USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1013 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 52 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 121 CYS SG : rot -163:sc= 0.701 USER MOD Set 2.1: A 57 ASN : amide:sc= 0.676 K(o=1.9,f=-3.5!) USER MOD Set 2.2: A 58 SER OG : rot -79:sc= 1.18 USER MOD Set 2.3: A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 6 GLN : amide:sc= 1.86 K(o=3.8,f=-1.6) USER MOD Set 3.2: A 92 THR OG1 : rot -95:sc= 1.32 USER MOD Set 3.3: A 115 MET CE :methyl -171:sc= 0 (180deg=-0.0411) USER MOD Set 3.4: A 117 SER OG : rot 180:sc= 0.663 USER MOD Set 4.1: A 84 SER OG : rot 176:sc= 1.25 USER MOD Set 4.2: A 86 HIS : no HD1:sc= 0 X(o=1.3,f=0.95) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0237 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 147:sc= 1.7 USER MOD Single : A 29 ASN : amide:sc= -0.0671 X(o=-0.067,f=-0.066) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 1.02 K(o=1,f=-5.5!) USER MOD Single : A 36 SER OG : rot 180:sc= 0.00409 USER MOD Single : A 39 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.18) USER MOD Single : A 41 CYS SG : rot -160:sc= -2.61 USER MOD Single : A 43 LYS NZ :NH3+ 144:sc= 0.151 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -179:sc= 1.24 (180deg=1.22) USER MOD Single : A 46 THR OG1 : rot 122:sc= 0.597 USER MOD Single : A 47 THR OG1 : rot 110:sc= 0.527 USER MOD Single : A 53 CYS SG : rot -80:sc= -1.65 USER MOD Single : A 65 SER OG : rot 64:sc= 0.387 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.424 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -130:sc= 0.379 USER MOD Single : A 72 MET CE :methyl 178:sc= 0 (180deg=-0.0116) USER MOD Single : A 74 GLN : amide:sc= -0.0125 K(o=-0.012,f=-0.83) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 1.16 K(o=1.2,f=-0.0036) USER MOD Single : A 83 LYS NZ :NH3+ 177:sc= 1.21 (180deg=1.21) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 MET CE :methyl -173:sc= 0 (180deg=-0.0782) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 63 N GLN A 6 7.958 28.944 0.819 1.00 0.00 N ATOM 64 CA GLN A 6 6.929 28.757 -0.208 1.00 0.00 C ATOM 65 C GLN A 6 6.461 30.074 -0.855 1.00 0.00 C ATOM 66 O GLN A 6 6.794 31.174 -0.407 1.00 0.00 O ATOM 67 CB GLN A 6 5.767 27.965 0.422 1.00 0.00 C ATOM 68 CG GLN A 6 4.919 28.726 1.455 1.00 0.00 C ATOM 69 CD GLN A 6 3.979 27.762 2.162 1.00 0.00 C ATOM 70 OE1 GLN A 6 2.925 27.401 1.663 1.00 0.00 O ATOM 71 NE2 GLN A 6 4.357 27.235 3.297 1.00 0.00 N ATOM 0 HA GLN A 6 7.357 28.193 -1.037 1.00 0.00 H new ATOM 0 HB2 GLN A 6 5.110 27.623 -0.378 1.00 0.00 H new ATOM 0 HB3 GLN A 6 6.176 27.075 0.901 1.00 0.00 H new ATOM 0 HG2 GLN A 6 5.568 29.215 2.182 1.00 0.00 H new ATOM 0 HG3 GLN A 6 4.346 29.511 0.961 1.00 0.00 H new ATOM 0 HE21 GLN A 6 5.235 27.526 3.727 1.00 0.00 H new ATOM 0 HE22 GLN A 6 3.774 26.533 3.753 1.00 0.00 H new ATOM 80 N ILE A 7 5.664 29.955 -1.922 1.00 0.00 N ATOM 81 CA ILE A 7 5.081 31.111 -2.626 1.00 0.00 C ATOM 82 C ILE A 7 4.147 31.929 -1.721 1.00 0.00 C ATOM 83 O ILE A 7 4.130 33.153 -1.806 1.00 0.00 O ATOM 84 CB ILE A 7 4.376 30.663 -3.930 1.00 0.00 C ATOM 85 CG1 ILE A 7 3.945 31.837 -4.833 1.00 0.00 C ATOM 86 CG2 ILE A 7 3.121 29.822 -3.668 1.00 0.00 C ATOM 87 CD1 ILE A 7 5.132 32.600 -5.419 1.00 0.00 C ATOM 0 H ILE A 7 5.402 29.055 -2.325 1.00 0.00 H new ATOM 0 HA ILE A 7 5.900 31.775 -2.902 1.00 0.00 H new ATOM 0 HB ILE A 7 5.137 30.069 -4.436 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.327 31.456 -5.646 1.00 0.00 H new ATOM 0 HG13 ILE A 7 3.326 32.524 -4.257 1.00 0.00 H new ATOM 0 HG21 ILE A 7 2.669 29.537 -4.618 1.00 0.00 H new ATOM 0 HG22 ILE A 7 3.394 28.925 -3.112 1.00 0.00 H new ATOM 0 HG23 ILE A 7 2.407 30.406 -3.087 1.00 0.00 H new ATOM 0 HD11 ILE A 7 4.768 33.414 -6.045 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.738 33.008 -4.610 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.739 31.923 -6.021 1.00 0.00 H new ATOM 99 N LEU A 8 3.388 31.268 -0.839 1.00 0.00 N ATOM 100 CA LEU A 8 2.425 31.953 0.034 1.00 0.00 C ATOM 101 C LEU A 8 3.097 32.638 1.233 1.00 0.00 C ATOM 102 O LEU A 8 3.943 32.058 1.915 1.00 0.00 O ATOM 103 CB LEU A 8 1.309 31.005 0.528 1.00 0.00 C ATOM 104 CG LEU A 8 0.288 30.537 -0.524 1.00 0.00 C ATOM 105 CD1 LEU A 8 -0.887 29.847 0.170 1.00 0.00 C ATOM 106 CD2 LEU A 8 -0.311 31.700 -1.312 1.00 0.00 C ATOM 0 H LEU A 8 3.422 30.257 -0.710 1.00 0.00 H new ATOM 0 HA LEU A 8 1.972 32.727 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.779 30.123 0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.767 31.506 1.330 1.00 0.00 H new ATOM 0 HG LEU A 8 0.827 29.871 -1.198 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.608 29.517 -0.578 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.524 28.985 0.729 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.368 30.547 0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.025 31.316 -2.041 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.820 32.379 -0.628 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.484 32.236 -1.830 1.00 0.00 H new ATOM 118 N VAL A 9 2.651 33.865 1.508 1.00 0.00 N ATOM 119 CA VAL A 9 2.966 34.629 2.722 1.00 0.00 C ATOM 120 C VAL A 9 2.083 34.071 3.840 1.00 0.00 C ATOM 121 O VAL A 9 0.914 33.782 3.579 1.00 0.00 O ATOM 122 CB VAL A 9 2.658 36.130 2.531 1.00 0.00 C ATOM 123 CG1 VAL A 9 3.130 36.963 3.727 1.00 0.00 C ATOM 124 CG2 VAL A 9 3.298 36.705 1.262 1.00 0.00 C ATOM 0 H VAL A 9 2.039 34.374 0.871 1.00 0.00 H new ATOM 0 HA VAL A 9 4.026 34.536 2.957 1.00 0.00 H new ATOM 0 HB VAL A 9 1.574 36.192 2.441 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.895 38.013 3.554 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.624 36.622 4.630 1.00 0.00 H new ATOM 0 HG13 VAL A 9 4.207 36.847 3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.050 37.763 1.177 1.00 0.00 H new ATOM 0 HG22 VAL A 9 4.381 36.590 1.316 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.919 36.172 0.390 1.00 0.00 H new ATOM 134 N LEU A 10 2.597 33.937 5.067 1.00 0.00 N ATOM 135 CA LEU A 10 1.809 33.508 6.230 1.00 0.00 C ATOM 136 C LEU A 10 1.785 34.603 7.313 1.00 0.00 C ATOM 137 O LEU A 10 2.699 35.423 7.398 1.00 0.00 O ATOM 138 CB LEU A 10 2.229 32.123 6.783 1.00 0.00 C ATOM 139 CG LEU A 10 2.555 31.021 5.747 1.00 0.00 C ATOM 140 CD1 LEU A 10 4.001 31.090 5.260 1.00 0.00 C ATOM 141 CD2 LEU A 10 2.381 29.642 6.375 1.00 0.00 C ATOM 0 H LEU A 10 3.576 34.124 5.284 1.00 0.00 H new ATOM 0 HA LEU A 10 0.785 33.367 5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.106 32.263 7.416 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.427 31.758 7.425 1.00 0.00 H new ATOM 0 HG LEU A 10 1.874 31.182 4.912 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.179 30.296 4.535 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.181 32.057 4.791 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.676 30.966 6.107 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.613 28.874 5.637 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.054 29.542 7.226 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.351 29.523 6.711 1.00 0.00 H new ATOM 153 N ASP A 11 0.739 34.626 8.140 1.00 0.00 N ATOM 154 CA ASP A 11 0.491 35.671 9.140 1.00 0.00 C ATOM 155 C ASP A 11 -0.252 35.095 10.363 1.00 0.00 C ATOM 156 O ASP A 11 -1.452 34.815 10.255 1.00 0.00 O ATOM 157 CB ASP A 11 -0.363 36.790 8.522 1.00 0.00 C ATOM 158 CG ASP A 11 -0.486 38.017 9.443 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.468 38.319 10.201 1.00 0.00 O ATOM 160 OD2 ASP A 11 -1.537 38.701 9.400 1.00 0.00 O ATOM 0 H ASP A 11 0.021 33.901 8.135 1.00 0.00 H new ATOM 0 HA ASP A 11 1.454 36.068 9.462 1.00 0.00 H new ATOM 0 HB2 ASP A 11 0.077 37.095 7.573 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.358 36.404 8.303 1.00 0.00 H new ATOM 165 N PRO A 12 0.406 34.911 11.523 1.00 0.00 N ATOM 166 CA PRO A 12 1.837 35.108 11.781 1.00 0.00 C ATOM 167 C PRO A 12 2.758 34.166 10.959 1.00 0.00 C ATOM 168 O PRO A 12 2.435 32.990 10.784 1.00 0.00 O ATOM 169 CB PRO A 12 2.008 34.876 13.288 1.00 0.00 C ATOM 170 CG PRO A 12 0.824 33.980 13.658 1.00 0.00 C ATOM 171 CD PRO A 12 -0.273 34.496 12.738 1.00 0.00 C ATOM 0 HA PRO A 12 2.140 36.108 11.471 1.00 0.00 H new ATOM 0 HB2 PRO A 12 2.959 34.394 13.513 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.987 35.815 13.842 1.00 0.00 H new ATOM 0 HG2 PRO A 12 1.041 32.926 13.482 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.553 34.078 14.709 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.009 33.720 12.531 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -0.808 35.329 13.193 1.00 0.00 H new ATOM 179 N PRO A 13 3.918 34.652 10.464 1.00 0.00 N ATOM 180 CA PRO A 13 4.843 33.874 9.624 1.00 0.00 C ATOM 181 C PRO A 13 5.743 32.894 10.389 1.00 0.00 C ATOM 182 O PRO A 13 6.144 31.864 9.846 1.00 0.00 O ATOM 183 CB PRO A 13 5.711 34.920 8.918 1.00 0.00 C ATOM 184 CG PRO A 13 5.705 36.117 9.865 1.00 0.00 C ATOM 185 CD PRO A 13 4.305 36.056 10.466 1.00 0.00 C ATOM 0 HA PRO A 13 4.263 33.241 8.952 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.723 34.550 8.751 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.302 35.183 7.942 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.478 36.034 10.629 1.00 0.00 H new ATOM 0 HG3 PRO A 13 5.879 37.054 9.336 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.299 36.459 11.479 1.00 0.00 H new ATOM 0 HD3 PRO A 13 3.605 36.653 9.881 1.00 0.00 H new ATOM 193 N THR A 14 6.098 33.237 11.627 1.00 0.00 N ATOM 194 CA THR A 14 7.090 32.513 12.442 1.00 0.00 C ATOM 195 C THR A 14 6.493 31.349 13.235 1.00 0.00 C ATOM 196 O THR A 14 6.918 30.207 13.064 1.00 0.00 O ATOM 197 CB THR A 14 7.814 33.464 13.406 1.00 0.00 C ATOM 198 OG1 THR A 14 6.887 34.325 14.041 1.00 0.00 O ATOM 199 CG2 THR A 14 8.828 34.344 12.679 1.00 0.00 C ATOM 0 H THR A 14 5.699 34.043 12.108 1.00 0.00 H new ATOM 0 HA THR A 14 7.800 32.093 11.730 1.00 0.00 H new ATOM 0 HB THR A 14 8.327 32.836 14.134 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.363 34.924 14.653 1.00 0.00 H new ATOM 0 HG21 THR A 14 9.319 35.002 13.396 1.00 0.00 H new ATOM 0 HG22 THR A 14 9.574 33.715 12.194 1.00 0.00 H new ATOM 0 HG23 THR A 14 8.316 34.944 11.927 1.00 0.00 H new ATOM 207 N ASP A 15 5.507 31.631 14.092 1.00 0.00 N ATOM 208 CA ASP A 15 4.880 30.679 15.018 1.00 0.00 C ATOM 209 C ASP A 15 3.376 30.969 15.184 1.00 0.00 C ATOM 210 O ASP A 15 2.943 32.114 15.045 1.00 0.00 O ATOM 211 CB ASP A 15 5.575 30.757 16.386 1.00 0.00 C ATOM 212 CG ASP A 15 7.053 30.345 16.324 1.00 0.00 C ATOM 213 OD1 ASP A 15 7.351 29.170 16.014 1.00 0.00 O ATOM 214 OD2 ASP A 15 7.932 31.179 16.651 1.00 0.00 O ATOM 0 H ASP A 15 5.107 32.566 14.164 1.00 0.00 H new ATOM 0 HA ASP A 15 4.989 29.677 14.603 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.502 31.775 16.769 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.052 30.112 17.092 1.00 0.00 H new ATOM 219 N LEU A 16 2.586 29.956 15.555 1.00 0.00 N ATOM 220 CA LEU A 16 1.169 30.105 15.902 1.00 0.00 C ATOM 221 C LEU A 16 1.070 30.436 17.398 1.00 0.00 C ATOM 222 O LEU A 16 1.542 29.681 18.247 1.00 0.00 O ATOM 223 CB LEU A 16 0.394 28.803 15.605 1.00 0.00 C ATOM 224 CG LEU A 16 -0.175 28.592 14.190 1.00 0.00 C ATOM 225 CD1 LEU A 16 -1.332 29.537 13.877 1.00 0.00 C ATOM 226 CD2 LEU A 16 0.874 28.726 13.092 1.00 0.00 C ATOM 0 H LEU A 16 2.919 28.994 15.624 1.00 0.00 H new ATOM 0 HA LEU A 16 0.731 30.904 15.304 1.00 0.00 H new ATOM 0 HB2 LEU A 16 1.057 27.966 15.824 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.437 28.744 16.308 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.540 27.565 14.198 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.695 29.345 12.867 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.139 29.372 14.591 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.989 30.569 13.949 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.406 28.566 12.121 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.309 29.725 13.125 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.657 27.983 13.245 1.00 0.00 H new ATOM 238 N LYS A 17 0.440 31.567 17.722 1.00 0.00 N ATOM 239 CA LYS A 17 0.351 32.101 19.087 1.00 0.00 C ATOM 240 C LYS A 17 -1.055 31.913 19.646 1.00 0.00 C ATOM 241 O LYS A 17 -2.011 32.546 19.198 1.00 0.00 O ATOM 242 CB LYS A 17 0.812 33.568 19.123 1.00 0.00 C ATOM 243 CG LYS A 17 2.292 33.720 18.733 1.00 0.00 C ATOM 244 CD LYS A 17 2.748 35.181 18.845 1.00 0.00 C ATOM 245 CE LYS A 17 4.226 35.305 18.449 1.00 0.00 C ATOM 246 NZ LYS A 17 4.707 36.710 18.567 1.00 0.00 N ATOM 0 H LYS A 17 -0.032 32.150 17.031 1.00 0.00 H new ATOM 0 HA LYS A 17 1.025 31.541 19.735 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.196 34.158 18.444 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.658 33.971 20.124 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.907 33.094 19.379 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.440 33.367 17.712 1.00 0.00 H new ATOM 0 HD2 LYS A 17 2.137 35.811 18.199 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.606 35.537 19.865 1.00 0.00 H new ATOM 0 HE2 LYS A 17 4.830 34.658 19.085 1.00 0.00 H new ATOM 0 HE3 LYS A 17 4.359 34.959 17.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.709 36.758 18.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.146 37.323 17.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.602 37.031 19.551 1.00 0.00 H new ATOM 260 N PHE A 18 -1.161 31.033 20.634 1.00 0.00 N ATOM 261 CA PHE A 18 -2.393 30.684 21.333 1.00 0.00 C ATOM 262 C PHE A 18 -2.467 31.452 22.655 1.00 0.00 C ATOM 263 O PHE A 18 -1.710 31.175 23.585 1.00 0.00 O ATOM 264 CB PHE A 18 -2.439 29.160 21.529 1.00 0.00 C ATOM 265 CG PHE A 18 -2.433 28.394 20.225 1.00 0.00 C ATOM 266 CD1 PHE A 18 -3.658 28.196 19.570 1.00 0.00 C ATOM 267 CD2 PHE A 18 -1.238 27.941 19.626 1.00 0.00 C ATOM 268 CE1 PHE A 18 -3.702 27.581 18.312 1.00 0.00 C ATOM 269 CE2 PHE A 18 -1.286 27.304 18.376 1.00 0.00 C ATOM 270 CZ PHE A 18 -2.510 27.146 17.706 1.00 0.00 C ATOM 0 H PHE A 18 -0.353 30.519 20.986 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.268 30.970 20.749 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.583 28.851 22.129 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.335 28.899 22.093 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.575 28.520 20.040 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.292 28.084 20.127 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.648 27.442 17.810 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.376 26.933 17.927 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.536 26.691 16.727 1.00 0.00 H new ATOM 280 N LYS A 19 -3.367 32.438 22.732 1.00 0.00 N ATOM 281 CA LYS A 19 -3.637 33.224 23.949 1.00 0.00 C ATOM 282 C LYS A 19 -5.030 32.909 24.490 1.00 0.00 C ATOM 283 O LYS A 19 -6.005 32.985 23.741 1.00 0.00 O ATOM 284 CB LYS A 19 -3.387 34.714 23.652 1.00 0.00 C ATOM 285 CG LYS A 19 -3.454 35.637 24.885 1.00 0.00 C ATOM 286 CD LYS A 19 -4.856 36.105 25.324 1.00 0.00 C ATOM 287 CE LYS A 19 -5.703 36.791 24.236 1.00 0.00 C ATOM 288 NZ LYS A 19 -5.110 38.077 23.765 1.00 0.00 N ATOM 0 H LYS A 19 -3.941 32.720 21.937 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.953 32.949 24.752 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.405 34.819 23.190 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.121 35.053 22.921 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.990 35.118 25.724 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.848 36.520 24.682 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.407 35.241 25.696 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.743 36.796 26.160 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -5.813 36.115 23.388 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -6.703 36.979 24.