USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1045 hydrogens (27 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 18 ASN : amide:sc= -0.217 K(o=1,f=-0.35!) USER MOD Set 1.2: A 101 SER OG : rot -44:sc= 1.24 USER MOD Set 2.1: A 14 LYS NZ :NH3+ 151:sc= -0.194 (180deg=-0.798) USER MOD Set 2.2: A 133 GLN : amide:sc= -0.0761 K(o=-0.27,f=-0.85) USER MOD Single : A 3 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot -84:sc= 1.24 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 153:sc= -0.0522 (180deg=-0.371) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 41 MET CE :methyl -153:sc= 0 (180deg=-0.00475) USER MOD Single : A 43 ASN : amide:sc= 0.281 K(o=0.28,f=-2.3!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -68:sc= 1.24 USER MOD Single : A 56 THR OG1 : rot 170:sc= -1.37 USER MOD Single : A 59 GLN : amide:sc= -0.158 K(o=-0.16,f=-1.3!) USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.0137 K(o=-0.014,f=-1.1) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0.106 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot -9:sc= -0.886 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.918 X(o=-0.92,f=-1.3) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.33 USER MOD Single : A 108 ASN : amide:sc= -0.106 K(o=-0.11,f=-1.8!) USER MOD Single : A 109 MET CE :methyl 166:sc= -2.43 (180deg=-3.15!) USER MOD Single : A 110 TYR OH : rot 30:sc= -0.793! USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= -0.268 K(o=-0.27,f=-1.7!) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 C1 MYR A 1 1.330 13.489 2.629 1.00 14.05 C HETATM 2 O1 MYR A 1 2.069 13.477 3.613 1.00 72.02 O HETATM 3 C2 MYR A 1 0.535 12.224 2.302 1.00 64.25 C HETATM 4 C3 MYR A 1 1.402 10.969 2.048 1.00 63.40 C HETATM 5 C4 MYR A 1 0.549 9.737 1.693 1.00 40.03 C HETATM 6 C5 MYR A 1 1.361 8.430 1.757 1.00 60.32 C HETATM 7 C6 MYR A 1 2.526 8.418 0.749 1.00 60.22 C HETATM 8 C7 MYR A 1 3.177 7.027 0.628 1.00 61.10 C HETATM 9 C8 MYR A 1 2.926 6.384 -0.749 1.00 32.30 C HETATM 10 C9 MYR A 1 1.822 5.310 -0.697 1.00 42.34 C HETATM 11 C10 MYR A 1 1.151 5.096 -2.070 1.00 63.40 C HETATM 12 C11 MYR A 1 0.300 3.812 -2.167 1.00 65.33 C HETATM 13 C12 MYR A 1 1.091 2.507 -1.940 1.00 63.51 C HETATM 14 C13 MYR A 1 0.892 1.944 -0.522 1.00 33.10 C HETATM 15 C14 MYR A 1 0.892 0.409 -0.512 1.00 14.12 C HETATM 0 H143 MYR A 1 0.082 