061 -10.476 -1.210 1.00 10.00 H new ATOM 0 HG21 THR B 66 27.920 -10.436 1.079 1.00 10.00 H new ATOM 0 HG22 THR B 66 27.179 -9.017 1.855 1.00 10.00 H new ATOM 0 HG23 THR B 66 26.161 -10.184 0.980 1.00 10.00 H new ATOM 1566 N LEU B 67 26.578 -6.536 -2.527 1.00 10.00 N ATOM 1567 CA LEU B 67 26.481 -6.095 -3.922 1.00 10.00 C ATOM 1568 C LEU B 67 27.811 -6.432 -4.607 1.00 10.00 C ATOM 1569 O LEU B 67 28.812 -6.736 -3.968 1.00 10.00 O ATOM 1570 CB LEU B 67 26.257 -4.575 -3.950 1.00 10.00 C ATOM 1571 CG LEU B 67 24.858 -4.075 -3.544 1.00 10.00 C ATOM 1572 CD1 LEU B 67 24.430 -4.446 -2.119 1.00 10.00 C ATOM 1573 CD2 LEU B 67 24.853 -2.551 -3.640 1.00 10.00 C ATOM 0 H LEU B 67 27.201 -5.951 -1.969 1.00 10.00 H new ATOM 0 HA LEU B 67 25.654 -6.587 -4.433 1.00 10.00 H new ATOM 0 HB2 LEU B 67 26.989 -4.111 -3.289 1.00 10.00 H new ATOM 0 HB3 LEU B 67 26.466 -4.219 -4.959 1.00 10.00 H new ATOM 0 HG LEU B 67 24.155 -4.560 -4.221 1.00 10.00 H new ATOM 0 HD11 LEU B 67 23.433 -4.051 -1.924 1.00 10.00 H new ATOM 0 HD12 LEU B 67 24.418 -5.531 -2.014 1.00 10.00 H new ATOM 0 HD13 LEU B 67 25.135 -4.020 -1.405 1.00 10.00 H new ATOM 0 HD21 LEU B 67 23.871 -2.172 -3.357 1.00 10.00 H new ATOM 0 HD22 LEU B 67 25.608 -2.142 -2.968 1.00 10.00 H new ATOM 0 HD23 LEU B 67 25.077 -2.250 -4.663 1.00 10.00 H new ATOM 1585 N HIS B 68 27.767 -6.364 -5.933 1.00 10.00 N ATOM 1586 CA HIS B 68 28.971 -6.541 -6.754 1.00 10.00 C ATOM 1587 C HIS B 68 29.273 -5.266 -7.542 1.00 10.00 C ATOM 1588 O HIS B 68 28.383 -4.494 -7.878 1.00 10.00 O ATOM 1589 CB HIS B 68 28.809 -7.739 -7.691 1.00 10.00 C ATOM 1590 CG HIS B 68 28.972 -9.048 -6.917 1.00 10.00 C ATOM 1591 ND1 HIS B 68 28.020 -9.684 -6.239 1.00 10.00 N ATOM 1592 CD2 HIS B 68 30.086 -9.766 -6.843 1.00 10.00 C ATOM 1593 CE1 HIS B 68 28.551 -10.796 -5.739 1.00 10.00 C ATOM 1594 NE2 HIS B 68 29.827 -10.848 -6.119 1.00 10.00 N ATOM 0 H HIS B 68 26.915 -6.188 -6.466 1.00 10.00 H new ATOM 0 HA HIS B 68 29.816 -6.740 -6.095 1.00 10.00 H new ATOM 0 HB2 HIS B 68 27.827 -7.709 -8.164 1.00 10.00 H new ATOM 0 HB3 HIS B 68 29.549 -7.687 -8.489 1.00 10.00 H new ATOM 0 HD2 HIS B 68 31.035 -9.514 -7.292 1.00 10.00 H new ATOM 0 HE1 HIS B 68 28.038 -11.528 -5.132 1.00 10.00 H new ATOM 0 HE2 HIS B 68 30.489 -11.590 -5.893 1.00 10.00 H new ATOM 1603 N LEU B 69 30.575 -5.081 -7.747 1.00 10.00 N ATOM 1604 CA LEU B 69 31.108 -3.936 -8.491 1.00 10.00 C ATOM 1605 C LEU B 69 31.811 -4.427 -9.761 1.00 10.00 C ATOM 1606 O LEU B 69 32.679 -5.288 -9.723 1.00 10.00 O ATOM 1607 CB LEU B 69 32.095 -3.179 -7.592 1.00 10.00 C ATOM 1608 CG LEU B 69 32.810 -2.020 -8.301 1.00 10.00 C ATOM 1609 CD1 LEU B 69 31.830 -0.925 -8.723 1.00 10.00 C ATOM 1610 CD2 LEU B 69 33.900 -1.444 -7.400 1.00 10.00 C ATOM 0 H LEU B 69 31.293 -5.719 -7.403 1.00 10.00 H new ATOM 0 HA LEU B 69 30.297 -3.268 -8.782 1.00 10.00 H new ATOM 0 HB2 LEU B 69 31.559 -2.789 -6.727 1.00 10.00 H new ATOM 0 HB3 LEU B 69 32.841 -3.879 -7.216 1.00 10.00 H new ATOM 0 HG LEU B 69 33.269 -2.415 -9.207 1.00 10.00 H new ATOM 0 HD11 LEU B 69 32.374 -0.122 -9.221 1.00 10.00 H new ATOM 0 HD12 LEU B 69 31.091 -1.342 -9.407 1.00 10.00 H new ATOM 0 HD13 LEU B 69 31.326 -0.529 -7.842 1.00 10.00 H new ATOM 0 HD21 LEU B 69 34.400 -0.623 -7.913 1.00 10.00 H new ATOM 0 HD22 LEU B 69 33.452 -1.076 -6.477 1.00 10.00 H new ATOM 0 HD23 LEU B 69 34.627 -2.222 -7.166 1.00 10.00 H new ATOM 1622 N VAL B 70 31.430 -3.788 -10.889 1.00 10.00 N ATOM 1623 CA VAL B 70 32.067 -4.010 -12.168 1.00 10.00 C ATOM 1624 C VAL B 70 32.711 -2.663 -12.541 1.00 10.00 C ATOM 1625 O VAL B 70 32.094 -1.598 -12.370 1.00 10.00 O ATOM 1626 CB VAL B 70 31.015 -4.455 -13.252 1.00 10.00 C ATOM 1627 CG1 VAL B 70 31.624 -4.489 -14.662 1.00 10.00 C ATOM 1628 CG2 VAL B 70 30.378 -5.802 -12.880 1.00 10.00 C ATOM 0 H VAL B 70 30.671 -3.108 -10.919 1.00 10.00 H new ATOM 0 HA VAL B 70 32.806 -4.809 -12.118 1.00 10.00 H new ATOM 0 HB VAL B 70 30.224 -3.705 -13.268 1.00 10.00 H new ATOM 0 HG11 VAL B 70 30.865 -4.801 -15.379 1.00 10.00 H new ATOM 0 HG12 VAL B 70 31.986 -3.495 -14.926 1.00 10.00 H new ATOM 0 HG13 VAL B 70 32.454 -5.195 -14.683 1.00 10.00 H new ATOM 0 HG21 VAL B 70 29.655 -6.086 -13.645 1.00 10.00 H new ATOM 0 HG22 VAL B 70 31.154 -6.565 -12.812 1.00 10.00 H new ATOM 0 HG23 VAL B 70 29.872 -5.712 -11.919 1.00 10.00 H new ATOM 1638 N LEU B 71 33.936 -2.714 -13.045 1.00 10.00 N ATOM 1639 CA LEU B 71 34.685 -1.508 -13.351 1.00 10.00 C ATOM 1640 C LEU B 71 34.486 -1.110 -14.818 1.00 10.00 C ATOM 1641 O LEU B 71 34.892 -1.838 -15.722 1.00 10.00 O ATOM 1642 CB LEU B 71 36.177 -1.723 -13.048 1.00 10.00 C ATOM 1643 CG LEU B 71 36.855 -0.540 -12.372 1.00 10.00 C ATOM 1644 CD1 LEU B 71 36.693 -0.662 -10.847 1.00 10.00 C ATOM 1645 CD2 LEU B 71 38.355 -0.363 -12.841 1.00 10.00 C ATOM 0 H LEU B 71 34.432 -3.581 -13.250 1.00 10.00 H new ATOM 0 HA LEU B 71 34.314 -0.697 -12.724 1.00 10.00 H new ATOM 0 HB2 LEU B 71 36.284 -2.601 -12.411 1.00 10.00 H new ATOM 0 HB3 LEU B 71 36.698 -1.941 -13.981 1.00 10.00 H new ATOM 0 HG LEU B 71 36.363 0.382 -12.682 1.00 10.00 H new ATOM 0 HD11 LEU B 71 37.178 0.184 -10.361 1.00 10.00 H new ATOM 0 HD12 LEU B 71 35.633 -0.668 -10.593 1.00 10.00 H new ATOM 0 HD13 LEU B 71 37.153 -1.589 -10.505 1.00 10.00 H new ATOM 0 HD21 LEU B 71 38.797 0.493 -12.332 1.00 10.00 H new ATOM 0 HD22 LEU B 71 38.921 -1.262 -12.597 1.00 10.00 H new ATOM 0 HD23 LEU B 71 38.382 -0.198 -13.918 1.00 10.00 H new