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -5.721 38.494 23.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.029 38.736 24.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -4.166 37.899 23.366 1.00 0.00 H new ATOM 302 N GLY A 20 -5.147 32.594 25.781 1.00 0.00 N ATOM 303 CA GLY A 20 -6.418 32.285 26.422 1.00 0.00 C ATOM 304 C GLY A 20 -6.199 31.555 27.746 1.00 0.00 C ATOM 305 O GLY A 20 -5.059 31.302 28.132 1.00 0.00 O ATOM 0 H GLY A 20 -4.350 32.547 26.415 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.974 33.206 26.598 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.024 31.668 25.758 1.00 0.00 H new ATOM 309 N PRO A 21 -7.277 31.195 28.461 1.00 0.00 N ATOM 310 CA PRO A 21 -7.133 30.464 29.721 1.00 0.00 C ATOM 311 C PRO A 21 -6.799 28.974 29.652 1.00 0.00 C ATOM 312 O PRO A 21 -6.366 28.330 30.607 1.00 0.00 O ATOM 313 CB PRO A 21 -8.499 30.596 30.367 1.00 0.00 C ATOM 314 CG PRO A 21 -9.085 31.885 29.820 1.00 0.00 C ATOM 315 CD PRO A 21 -8.601 31.808 28.374 1.00 0.00 C ATOM 0 HA PRO A 21 -6.278 30.889 30.247 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.132 29.743 30.123 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.417 30.632 31.453 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.172 31.912 29.894 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.708 32.766 30.339 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.275 31.210 27.761 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.551 32.797 27.919 1.00 0.00 H new ATOM 323 N PHE A 22 -7.128 28.477 28.479 1.00 0.00 N ATOM 324 CA PHE A 22 -7.197 27.097 27.998 1.00 0.00 C ATOM 325 C PHE A 22 -8.261 26.254 28.724 1.00 0.00 C ATOM 326 O PHE A 22 -8.231 25.028 28.698 1.00 0.00 O ATOM 327 CB PHE A 22 -5.794 26.491 27.913 1.00 0.00 C ATOM 328 CG PHE A 22 -4.788 27.326 27.136 1.00 0.00 C ATOM 329 CD1 PHE A 22 -4.648 27.174 25.743 1.00 0.00 C ATOM 330 CD2 PHE A 22 -3.989 28.268 27.811 1.00 0.00 C ATOM 331 CE1 PHE A 22 -3.679 27.924 25.049 1.00 0.00 C ATOM 332 CE2 PHE A 22 -3.030 29.020 27.116 1.00 0.00 C ATOM 333 CZ PHE A 22 -2.868 28.843 25.735 1.00 0.00 C ATOM 0 H PHE A 22 -7.392 29.117 27.729 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.572 27.097 26.974 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -5.416 26.340 28.924 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -5.865 25.507 27.449 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.283 26.483 25.208 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -4.115 28.413 28.874 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.559 27.792 23.984 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -2.417 29.735 27.645 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.122 29.412 25.200 1.00 0.00 H new ATOM 343 N THR A 23 -9.255 26.929 29.311 1.00 0.00 N ATOM 344 CA THR A 23 -10.480 26.336 29.887 1.00 0.00 C ATOM 345 C THR A 23 -11.538 25.993 28.826 1.00 0.00 C ATOM 346 O THR A 23 -12.458 25.214 29.082 1.00 0.00 O ATOM 347 CB THR A 23 -11.093 27.300 30.914 1.00 0.00 C ATOM 348 OG1 THR A 23 -11.450 28.514 30.286 1.00 0.00 O ATOM 349 CG2 THR A 23 -10.086 27.651 32.010 1.00 0.00 C ATOM 0 H THR A 23 -9.233 27.944 29.405 1.00 0.00 H new ATOM 0 HA THR A 23 -10.181 25.403 30.364 1.00 0.00 H new ATOM 0 HB THR A 23 -11.963 26.802 31.342 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.841 29.122 30.948 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.547 28.335 32.723 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.779 26.742 32.526 1.00 0.00 H new ATOM 0 HG23 THR A 23 -9.213 28.127 31.563 1.00 0.00 H new ATOM 357 N ASP A 24 -11.384 26.550 27.619 1.00 0.00 N ATOM 358 CA ASP A 24 -12.185 26.285 26.414 1.00 0.00 C ATOM 359 C ASP A 24 -11.279 26.227 25.162 1.00 0.00 C ATOM 360 O ASP A 24 -10.066 26.446 25.246 1.00 0.00 O ATOM 361 CB ASP A 24 -13.235 27.407 26.281 1.00 0.00 C ATOM 362 CG ASP A 24 -14.393 27.113 25.311 1.00 0.00 C ATOM 363 OD1 ASP A 24 -14.557 25.954 24.860 1.00 0.00 O ATOM 364 OD2 ASP A 24 -15.148 28.065 24.998 1.00 0.00 O ATOM 0 H ASP A 24 -10.653 27.240 27.445 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.684 25.320 26.499 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.652 27.610 27.267 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.731 28.317 25.954 1.00 0.00 H new ATOM 369 N VAL A 25 -11.867 25.975 23.990 1.00 0.00 N ATOM 370 CA VAL A 25 -11.170 26.033 22.697 1.00 0.00 C ATOM 371 C VAL A 25 -10.615 27.440 22.448 1.00 0.00 C ATOM 372 O VAL A 25 -11.314 28.443 22.622 1.00 0.00 O ATOM 373 CB VAL A 25 -12.108 25.618 21.542 1.00 0.00 C ATOM 374 CG1 VAL A 25 -11.543 25.940 20.149 1.00 0.00 C ATOM 375 CG2 VAL A 25 -12.372 24.111 21.571 1.00 0.00 C ATOM 0 H VAL A 25 -12.852 25.722 23.908 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.339 25.329 22.732 1.00 0.00 H new ATOM 0 HB VAL A 25 -13.020 26.194 21.700 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.253 25.622 19.386 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.375 27.014 20.064 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.599 25.413 20.008 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.035 23.842 20.749 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.429 23.574 21.467 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -12.841 23.842 22.518 1.00 0.00 H new ATOM 385 N VAL A 26 -9.374 27.502 21.963 1.00 0.00 N ATOM 386 CA VAL A 26 -8.720 28.715 21.459 1.00 0.00 C ATOM 387 C VAL A 26 -8.842 28.737 19.940 1.00 0.00 C ATOM 388 O VAL A 26 -8.380 27.820 19.262 1.00 0.00 O ATOM 389 CB VAL A 26 -7.235 28.779 21.859 1.00 0.00 C ATOM 390 CG1 VAL A 26 -6.582 30.102 21.442 1.00 0.00 C ATOM 391 CG2 VAL A 26 -7.048 28.648 23.366 1.00 0.00 C ATOM 0 H VAL A 26 -8.773 26.680 21.907 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.213 29.581 21.901 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.763 27.945 21.341 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.535 30.102 21.745 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.647 30.215 20.360 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.099 30.931 21.925 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.986 28.698 23.607 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.573 29.460 23.870 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.451 27.692 23.701 1.00 0.00 H new ATOM 401 N THR A 27 -9.448 29.797 19.410 1.00 0.00 N ATOM 402 CA THR A 27 -9.466 30.072 17.964 1.00 0.00 C ATOM 403 C THR A 27 -8.290 30.977 17.615 1.00 0.00 C ATOM 404 O THR A 27 -8.213 32.111 18.089 1.00 0.00 O ATOM 405 CB THR A 27 -10.803 30.678 17.504 1.00 0.00 C ATOM 406 OG1 THR A 27 -11.857 29.778 17.775 1.00 0.00 O ATOM 407 CG2 THR A 27 -10.830 30.941 15.995 1.00 0.00 C ATOM 0 H THR A 27 -9.943 30.494 19.967 1.00 0.00 H new ATOM 0 HA THR A 27 -9.365 29.128 17.428 1.00 0.00 H new ATOM 0 HB THR A 27 -10.918 31.618 18.044 1.00 0.00 H new ATOM 0 HG1 THR A 27 -12.706 30.170 17.481 1.00 0.00 H new ATOM 0 HG21 THR A 27 -11.793 31.369 15.717 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.034 31.638 15.733 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.681 30.003 15.460 1.00 0.00 H new ATOM 415 N THR A 28 -7.397 30.483 16.761 1.00 0.00 N ATOM 416 CA THR A 28 -6.231 31.216 16.243 1.00 0.00 C ATOM 417 C THR A 28 -6.363 31.276 14.730 1.00 0.00 C ATOM 418 O THR A 28 -6.324 30.243 14.068 1.00 0.00 O ATOM 419 CB THR A 28 -4.919 30.531 16.665 1.00 0.00 C ATOM 420 OG1 THR A 28 -4.799 30.586 18.067 1.00 0.00 O ATOM 421 CG2 THR A 28 -3.663 31.194 16.096 1.00 0.00 C ATOM 0 H THR A 28 -7.461 29.533 16.396 1.00 0.00 H new ATOM 0 HA THR A 28 -6.201 32.225 16.655 1.00 0.00 H new ATOM 0 HB THR A 28 -4.978 29.514 16.278 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.333 29.786 18.387 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.780 30.654 16.438 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.702 31.173 15.007 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.611 32.228 16.437 1.00 0.00 H new ATOM 429 N ASN A 29 -6.544 32.469 14.166 1.00 0.00 N ATOM 430 CA ASN A 29 -6.582 32.640 12.717 1.00 0.00 C ATOM 431 C ASN A 29 -5.164 32.811 12.145 1.00 0.00 C ATOM 432 O ASN A 29 -4.336 33.543 12.692 1.00 0.00 O ATOM 433 CB ASN A 29 -7.552 33.766 12.323 1.00 0.00 C ATOM 434 CG ASN A 29 -7.256 35.118 12.951 1.00 0.00 C ATOM 435 OD1 ASN A 29 -6.439 35.894 12.477 1.00 0.00 O ATOM 436 ND2 ASN A 29 -7.925 35.441 14.035 1.00 0.00 N ATOM 0 H ASN A 29 -6.667 33.333 14.694 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.978 31.732 12.261 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.537 33.875 11.239 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.563 33.467 12.600 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -7.764 36.342 14.484 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.606 34.790 14.427 1.00 0.00 H new ATOM 443 N LEU A 30 -4.907 32.127 11.028 1.00 0.00 N ATOM 444 CA LEU A 30 -3.705 32.251 10.209 1.00 0.00 C ATOM 445 C LEU A 30 -4.115 32.837 8.850 1.00 0.00 C ATOM 446 O LEU A 30 -4.935 32.244 8.150 1.00 0.00 O ATOM 447 CB LEU A 30 -3.048 30.860 10.090 1.00 0.00 C ATOM 448 CG LEU A 30 -1.655 30.881 9.435 1.00 0.00 C ATOM 449 CD1 LEU A 30 -0.575 31.386 10.387 1.00 0.00 C ATOM 450 CD2 LEU A 30 -1.236 29.479 9.004 1.00 0.00 C ATOM 0 H LEU A 30 -5.563 31.441 10.655 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.969 32.921 10.653 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.964 30.423 11.085 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.702 30.209 9.510 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.742 31.552 8.580 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.389 31.382 9.878 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.814 32.401 10.703 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.527 30.736 11.261 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.249 29.520 8.544 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.204 28.825 9.875 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.956 29.089 8.284 1.00 0.00 H new ATOM 462 N LYS A 31 -3.573 33.995 8.472 1.00 0.00 N ATOM 463 CA LYS A 31 -3.834 34.644 7.175 1.00 0.00 C ATOM 464 C LYS A 31 -2.777 34.228 6.157 1.00 0.00 C ATOM 465 O LYS A 31 -1.593 34.474 6.374 1.00 0.00 O ATOM 466 CB LYS A 31 -3.909 36.173 7.354 1.00 0.00 C ATOM 467 CG LYS A 31 -5.378 36.562 7.327 1.00 0.00 C ATOM 468 CD LYS A 31 -5.629 38.051 7.538 1.00 0.00 C ATOM 469 CE LYS A 31 -7.146 38.211 7.439 1.00 0.00 C ATOM 470 NZ LYS A 31 -7.582 39.618 7.655 1.00 0.00 N ATOM 0 H LYS A 31 -2.930 34.521 9.063 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.799 34.316 6.789 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.450 36.472 8.296 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.363 36.680 6.558 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.805 36.264 6.369 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.906 36.002 8.099 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.259 38.380 8.509 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.118 38.649 6.783 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.481 37.876 6.457 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.626 37.567 8.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.618 39.676 7.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.287 39.931 8.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.147 40.231 6.936 1.00 0.00 H new ATOM 484 N LEU A 32 -3.191 33.598 5.057 1.00 0.00 N ATOM 485 CA LEU A 32 -2.301 33.202 3.963 1.00 0.00 C ATOM 486 C LEU A 32 -2.565 34.056 2.729 1.00 0.00 C ATOM 487 O LEU A 32 -3.694 34.075 2.247 1.00 0.00 O ATOM 488 CB LEU A 32 -2.462 31.711 3.617 1.00 0.00 C ATOM 489 CG LEU A 32 -2.126 30.662 4.691 1.00 0.00 C ATOM 490 CD1 LEU A 32 -1.012 31.082 5.634 1.00 0.00 C ATOM 491 CD2 LEU A 32 -3.350 30.296 5.519 1.00 0.00 C ATOM 0 H LEU A 32 -4.166 33.345 4.898 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.276 33.362 4.296 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.497 31.552 3.313 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.839 31.505 2.747 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.778 29.796 4.128 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.834 30.290 6.362 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.101 31.262 5.063 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.301 31.995 6.155 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.074 29.553 6.267 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.732 31.187 6.017 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.121 29.886 4.867 1.00 0.00 H new ATOM 503 N ARG A 33 -1.544 34.741 2.208 1.00 0.00 N ATOM 504 CA ARG A 33 -1.659 35.686 1.080 1.00 0.00 C ATOM 505 C ARG A 33 -0.766 35.281 -0.090 1.00 0.00 C ATOM 506 O ARG A 33 0.355 34.825 0.122 1.00 0.00 O ATOM 507 CB ARG A 33 -1.390 37.115 1.592 1.00 0.00 C ATOM 508 CG ARG A 33 -1.530 38.171 0.488 1.00 0.00 C ATOM 509 CD ARG A 33 -1.628 39.587 1.068 1.00 0.00 C ATOM 510 NE ARG A 33 -1.758 40.598 0.000 1.00 0.00 N ATOM 511 CZ ARG A 33 -2.787 40.793 -0.807 1.00 0.00 C ATOM 512 NH1 ARG A 33 -3.903 40.127 -0.707 1.00 0.00 N ATOM 513 NH2 ARG A 33 -2.708 41.668 -1.767 1.00 0.00 N ATOM 0 H ARG A 33 -0.591 34.657 2.562 1.00 0.00 H new ATOM 0 HA ARG A 33 -2.673 35.660 0.681 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -2.085 37.345 2.400 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -0.385 37.164 2.012 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -0.674 38.111 -0.184 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -2.418 37.959 -0.108 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -2.486 39.649 1.737 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.742 39.799 1.666 1.00 0.00 H new ATOM 0 HE ARG A 33 -0.960 41.219 -0.131 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -4.011 39.418 0.019 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -4.669 40.314 -1.354 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -1.851 42.205 -1.898 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.503 41.817 -2.388 1.00 0.00 H new ATOM 527 N ASN A 34 -1.242 35.465 -1.320 1.00 0.00 N ATOM 528 CA ASN A 34 -0.525 35.067 -2.531 1.00 0.00 C ATOM 529 C ASN A 34 0.091 36.291 -3.236 1.00 0.00 C ATOM 530 O ASN A 34 -0.654 37.131 -3.745 1.00 0.00 O ATOM 531 CB ASN A 34 -1.505 34.295 -3.429 1.00 0.00 C ATOM 532 CG ASN A 34 -0.862 33.719 -4.678 1.00 0.00 C ATOM 533 OD1 ASN A 34 0.338 33.801 -4.901 1.00 0.00 O ATOM 534 ND2 ASN A 34 -1.652 33.114 -5.522 1.00 0.00 N ATOM 0 H ASN A 34 -2.146 35.899 -1.506 1.00 0.00 H new ATOM 0 HA ASN A 34 0.314 34.417 -2.285 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -1.950 33.484 -2.853 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -2.317 34.961 -3.723 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.270 32.705 -6.375 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -2.651 33.050 -5.329 1.00 0.00 H new ATOM 541 N PRO A 35 1.432 36.388 -3.306 1.00 0.00 N ATOM 542 CA PRO A 35 2.117 37.478 -3.997 1.00 0.00 C ATOM 543 C PRO A 35 2.078 37.338 -5.532 1.00 0.00 C ATOM 544 O PRO A 35 2.232 38.323 -6.257 1.00 0.00 O ATOM 545 CB PRO A 35 3.557 37.395 -3.505 1.00 0.00 C ATOM 546 CG PRO A 35 3.779 35.928 -3.172 1.00 0.00 C ATOM 547 CD PRO A 35 2.401 35.473 -2.710 1.00 0.00 C ATOM 0 HA PRO A 35 1.635 38.432 -3.783 1.00 0.00 H new ATOM 0 HB2 PRO A 35 4.255 37.735 -4.270 1.00 0.00 H new ATOM 0 HB3 PRO A 35 3.711 38.026 -2.629 1.00 0.00 H new ATOM 0 HG2 PRO A 35 4.121 35.364 -4.040 1.00 0.00 H new ATOM 0 HG3 PRO A 35 4.530 35.800 -2.392 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.207 34.447 -3.024 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.332 35.492 -1.622 1.00 0.00 H new ATOM 555 N SER A 36 1.928 36.102 -6.017 1.00 0.00 N ATOM 556 CA SER A 36 2.066 35.710 -7.427 1.00 0.00 C ATOM 557 C SER A 36 0.915 36.163 -8.340 1.00 0.00 C ATOM 558 O SER A 36 -0.137 36.620 -7.893 1.00 0.00 O ATOM 559 CB SER A 36 2.214 34.185 -7.524 1.00 0.00 C ATOM 560 OG SER A 36 2.913 33.848 -8.710 1.00 0.00 O ATOM 0 H SER A 36 1.697 35.312 -5.414 1.00 0.00 H new ATOM 0 HA SER A 36 2.956 36.225 -7.788 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.750 33.806 -6.654 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.231 33.714 -7.523 1.00 0.00 H new ATOM 0 HG SER A 36 3.008 32.874 -8.769 1.00 0.00 H new ATOM 566 N ASP A 37 1.113 35.942 -9.641 1.00 0.00 N ATOM 567 CA ASP A 37 0.152 36.135 -10.739 1.00 0.00 C ATOM 568 C ASP A 37 -0.500 34.798 -11.179 1.00 0.00 C ATOM 569 O ASP A 37 -0.975 34.653 -12.309 1.00 0.00 O ATOM 570 CB ASP A 37 0.864 36.879 -11.881 1.00 0.00 C ATOM 571 CG ASP A 37 -0.099 37.415 -12.956 1.00 0.00 C ATOM 572 OD1 ASP A 37 -1.117 38.059 -12.601 1.00 0.00 O ATOM 573 OD2 ASP A 37 0.189 37.247 -14.167 1.00 0.00 O ATOM 0 H ASP A 37 2.011 35.599 -9.984 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.684 36.747 -10.402 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.431 37.711 -11.464 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.583 36.207 -12.350 1.00 0.00 H new ATOM 578 N ARG A 38 -0.483 33.790 -10.290 1.00 0.00 N ATOM 579 CA ARG A 38 -0.889 32.390 -10.525 1.00 0.00 C ATOM 580 C ARG A 38 -1.722 31.871 -9.353 1.00 0.00 C ATOM 581 O ARG A 38 -1.568 32.347 -8.229 1.00 0.00 O ATOM 582 CB ARG A 38 0.360 31.501 -10.704 1.00 0.00 C ATOM 583 CG ARG A 38 1.265 31.920 -11.876 1.00 0.00 C ATOM 584 CD ARG A 38 2.528 31.051 -11.969 1.00 0.00 C ATOM 585 NE ARG A 38 2.229 29.630 -12.247 1.00 0.00 N ATOM 586 CZ ARG A 38 1.956 29.080 -13.420 1.00 0.00 C ATOM 587 NH1 ARG A 38 1.888 29.780 -14.517 1.00 0.00 N ATOM 588 NH2 ARG A 38 1.745 27.798 -13.516 1.00 0.00 N ATOM 0 H ARG A 38 -0.167 33.937 -9.331 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.493 32.353 -11.432 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.943 31.522 -9.783 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.041 30.470 -10.856 1.00 0.00 H new ATOM 0 HG2 ARG A 38 0.706 31.848 -12.809 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.552 32.965 -11.756 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.175 31.442 -12.755 1.00 0.00 H new ATOM 0 HD3 ARG A 38 3.083 31.124 -11.034 1.00 0.00 H new ATOM 0 HE ARG A 38 2.234 29.002 -11.443 1.00 0.00 H new ATOM 0 HH11 ARG A 38 2.048 30.787 -14.490 1.00 0.00 H new ATOM 0 HH12 ARG A 38 1.675 29.321 -15.403 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.790 27.210 -12.684 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.535 27.382 -14.423 1.00 0.00 H new ATOM 602 N LYS A 39 -2.566 30.867 -9.598 1.00 0.00 N ATOM 603 CA LYS A 39 -3.365 30.181 -8.560 1.00 0.00 C ATOM 604 C LYS A 39 -2.513 29.136 -7.842 1.00 0.00 C ATOM 605 O LYS A 39 -1.655 28.507 -8.458 1.00 0.00 O ATOM 606 CB LYS A 39 -4.642 29.553 -9.162 1.00 0.00 C ATOM 607 CG LYS A 39 -5.629 30.595 -9.709 1.00 0.00 C ATOM 608 CD LYS A 39 -5.450 30.900 -11.210 1.00 0.00 C ATOM 609 CE LYS A 39 -5.981 32.287 -11.606 1.00 0.00 C ATOM 610 NZ LYS A 39 -7.436 32.448 -11.323 1.00 0.00 N ATOM 0 H LYS A 39 -2.722 30.496 -10.535 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.686 30.921 -7.826 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.360 28.872 -9.965 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.140 28.956 -8.398 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.646 30.242 -9.539 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -5.515 31.520 -9.144 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.392 30.835 -11.465 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.966 30.138 -11.794 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.423 33.053 -11.067 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -5.801 32.451 -12.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.772 33.344 -11.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.962 31.657 -11.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.591 32.455 -10.295 1.00 0.00 H new ATOM 624 N VAL A 40 -2.746 28.915 -6.551 1.00 0.00 N ATOM 625 CA VAL A 40 -1.968 27.956 -5.738 1.00 0.00 C ATOM 626 C VAL A 40 -2.865 27.231 -4.738 1.00 0.00 C ATOM 627 O VAL A 40 -3.645 27.860 -4.028 1.00 0.00 O ATOM 628 CB VAL A 40 -0.768 28.670 -5.078 1.00 0.00 C ATOM 629 CG1 VAL A 40 -1.176 29.785 -4.121 1.00 0.00 C ATOM 630 CG2 VAL A 40 0.157 27.714 -4.321 1.00 0.00 C ATOM 0 H VAL A 40 -3.480 29.393 -6.028 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.558 27.182 -6.386 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.233 29.103 -5.923 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.284 30.243 -3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -1.747 30.539 -4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.790 29.371 -3.321 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.980 28.277 -3.880 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.404 27.214 -3.532 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.555 26.970 -5.011 1.00 0.00 H new ATOM 640 N CYS A 41 -2.751 25.906 -4.668 1.00 0.00 N ATOM 641 CA CYS A 41 -3.469 25.084 -3.698 1.00 0.00 C ATOM 642 C CYS A 41 -2.669 24.990 -2.398 1.00 0.00 C ATOM 643 O CYS A 41 -1.449 24.816 -2.439 1.00 0.00 O ATOM 644 CB CYS A 41 -3.754 23.700 -4.289 1.00 0.00 C ATOM 645 SG CYS A 41 -4.882 23.867 -5.703 1.00 0.00 S ATOM 0 H CYS A 41 -2.150 25.367 -5.291 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.427 25.549 -3.467 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -2.823 23.229 -4.606 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.196 23.053 -3.531 1.00 0.00 H new ATOM 0 HG CYS A 41 -5.453 22.723 -5.940 1.00 0.00 H new ATOM 651 N PHE A 42 -3.354 25.085 -1.258 1.00 0.00 N ATOM 652 CA PHE A 42 -2.754 24.956 0.081 1.00 0.00 C ATOM 653 C PHE A 42 -3.295 23.776 0.902 1.00 0.00 C ATOM 654 O PHE A 42 -4.440 23.356 0.741 1.00 0.00 O ATOM 655 CB PHE A 42 -2.857 26.286 0.851 1.00 0.00 C ATOM 656 CG PHE A 42 -4.229 26.629 1.403 1.00 0.00 C ATOM 657 CD1 PHE A 42 -4.613 26.177 2.681 1.00 0.00 C ATOM 658 CD2 PHE A 42 -5.107 27.435 0.656 1.00 0.00 C ATOM 659 CE1 PHE A 42 -5.875 26.517 3.201 1.00 0.00 C ATOM 660 CE2 PHE A 42 -6.357 27.802 1.186 1.00 0.00 C ATOM 661 CZ PHE A 42 -6.745 27.334 2.456 1.00 0.00 C ATOM 0 H PHE A 42 -4.359 25.257 -1.233 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.701 24.723 -0.079 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.150 26.259 1.680 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -2.541 27.092 0.189 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -3.937 25.568 3.263 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -4.820 27.773 -0.329 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -6.176 26.151 4.172 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.018 28.442 0.620 1.00 0.00 H new ATOM 0 HZ PHE A 42 -7.711 27.602 2.858 1.00 0.00 H new ATOM 671 N LYS A 43 -2.461 23.276 1.820 1.00 0.00 N ATOM 672 CA LYS A 43 -2.751 22.208 2.792 1.00 0.00 C ATOM 673 C LYS A 43 -2.147 22.491 4.176 1.00 0.00 C ATOM 674 O LYS A 43 -1.092 23.114 4.254 1.00 0.00 O ATOM 675 CB LYS A 43 -2.208 20.872 2.241 1.00 0.00 C ATOM 676 CG LYS A 43 -3.267 20.056 1.491 1.00 0.00 C ATOM 677 CD LYS A 43 -2.662 18.746 0.967 1.00 0.00 C ATOM 678 CE LYS A 43 -3.751 17.876 0.323 1.00 0.00 C ATOM 679 NZ LYS A 43 -3.198 16.580 -0.160 1.00 0.00 N ATOM 0 H LYS A 43 -1.507 23.625 1.913 1.00 0.00 H new ATOM 0 HA LYS A 43 -3.832 22.158 2.925 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -1.373 21.075 1.571 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -1.817 20.277 3.067 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -4.104 19.838 2.154 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -3.663 20.639 0.660 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.882 18.964 0.237 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.190 18.203 1.785 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -4.544 17.688 1.047 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.202 18.414 -0.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -3.901 15.827 -0.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -2.972 16.655 -1.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -2.334 16.352 0.371 1.00 0.00 H new ATOM 693 N VAL A 44 -2.770 21.999 5.257 1.00 0.00 N ATOM 694 CA VAL A 44 -2.280 22.131 6.649 1.00 0.00 C ATOM 695 C VAL A 44 -2.063 20.760 7.320 1.00 0.00 C ATOM 696 O VAL A 44 -2.861 19.841 7.136 1.00 0.00 O ATOM 697 CB VAL A 44 -3.218 23.032 7.496 1.00 0.00 C ATOM 698 CG1 VAL A 44 -2.534 23.415 8.810 1.00 0.00 C ATOM 699 CG2 VAL A 44 -3.554 24.340 6.760 1.00 0.00 C ATOM 0 H VAL A 44 -3.649 21.486 5.193 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.306 22.619 6.598 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.130 22.463 7.677 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.201 24.047 9.397 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.300 22.513 9.375 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.614 23.959 8.596 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.212 24.948 7.381 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.635 24.890 6.558 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.053 24.110 5.819 1.00 0.00 H new ATOM 709 N LYS A 45 -0.999 20.640 8.130 1.00 0.00 N ATOM 710 CA LYS A 45 -0.679 19.506 9.027 1.00 0.00 C ATOM 711 C LYS A 45 -0.372 20.009 10.449 1.00 0.00 C ATOM 712 O LYS A 45 0.044 21.153 10.620 1.00 0.00 O ATOM 713 CB LYS A 45 0.526 18.714 8.479 1.00 0.00 C ATOM 714 CG LYS A 45 0.287 18.018 7.129 1.00 0.00 C ATOM 715 CD LYS A 45 1.609 17.421 6.615 1.00 0.00 C ATOM 716 CE LYS A 45 1.470 16.731 5.248 1.00 0.00 C ATOM 717 NZ LYS A 45 0.937 15.343 5.351 1.00 0.00 N ATOM 0 H LYS A 45 -0.293 21.374 8.183 1.00 0.00 H new ATOM 0 HA LYS A 45 -1.547 18.848 9.069 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.372 19.394 8.375 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.811 17.961 9.214 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -0.460 17.232 7.241 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -0.107 18.731 6.405 1.00 0.00 H new ATOM 0 HD2 LYS A 45 2.354 18.213 6.541 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.982 16.700 7.343 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.810 17.322 4.614 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.444 16.706 4.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.881 14.921 4.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 1.570 14.772 5.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.012 15.366 5.776 1.00 0.00 H new ATOM 731 N THR A 46 -0.546 19.161 11.463 1.00 0.00 N ATOM 732 CA THR A 46 -0.358 19.492 12.898 1.00 0.00 C ATOM 733 C THR A 46 0.150 18.290 13.702 1.00 0.00 C ATOM 734 O THR A 46 -0.044 17.154 13.281 1.00 0.00 O ATOM 735 CB THR A 46 -1.671 20.028 13.495 1.00 0.00 C ATOM 736 OG1 THR A 46 -1.423 20.568 14.768 1.00 0.00 O ATOM 737 CG2 THR A 46 -2.757 18.960 13.656 1.00 0.00 C ATOM 0 H THR A 46 -0.830 18.192 11.317 1.00 0.00 H new ATOM 0 HA THR A 46 0.405 20.267 12.962 1.00 0.00 H new ATOM 0 HB THR A 46 -2.034 20.776 12.790 1.00 0.00 H new ATOM 0 HG1 THR A 46 -1.701 21.507 14.785 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.652 19.413 14.082 1.00 0.00 H new ATOM 0 HG22 THR A 46 -2.995 18.533 12.682 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.398 18.173 14.319 1.00 0.00 H new ATOM 745 N THR A 47 0.800 18.489 14.851 1.00 0.00 N ATOM 746 CA THR A 47 1.431 17.397 15.629 1.00 0.00 C ATOM 747 C THR A 47 0.484 16.585 16.522 1.00 0.00 C ATOM 748 O THR A 47 0.892 15.559 17.066 1.00 0.00 O ATOM 749 CB THR A 47 2.585 17.938 16.479 1.00 0.00 C ATOM 750 OG1 THR A 47 2.188 19.080 17.211 1.00 0.00 O ATOM 751 CG2 THR A 47 3.741 18.370 15.590 1.00 0.00 C ATOM 0 H THR A 47 0.909 19.410 15.277 1.00 0.00 H new ATOM 0 HA THR A 47 1.790 16.702 14.870 1.00 0.00 H new ATOM 0 HB THR A 47 2.883 17.136 17.154 1.00 0.00 H new ATOM 0 HG1 THR A 47 2.137 18.856 18.164 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.553 18.752 16.209 1.00 0.00 H new ATOM 0 HG22 THR A 47 4.095 17.516 15.013 1.00 0.00 H new ATOM 0 HG23 THR A 47 3.404 19.152 14.910 1.00 0.00 H new ATOM 759 N ALA A 48 -0.764 17.030 16.710 1.00 0.00 N ATOM 760 CA ALA A 48 -1.739 16.335 17.564 1.00 0.00 C ATOM 761 C ALA A 48 -3.193 16.564 17.097 1.00 0.00 C ATOM 762 O ALA A 48 -3.783 17.589 17.439 1.00 0.00 O ATOM 763 CB ALA A 48 -1.516 16.806 19.015 1.00 0.00 C ATOM 0 H ALA A 48 -1.127 17.879 16.277 1.00 0.00 H new ATOM 0 HA ALA A 48 -1.583 15.258 17.497 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.227 16.306 19.673 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.500 16.561 19.325 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -1.663 17.884 19.074 1.00 0.00 H new ATOM 769 N PRO A 49 -3.838 15.615 16.386 1.00 0.00 N ATOM 770 CA PRO A 49 -5.176 15.822 15.809 1.00 0.00 C ATOM 771 C PRO A 49 -6.291 15.851 16.873 1.00 0.00 C ATOM 772 O PRO A 49 -7.363 16.406 16.644 1.00 0.00 O ATOM 773 CB PRO A 49 -5.343 14.672 14.809 1.00 0.00 C ATOM 774 CG PRO A 49 -4.525 13.539 15.428 1.00 0.00 C ATOM 775 CD PRO A 49 -3.357 14.268 16.090 1.00 0.00 C ATOM 0 HA PRO A 49 -5.262 16.797 15.328 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.390 14.393 14.690 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -4.971 14.942 13.821 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -5.108 12.972 16.154 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.182 12.832 14.673 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -3.044 13.757 17.000 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -2.491 14.300 15.428 1.00 0.00 H new ATOM 783 N ARG A 50 -6.011 15.306 18.071 1.00 0.00 N ATOM 784 CA ARG A 50 -6.862 15.378 19.276 1.00 0.00 C ATOM 785 C ARG A 50 -6.672 16.646 20.130 1.00 0.00 C ATOM 786 O ARG A 50 -7.456 16.878 21.045 1.00 0.00 O ATOM 787 CB ARG A 50 -6.815 14.030 20.035 1.00 0.00 C ATOM 788 CG ARG A 50 -5.420 13.471 20.380 1.00 0.00 C ATOM 789 CD ARG A 50 -4.751 14.228 21.528 1.00 0.00 C ATOM 790 NE ARG A 50 -3.403 13.690 21.801 1.00 0.00 N ATOM 791 CZ ARG A 50 -2.712 13.775 22.926 1.00 0.00 C ATOM 792 NH1 ARG A 50 -3.174 14.347 24.000 1.00 0.00 N ATOM 793 NH2 ARG A 50 -1.511 13.274 