0.041 -1.142 1.00 14.12 H new HETATM 0 H142 MYR A 1 1.845 0.043 -0.894 1.00 14.12 H new HETATM 0 H141 MYR A 1 0.749 0.052 0.508 1.00 14.12 H new HETATM 0 H132 MYR A 1 1.685 2.312 0.129 1.00 33.10 H new HETATM 0 H131 MYR A 1 -0.050 2.310 -0.115 1.00 33.10 H new HETATM 0 H122 MYR A 1 0.777 1.762 -2.672 1.00 63.51 H new HETATM 0 H121 MYR A 1 2.152 2.693 -2.109 1.00 63.51 H new HETATM 0 H112 MYR A 1 -0.505 3.867 -1.434 1.00 65.33 H new HETATM 0 H111 MYR A 1 -0.167 3.773 -3.151 1.00 65.33 H new HETATM 0 H102 MYR A 1 0.518 5.955 -2.290 1.00 63.40 H new HETATM 0 H101 MYR A 1 1.924 5.065 -2.838 1.00 63.40 H new HETATM 0 H92 MYR A 1 2.250 4.368 -0.353 1.00 42.34 H new HETATM 0 H91 MYR A 1 1.067 5.603 0.033 1.00 42.34 H new HETATM 0 H82 MYR A 1 2.645 7.158 -1.464 1.00 32.30 H new HETATM 0 H81 MYR A 1 3.850 5.935 -1.113 1.00 32.30 H new HETATM 0 H72 MYR A 1 4.250 7.114 0.796 1.00 61.10 H new HETATM 0 H71 MYR A 1 2.784 6.375 1.408 1.00 61.10 H new HETATM 0 H62 MYR A 1 2.161 8.733 -0.229 1.00 60.22 H new HETATM 0 H61 MYR A 1 3.278 9.144 1.057 1.00 60.22 H new HETATM 0 H52 MYR A 1 1.754 8.297 2.765 1.00 60.32 H new HETATM 0 H51 MYR A 1 0.702 7.585 1.558 1.00 60.32 H new HETATM 0 H42 MYR A 1 -0.296 9.672 2.379 1.00 40.03 H new HETATM 0 H41 MYR A 1 0.137 9.858 0.691 1.00 40.03 H new HETATM 0 H32 MYR A 1 2.102 11.171 1.237 1.00 63.40 H new HETATM 0 H31 MYR A 1 1.997 10.754 2.936 1.00 63.40 H new HETATM 0 H22 MYR A 1 -0.149 12.017 3.125 1.00 64.25 H new HETATM 0 H21 MYR A 1 -0.076 12.412 1.419 1.00 64.25 H new ATOM 43 N GLY A 2 1.198 14.548 1.836 1.00 4.12 N ATOM 44 CA GLY A 2 1.939 15.768 2.099 1.00 14.33 C ATOM 45 C GLY A 2 2.357 16.479 0.827 1.00 34.42 C ATOM 46 O GLY A 2 3.545 16.692 0.589 1.00 14.35 O ATOM 0 HA2 GLY A 2 1.326 16.439 2.702 1.00 14.33 H new ATOM 0 HA3 GLY A 2 2.826 15.531 2.687 1.00 14.33 H new ATOM 50 N ASN A 3 1.377 16.844 0.006 1.00 4.02 N ATOM 51 CA ASN A 3 1.650 17.532 -1.250 1.00 42.52 C ATOM 52 C ASN A 3 2.577 16.704 -2.135 1.00 34.53 C ATOM 53 O ASN A 3 3.696 17.115 -2.437 1.00 53.34 O ATOM 54 CB ASN A 3 2.276 18.902 -0.980 1.00 11.32 C ATOM 55 CG ASN A 3 1.233 19.981 -0.758 1.00 71.34 C ATOM 56 OD1 ASN A 3 0.936 20.766 -1.658 1.00 54.43 O ATOM 57 ND2 ASN A 3 0.672 20.023 0.444 1.00 32.15 N ATOM 0 H ASN A 3 0.388 16.675 0.188 1.00 4.02 H new ATOM 0 HA ASN A 3 0.703 17.668 -1.773 1.00 42.52 H new ATOM 0 HB2 ASN A 3 2.920 18.838 -0.103 1.00 11.32 H new ATOM 0 HB3 ASN A 3 2.910 19.181 -1.822 1.00 11.32 H new ATOM 0 HD21 ASN A 3 -0.037 20.727 0.652 1.00 32.15 H new ATOM 0 HD22 ASN A 3 0.949 19.352 1.160 1.00 32.15 H new ATOM 64 N GLY A 4 2.101 15.532 -2.547 1.00 1.13 N ATOM 65 CA GLY A 4 2.899 14.664 -3.393 1.00 32.23 C ATOM 66 C GLY A 4 3.483 13.490 -2.632 1.00 2.33 C ATOM 67 O GLY A 4 3.121 13.246 -1.481 1.00 64.12 O ATOM 0 H GLY A 4 1.178 15.169 -2.310 1.00 1.13 H new ATOM 0 HA2 GLY A 4 2.282 14.292 -4.211 1.00 32.23 H new ATOM 0 HA3 GLY A 4 3.708 15.242 -3.841 1.00 32.23 H new ATOM 71 N ALA A 5 4.389 12.761 -3.276 1.00 15.11 N ATOM 72 CA ALA A 5 5.024 11.607 -2.652 1.00 42.13 C ATOM 73 C ALA A 5 6.493 11.508 -3.050 1.00 71.33 C ATOM 74 O ALA A 5 6.824 11.481 -4.236 1.00 22.25 O ATOM 75 CB ALA A 5 4.286 10.331 -3.028 1.00 31.20 C ATOM 0 H ALA A 5 4.699 12.949 -4.229 1.00 15.11 H new ATOM 0 HA ALA A 5 4.975 11.736 -1.571 1.00 42.13 H new ATOM 0 HB1 ALA A 5 4.771 9.477 -2.555 1.00 31.20 H new ATOM 0 HB2 ALA A 5 3.252 10.395 -2.688 1.00 31.20 H new ATOM 0 HB3 ALA A 5 4.305 10.205 -4.111 1.00 31.20 H new ATOM 81 N SER A 6 7.369 11.454 -2.052 1.00 43.15 N ATOM 82 CA SER A 6 8.804 11.362 -2.299 1.00 14.30 C ATOM 83 C SER A 6 9.523 10.753 -1.100 1.00 20.44 C ATOM 84 O SER A 6 9.977 9.609 -1.149 1.00 53.35 O ATOM 85 CB SER A 6 9.380 12.746 -2.604 1.00 53.31 C ATOM 86 OG SER A 6 10.787 12.690 -2.761 1.00 71.31 O ATOM 0 H SER A 6 7.111 11.472 -1.065 1.00 43.15 H new ATOM 0 HA SER A 6 8.959 10.714 -3.161 1.00 14.30 H new ATOM 0 HB2 SER A 6 8.925 13.140 -3.513 1.00 53.31 H new ATOM 0 HB3 SER A 6 9.128 13.434 -1.797 1.00 53.31 H new ATOM 0 HG SER A 6 11.130 13.587 -2.957 1.00 71.31 H new ATOM 92 N ARG A 7 9.623 11.525 -0.023 1.00 21.35 N ATOM 93 CA ARG A 7 10.288 11.062 1.190 1.00 41.52 C ATOM 94 C ARG A 7 9.550 9.872 1.795 1.00 54.13 C ATOM 95 O ARG A 7 10.166 8.882 2.189 1.00 33.21 O ATOM 96 CB ARG A 7 10.375 12.196 2.213 1.00 11.13 C ATOM 97 CG ARG A 7 11.761 12.809 2.327 1.00 41.20 C ATOM 98 CD ARG A 7 12.534 12.225 3.499 1.00 11.44 C ATOM 99 NE ARG A 7 13.458 13.194 4.082 1.00 4.22 N ATOM 100 CZ ARG A 7 14.394 12.875 4.969 1.00 2.23 C ATOM 101 NH1 ARG A 7 14.529 11.620 5.373 1.00 22.41 N ATOM 102 NH2 ARG A 7 15.198 13.813 5.454 1.00 11.20 N ATOM 0 H ARG A 7 9.252 12.474 0.035 1.00 21.35 H new ATOM 0 