22.991 1.00 0.00 N ATOM 0 H ARG A 50 -5.151 14.782 18.234 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.894 15.515 18.952 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -7.374 14.144 20.964 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -7.340 13.285 19.437 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.510 12.418 20.648 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.784 13.522 19.497 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.680 15.287 21.278 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.365 14.153 22.425 1.00 0.00 H new ATOM 0 HE ARG A 50 -2.952 13.195 21.032 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -4.109 14.755 23.998 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -2.601 14.387 24.843 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -1.104 12.817 22.175 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -0.977 13.339 23.858 1.00 0.00 H new ATOM 807 N ARG A 51 -5.678 17.490 19.805 1.00 0.00 N ATOM 808 CA ARG A 51 -5.489 18.847 20.374 1.00 0.00 C ATOM 809 C ARG A 51 -5.715 19.974 19.363 1.00 0.00 C ATOM 810 O ARG A 51 -6.043 21.072 19.790 1.00 0.00 O ATOM 811 CB ARG A 51 -4.098 18.997 21.026 1.00 0.00 C ATOM 812 CG ARG A 51 -3.895 18.204 22.327 1.00 0.00 C ATOM 813 CD ARG A 51 -4.821 18.662 23.465 1.00 0.00 C ATOM 814 NE ARG A 51 -4.591 17.874 24.689 1.00 0.00 N ATOM 815 CZ ARG A 51 -3.782 18.130 25.697 1.00 0.00 C ATOM 816 NH1 ARG A 51 -2.987 19.165 25.718 1.00 0.00 N ATOM 817 NH2 ARG A 51 -3.757 17.320 26.712 1.00 0.00 N ATOM 0 H ARG A 51 -4.961 17.246 19.121 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.259 18.947 21.139 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.342 18.683 20.307 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -3.923 20.053 21.232 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.067 17.146 22.131 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.858 18.304 22.648 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -4.652 19.719 23.672 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.861 18.561 23.154 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.132 17.013 24.766 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -2.975 19.815 24.932 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -2.377 19.324 26.520 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -4.359 16.497 26.723 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -3.135 17.507 27.499 1.00 0.00 H new ATOM 831 N TYR A 52 -5.593 19.724 18.060 1.00 0.00 N ATOM 832 CA TYR A 52 -5.667 20.752 17.017 1.00 0.00 C ATOM 833 C TYR A 52 -6.581 20.364 15.852 1.00 0.00 C ATOM 834 O TYR A 52 -6.420 19.302 15.248 1.00 0.00 O ATOM 835 CB TYR A 52 -4.262 21.009 16.477 1.00 0.00 C ATOM 836 CG TYR A 52 -3.314 21.624 17.481 1.00 0.00 C ATOM 837 CD1 TYR A 52 -3.391 22.998 17.772 1.00 0.00 C ATOM 838 CD2 TYR A 52 -2.362 20.812 18.122 1.00 0.00 C ATOM 839 CE1 TYR A 52 -2.474 23.571 18.672 1.00 0.00 C ATOM 840 CE2 TYR A 52 -1.477 21.374 19.059 1.00 0.00 C ATOM 841 CZ TYR A 52 -1.532 22.754 19.331 1.00 0.00 C ATOM 842 OH TYR A 52 -0.676 23.299 20.225 1.00 0.00 O ATOM 0 H TYR A 52 -5.437 18.786 17.691 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.091 21.645 17.475 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -3.841 20.066 16.128 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.333 21.667 15.611 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.150 23.610 17.307 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -2.310 19.757 17.895 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.491 24.635 18.858 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -0.758 20.749 19.568 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.094 22.600 20.589 1.00 0.00 H new ATOM 852 N CYS A 53 -7.481 21.279 15.490 1.00 0.00 N ATOM 853 CA CYS A 53 -8.372 21.157 14.336 1.00 0.00 C ATOM 854 C CYS A 53 -8.243 22.360 13.386 1.00 0.00 C ATOM 855 O CYS A 53 -7.976 23.477 13.824 1.00 0.00 O ATOM 856 CB CYS A 53 -9.807 20.915 14.832 1.00 0.00 C ATOM 857 SG CYS A 53 -9.844 19.324 15.700 1.00 0.00 S ATOM 0 H CYS A 53 -7.614 22.149 16.006 1.00 0.00 H new ATOM 0 HA CYS A 53 -8.079 20.296 13.735 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -10.120 21.719 15.498 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -10.503 20.907 13.993 1.00 0.00 H new ATOM 0 HG CYS A 53 -9.911 18.358 14.833 1.00 0.00 H new ATOM 863 N VAL A 54 -8.414 22.130 12.083 1.00 0.00 N ATOM 864 CA VAL A 54 -8.220 23.115 10.997 1.00 0.00 C ATOM 865 C VAL A 54 -9.442 23.064 10.081 1.00 0.00 C ATOM 866 O VAL A 54 -9.526 22.175 9.238 1.00 0.00 O ATOM 867 CB VAL A 54 -6.925 22.822 10.224 1.00 0.00 C ATOM 868 CG1 VAL A 54 -6.708 23.895 9.149 1.00 0.00 C ATOM 869 CG2 VAL A 54 -5.707 22.905 11.157 1.00 0.00 C ATOM 0 H VAL A 54 -8.703 21.217 11.732 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.121 24.118 11.412 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.021 21.826 9.792 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.788 23.683 8.604 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.550 23.892 8.456 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.632 24.874 9.622 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.800 22.694 10.591 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.644 23.906 11.585 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.812 22.174 11.959 1.00 0.00 H new ATOM 879 N ARG A 55 -10.390 24.002 10.211 1.00 0.00 N ATOM 880 CA ARG A 55 -11.709 23.907 9.539 1.00 0.00 C ATOM 881 C ARG A 55 -11.689 23.630 8.031 1.00 0.00 C ATOM 882 O ARG A 55 -12.299 22.648 7.608 1.00 0.00 O ATOM 883 CB ARG A 55 -12.614 25.097 9.896 1.00 0.00 C ATOM 884 CG ARG A 55 -14.099 24.800 9.617 1.00 0.00 C ATOM 885 CD ARG A 55 -15.018 25.979 9.969 1.00 0.00 C ATOM 886 NE ARG A 55 -14.747 27.159 9.116 1.00 0.00 N ATOM 887 CZ ARG A 55 -14.093 28.261 9.440 1.00 0.00 C ATOM 888 NH1 ARG A 55 -13.671 28.485 10.650 1.00 0.00 N ATOM 889 NH2 ARG A 55 -13.829 29.162 8.540 1.00 0.00 N ATOM 0 H ARG A 55 -10.274 24.843 10.777 1.00 0.00 H new ATOM 0 HA ARG A 55 -12.143 22.996 9.952 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.486 25.346 10.950 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.306 25.971 9.323 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.223 24.551 8.563 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.404 23.924 10.190 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -16.059 25.677 9.852 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.880 26.248 11.016 1.00 0.00 H new ATOM 0 HE ARG A 55 -15.109 27.116 8.163 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -13.842 27.799 11.385 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -13.169 29.347 10.864 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.127 29.021 7.575 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -13.324 30.009 8.799 1.00 0.00 H new ATOM 903 N PRO A 56 -10.984 24.432 7.218 1.00 0.00 N ATOM 904 CA PRO A 56 -10.807 24.128 5.801 1.00 0.00 C ATOM 905 C PRO A 56 -10.022 22.836 5.508 1.00 0.00 C ATOM 906 O PRO A 56 -10.314 22.144 4.539 1.00 0.00 O ATOM 907 CB PRO A 56 -10.004 25.309 5.237 1.00 0.00 C ATOM 908 CG PRO A 56 -9.362 25.918 6.482 1.00 0.00 C ATOM 909 CD PRO A 56 -10.438 25.747 7.517 1.00 0.00 C ATOM 0 HA PRO A 56 -11.791 23.979 5.355 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.255 24.980 4.517 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.646 26.025 4.724 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.444 25.400 6.761 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -9.104 26.967 6.334 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.034 25.795 8.528 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.198 26.525 7.440 1.00 0.00 H new ATOM 917 N ASN A 57 -8.987 22.565 6.320 1.00 0.00 N ATOM 918 CA ASN A 57 -7.909 21.559 6.203 1.00 0.00 C ATOM 919 C ASN A 57 -6.999 21.752 4.965 1.00 0.00 C ATOM 920 O ASN A 57 -5.820 21.389 4.977 1.00 0.00 O ATOM 921 CB ASN A 57 -8.445 20.126 6.420 1.00 0.00 C ATOM 922 CG ASN A 57 -9.118 19.483 5.212 1.00 0.00 C ATOM 923 OD1 ASN A 57 -8.594 19.460 4.105 1.00 0.00 O ATOM 924 ND2 ASN A 57 -10.282 18.896 5.388 1.00 0.00 N ATOM 0 H ASN A 57 -8.869 23.108 7.176 1.00 0.00 H new ATOM 0 HA ASN A 57 -7.216 21.733 7.026 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.616 19.491 6.732 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.159 20.145 7.243 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -10.740 18.427 4.606 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -10.726 18.910 6.306 1.00 0.00 H new ATOM 931 N SER A 58 -7.539 22.380 3.922 1.00 0.00 N ATOM 932 CA SER A 58 -6.934 22.624 2.610 1.00 0.00 C ATOM 933 C SER A 58 -7.784 23.613 1.798 1.00 0.00 C ATOM 934 O SER A 58 -8.930 23.905 2.157 1.00 0.00 O ATOM 935 CB SER A 58 -6.801 21.304 1.830 1.00 0.00 C ATOM 936 OG SER A 58 -8.037 20.625 1.707 1.00 0.00 O ATOM 0 H SER A 58 -8.484 22.762 3.974 1.00 0.00 H new ATOM 0 HA SER A 58 -5.944 23.052 2.768 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.402 21.510 0.837 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.083 20.658 2.334 1.00 0.00 H new ATOM 0 HG SER A 58 -8.237 20.155 2.543 1.00 0.00 H new ATOM 942 N GLY A 59 -7.234 24.144 0.706 1.00 0.00 N ATOM 943 CA GLY A 59 -7.954 25.073 -0.174 1.00 0.00 C ATOM 944 C GLY A 59 -7.117 25.579 -1.347 1.00 0.00 C ATOM 945 O GLY A 59 -6.092 24.990 -1.683 1.00 0.00 O ATOM 0 H GLY A 59 -6.280 23.945 0.405 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -8.844 24.577 -0.561 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.294 25.926 0.413 1.00 0.00 H new ATOM 949 N ILE A 60 -7.555 26.664 -1.988 1.00 0.00 N ATOM 950 CA ILE A 60 -6.832 27.346 -3.078 1.00 0.00 C ATOM 951 C ILE A 60 -6.841 28.871 -2.855 1.00 0.00 C ATOM 952 O ILE A 60 -7.846 29.413 -2.388 1.00 0.00 O ATOM 953 CB ILE A 60 -7.435 26.980 -4.456 1.00 0.00 C ATOM 954 CG1 ILE A 60 -7.864 25.496 -4.593 1.00 0.00 C ATOM 955 CG2 ILE A 60 -6.498 27.406 -5.607 1.00 0.00 C ATOM 956 CD1 ILE A 60 -8.378 25.094 -5.985 1.00 0.00 C ATOM 0 H ILE A 60 -8.445 27.109 -1.762 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.796 27.006 -3.070 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.360 27.552 -4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.014 24.863 -4.339 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -8.645 25.290 -3.861 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.949 27.136 -6.562 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.344 28.484 -5.571 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.539 26.899 -5.502 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.653 24.039 -5.981 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.251 25.696 -6.238 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.595 25.262 -6.724 1.00 0.00 H new ATOM 968 N ILE A 61 -5.757 29.571 -3.220 1.00 0.00 N ATOM 969 CA ILE A 61 -5.671 31.042 -3.234 1.00 0.00 C ATOM 970 C ILE A 61 -5.427 31.566 -4.657 1.00 0.00 C ATOM 971 O ILE A 61 -4.584 31.051 -5.393 1.00 0.00 O ATOM 972 CB ILE A 61 -4.614 31.569 -2.235 1.00 0.00 C ATOM 973 CG1 ILE A 61 -4.759 30.822 -0.892 1.00 0.00 C ATOM 974 CG2 ILE A 61 -4.755 33.097 -2.072 1.00 0.00 C ATOM 975 CD1 ILE A 61 -4.099 31.482 0.314 1.00 0.00 C ATOM 0 H ILE A 61 -4.893 29.120 -3.522 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.633 31.431 -2.901 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.611 31.378 -2.616 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.821 30.701 -0.679 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.341 29.822 -1.008 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.007 33.458 -1.367 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.607 33.581 -3.037 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.751 33.332 -1.697 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.266 30.870 1.200 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.028 31.578 0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.531 32.471 0.470 1.00 0.00 H new ATOM 987 N ASP A 62 -6.152 32.624 -5.020 1.00 0.00 N ATOM 988 CA ASP A 62 -6.042 33.344 -6.298 1.00 0.00 C ATOM 989 C ASP A 62 -4.911 34.401 -6.291 1.00 0.00 C ATOM 990 O ASP A 62 -4.366 34.711 -5.228 1.00 0.00 O ATOM 991 CB ASP A 62 -7.413 33.961 -6.632 1.00 0.00 C ATOM 992 CG ASP A 62 -8.297 32.978 -7.414 1.00 0.00 C ATOM 993 OD1 ASP A 62 -8.037 32.783 -8.627 1.00 0.00 O ATOM 994 OD2 ASP A 62 -9.253 32.414 -6.828 1.00 0.00 O ATOM 0 H ASP A 62 -6.864 33.023 -4.408 1.00 0.00 H new ATOM 0 HA ASP A 62 -5.763 32.637 -7.079 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -7.917 34.251 -5.710 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.271 34.870 -7.217 1.00 0.00 H new ATOM 999 N PRO A 63 -4.522 34.978 -7.446 1.00 0.00 N ATOM 1000 CA PRO A 63 -3.500 36.023 -7.506 1.00 0.00 C ATOM 1001 C PRO A 63 -3.853 37.240 -6.638 1.00 0.00 C ATOM 1002 O PRO A 63 -4.988 37.727 -6.673 1.00 0.00 O ATOM 1003 CB PRO A 63 -3.392 36.409 -8.984 1.00 0.00 C ATOM 1004 CG PRO A 63 -3.887 35.170 -9.722 1.00 0.00 C ATOM 1005 CD PRO A 63 -4.976 34.655 -8.790 1.00 0.00 C ATOM 0 HA PRO A 63 -2.552 35.658 -7.109 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -4.002 37.282 -9.215 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -2.366 36.655 -9.259 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -4.278 35.413 -10.710 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -3.093 34.437 -9.865 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.933 35.129 -9.005 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.118 33.581 -8.909 1.00 0.00 H new ATOM 1013 N GLY A 64 -2.899 37.729 -5.835 1.00 0.00 N ATOM 1014 CA GLY A 64 -3.070 38.947 -5.023 1.00 0.00 C ATOM 1015 C GLY A 64 -4.160 38.840 -3.954 1.00 0.00 C ATOM 1016 O GLY A 64 -4.656 39.861 -3.471 1.00 0.00 O ATOM 0 H GLY A 64 -1.984 37.292 -5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.123 39.183 -4.538 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.306 39.781 -5.684 1.00 0.00 H new ATOM 1020 N SER A 65 -4.556 37.612 -3.606 1.00 0.00 N ATOM 1021 CA SER A 65 -5.681 37.309 -2.716 1.00 0.00 C ATOM 1022 C SER A 65 -5.208 36.684 -1.400 1.00 0.00 C ATOM 1023 O SER A 65 -4.065 36.238 -1.293 1.00 0.00 O ATOM 1024 CB SER A 65 -6.684 36.406 -3.452 1.00 0.00 C ATOM 1025 OG SER A 65 -7.111 37.009 -4.664 1.00 0.00 O ATOM 0 H SER A 65 -4.087 36.773 -3.948 1.00 0.00 H new ATOM 0 HA SER A 65 -6.181 38.240 -2.449 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.224 35.441 -3.663 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.546 36.215 -2.812 1.00 0.00 H new ATOM 0 HG SER A 65 -6.345 37.107 -5.268 1.00 0.00 H new ATOM 1031 N THR A 66 -6.088 36.650 -0.395 1.00 0.00 N ATOM 1032 CA THR A 66 -5.801 36.119 0.954 1.00 0.00 C ATOM 1033 C THR A 66 -6.918 35.174 1.418 1.00 0.00 C ATOM 1034 O THR A 66 -8.096 35.453 1.184 1.00 0.00 O ATOM 1035 CB THR A 66 -5.622 37.252 1.988 1.00 0.00 C ATOM 1036 OG1 THR A 66 -4.764 38.269 1.510 1.00 0.00 O ATOM 1037 CG2 THR A 66 -5.023 36.791 3.324 1.00 0.00 C ATOM 0 H THR A 66 -7.042 36.997 -0.492 1.00 0.00 H new ATOM 0 HA THR A 66 -4.865 35.565 0.885 1.00 0.00 H new ATOM 0 HB THR A 66 -6.638 37.615 2.146 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.676 38.969 2.190 1.00 0.00 H new ATOM 0 HG21 THR A 66 -4.930 37.645 3.995 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.675 36.044 3.776 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.039 36.356 3.151 1.00 0.00 H new ATOM 1045 N VAL A 67 -6.567 34.088 2.114 1.00 0.00 N ATOM 1046 CA VAL A 67 -7.510 33.192 2.819 1.00 0.00 C ATOM 1047 C VAL A 67 -7.158 33.166 4.304 1.00 0.00 C ATOM 1048 O VAL A 67 -5.984 33.104 4.669 1.00 0.00 O ATOM 1049 CB VAL A 67 -7.526 31.770 2.212 1.00 0.00 C ATOM 1050 CG1 VAL A 67 -8.442 30.802 2.980 1.00 0.00 C ATOM 1051 CG2 VAL A 67 -8.023 31.815 0.762 1.00 0.00 C ATOM 0 H VAL A 67 -5.595 33.794 2.210 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.520 33.582 2.697 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.499 31.409 2.273 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.412 29.820 2.507 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.100 30.719 4.012 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.464 31.180 2.966 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.029 30.807 0.348 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.033 32.224 0.736 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.361 32.447 0.170 1.00 0.00 H new ATOM 1061 N THR A 68 -8.171 33.204 5.170 1.00 0.00 N ATOM 1062 CA THR A 68 -8.015 33.089 6.621 1.00 0.00 C ATOM 1063 C THR A 68 -8.396 31.678 7.059 1.00 0.00 C ATOM 1064 O THR A 68 -9.524 31.229 6.855 1.00 0.00 O ATOM 1065 CB THR A 68 -8.864 34.141 7.344 1.00 0.00 C ATOM 1066 OG1 THR A 68 -8.575 35.432 6.853 1.00 0.00 O ATOM 1067 CG2 THR A 68 -8.560 34.164 8.833 1.00 0.00 C ATOM 0 H THR A 68 -9.142 33.318 4.877 1.00 0.00 H new ATOM 0 HA THR A 68 -6.974 33.272 6.887 1.00 0.00 H new ATOM 0 HB THR A 68 -9.907 33.876 7.170 1.00 0.00 H new ATOM 0 HG1 THR A 68 -9.126 36.092 7.323 1.00 0.00 H new ATOM 0 HG21 THR A 68 -9.177 34.920 9.319 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.777 33.187 9.264 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.507 34.402 8.986 1.00 0.00 H new ATOM 1075 N VAL A 69 -7.441 30.982 7.667 1.00 0.00 N ATOM 1076 CA VAL A 69 -7.565 29.604 8.166 1.00 0.00 C ATOM 1077 C VAL A 69 -7.738 29.633 9.682 1.00 0.00 C ATOM 1078 O VAL A 69 -6.877 30.145 10.394 1.00 0.00 O ATOM 1079 CB VAL A 69 -6.335 28.778 7.734 1.00 0.00 C ATOM 1080 CG1 VAL A 69 -6.322 27.377 8.355 1.00 0.00 C ATOM 1081 CG2 VAL A 69 -6.305 28.617 6.209 1.00 0.00 C ATOM 0 H VAL A 69 -6.515 31.375 7.836 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.444 29.122 7.738 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.462 29.328 8.085 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.436 26.838 8.019 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.305 27.461 9.442 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.216 26.834 8.047 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.431 28.032 5.922 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.209 28.105 5.879 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.254 29.600 5.740 1.00 0.00 H new ATOM 1091 N SER A 70 -8.842 29.081 10.185 1.00 0.00 N ATOM 1092 CA SER A 70 -9.115 28.980 11.627 1.00 0.00 C ATOM 1093 C SER A 70 -8.506 27.702 12.208 1.00 0.00 C ATOM 1094 O SER A 70 -8.883 26.594 11.820 1.00 0.00 O ATOM 1095 CB SER A 70 -10.626 28.995 11.900 1.00 0.00 C ATOM 1096 OG SER A 70 -11.280 30.056 11.215 1.00 0.00 O ATOM 0 H SER A 70 -9.581 28.687 9.602 1.00 0.00 H new ATOM 0 HA SER A 70 -8.658 29.844 12.110 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.060 28.043 11.593 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.800 29.093 12.972 1.00 0.00 H new ATOM 0 HG SER A 70 -11.847 30.551 11.843 1.00 0.00 H new ATOM 1102 N VAL A 71 -7.595 27.861 13.167 1.00 0.00 N ATOM 1103 CA VAL A 71 -7.059 26.774 13.994 1.00 0.00 C ATOM 1104 C VAL A 71 -7.848 26.749 15.299 1.00 0.00 C ATOM 1105 O VAL A 71 -7.931 27.761 15.991 1.00 0.00 O ATOM 1106 CB VAL A 71 -5.552 26.941 14.263 1.00 0.00 C ATOM 1107 CG1 VAL A 71 -5.041 25.797 15.145 1.00 0.00 C ATOM 1108 CG2 VAL A 71 -4.742 26.948 12.960 1.00 0.00 C ATOM 0 H VAL A 71 -7.197 28.771 13.398 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.168 25.828 13.464 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.420 27.898 14.768 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.974 25.927 15.328 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.575 25.804 16.095 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.209 24.846 14.641 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.683 27.068 13.190 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -4.894 26.007 12.432 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.072 27.775 12.331 1.00 0.00 H new ATOM 1118 N MET A 72 -8.412 25.595 15.636 1.00 0.00 N ATOM 1119 CA MET A 72 -9.130 25.324 16.881 1.00 0.00 C ATOM 1120 C MET A 72 -8.245 24.445 17.771 1.00 0.00 C ATOM 1121 O MET A 72 -8.119 23.242 17.539 1.00 0.00 O ATOM 1122 CB MET A 72 -10.467 24.647 16.540 1.00 0.00 C ATOM 1123 CG MET A 72 -11.470 25.631 15.923 1.00 0.00 C ATOM 1124 SD MET A 72 -12.975 24.861 15.254 1.00 0.00 S ATOM 1125 CE MET A 72 -13.756 24.242 16.773 1.00 0.00 C ATOM 0 H MET A 72 -8.381 24.782 15.021 1.00 0.00 H new ATOM 0 HA MET A 72 -9.350 26.242 17.426 1.00 0.00 H new ATOM 0 HB2 MET A 72 -10.291 23.826 15.845 1.00 0.00 H new ATOM 0 HB3 MET A 72 -10.894 24.213 17.444 1.00 0.00 H new ATOM 0 HG2 MET A 72 -11.757 26.359 16.681 1.00 0.00 H new ATOM 0 HG3 MET A 72 -10.974 26.182 15.124 1.00 0.00 H new ATOM 0 HE1 MET A 72 -14.710 23.775 16.527 1.00 0.00 H new ATOM 0 HE2 MET A 72 -13.103 23.508 17.245 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.925 25.072 17.459 1.00 0.00 H new ATOM 1135 N LEU A 73 -7.616 25.056 18.773 1.00 0.00 N ATOM 1136 CA LEU A 73 -6.768 24.390 19.764 1.00 0.00 C ATOM 1137 C LEU A 73 -7.604 24.065 21.005 1.00 0.00 C ATOM 1138 O LEU A 73 -8.251 24.934 21.584 1.00 0.00 O ATOM 1139 CB LEU A 73 -5.539 25.273 20.010 1.00 0.00 C ATOM 1140 CG LEU A 73 -4.549 24.900 21.132 1.00 0.00 C ATOM 1141 CD1 LEU A 73 -4.883 25.604 22.445 1.00 0.00 C ATOM 1142 CD2 LEU A 73 -4.341 23.415 21.426 1.00 0.00 C ATOM 0 H LEU A 73 -7.684 26.062 18.924 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.388 23.429 19.418 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -4.976 25.316 19.078 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -5.897 26.282 20.212 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.607 25.250 20.710 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -4.161 25.313 23.208 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.842 26.683 22.300 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -5.885 25.319 22.766 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -3.620 23.302 22.236 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.290 22.966 21.719 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -3.964 22.917 20.533 1.00 0.00 H new ATOM 1154 N GLN A 74 -7.635 22.790 21.367 1.00 0.00 N ATOM 1155 CA GLN A 74 -8.511 22.227 22.398 1.00 0.00 C ATOM 1156 C GLN A 74 -8.057 22.597 23.831 1.00 0.00 C ATOM 1157 O GLN A 74 -6.854 22.757 24.067 1.00 0.00 O ATOM 1158 CB GLN A 74 -8.601 20.701 22.207 1.00 0.00 C ATOM 1159 CG GLN A 74 -9.153 20.283 20.827 1.00 0.00 C ATOM 1160 CD GLN A 74 -10.597 20.713 20.575 1.00 0.00 C ATOM 1161 OE1 GLN A 74 -11.394 20.909 21.481 1.00 0.00 O ATOM 1162 NE2 GLN A 74 -10.990 20.882 19.329 1.00 0.00 N ATOM 0 H GLN A 74 -7.030 22.089 20.938 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.503 22.664 22.281 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.610 20.267 22.339 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.238 20.283 22.986 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.518 20.708 20.050 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -9.087 19.199 20.735 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -10.337 20.722 18.562 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -11.948 21.172 19.131 1.00 0.00 H new ATOM 1171 N PRO A 75 -8.987 22.723 24.802 1.00 0.00 N ATOM 1172 CA PRO A 75 -8.661 23.125 26.173 1.00 0.00 C ATOM 1173 C PRO A 75 -7.728 22.146 26.902 1.00 0.00 C ATOM 1174 O PRO A 75 -7.809 20.929 26.702 1.00 0.00 O ATOM 1175 CB PRO A 75 -9.999 23.267 26.903 1.00 0.00 C ATOM 1176 CG PRO A 75 -11.021 22.524 26.049 1.00 0.00 C ATOM 1177 CD PRO A 75 -10.426 22.555 24.644 1.00 0.00 C ATOM 0 HA PRO A 75 -8.102 24.061 26.155 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.944 22.842 27.905 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.273 24.316 27.016 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -11.164 21.502 26.399 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -11.996 23.011 26.080 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.651 21.633 24.108 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -10.850 23.374 24.062 1.00 0.00 H new ATOM 1185 N PHE A 76 -6.866 22.676 27.781 1.00 0.00 N ATOM 1186 CA PHE A 76 -5.966 21.877 28.630 1.00 0.00 C ATOM 1187 C PHE A 76 -5.518 22.609 29.910 1.00 0.00 C ATOM 1188 O PHE A 76 -5.714 23.814 30.078 1.00 0.00 O ATOM 1189 CB PHE A 76 -4.745 21.396 27.822 1.00 0.00 C ATOM 1190 CG PHE A 76 -3.716 22.452 27.459 1.00 0.00 C ATOM 1191 CD1 PHE A 76 -3.897 23.260 26.320 1.00 0.00 C ATOM 1192 CD2 PHE A 76 -2.547 22.595 28.234 1.00 0.00 C ATOM 1193 CE1 PHE A 76 -2.918 24.202 25.961 1.00 0.00 C ATOM 1194 CE2 PHE A 76 -1.567 23.538 27.871 1.00 0.00 C ATOM 1195 CZ PHE A 76 -1.754 24.342 26.734 1.00 0.00 C ATOM 0 H PHE A 76 -6.772 23.681 27.925 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.544 21.014 28.961 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.245 20.614 28.393 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.104 20.938 26.900 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.790 23.156 25.721 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -2.403 21.979 29.109 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.061 24.821 25.087 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.672 23.643 28.466 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.004 25.067 26.455 1.00 0.00 H new ATOM 1205 N ASP A 77 -4.889 21.863 30.825 1.00 0.00 N ATOM 1206 CA ASP A 77 -4.373 22.362 32.107 1.00 0.00 C ATOM 1207 C ASP A 77 -3.043 23.128 31.929 1.00 0.00 C ATOM 1208 O ASP A 77 -1.959 22.638 32.262 1.00 0.00 O ATOM 1209 CB ASP A 77 -4.264 21.205 33.112 1.00 0.00 C ATOM 1210 CG ASP A 77 -5.641 20.640 33.492 1.00 0.00 C ATOM 1211 OD1 ASP A 77 -6.362 21.291 34.287 1.00 0.00 O ATOM 1212 OD2 ASP A 77 -6.002 19.538 33.012 1.00 0.00 O ATOM 0 H ASP A 77 -4.719 20.866 30.691 1.00 0.00 H new ATOM 0 HA ASP A 77 -5.078 23.087 32.512 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -3.652 20.411 32.685 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -3.754 21.552 34.011 1.00 0.00 H new ATOM 1217 N TYR A 78 -3.133 24.340 31.375 1.00 0.00 N ATOM 1218 CA TYR A 78 -2.001 25.243 31.145 1.00 0.00 C ATOM 1219 C TYR A 78 -1.287 25.650 32.448 1.00 0.00 C ATOM 1220 O TYR A 78 -1.925 25.979 33.456 1.00 0.00 O ATOM 1221 CB TYR A 78 -2.498 26.486 30.390 1.00 0.00 C ATOM 1222 CG TYR A 78 -1.505 27.635 30.322 1.00 0.00 C ATOM 1223 CD1 TYR A 78 -1.471 28.596 31.356 1.00 0.00 C ATOM 1224 CD2 TYR A 78 -0.606 27.741 29.242 1.00 0.00 C ATOM 1225 CE1 TYR A 78 -0.545 29.654 31.315 1.00 0.00 C ATOM 1226 CE2 TYR A 78 0.306 28.815 29.186 1.00 0.00 C ATOM 1227 CZ TYR A 78 0.333 29.777 30.215 1.00 0.00 C ATOM 1228 OH TYR A 78 1.198 30.826 30.145 1.00 0.00 O ATOM 0 H TYR A 78 -4.022 24.732 31.065 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.262 24.709 30.547 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.763 26.194 29.374 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.411 26.842 30.868 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.160 28.518 32.184 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.616 26.999 28.457 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.505 30.370 32.122 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.986 28.900 28.351 1.00 0.00 H new ATOM 0 HH TYR A 78 1.730 30.757 29.325 1.00 0.00 H new ATOM 1238 N ASP A 79 0.049 25.648 32.411 1.00 0.00 N ATOM 1239 CA ASP A 79 0.927 26.202 33.447 1.00 0.00 C ATOM 1240 C ASP A 79 1.915 27.206 32.813 1.00 0.00 C ATOM 1241 O ASP A 79 2.534 26.861 31.800 1.00 0.00 O ATOM 1242 CB ASP A 79 1.673 25.068 34.162 1.00 0.00 C ATOM 1243 CG ASP A 79 2.220 25.523 35.518 1.00 0.00 C ATOM 1244 OD1 ASP A 79 3.193 26.311 35.524 1.00 0.00 O ATOM 1245 OD2 ASP A 79 1.674 25.110 36.569 1.00 0.00 O ATOM 0 H ASP A 79 0.568 25.246 31.630 1.00 0.00 H new ATOM 0 HA ASP A 79 0.328 26.733 34.187 1.00 0.00 H new ATOM 0 HB2 ASP A 79 1.000 24.222 34.305 1.00 0.00 H new ATOM 0 HB3 ASP A 79 2.494 24.720 33.536 1.00 0.00 H new ATOM 1250 N PRO A 80 2.142 28.408 33.383 1.00 0.00 N ATOM 1251 CA PRO A 80 3.097 29.376 32.842 1.00 0.00 C ATOM 1252 C PRO A 80 4.562 28.909 32.949 1.00 0.00 C ATOM 1253 O PRO A 80 5.440 29.488 32.304 1.00 0.00 O ATOM 1254 CB PRO A 80 2.845 30.671 33.621 1.00 0.00 C ATOM 1255 CG PRO A 80 2.323 30.177 34.969 1.00 0.00 C ATOM 1256 CD PRO A 80 1.522 28.934 34.589 1.00 0.00 C ATOM 0 HA PRO A 80 2.946 29.511 31.771 1.00 0.00 H new ATOM 0 HB2 PRO A 80 3.758 31.256 33.733 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.118 31.308 33.117 1.00 0.00 H new ATOM 0 HG2 PRO A 80 3.136 29.940 35.655 1.00 0.00 H new ATOM 0 HG3 PRO A 80 1.700 30.925 35.460 1.00 0.00 H new ATOM 0 HD2 PRO A 80 1.543 28.197 35.391 1.00 0.00 H new ATOM 0 HD3 PRO A 80 0.476 29.183 34.412 1.00 0.00 H new ATOM 1264 N ASN A 81 4.829 27.861 33.738 1.00 0.00 N ATOM 1265 CA ASN A 81 6.145 27.216 33.845 1.00 0.00 C ATOM 1266 C ASN A 81 6.335 26.049 32.849 1.00 0.00 C ATOM 1267 O ASN A 81 7.473 25.647 32.599 1.00 0.00 O ATOM 1268 CB ASN A 81 6.394 26.740 35.290 1.00 0.00 C ATOM 1269 CG ASN A 81 6.199 27.822 36.339 1.00 0.00 C ATOM 1270 OD1 ASN A 81 7.112 28.556 36.694 1.00 0.00 O ATOM 1271 ND2 ASN A 81 5.003 27.949 36.867 1.00 0.00 N ATOM 0 H ASN A 81 4.122 27.428 34.332 1.00 0.00 H new ATOM 0 HA ASN A 81 6.884 27.972 33.579 1.00 0.00 H new ATOM 0 HB2 ASN A 81 5.722 25.910 35.509 1.00 0.00 H new ATOM 0 HB3 ASN A 81 7.411 26.355 35.365 1.00 0.00 H new ATOM 0 HD21 ASN A 81 4.832 28.662 37.576 1.00 0.00 H new ATOM 0 HD22 ASN A 81 4.246 27.335 36.568 1.00 0.00 H new ATOM 1278 N GLU A 82 5.258 25.492 32.276 1.00 0.00 N ATOM 1279 CA GLU A 82 5.350 24.421 31.270 1.00 0.00 C ATOM 1280 C GLU A 82 5.827 24.943 29.893 1.00 0.00 C ATOM 1281 O GLU A 82 5.571 26.094 29.525 1.00 0.00 O ATOM 1282 CB GLU A 82 4.015 23.661 31.195 1.00 0.00 C ATOM 1283 CG GLU A 82 4.061 22.367 30.372 1.00 0.00 C ATOM 1284 CD GLU A 82 5.045 21.334 30.950 1.00 0.00 C ATOM 1285 OE1 GLU A 82 6.257 21.423 30.643 1.00 0.00 O ATOM 1286 OE2 GLU A 82 4.615 20.436 31.715 1.00 0.00 O ATOM 0 H GLU A 82 4.301 25.769 32.495 1.00 0.00 H new ATOM 0 HA GLU A 82 6.119 23.716 31.585 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.692 23.420 32.208 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.260 24.321 30.768 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.063 21.930 30.332 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.347 22.602 29.347 1.00 0.00 H new ATOM 1293 N LYS A 83 6.521 24.087 29.125 1.00 0.00 N ATOM 1294 CA LYS A 83 7.092 24.387 27.796 1.00 0.00 C ATOM 1295 C LYS A 83 6.373 23.648 26.656 1.00 0.00 C ATOM 1296 O LYS A 83 5.779 22.587 26.862 1.00 0.00 O ATOM 1297 CB LYS A 83 8.628 24.187 27.771 1.00 0.00 C ATOM 1298 CG LYS A 83 9.130 22.733 27.876 1.00 0.00 C ATOM 1299 CD LYS A 83 9.239 22.228 29.324 1.00 0.00 C ATOM 1300 CE LYS A 83 9.274 20.693 29.366 1.00 0.00 C ATOM 1301 NZ LYS A 83 8.768 20.186 30.668 1.00 0.00 N ATOM 0 H LYS A 83 6.708 23.129 29.422 1.00 0.00 H new ATOM 0 HA LYS A 83 6.913 25.446 27.611 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.014 24.616 26.846 1.00 0.00 H new ATOM 0 HB3 LYS A 83 9.061 24.758 28.592 1.00 0.00 H new ATOM 0 HG2 LYS A 83 8.454 22.082 27.322 1.00 0.00 H new ATOM 0 HG3 LYS A 83 10.107 22.658 27.398 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.141 22.629 29.787 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.392 22.593 29.906 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.669 20.289 28.554 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.294 20.344 29.