HA ARG A 7 11.296 10.744 0.923 1.00 41.52 H new ATOM 0 HB2 ARG A 7 9.664 12.975 1.940 1.00 11.13 H new ATOM 0 HB3 ARG A 7 10.073 11.817 3.189 1.00 11.13 H new ATOM 0 HG2 ARG A 7 12.313 12.636 1.403 1.00 41.20 H new ATOM 0 HG3 ARG A 7 11.674 13.889 2.449 1.00 41.20 H new ATOM 0 HD2 ARG A 7 11.834 11.887 4.263 1.00 11.44 H new ATOM 0 HD3 ARG A 7 13.090 11.349 3.166 1.00 11.44 H new ATOM 0 HE ARG A 7 13.380 14.169 3.792 1.00 4.22 H new ATOM 0 HH11 ARG A 7 13.913 10.896 5.003 1.00 22.41 H new ATOM 0 HH12 ARG A 7 15.249 11.378 6.054 1.00 22.41 H new ATOM 0 HH21 ARG A 7 15.098 14.780 5.146 1.00 11.20 H new ATOM 0 HH22 ARG A 7 15.916 13.567 6.135 1.00 11.20 H new ATOM 116 N ASP A 8 8.227 9.977 1.865 1.00 22.40 N ATOM 117 CA ASP A 8 7.404 8.909 2.421 1.00 23.13 C ATOM 118 C ASP A 8 7.647 7.596 1.684 1.00 72.40 C ATOM 119 O ASP A 8 7.650 6.524 2.290 1.00 43.02 O ATOM 120 CB ASP A 8 5.924 9.285 2.345 1.00 33.15 C ATOM 121 CG ASP A 8 5.115 8.683 3.478 1.00 52.22 C ATOM 122 OD1 ASP A 8 4.607 7.555 3.309 1.00 12.22 O ATOM 123 OD2 ASP A 8 4.989 9.341 4.532 1.00 21.23 O ATOM 0 H ASP A 8 7.702 10.790 1.544 1.00 22.40 H new ATOM 0 HA ASP A 8 7.683 8.775 3.466 1.00 23.13 H new ATOM 0 HB2 ASP A 8 5.826 10.370 2.369 1.00 33.15 H new ATOM 0 HB3 ASP A 8 5.515 8.949 1.392 1.00 33.15 H new ATOM 128 N TRP A 9 7.848 7.687 0.374 1.00 11.15 N ATOM 129 CA TRP A 9 8.090 6.506 -0.446 1.00 30.53 C ATOM 130 C TRP A 9 9.467 5.916 -0.159 1.00 14.43 C ATOM 131 O TRP A 9 9.615 4.703 -0.008 1.00 41.52 O ATOM 132 CB TRP A 9 7.971 6.856 -1.930 1.00 0.53 C ATOM 133 CG TRP A 9 8.373 5.735 -2.839 1.00 45.33 C ATOM 134 CD1 TRP A 9 9.643 5.403 -3.219 1.00 34.04 C ATOM 135 CD2 TRP A 9 7.502 4.801 -3.485 1.00 71.20 C ATOM 136 NE1 TRP A 9 9.613 4.318 -4.061 1.00 55.03 N ATOM 137 CE2 TRP A 9 8.311 3.929 -4.240 1.00 3.22 C ATOM 138 CE3 TRP A 9 6.117 4.614 -3.498 1.00 21.05 C ATOM 139 CZ2 TRP A 9 7.780 2.890 -4.998 1.00 74.23 C ATOM 140 CZ3 TRP A 9 5.591 3.582 -4.251 1.00 50.00 C ATOM 141 CH2 TRP A 9 6.421 2.730 -4.992 1.00 55.13 C ATOM 0 H TRP A 9 7.848 8.566 -0.143 1.00 11.15 H new ATOM 0 HA TRP A 9 7.336 5.760 -0.195 1.00 30.53 H new ATOM 0 HB2 TRP A 9 6.941 7.139 -2.148 1.00 0.53 H new ATOM 0 HB3 TRP A 9 8.592 7.726 -2.142 1.00 0.53 H new ATOM 0 HD1 TRP A 9 10.538 5.918 -2.904 1.00 34.04 H new ATOM 0 HE1 TRP A 9 10.428 3.874 -4.484 1.00 55.03 H new ATOM 0 HE3 TRP A 9 5.469 5.265 -2.929 1.00 21.05 H new ATOM 0 HZ2 TRP A 9 8.418 2.233 -5.571 1.00 74.23 H new ATOM 0 HZ3 TRP A 9 4.522 3.429 -4.269 1.00 50.00 H new ATOM 0 HH2 TRP A 9 5.979 1.931 -5.570 1.00 55.13 H new ATOM 152 N LYS A 10 10.472 6.782 -0.084 1.00 31.03 N ATOM 153 CA LYS A 10 11.837 6.348 0.187 1.00 63.10 C ATOM 154 C LYS A 10 11.902 5.525 1.470 1.00 45.04 C ATOM 155 O LYS A 10 12.589 4.506 1.530 1.00 62.44 O ATOM 156 CB LYS A 10 12.767 7.559 0.297 1.00 32.35 C ATOM 157 CG LYS A 10 14.240 7.206 0.193 1.00 24.30 C ATOM 158 CD LYS A 10 14.748 7.348 -1.232 1.00 62.20 C ATOM 159 CE LYS A 10 14.386 6.136 -2.076 1.00 72.43 C ATOM 160 NZ LYS A 10 15.420 5.849 -3.108 1.00 44.24 N ATOM 0 H LYS A 10 10.367 7.789 -0.207 1.00 31.03 H new ATOM 0 HA LYS A 10 12.164 5.721 -0.643 1.00 63.10 H new ATOM 0 HB2 LYS A 10 12.516 8.271 -0.489 1.00 32.35 H new ATOM 0 HB3 LYS A 10 12.588 8.059 1.249 1.00 32.35 H new ATOM 0 HG2 LYS A 10 14.818 7.854 0.852 1.00 24.30 H new ATOM 0 HG3 LYS A 10 14.395 6.183 0.535 1.00 24.30 H new ATOM 0 HD2 LYS A 10 14.325 8.246 -1.682 1.00 62.20 H new ATOM 0 HD3 LYS A 10 15.830 7.476 -1.222 1.00 62.20 H new ATOM 0 HE2 LYS A 10 14.267 5.266 -1.430 1.00 72.43 H new ATOM 0 HE3 LYS A 10 13.425 6.306 -2.562 1.00 72.43 H new ATOM 0 HZ1 LYS A 10 15.136 5.016 -3.662 1.00 44.24 H new ATOM 0 HZ2 LYS A 10 15.516 6.669 -3.741 1.00 44.24 H new ATOM 0 HZ3 LYS A 10 16.331 5.661 -2.643 1.00 44.24 H new ATOM 174 N MET A 11 11.182 5.974 2.493 1.00 64.25 N ATOM 175 CA MET A 11 11.157 5.277 3.773 1.00 21.50 C ATOM 176 C MET A 11 10.377 3.970 3.665 1.00 15.45 C ATOM 177 O MET A 11 10.818 2.931 4.153 1.00 24.42 O ATOM 178 CB MET A 11 10.537 6.168 4.851 1.00 31.50 C ATOM 179 CG MET A 11 11.504 7.190 5.424 1.00 0.54 C ATOM 180 SD MET A 11 11.781 6.970 7.192 1.00 12.04 S ATOM 181 CE MET A 11 13.557 7.177 7.285 1.00 25.14 C ATOM 0 H MET A 11 10.609 6.817 2.460 1.00 64.25 H new ATOM 0 HA MET A 11 12.185 5.044 4.052 1.00 21.50 H new ATOM 0 HB2 MET A 11 9.677 6.689 4.430 1.00 31.50 H new ATOM 0 HB3 MET A 11 10.164 5.540 5.660 1.00 31.50 H new ATOM 0 HG2 MET A 11 12.457 7.117 4.899 1.00 0.54 H new ATOM 0 HG3 MET A 11 11.116 8.193 5.243 1.00 0.54 H new ATOM 0 HE1 MET A 11 13.882 7.068 8.320 1.00 25.14 H new ATOM 0 HE2 MET A 11 14.044 6.420 6.670 1.00 25.14 H new ATOM 0 HE3 MET A 11 13.827 8.169 6.922 1.00 25.14 