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.754 19.146 30.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.391 20.513 31.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.805 20.543 30.829 1.00 0.00 H new ATOM 1315 N SER A 84 6.445 24.208 25.445 1.00 0.00 N ATOM 1316 CA SER A 84 5.810 23.667 24.233 1.00 0.00 C ATOM 1317 C SER A 84 6.760 22.805 23.389 1.00 0.00 C ATOM 1318 O SER A 84 7.969 23.051 23.342 1.00 0.00 O ATOM 1319 CB SER A 84 5.267 24.817 23.381 1.00 0.00 C ATOM 1320 OG SER A 84 4.573 24.314 22.257 1.00 0.00 O ATOM 0 H SER A 84 6.959 25.072 25.273 1.00 0.00 H new ATOM 0 HA SER A 84 4.999 23.017 24.562 1.00 0.00 H new ATOM 0 HB2 SER A 84 4.601 25.438 23.980 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.088 25.454 23.054 1.00 0.00 H new ATOM 0 HG SER A 84 4.174 25.058 21.759 1.00 0.00 H new ATOM 1326 N LYS A 85 6.188 21.814 22.687 1.00 0.00 N ATOM 1327 CA LYS A 85 6.859 21.003 21.647 1.00 0.00 C ATOM 1328 C LYS A 85 5.981 20.729 20.410 1.00 0.00 C ATOM 1329 O LYS A 85 6.392 20.012 19.497 1.00 0.00 O ATOM 1330 CB LYS A 85 7.489 19.732 22.258 1.00 0.00 C ATOM 1331 CG LYS A 85 6.556 18.550 22.584 1.00 0.00 C ATOM 1332 CD LYS A 85 5.455 18.867 23.607 1.00 0.00 C ATOM 1333 CE LYS A 85 4.798 17.600 24.185 1.00 0.00 C ATOM 1334 NZ LYS A 85 4.117 16.770 23.149 1.00 0.00 N ATOM 0 H LYS A 85 5.215 21.543 22.829 1.00 0.00 H new ATOM 0 HA LYS A 85 7.678 21.605 21.253 1.00 0.00 H new ATOM 0 HB2 LYS A 85 8.254 19.374 21.569 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.998 20.020 23.178 1.00 0.00 H new ATOM 0 HG2 LYS A 85 6.088 18.208 21.661 1.00 0.00 H new ATOM 0 HG3 LYS A 85 7.157 17.723 22.962 1.00 0.00 H new ATOM 0 HD2 LYS A 85 5.879 19.455 24.421 1.00 0.00 H new ATOM 0 HD3 LYS A 85 4.691 19.484 23.133 1.00 0.00 H new ATOM 0 HE2 LYS A 85 5.559 16.998 24.682 1.00 0.00 H new ATOM 0 HE3 LYS A 85 4.072 17.889 24.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 3.694 15.932 23.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.371 17.331 22.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.811 16.468 22.435 1.00 0.00 H new ATOM 1348 N HIS A 86 4.772 21.294 20.381 1.00 0.00 N ATOM 1349 CA HIS A 86 3.774 21.131 19.318 1.00 0.00 C ATOM 1350 C HIS A 86 4.076 22.039 18.116 1.00 0.00 C ATOM 1351 O HIS A 86 4.597 23.145 18.287 1.00 0.00 O ATOM 1352 CB HIS A 86 2.383 21.430 19.893 1.00 0.00 C ATOM 1353 CG HIS A 86 2.052 20.687 21.166 1.00 0.00 C ATOM 1354 ND1 HIS A 86 2.426 21.083 22.455 1.00 0.00 N ATOM 1355 CD2 HIS A 86 1.308 19.548 21.252 1.00 0.00 C ATOM 1356 CE1 HIS A 86 1.862 20.195 23.290 1.00 0.00 C ATOM 1357 NE2 HIS A 86 1.193 19.257 22.596 1.00 0.00 N ATOM 0 H HIS A 86 4.446 21.905 21.130 1.00 0.00 H new ATOM 0 HA HIS A 86 3.808 20.104 18.955 1.00 0.00 H new ATOM 0 HB2 HIS A 86 2.306 22.501 20.083 1.00 0.00 H new ATOM 0 HB3 HIS A 86 1.634 21.185 19.140 1.00 0.00 H new ATOM 0 HD2 HIS A 86 0.891 18.985 20.430 1.00 0.00 H new ATOM 0 HE1 HIS A 86 1.935 20.229 24.367 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.687 18.466 22.995 1.00 0.00 H new ATOM 1365 N LYS A 87 3.745 21.580 16.902 1.00 0.00 N ATOM 1366 CA LYS A 87 4.034 22.287 15.640 1.00 0.00 C ATOM 1367 C LYS A 87 2.899 22.184 14.610 1.00 0.00 C ATOM 1368 O LYS A 87 2.071 21.275 14.644 1.00 0.00 O ATOM 1369 CB LYS A 87 5.372 21.810 15.023 1.00 0.00 C ATOM 1370 CG LYS A 87 6.596 22.004 15.940 1.00 0.00 C ATOM 1371 CD LYS A 87 7.930 21.807 15.196 1.00 0.00 C ATOM 1372 CE LYS A 87 9.098 21.775 16.198 1.00 0.00 C ATOM 1373 NZ LYS A 87 10.386 21.393 15.554 1.00 0.00 N ATOM 0 H LYS A 87 3.261 20.693 16.763 1.00 0.00 H new ATOM 0 HA LYS A 87 4.121 23.341 15.903 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.286 20.753 14.770 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.542 22.349 14.091 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.568 23.005 16.370 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.539 21.299 16.770 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.904 20.878 14.627 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.078 22.615 14.480 1.00 0.00 H new ATOM 0 HE2 LYS A 87 9.203 22.756 16.661 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.870 21.068 16.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 11.142 21.385 16.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.297 20.446 15.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.620 22.081 14.810 1.00 0.00 H new ATOM 1387 N PHE A 88 2.936 23.099 13.648 1.00 0.00 N ATOM 1388 CA PHE A 88 2.136 23.140 12.424 1.00 0.00 C ATOM 1389 C PHE A 88 3.044 23.137 11.195 1.00 0.00 C ATOM 1390 O PHE A 88 4.184 23.603 11.246 1.00 0.00 O ATOM 1391 CB PHE A 88 1.245 24.391 12.412 1.00 0.00 C ATOM 1392 CG PHE A 88 -0.062 24.183 13.133 1.00 0.00 C ATOM 1393 CD1 PHE A 88 -1.176 23.687 12.433 1.00 0.00 C ATOM 1394 CD2 PHE A 88 -0.154 24.450 14.509 1.00 0.00 C ATOM 1395 CE1 PHE A 88 -2.384 23.458 13.109 1.00 0.00 C ATOM 1396 CE2 PHE A 88 -1.358 24.208 15.188 1.00 0.00 C ATOM 1397 CZ PHE A 88 -2.468 23.709 14.488 1.00 0.00 C ATOM 0 H PHE A 88 3.574 23.893 13.706 1.00 0.00 H new ATOM 0 HA PHE A 88 1.502 22.254 12.396 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.782 25.219 12.875 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.044 24.679 11.380 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.102 23.482 11.375 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.700 24.841 15.043 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.245 23.090 12.571 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.431 24.405 16.247 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.392 23.517 15.013 1.00 0.00 H new ATOM 1407 N MET A 89 2.516 22.660 10.071 1.00 0.00 N ATOM 1408 CA MET A 89 3.150 22.774 8.758 1.00 0.00 C ATOM 1409 C MET A 89 2.100 23.166 7.716 1.00 0.00 C ATOM 1410 O MET A 89 0.993 22.629 7.719 1.00 0.00 O ATOM 1411 CB MET A 89 3.873 21.461 8.416 1.00 0.00 C ATOM 1412 CG MET A 89 4.734 21.556 7.149 1.00 0.00 C ATOM 1413 SD MET A 89 5.398 19.971 6.563 1.00 0.00 S ATOM 1414 CE MET A 89 6.460 19.509 7.962 1.00 0.00 C ATOM 0 H MET A 89 1.619 22.174 10.045 1.00 0.00 H new ATOM 0 HA MET A 89 3.905 23.560 8.764 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.505 21.173 9.256 1.00 0.00 H new ATOM 0 HB3 MET A 89 3.134 20.670 8.287 1.00 0.00 H new ATOM 0 HG2 MET A 89 4.137 22.001 6.353 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.565 22.234 7.341 1.00 0.00 H new ATOM 0 HE1 MET A 89 7.035 18.620 7.704 1.00 0.00 H new ATOM 0 HE2 MET A 89 7.142 20.329 8.188 1.00 0.00 H new ATOM 0 HE3 MET A 89 5.842 19.301 8.835 1.00 0.00 H new ATOM 1424 N VAL A 90 2.445 24.091 6.821 1.00 0.00 N ATOM 1425 CA VAL A 90 1.596 24.521 5.699 1.00 0.00 C ATOM 1426 C VAL A 90 2.315 24.186 4.397 1.00 0.00 C ATOM 1427 O VAL A 90 3.429 24.658 4.180 1.00 0.00 O ATOM 1428 CB VAL A 90 1.246 26.020 5.795 1.00 0.00 C ATOM 1429 CG1 VAL A 90 0.363 26.478 4.627 1.00 0.00 C ATOM 1430 CG2 VAL A 90 0.495 26.326 7.098 1.00 0.00 C ATOM 0 H VAL A 90 3.342 24.576 6.852 1.00 0.00 H new ATOM 0 HA VAL A 90 0.645 23.989 5.733 1.00 0.00 H new ATOM 0 HB VAL A 90 2.194 26.556 5.766 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.140 27.540 4.734 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.888 26.310 3.687 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.567 25.910 4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.260 27.389 7.141 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.429 25.748 7.130 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.120 26.058 7.950 1.00 0.00 H new ATOM 1440 N GLN A 91 1.685 23.376 3.548 1.00 0.00 N ATOM 1441 CA GLN A 91 2.211 22.882 2.271 1.00 0.00 C ATOM 1442 C GLN A 91 1.435 23.501 1.101 1.00 0.00 C ATOM 1443 O GLN A 91 0.217 23.636 1.180 1.00 0.00 O ATOM 1444 CB GLN A 91 2.122 21.345 2.275 1.00 0.00 C ATOM 1445 CG GLN A 91 2.728 20.681 1.026 1.00 0.00 C ATOM 1446 CD GLN A 91 2.586 19.160 1.070 1.00 0.00 C ATOM 1447 OE1 GLN A 91 1.762 18.561 0.394 1.00 0.00 O ATOM 1448 NE2 GLN A 91 3.372 18.476 1.876 1.00 0.00 N ATOM 0 H GLN A 91 0.746 23.027 3.739 1.00 0.00 H new ATOM 0 HA GLN A 91 3.254 23.174 2.146 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.631 20.964 3.160 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.075 21.052 2.358 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.236 21.067 0.133 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.782 20.946 0.948 1.00 0.00 H new ATOM 0 HE21 GLN A 91 4.064 18.962 2.446 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.288 17.461 1.930 1.00 0.00 H new ATOM 1457 N THR A 92 2.105 23.858 0.007 1.00 0.00 N ATOM 1458 CA THR A 92 1.484 24.463 -1.186 1.00 0.00 C ATOM 1459 C THR A 92 2.063 23.953 -2.503 1.00 0.00 C ATOM 1460 O THR A 92 3.221 23.538 -2.578 1.00 0.00 O ATOM 1461 CB THR A 92 1.556 25.993 -1.174 1.00 0.00 C ATOM 1462 OG1 THR A 92 2.834 26.462 -0.832 1.00 0.00 O ATOM 1463 CG2 THR A 92 0.549 26.606 -0.209 1.00 0.00 C ATOM 0 H THR A 92 3.114 23.736 -0.084 1.00 0.00 H new ATOM 0 HA THR A 92 0.441 24.150 -1.129 1.00 0.00 H new ATOM 0 HB THR A 92 1.319 26.300 -2.192 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.868 26.649 0.130 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.636 27.692 -0.234 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.460 26.316 -0.503 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.749 26.249 0.801 1.00 0.00 H new ATOM 1471 N ILE A 93 1.245 24.007 -3.559 1.00 0.00 N ATOM 1472 CA ILE A 93 1.657 23.715 -4.945 1.00 0.00 C ATOM 1473 C ILE A 93 0.835 24.539 -5.946 1.00 0.00 C ATOM 1474 O ILE A 93 -0.343 24.809 -5.712 1.00 0.00 O ATOM 1475 CB ILE A 93 1.582 22.190 -5.194 1.00 0.00 C ATOM 1476 CG1 ILE A 93 2.557 21.700 -6.289 1.00 0.00 C ATOM 1477 CG2 ILE A 93 0.141 21.683 -5.375 1.00 0.00 C ATOM 1478 CD1 ILE A 93 2.006 21.585 -7.711 1.00 0.00 C ATOM 0 H ILE A 93 0.260 24.259 -3.478 1.00 0.00 H new ATOM 0 HA ILE A 93 2.693 24.016 -5.097 1.00 0.00 H new ATOM 0 HB ILE A 93 1.938 21.722 -4.276 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.410 22.378 -6.311 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.935 20.722 -5.992 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.153 20.607 -5.546 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.437 21.901 -4.477 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.315 22.181 -6.230 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.792 21.231 -8.378 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.175 20.880 -7.723 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.658 22.562 -8.046 1.00 0.00 H new ATOM 1490 N PHE A 94 1.444 24.981 -7.051 1.00 0.00 N ATOM 1491 CA PHE A 94 0.745 25.792 -8.057 1.00 0.00 C ATOM 1492 C PHE A 94 -0.414 25.021 -8.712 1.00 0.00 C ATOM 1493 O PHE A 94 -0.264 23.883 -9.158 1.00 0.00 O ATOM 1494 CB PHE A 94 1.719 26.339 -9.105 1.00 0.00 C ATOM 1495 CG PHE A 94 2.537 27.525 -8.628 1.00 0.00 C ATOM 1496 CD1 PHE A 94 1.905 28.764 -8.403 1.00 0.00 C ATOM 1497 CD2 PHE A 94 3.926 27.407 -8.433 1.00 0.00 C ATOM 1498 CE1 PHE A 94 2.658 29.883 -8.006 1.00 0.00 C ATOM 1499 CE2 PHE A 94 4.679 28.527 -8.039 1.00 0.00 C ATOM 1500 CZ PHE A 94 4.048 29.766 -7.837 1.00 0.00 C ATOM 0 H PHE A 94 2.421 24.791 -7.273 1.00 0.00 H new ATOM 0 HA PHE A 94 0.307 26.644 -7.537 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.397 25.541 -9.407 1.00 0.00 H new ATOM 0 HB3 PHE A 94 1.156 26.632 -9.991 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.837 28.855 -8.536 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.414 26.456 -8.586 1.00 0.00 H new ATOM 0 HE1 PHE A 94 2.169 30.830 -7.831 1.00 0.00 H new ATOM 0 HE2 PHE A 94 5.745 28.435 -7.891 1.00 0.00 H new ATOM 0 HZ PHE A 94 4.632 30.629 -7.552 1.00 0.00 H new ATOM 1510 N ALA A 95 -1.576 25.667 -8.773 1.00 0.00 N ATOM 1511 CA ALA A 95 -2.814 25.103 -9.306 1.00 0.00 C ATOM 1512 C ALA A 95 -2.932 25.308 -10.832 1.00 0.00 C ATOM 1513 O ALA A 95 -2.326 26.241 -11.376 1.00 0.00 O ATOM 1514 CB ALA A 95 -3.987 25.749 -8.554 1.00 0.00 C ATOM 0 H ALA A 95 -1.686 26.626 -8.443 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.822 24.024 -9.152 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.927 25.346 -8.931 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.901 25.532 -7.489 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.967 26.828 -8.707 1.00 0.00 H new ATOM 1520 N PRO A 96 -3.726 24.479 -11.539 1.00 0.00 N ATOM 1521 CA PRO A 96 -4.075 24.730 -12.941 1.00 0.00 C ATOM 1522 C PRO A 96 -4.920 26.022 -13.075 1.00 0.00 C ATOM 1523 O PRO A 96 -5.512 26.475 -12.088 1.00 0.00 O ATOM 1524 CB PRO A 96 -4.833 23.474 -13.391 1.00 0.00 C ATOM 1525 CG PRO A 96 -5.482 22.983 -12.101 1.00 0.00 C ATOM 1526 CD PRO A 96 -4.435 23.306 -11.038 1.00 0.00 C ATOM 0 HA PRO A 96 -3.201 24.900 -13.570 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.576 23.703 -14.155 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -4.161 22.727 -13.814 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -6.425 23.493 -11.905 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -5.699 21.916 -12.141 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.903 23.511 -10.075 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -3.754 22.468 -10.890 1.00 0.00 H new ATOM 1599 N MET A 102 -9.740 20.089 -6.191 1.00 0.00 N ATOM 1600 CA MET A 102 -8.485 20.444 -5.507 1.00 0.00 C ATOM 1601 C MET A 102 -7.655 19.231 -5.081 1.00 0.00 C ATOM 1602 O MET A 102 -6.503 19.392 -4.706 1.00 0.00 O ATOM 1603 CB MET A 102 -8.728 21.392 -4.320 1.00 0.00 C ATOM 1604 CG MET A 102 -9.505 20.784 -3.146 1.00 0.00 C ATOM 1605 SD MET A 102 -9.707 21.948 -1.768 1.00 0.00 S ATOM 1606 CE MET A 102 -10.573 20.877 -0.587 1.00 0.00 C ATOM 0 HA MET A 102 -7.891 20.974 -6.251 1.00 0.00 H new ATOM 0 HB2 MET A 102 -7.764 21.743 -3.953 1.00 0.00 H new ATOM 0 HB3 MET A 102 -9.270 22.267 -4.679 1.00 0.00 H new ATOM 0 HG2 MET A 102 -10.487 20.462 -3.492 1.00 0.00 H new ATOM 0 HG3 MET A 102 -8.985 19.894 -2.792 1.00 0.00 H new ATOM 0 HE1 MET A 102 -10.779 21.435 0.327 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.512 20.538 -1.024 1.00 0.00 H new ATOM 0 HE3 MET A 102 -9.949 20.014 -0.353 1.00 0.00 H new ATOM 1616 N GLU A 103 -8.209 18.017 -5.146 1.00 0.00 N ATOM 1617 CA GLU A 103 -7.490 16.778 -4.814 1.00 0.00 C ATOM 1618 C GLU A 103 -6.524 16.396 -5.943 1.00 0.00 C ATOM 1619 O GLU A 103 -5.422 15.908 -5.697 1.00 0.00 O ATOM 1620 