H new ATOM 191 N ALA A 12 9.214 4.032 3.024 1.00 21.12 N ATOM 192 CA ALA A 12 8.374 2.854 2.852 1.00 74.34 C ATOM 193 C ALA A 12 9.168 1.695 2.259 1.00 30.42 C ATOM 194 O ALA A 12 8.929 0.533 2.590 1.00 20.14 O ATOM 195 CB ALA A 12 7.179 3.183 1.969 1.00 34.51 C ATOM 0 H ALA A 12 8.833 4.885 2.616 1.00 21.12 H new ATOM 0 HA ALA A 12 8.014 2.549 3.834 1.00 74.34 H new ATOM 0 HB1 ALA A 12 6.560 2.294 1.849 1.00 34.51 H new ATOM 0 HB2 ALA A 12 6.591 3.975 2.433 1.00 34.51 H new ATOM 0 HB3 ALA A 12 7.529 3.516 0.992 1.00 34.51 H new ATOM 201 N ILE A 13 10.112 2.018 1.382 1.00 61.20 N ATOM 202 CA ILE A 13 10.941 1.003 0.744 1.00 24.33 C ATOM 203 C ILE A 13 12.134 0.637 1.621 1.00 2.01 C ATOM 204 O ILE A 13 12.554 -0.520 1.668 1.00 54.45 O ATOM 205 CB ILE A 13 11.454 1.476 -0.629 1.00 32.31 C ATOM 206 CG1 ILE A 13 10.278 1.812 -1.548 1.00 71.13 C ATOM 207 CG2 ILE A 13 12.339 0.411 -1.260 1.00 35.34 C ATOM 208 CD1 ILE A 13 9.415 0.617 -1.887 1.00 33.20 C ATOM 0 H ILE A 13 10.322 2.975 1.097 1.00 61.20 H new ATOM 0 HA ILE A 13 10.312 0.124 0.604 1.00 24.33 H new ATOM 0 HB ILE A 13 12.050 2.378 -0.487 1.00 32.31 H new ATOM 0 HG12 ILE A 13 9.660 2.572 -1.070 1.00 71.13 H new ATOM 0 HG13 ILE A 13 10.661 2.247 -2.471 1.00 71.13 H new ATOM 0 HG21 ILE A 13 12.694 0.760 -2.230 1.00 35.34 H new ATOM 0 HG22 ILE A 13 13.192 0.215 -0.611 1.00 35.34 H new ATOM 0 HG23 ILE A 13 11.766 -0.507 -1.392 1.00 35.34 H new ATOM 0 HD11 ILE A 13 8.601 0.930 -2.541 1.00 33.20 H new ATOM 0 HD12 ILE A 13 10.019 -0.136 -2.393 1.00 33.20 H new ATOM 0 HD13 ILE A 13 9.002 0.195 -0.971 1.00 33.20 H new ATOM 220 N LYS A 14 12.676 1.630 2.317 1.00 3.42 N ATOM 221 CA LYS A 14 13.819 1.415 3.196 1.00 24.43 C ATOM 222 C LYS A 14 13.504 0.356 4.249 1.00 43.52 C ATOM 223 O LYS A 14 14.394 -0.361 4.707 1.00 12.21 O ATOM 224 CB LYS A 14 14.219 2.725 3.879 1.00 73.13 C ATOM 225 CG LYS A 14 15.708 2.836 4.158 1.00 35.02 C ATOM 226 CD LYS A 14 16.460 3.388 2.959 1.00 2.54 C ATOM 227 CE LYS A 14 16.700 4.885 3.093 1.00 74.42 C ATOM 228 NZ LYS A 14 17.544 5.208 4.276 1.00 61.10 N ATOM 0 H LYS A 14 12.342 2.593 2.289 1.00 3.42 H new ATOM 0 HA LYS A 14 14.651 1.062 2.587 1.00 24.43 H new ATOM 0 HB2 LYS A 14 13.912 3.561 3.250 1.00 73.13 H new ATOM 0 HB3 LYS A 14 13.674 2.816 4.819 1.00 73.13 H new ATOM 0 HG2 LYS A 14 15.870 3.483 5.020 1.00 35.02 H new