CB GLU A 103 -8.515 15.663 -4.542 1.00 0.00 C ATOM 1621 CG GLU A 103 -7.865 14.362 -4.052 1.00 0.00 C ATOM 1622 CD GLU A 103 -8.931 13.306 -3.711 1.00 0.00 C ATOM 1623 OE1 GLU A 103 -9.322 12.518 -4.608 1.00 0.00 O ATOM 1624 OE2 GLU A 103 -9.382 13.249 -2.539 1.00 0.00 O ATOM 0 H GLU A 103 -9.176 17.862 -5.432 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.889 16.928 -3.917 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -9.231 16.009 -3.797 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.076 15.462 -5.454 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.196 13.974 -4.820 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -7.255 14.565 -3.172 1.00 0.00 H new ATOM 1631 N ALA A 104 -6.909 16.679 -7.191 1.00 0.00 N ATOM 1632 CA ALA A 104 -6.195 16.227 -8.382 1.00 0.00 C ATOM 1633 C ALA A 104 -4.819 16.888 -8.539 1.00 0.00 C ATOM 1634 O ALA A 104 -3.886 16.237 -9.014 1.00 0.00 O ATOM 1635 CB ALA A 104 -7.079 16.508 -9.596 1.00 0.00 C ATOM 0 H ALA A 104 -7.737 17.236 -7.402 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.998 15.159 -8.288 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.569 16.179 -10.501 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.020 15.968 -9.494 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -7.280 17.577 -9.660 1.00 0.00 H new ATOM 1641 N VAL A 105 -4.661 18.138 -8.075 1.00 0.00 N ATOM 1642 CA VAL A 105 -3.366 18.836 -8.157 1.00 0.00 C ATOM 1643 C VAL A 105 -2.282 18.104 -7.356 1.00 0.00 C ATOM 1644 O VAL A 105 -1.130 18.040 -7.765 1.00 0.00 O ATOM 1645 CB VAL A 105 -3.469 20.311 -7.736 1.00 0.00 C ATOM 1646 CG1 VAL A 105 -3.489 20.508 -6.220 1.00 0.00 C ATOM 1647 CG2 VAL A 105 -2.292 21.113 -8.290 1.00 0.00 C ATOM 0 H VAL A 105 -5.407 18.683 -7.642 1.00 0.00 H new ATOM 0 HA VAL A 105 -3.071 18.826 -9.206 1.00 0.00 H new ATOM 0 HB VAL A 105 -4.416 20.663 -8.144 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -3.563 21.571 -5.992 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -4.347 19.986 -5.797 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.571 20.108 -5.789 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -2.384 22.154 -7.981 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.358 20.701 -7.906 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -2.293 21.056 -9.379 1.00 0.00 H new ATOM 1657 N TRP A 106 -2.656 17.489 -6.233 1.00 0.00 N ATOM 1658 CA TRP A 106 -1.743 16.746 -5.365 1.00 0.00 C ATOM 1659 C TRP A 106 -1.378 15.372 -5.941 1.00 0.00 C ATOM 1660 O TRP A 106 -0.295 14.855 -5.663 1.00 0.00 O ATOM 1661 CB TRP A 106 -2.416 16.608 -4.004 1.00 0.00 C ATOM 1662 CG TRP A 106 -2.801 17.917 -3.377 1.00 0.00 C ATOM 1663 CD1 TRP A 106 -4.062 18.379 -3.243 1.00 0.00 C ATOM 1664 CD2 TRP A 106 -1.944 18.999 -2.896 1.00 0.00 C ATOM 1665 NE1 TRP A 106 -4.054 19.632 -2.669 1.00 0.00 N ATOM 1666 CE2 TRP A 106 -2.771 20.064 -2.427 1.00 0.00 C ATOM 1667 CE3 TRP A 106 -0.551 19.205 -2.845 1.00 0.00 C ATOM 1668 CZ2 TRP A 106 -2.252 21.238 -1.872 1.00 0.00 C ATOM 1669 CZ3 TRP A 106 -0.016 20.401 -2.331 1.00 0.00 C ATOM 1670 CH2 TRP A 106 -0.860 21.399 -1.812 1.00 0.00 C ATOM 0 H TRP A 106 -3.619 17.494 -5.896 1.00 0.00 H new ATOM 0 HA TRP A 106 -0.802 17.290 -5.278 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -3.309 15.992 -4.113 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -1.743 16.078 -3.330 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -4.951 17.843 -3.543 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -4.893 20.170 -2.451 1.00 0.00 H new ATOM 0 HE3 TRP A 106 0.115 18.435 -3.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -2.911 22.007 -1.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 1.053 20.554 -2.335 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -0.437 22.288 -1.368 1.00 0.00 H new ATOM 1681 N LYS A 107 -2.265 14.797 -6.766 1.00 0.00 N ATOM 1682 CA LYS A 107 -2.036 13.530 -7.478 1.00 0.00 C ATOM 1683 C LYS A 107 -1.152 13.701 -8.719 1.00 0.00 C ATOM 1684 O LYS A 107 -0.388 12.795 -9.054 1.00 0.00 O ATOM 1685 CB LYS A 107 -3.388 12.883 -7.830 1.00 0.00 C ATOM 1686 CG LYS A 107 -4.318 12.642 -6.625 1.00 0.00 C ATOM 1687 CD LYS A 107 -3.734 11.706 -5.555 1.00 0.00 C ATOM 1688 CE LYS A 107 -4.667 11.670 -4.337 1.00 0.00 C ATOM 1689 NZ LYS A 107 -4.211 10.679 -3.325 1.00 0.00 N ATOM 0 H LYS A 107 -3.179 15.207 -6.961 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.486 12.866 -6.812 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.904 13.520 -8.549 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -3.202 11.930 -8.325 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.552 13.601 -6.164 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.258 12.223 -6.984 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -3.613 10.702 -5.963 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.744 12.051 -5.257 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.711 12.660 -3.883 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.678 11.422 -4.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.865 10.682 -2.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.193 9.731 -3.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.256 10.930 -2.999 1.00 0.00 H new ATOM 1703 N GLU A 108 -1.208 14.865 -9.373 1.00 0.00 N ATOM 1704 CA GLU A 108 -0.331 15.215 -10.504 1.00 0.00 C ATOM 1705 C GLU A 108 1.024 15.814 -10.085 1.00 0.00 C ATOM 1706 O GLU A 108 2.010 15.723 -10.823 1.00 0.00 O ATOM 1707 CB GLU A 108 -1.074 16.150 -11.464 1.00 0.00 C ATOM 1708 CG GLU A 108 -1.258 17.590 -11.001 1.00 0.00 C ATOM 1709 CD GLU A 108 -2.005 18.424 -12.059 1.00 0.00 C ATOM 1710 OE1 GLU A 108 -1.355 18.906 -13.020 1.00 0.00 O ATOM 1711 OE2 GLU A 108 -3.241 18.611 -11.940 1.00 0.00 O ATOM 0 H GLU A 108 -1.870 15.602 -9.132 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.086 14.281 -11.010 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.537 16.162 -12.413 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.059 15.726 -11.660 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.814 17.605 -10.063 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.284 18.038 -10.802 1.00 0.00 H new ATOM 1718 N ALA A 109 1.074 16.418 -8.897 1.00 0.00 N ATOM 1719 CA ALA A 109 2.264 17.008 -8.295 1.00 0.00 C ATOM 1720 C ALA A 109 3.316 15.944 -7.973 1.00 0.00 C ATOM 1721 O ALA A 109 3.000 14.822 -7.556 1.00 0.00 O ATOM 1722 CB ALA A 109 1.901 17.798 -7.030 1.00 0.00 C ATOM 0 H ALA A 109 0.249 16.512 -8.305 1.00 0.00 H new ATOM 0 HA ALA A 109 2.693 17.695 -9.025 1.00 0.00 H new ATOM 0 HB1 ALA A 109 2.804 18.229 -6.598 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.205 18.597 -7.287 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.435 17.130 -6.305 1.00 0.00 H new ATOM 1728 N LYS A 110 4.583 16.336 -8.123 1.00 0.00 N ATOM 1729 CA LYS A 110 5.747 15.531 -7.763 1.00 0.00 C ATOM 1730 C LYS A 110 6.412 16.058 -6.489 1.00 0.00 C ATOM 1731 O LYS A 110 6.308 17.251 -6.207 1.00 0.00 O ATOM 1732 CB LYS A 110 6.702 15.486 -8.975 1.00 0.00 C ATOM 1733 CG LYS A 110 6.169 14.541 -10.061 1.00 0.00 C ATOM 1734 CD LYS A 110 7.135 14.457 -11.248 1.00 0.00 C ATOM 1735 CE LYS A 110 6.594 13.461 -12.282 1.00 0.00 C ATOM 1736 NZ LYS A 110 7.499 13.343 -13.457 1.00 0.00 N ATOM 0 H LYS A 110 4.832 17.247 -8.509 1.00 0.00 H new ATOM 0 HA LYS A 110 5.445 14.510 -7.528 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.821 16.488 -9.386 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.689 15.155 -8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.019 13.547 -9.640 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.196 14.891 -10.405 1.00 0.00 H new ATOM 0 HD2 LYS A 110 7.254 15.440 -11.703 1.00 0.00 H new ATOM 0 HD3 LYS A 110 8.121 14.142 -10.906 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.472 12.483 -11.816 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.606 13.781 -12.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.101 12.662 -14.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.595 14.271 -13.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.434 13.013 -13.143 1.00 0.00 H new ATOM 1750 N PRO A 111 7.153 15.214 -5.752 1.00 0.00 N ATOM 1751 CA PRO A 111 7.805 15.578 -4.486 1.00 0.00 C ATOM 1752 C PRO A 111 8.837 16.714 -4.610 1.00 0.00 C ATOM 1753 O PRO A 111 9.197 17.336 -3.609 1.00 0.00 O ATOM 1754 CB PRO A 111 8.418 14.275 -3.956 1.00 0.00 C ATOM 1755 CG PRO A 111 8.554 13.391 -5.194 1.00 0.00 C ATOM 1756 CD PRO A 111 7.370 13.806 -6.046 1.00 0.00 C ATOM 0 HA PRO A 111 7.076 15.996 -3.792 1.00 0.00 H new ATOM 0 HB2 PRO A 111 9.385 14.453 -3.486 1.00 0.00 H new ATOM 0 HB3 PRO A 111 7.779 13.812 -3.205 1.00 0.00 H new ATOM 0 HG2 PRO A 111 9.500 13.561 -5.708 1.00 0.00 H new ATOM 0 HG3 PRO A 111 8.515 12.332 -4.939 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.577 13.654 -7.105 1.00 0.00 H new ATOM 0 HD3 PRO A 111 6.487 13.214 -5.805 1.00 0.00 H new ATOM 1764 N ASP A 112 9.273 17.021 -5.835 1.00 0.00 N ATOM 1765 CA ASP A 112 10.179 18.132 -6.159 1.00 0.00 C ATOM 1766 C ASP A 112 9.459 19.469 -6.462 1.00 0.00 C ATOM 1767 O ASP A 112 10.087 20.530 -6.457 1.00 0.00 O ATOM 1768 CB ASP A 112 11.083 17.693 -7.321 1.00 0.00 C ATOM 1769 CG ASP A 112 12.279 18.639 -7.531 1.00 0.00 C ATOM 1770 OD1 ASP A 112 13.103 18.792 -6.596 1.00 0.00 O ATOM 1771 OD2 ASP A 112 12.434 19.188 -8.650 1.00 0.00 O ATOM 0 H ASP A 112 8.997 16.486 -6.658 1.00 0.00 H new ATOM 0 HA ASP A 112 10.776 18.348 -5.273 1.00 0.00 H new ATOM 0 HB2 ASP A 112 11.451 16.685 -7.129 1.00 0.00 H new ATOM 0 HB3 ASP A 112 10.495 17.648 -8.237 1.00 0.00 H new ATOM 1776 N GLU A 113 8.141 19.443 -6.696 1.00 0.00 N ATOM 1777 CA GLU A 113 7.302 20.619 -6.997 1.00 0.00 C ATOM 1778 C GLU A 113 6.587 21.190 -5.754 1.00 0.00 C ATOM 1779 O GLU A 113 6.080 22.313 -5.786 1.00 0.00 O ATOM 1780 CB GLU A 113 6.247 20.249 -8.058 1.00 0.00 C ATOM 1781 CG GLU A 113 6.825 19.762 -9.397 1.00 0.00 C ATOM 1782 CD GLU A 113 7.703 20.819 -10.099 1.00 0.00 C ATOM 1783 OE1 GLU A 113 7.278 21.993 -10.226 1.00 0.00 O ATOM 1784 OE2 GLU A 113 8.816 20.474 -10.565 1.00 0.00 O ATOM 0 H GLU A 113 7.607 18.574 -6.681 1.00 0.00 H new ATOM 0 HA GLU A 113 7.974 21.393 -7.369 1.00 0.00 H new ATOM 0 HB2 GLU A 113 5.601 19.470 -7.652 1.00 0.00 H new ATOM 0 HB3 GLU A 113 5.618 21.120 -8.244 1.00 0.00 H new ATOM 0 HG2 GLU A 113 7.417 18.863 -9.225 1.00 0.00 H new ATOM 0 HG3 GLU A 113 6.006 19.482 -10.059 1.00 0.00 H new ATOM 1791 N LEU A 114 6.532 20.420 -4.661 1.00 0.00 N ATOM 1792 CA LEU A 114 5.824 20.761 -3.425 1.00 0.00 C ATOM 1793 C LEU A 114 6.658 21.746 -2.589 1.00 0.00 C ATOM 1794 O LEU A 114 7.859 21.539 -2.389 1.00 0.00 O ATOM 1795 CB LEU A 114 5.524 19.468 -2.635 1.00 0.00 C ATOM 1796 CG LEU A 114 4.607 18.468 -3.369 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.625 17.095 -2.701 1.00 0.00 C ATOM 1798 CD2 LEU A 114 3.156 18.927 -3.398 1.00 0.00 C ATOM 0 H LEU A 114 6.995 19.512 -4.613 1.00 0.00 H new ATOM 0 HA LEU A 114 4.879 21.249 -3.665 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.467 18.973 -2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.061 19.737 -1.685 1.00 0.00 H new ATOM 0 HG LEU A 114 5.001 18.411 -4.384 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.968 16.417 -3.245 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.641 16.700 -2.709 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.279 17.187 -1.671 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.551 18.189 -3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 114 2.788 19.035 -2.378 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.088 19.886 -3.912 1.00 0.00 H new ATOM 1810 N MET A 115 6.015 22.794 -2.069 1.00 0.00 N ATOM 1811 CA MET A 115 6.619 23.780 -1.164 1.00 0.00 C ATOM 1812 C MET A 115 6.015 23.664 0.242 1.00 0.00 C ATOM 1813 O MET A 115 4.846 23.305 0.372 1.00 0.00 O ATOM 1814 CB MET A 115 6.380 25.202 -1.692 1.00 0.00 C ATOM 1815 CG MET A 115 7.001 25.501 -3.057 1.00 0.00 C ATOM 1816 SD MET A 115 6.449 27.070 -3.792 1.00 0.00 S ATOM 1817 CE MET A 115 4.793 26.589 -4.366 1.00 0.00 C ATOM 0 H MET A 115 5.034 22.987 -2.270 1.00 0.00 H new ATOM 0 HA MET A 115 7.689 23.581 -1.115 1.00 0.00 H new ATOM 0 HB2 MET A 115 5.305 25.374 -1.754 1.00 0.00 H new ATOM 0 HB3 MET A 115 6.775 25.913 -0.967 1.00 0.00 H new ATOM 0 HG2 MET A 115 8.086 25.521 -2.955 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.760 24.687 -3.741 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.376 27.386 -4.982 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.863 25.674 -4.955 1.00 0.00 H new ATOM 0 HE3 MET A 115 4.145 26.418 -3.506 1.00 0.00 H new ATOM 1827 N ASP A 116 6.760 24.001 1.297 1.00 0.00 N ATOM 1828 CA ASP A 116 6.225 24.046 2.668 1.00 0.00 C ATOM 1829 C ASP A 116 6.904 25.078 3.594 1.00 0.00 C ATOM 1830 O ASP A 116 7.962 25.629 3.280 1.00 0.00 O ATOM 1831 CB ASP A 116 6.238 22.641 3.297 1.00 0.00 C ATOM 1832 CG ASP A 116 7.662 22.118 3.555 1.00 0.00 C ATOM 1833 OD1 ASP A 116 8.254 22.463 4.606 1.00 0.00 O ATOM 1834 OD2 ASP A 116 8.187 21.345 2.717 1.00 0.00 O ATOM 0 H ASP A 116 7.747 24.250 1.230 1.00 0.00 H new ATOM 0 HA ASP A 116 5.197 24.394 2.570 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.688 22.664 4.238 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.715 21.948 2.638 1.00 0.00 H new ATOM 1839 N SER A 117 6.267 25.311 4.748 1.00 0.00 N ATOM 1840 CA SER A 117 6.765 26.074 5.906 1.00 0.00 C ATOM 1841 C SER A 117 6.328 25.370 7.192 1.00 0.00 C ATOM 1842 O SER A 117 5.211 24.853 7.238 1.00 0.00 O ATOM 1843 CB SER A 117 6.188 27.499 5.939 1.00 0.00 C ATOM 1844 OG SER A 117 6.602 28.260 4.823 1.00 0.00 O ATOM 0 H SER A 117 5.328 24.949 4.911 1.00 0.00 H new ATOM 0 HA SER A 117 7.850 26.130 5.823 1.00 0.00 H new ATOM 0 HB2 SER A 117 5.099 27.450 5.961 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.503 27.997 6.856 1.00 0.00 H new ATOM 0 HG SER A 117 6.214 29.158 4.878 1.00 0.00 H new ATOM 1850 N LYS A 118 7.156 25.396 8.246 1.00 0.00 N ATOM 1851 CA LYS A 118 6.820 24.860 9.583 1.00 0.00 C ATOM 1852 C LYS A 118 6.889 25.927 10.685 1.00 0.00 C ATOM 1853 O LYS A 118 7.689 26.861 10.607 1.00 0.00 O ATOM 1854 CB LYS A 118 7.616 23.574 9.894 1.00 0.00 C ATOM 1855 CG LYS A 118 9.049 23.735 10.437 1.00 0.00 C ATOM 1856 CD LYS A 118 9.994 24.536 9.525 1.00 0.00 C ATOM 1857 CE LYS A 118 11.453 24.515 10.012 1.00 0.00 C ATOM 1858 NZ LYS A 118 12.126 23.207 9.766 1.00 0.00 N ATOM 0 H LYS A 118 8.093 25.795 8.198 1.00 0.00 H new ATOM 0 HA LYS A 118 5.772 24.561 9.563 1.00 0.00 H new ATOM 0 HB2 LYS A 118 7.046 22.993 10.619 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.668 22.982 8.980 1.00 0.00 H new ATOM 0 HG2 LYS A 118 9.002 24.225 11.409 1.00 0.00 H new ATOM 0 HG3 LYS A 118 9.475 22.745 10.600 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.947 24.130 8.515 1.00 0.00 H new ATOM 0 HD3 LYS A 118 9.649 25.569 9.470 1.00 0.00 H new ATOM 0 HE2 LYS A 118 12.010 25.305 9.509 1.00 0.00 H new ATOM 0 HE3 LYS A 118 11.478 24.736 11.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 13.105 23.250 10.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 11.613 22.453 10.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 12.129 23.005 8.746 1.00 0.00 H new ATOM 1872 N LEU A 119 6.014 25.800 11.681 1.00 0.00 N ATOM 1873 CA LEU A 119 5.760 26.789 12.735 1.00 0.00 C ATOM 1874 C LEU A 119 5.515 26.076 14.073 1.00 0.00 C ATOM 1875 O LEU A 119 4.953 24.983 14.079 1.00 0.00 O ATOM 1876 CB LEU A 119 4.523 27.642 12.355 1.00 0.00 C ATOM 1877 CG LEU A 119 4.664 28.534 11.100 1.00 0.00 C ATOM 1878 CD1 LEU A 119 4.143 27.855 9.828 1.00 0.00 C ATOM 1879 CD2 LEU A 119 3.833 29.812 11.240 1.00 0.00 C ATOM 0 H LEU A 119 5.434 24.967 11.783 1.00 0.00 H new ATOM 0 HA LEU A 119 6.628 27.440 12.837 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.678 26.970 12.204 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.275 28.281 13.203 1.00 0.00 H new ATOM 0 HG LEU A 119 5.732 28.737 11.019 1.00 0.00 H new ATOM 0 HD11 LEU A 119 4.267 28.528 8.979 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.704 26.938 9.649 1.00 0.00 H new ATOM 0 HD13 LEU A 119 3.086 27.616 9.950 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.950 30.422 10.344 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.782 29.551 11.367 1.00 0.00 H new ATOM 0 HD23 LEU A 119 4.174 30.375 12.109 1.00 0.00 H new ATOM 1891 N ARG A 120 5.885 26.669 15.212 1.00 0.00 N ATOM 1892 CA ARG A 120 5.615 26.100 16.553 1.00 0.00 C ATOM 1893 C ARG A 120 4.311 26.654 17.134 1.00 0.00 C ATOM 1894 O ARG A 120 3.854 27.715 16.715 1.00 0.00 O ATOM 1895 CB ARG A 120 6.786 26.385 17.511 1.00 0.00 C ATOM 1896 CG ARG A 120 8.170 26.011 16.940 1.00 0.00 C ATOM 1897 CD ARG A 120 9.302 26.582 17.801 1.00 0.00 C ATOM 1898 NE ARG A 120 9.343 28.055 17.692 1.00 0.00 N ATOM 1899 CZ ARG A 120 10.169 28.882 18.300 1.00 0.00 C ATOM 1900 NH1 ARG A 120 11.109 28.465 19.103 1.00 0.00 N ATOM 1901 NH2 ARG A 120 10.052 30.162 18.106 1.00 0.00 N ATOM 0 H ARG A 120 6.382 27.559 15.239 1.00 0.00 H new ATOM 0 HA ARG A 120 5.509 25.021 16.441 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.784 27.445 17.766 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.626 25.834 18.438 1.00 0.00 H new ATOM 0 HG2 ARG A 120 8.263 24.926 16.887 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.259 26.389 15.921 1.00 0.00 H new ATOM 0 HD2 ARG A 120 9.157 26.292 18.842 1.00 0.00 H new ATOM 0 HD3 ARG A 120 10.256 26.161 17.483 1.00 0.00 H new ATOM 0 HE ARG A 120 8.652 28.481 17.075 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.224 27.467 19.279 1.00 0.00 H new ATOM 0 HH12 ARG A 120 11.729 29.137 19.555 1.00 0.00 H new ATOM 0 HH21 ARG A 120 9.325 30.520 17.487 1.00 0.00 H new ATOM 0 HH22 ARG A 120 10.688 30.809 18.573 1.00 0.00 H new ATOM 1915 N CYS A 121 3.737 25.973 18.121 1.00 0.00 N ATOM 1916 CA CYS A 121 2.621 26.466 18.918 1.00 0.00 C ATOM 1917 C CYS A 121 3.154 27.136 20.191 1.00 0.00 C ATOM 1918 O CYS A 121 3.929 26.531 20.934 1.00 0.00 O ATOM 1919 CB CYS A 121 1.691 25.302 19.271 1.00 0.00 C ATOM 1920 SG CYS A 121 1.202 24.389 17.779 1.00 0.00 S ATOM 0 H CYS A 121 4.044 25.040 18.395 1.00 0.00 H new ATOM 0 HA CYS A 121 2.058 27.203 18.346 1.00 0.00 H new ATOM 0 HB2 CYS A 121 2.192 24.629 19.966 1.00 0.00 H new ATOM 0 HB3 CYS A 121 0.803 25.681 19.778 1.00 0.00 H new ATOM 0 HG CYS A 121 0.164 23.652 18.042 1.00 0.00 H new ATOM 1926 N VAL A 122 2.718 28.364 20.459 1.00 0.00 N ATOM 1927 CA VAL A 122 3.065 29.139 21.664 1.00 0.00 C ATOM 1928 C VAL A 122 1.836 29.285 22.543 1.00 0.00 C ATOM 1929 O VAL A 122 0.766 29.583 22.023 1.00 0.00 O ATOM 1930 CB VAL A 122 3.608 30.525 21.282 1.00 0.00 C ATOM 1931 CG1 VAL A 122 3.901 31.391 22.510 1.00 0.00 C ATOM 1932 CG2 VAL A 122 4.883 30.373 20.456 1.00 0.00 C ATOM 0 H VAL A 122 2.094 28.869 19.830 1.00 0.00 H new ATOM 0 HA VAL A 122 3.843 28.608 22.212 1.00 0.00 H new ATOM 0 HB VAL A 122 2.836 31.025 20.697 1.00 0.00 H new ATOM 0 HG11 VAL A 122 4.282 32.360 22.189 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.984 31.533 23.082 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.645 30.897 23.134 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.263 31.359 20.188 1.00 0.00 H new ATOM 0 HG22 VAL A 122 5.634 29.841 21.040 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.664 29.810 19.549 1.00 0.00 H new ATOM 1942 N PHE A 123 1.988 29.139 23.858 1.00 0.00 N ATOM 1943 CA PHE A 123 0.885 29.225 24.817 1.00 0.00 C ATOM 1944 C PHE A 123 1.050 30.430 25.757 1.00 0.00 C ATOM 1945 O PHE A 123 2.107 30.604 26.370 1.00 0.00 O ATOM 1946 CB PHE A 123 0.795 27.911 25.595 1.00 0.00 C ATOM 1947 CG PHE A 123 0.708 26.681 24.713 1.00 0.00 C ATOM 1948 CD1 PHE A 123 -0.397 26.506 23.861 1.00 0.00 C ATOM 1949 CD2 PHE A 123 1.740 25.723 24.724 1.00 0.00 C ATOM 1950 CE1 PHE A 123 -0.497 25.359 23.059 1.00 0.00 C ATOM 1951 CE2 PHE A 123 1.634 24.569 23.930 1.00 0.00 C ATOM 1952 CZ PHE A 123 0.511 24.380 23.107 1.00 0.00 C ATOM 0 H PHE A 123 2.892 28.955 24.294 1.00 0.00 H new ATOM 0 HA PHE A 123 -0.048 29.381 24.276 1.00 0.00 H new ATOM 0 HB2 PHE A 123 1.668 27.822 26.241 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -0.080 27.943 26.244 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.172 27.257 23.824 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.612 25.875 25.342 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.347 25.228 22.406 1.00 0.00 H new ATOM 0 HE2 PHE A 123 2.417 23.826 23.952 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.422 23.483 22.512 1.00 0.00 H new ATOM 1962 N GLU A 124 0.010 31.258 25.882 1.00 0.00 N ATOM 1963 CA GLU A 124 0.004 32.483 26.692 1.00 0.00 C ATOM 1964 C GLU A 124 -1.302 32.658 27.484 1.00 0.00 C ATOM 1965 O GLU A 124 -2.398 32.453 26.960 1.00 0.00 O ATOM 1966 CB GLU A 124 0.207 33.720 25.797 1.00 0.00 C ATOM 1967 CG GLU A 124 1.602 33.836 25.163 1.00 0.00 C ATOM 1968 CD GLU A 124 2.750 34.011 26.182 1.00 0.00 C ATOM 1969 OE1 GLU A 124 2.506 34.412 27.348 1.00 0.00 O ATOM 1970 OE2 GLU A 124 3.927 33.799 25.801 1.00 0.00 O ATOM 0 H GLU A 124 -0.878 31.091 25.409 1.00 0.00 H new ATOM 0 HA GLU A 124 0.825 32.388 27.402 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.538 33.701 25.001 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.017 34.615 26.390 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.793 32.943 24.568 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.608 34.684 24.478 1.00 0.00 H new ATOM 1977 N MET A 125 -1.187 33.129 28.728 1.00 0.00 N ATOM 1978 CA MET A 125 -2.321 33.528 29.570 1.00 0.00 C ATOM 1979 C MET A 125 -2.673 35.021 29.374 1.00 0.00 C ATOM 1980 O MET A 125 -1.776 35.826 29.093 1.00 0.00 O ATOM 1981 CB MET A 125 -2.044 33.170 31.040 1.00 0.00 C ATOM 1982 CG MET A 125 -0.809 33.857 31.639 1.00 0.00 C ATOM 1983 SD MET A 125 -0.386 33.273 33.303 1.00 0.00 S ATOM 1984 CE MET A 125 1.118 34.244 33.593 1.00 0.00 C ATOM 0 H MET A 125 -0.285 33.247 29.189 1.00 0.00 H new ATOM 0 HA MET A 125 -3.203 32.968 29.260 1.00 0.00 H new ATOM 0 HB2 MET A 125 -2.917 33.435 31.636 1.00 0.00 H new ATOM 0 HB3 MET A 125 -1.919 32.090 31.121 1.00 0.00 H new ATOM 0 HG2 MET A 125 0.043 33.694 30.979 1.00 0.00 H new ATOM 0 HG3 MET A 125 -0.984 34.932 31.674 1.00 0.00 H new ATOM 0 HE1 MET A 125 1.518 34.010 34.580 1.00 0.00 H new ATOM 0 HE2 MET A 125 1.861 34.000 32.833 1.00 0.00 H new ATOM 0 HE3 MET A 125 0.881 35.307 33.541 1.00 0.00 H new ATOM 2301 N GLU B 358 5.792 13.766 15.311 1.00 0.00 N ATOM 2302 CA GLU B 358 4.758 13.048 14.558 1.00 0.00 C ATOM 2303 C GLU B 358 3.595 13.931 14.053 1.00 0.00 C ATOM 2304 O GLU B 358 2.556 14.083 14.700 1.00 0.00 O ATOM 2305 CB GLU B 358 4.331 11.784 15.319 1.00 0.00 C ATOM 2306 CG GLU B 358 3.510 10.852 14.425 1.00 0.00 C ATOM 2307 CD GLU B 358 3.307 9.474 15.083 1.00 0.00 C ATOM 2308 OE1 GLU B 358 2.595 9.379 16.113 1.00 0.00 O ATOM 2309 OE2 GLU B 358 3.862 8.470 14.572 1.00 0.00 O ATOM 0 HA GLU B 358 5.206 12.721 13.620 1.00 0.00 H new ATOM 0 HB2 GLU B 358 5.214 11.259 15.682 1.00 0.00 H new ATOM 0 HB3 GLU B 358 3.744 12.064 16.194 1.00 0.00 H new ATOM 0 HG2 GLU B 358 2.540 11.305 14.219 1.00 0.00 H new ATOM 0 HG3 GLU B 358 4.014 10.728 13.466 1.00 0.00 H new ATOM 2316 N PHE B 359 3.753 14.485 12.844 1.00 0.00 N ATOM 2317 CA PHE B 359 2.695 15.236 12.159 1.00 0.00 C ATOM 2318 C PHE B 359 1.549 14.335 11.656 1.00 0.00 C ATOM 2319 O PHE B 359 1.760 13.220 11.173 1.00 0.00 O ATOM 2320 CB PHE B 359 3.273 16.050 10.990 1.00 0.00 C ATOM 2321 CG PHE B 359 4.084 17.270 11.385 1.00 0.00 C ATOM 2322 CD1 PHE B 359 3.425 18.448 11.790 1.00 0.00 C ATOM 2323 CD2 PHE B 359 5.488 17.252 11.301 1.00 0.00 C ATOM 2324 CE1 PHE B 359 4.169 19.605 12.081 1.00 0.00 C ATOM 2325 CE2 PHE B 359 6.233 18.407 11.603 1.00 0.00 C ATOM 2326 CZ PHE B 359 5.570 19.590 11.980 1.00 0.00 C ATOM 0 H PHE B 359 4.621 14.424 12.312 1.00 0.00 H new ATOM 0 HA PHE B 359 2.272 15.914 12.900 1.00 0.00 H new ATOM 0 HB2 PHE B 359 3.904 15.394 10.390 1.00 0.00 H new ATOM 0 HB3 PHE B 359 2.450 16.373 10.352 1.00 0.00 H new ATOM 0 HD1 PHE B 359 2.349 18.462 11.877 1.00 0.00 H new ATOM 0 HD2 PHE B 359 5.997 16.347 11.003 1.00 0.00 H new ATOM 0 HE1 PHE B 359 3.661 20.509 12.383 1.00 0.00 H new ATOM 0 HE2 PHE B 359 7.311 18.386 11.546 1.00 0.00 H new ATOM 0 HZ PHE B 359 6.137 20.484 12.191 1.00 0.00 H new ATOM 2336 N PHE B 360 0.334 14.880 11.725 1.00 0.00 N ATOM 2337 CA PHE B 360 -0.938 14.339 11.244 1.00 0.00 C ATOM 2338 C PHE B 360 -1.641 15.365 10.334 1.00 0.00 C ATOM 2339 O PHE B 360 -1.367 16.565 10.394 1.00 0.00 O ATOM 2340 CB PHE B 360 -1.808 13.981 12.460 1.00 0.00 C ATOM 2341 CG PHE B 360 -1.597 12.574 12.992 1.00 0.00 C ATOM 2342 CD1 PHE B 360 -0.469 12.245 13.774 1.00 0.00 C ATOM 2343 CD2 PHE B 360 -2.558 11.584 12.709 1.00 0.00 C ATOM 2344 CE1 PHE B 360 -0.339 10.948 14.300 1.00 0.00 C ATOM 2345 CE2 PHE B 360 -2.411 10.282 13.218 1.00 0.00 C ATOM 2346 CZ PHE B 360 -1.305 9.965 14.023 1.00 0.00 C ATOM 0 H PHE B 360 0.203 15.794 12.158 1.00 0.00 H new ATOM 0 HA PHE B 360 -0.767 13.440 10.652 1.00 0.00 H new ATOM 0 HB2 PHE B 360 -1.603 14.693 13.260 1.00 0.00 H new ATOM 0 HB3 PHE B 360 -2.857 14.100 12.188 1.00 0.00 H new ATOM 0 HD1 PHE B 360 0.291 12.987 13.968 1.00 0.00 H new ATOM 0 HD2 PHE B 360 -3.414 11.827 12.097 1.00 0.00 H new ATOM 0 HE1 PHE B 360 0.510 10.705 14.922 1.00 0.00 H new ATOM 0 HE2 PHE B 360 -3.148 9.526 12.990 1.00 0.00 H new ATOM 0 HZ PHE B 360 -1.197 8.970 14.428 1.00 0.00 H new ATOM 2356 N ASP B 361 -2.596 14.916 9.519 1.00 0.00 N ATOM 2357 CA ASP B 361 -3.227 15.701 8.437 1.00 0.00 C ATOM 2358 C ASP B 361 -4.328 16.695 8.885 1.00 0.00 C ATOM 2359 O ASP B 361 -5.230 17.016 8.111 1.00 0.00 O ATOM 2360 CB ASP B 361 -3.682 14.745 7.323 1.00 0.00 C ATOM 2361 CG ASP B 361 -2.497 13.988 6.709 1.00 0.00 C ATOM 2362 OD1 ASP B 361 -1.611 14.648 6.113 1.00 0.00 O ATOM 2363 OD2 ASP B 361 -2.445 12.740 6.819 1.00 0.00 O ATOM 0 H ASP B 361 -2.969 13.969 9.589 1.00 0.00 H new ATOM 0 HA ASP B 361 -2.464 16.374 8.047 1.00 0.00 H new ATOM 0 HB2 ASP B 361 -4.401 14.032 7.726 1.00 0.00 H new ATOM 0 HB3 ASP B 361 -4.196 15.310 6.545 1.00 0.00 H new ATOM 2368 N ALA B 362 -4.248 17.174 10.135 1.00 0.00 N ATOM 2369 CA ALA B 362 -5.037 18.272 10.718 1.00 0.00 C ATOM 2370 C ALA B 362 -6.546 18.277 10.350 1.00 0.00 C ATOM 2371 O ALA B 362 -6.979 19.077 9.510 1.00 0.00 O ATOM 2372 CB ALA B 362 -4.324 19.587 10.378 1.00 0.00 C ATOM 0 H ALA B 362 -3.590 16.782 10.809 1.00 0.00 H new ATOM 0 HA ALA B 362 -5.074 18.127 11.798 1.00 0.00 H new ATOM 0 HB1 ALA B 362 -4.884 20.423 10.796 1.00 0.00 H new ATOM 0 HB2 ALA B 362 -3.319 19.576 10.800 1.00 0.00 H new ATOM 0 HB3 ALA B 362 -4.261 19.698 9.295 1.00 0.00 H new ATOM 2378 N PRO B 363 -7.366 17.404 10.972 1.00 0.00 N ATOM 2379 CA PRO B 363 -8.789 17.270 10.652 1.00 0.00 C ATOM 2380 C PRO B 363 -9.594 18.541 10.973 1.00 0.00 C ATOM 2381 O PRO B 363 -9.208 19.353 11.815 1.00 0.00 O ATOM 2382 CB PRO B 363 -9.275 16.061 11.460 1.00 0.00 C ATOM 2383 CG PRO B 363 -8.337 16.047 12.667 1.00 0.00 C ATOM 2384 CD PRO B 363 -7.011 16.505 12.065 1.00 0.00 C ATOM 0 HA PRO B 363 -8.936 17.125 9.582 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -10.317 16.171 11.761 1.00 0.00 H new ATOM 0 HB3 PRO B 363 -9.205 15.138 10.885 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -8.679 16.720 13.454 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -8.260 15.053 13.109 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -6.398 17.015 12.809 1.00 0.00 H new ATOM 0 HD3 PRO B 363 -6.431 15.656 11.702 1.00 0.00 H new ATOM 2392 N GLU B 364 -10.748 18.703 10.324 1.00 0.00 N ATOM 2393 CA GLU B 364 -11.619 19.872 10.506 1.00 0.00 C ATOM 2394 C GLU B 364 -12.223 19.973 11.907 1.00 0.00 C ATOM 2395 O GLU B 364 -12.398 21.083 12.413 1.00 0.00 O ATOM 2396 CB GLU B 364 -12.710 19.918 9.434 1.00 0.00 C ATOM 2397 CG GLU B 364 -13.667 18.715 9.420 1.00 0.00 C ATOM 2398 CD GLU B 364 -14.694 18.850 8.282 1.00 0.00 C ATOM 2399 OE1 GLU B 364 -15.780 19.441 8.505 1.00 0.00 O ATOM 2400 OE2 GLU B 364 -14.429 18.356 7.159 1.00 0.00 O ATOM 0 H GLU B 364 -11.109 18.025 9.653 1.00 0.00 H new ATOM 0 HA GLU B 364 -10.976 20.745 10.391 1.00 0.00 H new ATOM 0 HB2 GLU B 364 -13.296 20.826 9.574 1.00 0.00 H new ATOM 0 HB3 GLU B 364 -12.233 19.994 8.457 1.00 0.00 H new ATOM 0 HG2 GLU B 364 -13.099 17.793 9.296 1.00 0.00 H new ATOM 0 HG3 GLU B 364 -14.184 18.644 10.377 1.00 0.00 H new ATOM 2407 N ILE B 365 -12.508 18.829 12.540 1.00 0.00 N ATOM 2408 CA ILE B 365 -12.878 18.753 13.953 1.00 0.00 C ATOM 2409 C ILE B 365 -12.566 17.376 14.564 1.00 0.00 C ATOM 2410 O ILE B 365 -12.306 16.403 13.852 1.00 0.00 O ATOM 2411 CB ILE B 365 -14.342 19.200 14.173 1.00 0.00 C ATOM 2412 CG1 ILE B 365 -14.450 19.893 15.554 1.00 0.00 C ATOM 2413 CG2 ILE B 365 -15.357 18.051 14.006 1.00 0.00 C ATOM 2414 CD1 ILE B 365 -15.717 20.739 15.715 1.00 0.00 C ATOM 0 H ILE B 365 -12.487 17.920 12.077 1.00 0.00 H new ATOM 0 HA ILE B 365 -12.252 19.460 14.497 1.00 0.00 H new ATOM 0 HB ILE B 365 -14.608 19.914 13.393 1.00 0.00 H new ATOM 0 HG12 ILE B 365 -14.428 19.134 16.336 1.00 0.00 H new ATOM 0 HG13 ILE B 365 -13.577 20.528 15.702 1.00 0.00 H new ATOM 0 HG21 ILE B 365 -16.366 18.429 14.173 1.00 0.00 H new ATOM 0 HG22 ILE B 365 -15.284 17.645 12.997 1.00 0.00 H new ATOM 0 HG23 ILE B 365 -15.140 17.265 14.730 1.00 0.00 H new ATOM 0 HD11 ILE B 365 -15.727 21.195 16.705 1.00 0.00 H new ATOM 0 HD12 ILE B 365 -15.731 21.521 14.956 1.00 0.00 H new ATOM 0 HD13 ILE B 365 -16.595 20.104 15.599 1.00 0.00 H new ATOM 2426 N ILE B 366 -12.616 17.304 15.895 1.00 0.00 N ATOM 2427 CA ILE B 366 -12.455 16.099 16.714 1.00 0.00 C ATOM 2428 C ILE B 366 -13.614 16.018 17.730 1.00 0.00 C ATOM 2429 O ILE B 366 -14.026 17.035 18.289 1.00 0.00 O ATOM 2430 CB ILE B 366 -11.035 16.109 17.324 1.00 0.00 C ATOM 2431 CG1 ILE B 366 -10.603 14.722 17.851 1.00 0.00 C ATOM 2432 CG2 ILE B 366 -10.860 17.263 18.331 1.00 0.00 C ATOM 2433 CD1 ILE B 366 -10.865 14.457 19.333 1.00 0.00 C ATOM 0 H ILE B 366 -12.780 18.134 16.465 1.00 0.00 H new ATOM 0 HA ILE B 366 -12.524 15.181 16.130 1.00 0.00 H new ATOM 0 HB ILE B 366 -10.330 16.318 16.520 1.00 0.00 H new ATOM 0 HG12 ILE B 366 -11.118 13.958 17.269 1.00 0.00 H new ATOM 0 HG13 ILE B 366 -9.536 14.600 17.664 1.00 0.00 H new ATOM 0 HG21 ILE B 366 -9.850 17.239 18.740 1.00 0.00 H new ATOM 0 HG22 ILE B 366 -11.025 18.215 17.826 1.00 0.00 H new ATOM 0 HG23 ILE B 366 -11.582 17.152 19.140 1.00 0.00 H new ATOM 0 HD11 ILE B 366 -10.522 13.455 19.590 1.00 0.00 H new ATOM 0 HD12 ILE B 366 -10.327 15.190 19.934 1.00 0.00 H new ATOM 0 HD13 ILE B 366 -11.933 14.537 19.534 1.00 0.00 H new