ATOM 0 HG3 LYS A 14 16.105 1.854 4.417 1.00 35.02 H new ATOM 0 HD2 LYS A 14 17.415 2.873 2.858 1.00 2.54 H new ATOM 0 HD3 LYS A 14 15.893 3.189 2.049 1.00 2.54 H new ATOM 0 HE2 LYS A 14 17.183 5.258 2.190 1.00 74.42 H new ATOM 0 HE3 LYS A 14 15.743 5.400 3.178 1.00 74.42 H new ATOM 0 HZ1 LYS A 14 18.082 6.079 4.091 1.00 61.10 H new ATOM 0 HZ2 LYS A 14 16.936 5.346 5.109 1.00 61.10 H new ATOM 0 HZ3 LYS A 14 18.204 4.425 4.456 1.00 61.10 H new ATOM 242 N ARG A 15 12.233 0.264 4.626 1.00 24.03 N ATOM 243 CA ARG A 15 11.802 -0.707 5.624 1.00 34.04 C ATOM 244 C ARG A 15 11.288 -1.980 4.958 1.00 21.00 C ATOM 245 O ARG A 15 11.739 -3.082 5.272 1.00 21.21 O ATOM 246 CB ARG A 15 10.709 -0.107 6.512 1.00 44.13 C ATOM 247 CG ARG A 15 11.217 0.376 7.860 1.00 23.15 C ATOM 248 CD ARG A 15 11.784 1.784 7.771 1.00 53.32 C ATOM 249 NE ARG A 15 13.014 1.930 8.545 1.00 74.12 N ATOM 250 CZ ARG A 15 13.046 1.972 9.872 1.00 21.11 C ATOM 251 NH1 ARG A 15 11.922 1.879 10.569 1.00 1.42 N ATOM 252 NH2 ARG A 15 14.205 2.106 10.505 1.00 53.13 N ATOM 0 H ARG A 15 11.484 0.850 4.256 1.00 24.03 H new ATOM 0 HA ARG A 15 12.663 -0.962 6.241 1.00 34.04 H new ATOM 0 HB2 ARG A 15 10.244 0.728 5.988 1.00 44.13 H new ATOM 0 HB3 ARG A 15 9.932 -0.854 6.673 1.00 44.13 H new ATOM 0 HG2 ARG A 15 10.403 0.356 8.585 1.00 23.15 H new ATOM 0 HG3 ARG A 15 11.986 -0.305 8.225 1.00 23.15 H new ATOM 0 HD2 ARG A 15 11.981 2.030 6.728 1.00 53.32 H new ATOM 0 HD3 ARG A 15 11.042 2.497 8.132 1.00 53.32 H new ATOM 0 HE ARG A 15 13.896 2.004 8.039 1.00 74.12 H new ATOM 0 HH11 ARG A 15 11.030 1.775 10.086 1.00 1.42 H new ATOM 0 HH12 ARG A 15 11.950 1.912 11.588 1.00 1.42 H new ATOM 0 HH21 ARG A 15 15.072 2.177 9.972 1.00 53.13 H new ATOM 0 HH22 ARG A 15 14.229 2.138 11.524 1.00 53.13 H new ATOM 266 N CYS A 16 10.343 -1.820 4.038 1.00 23.12 N ATOM 267 CA CYS A 16 9.767 -2.957 3.328 1.00 2.32 C ATOM 268 C CYS A 16 10.855 -3.776 2.641 1.00 35.31 C ATOM 269 O CYS A 16 10.686 -4.972 2.401 1.00 43.22 O ATOM 270 CB CYS A 16 8.746 -2.476 2.297 1.00 53.43 C ATOM 271 SG CYS A 16 7.643 -3.774 1.689 1.00 44.53 S ATOM 0 H CYS A 16 9.960 -0.915 3.766 1.00 23.12 H new ATOM 0 HA CYS A 16 9.264 -3.593 4.057 1.00 2.32 H new ATOM 0 HB2 CYS A 16 8.145 -1.682 2.740 1.00 53.43 H new ATOM 0 HB3 CYS A 16 9.278 -2.040 1.451 1.00 53.43 H new ATOM 0 HG CYS A 16 8.228 -4.425 0.728 1.00 44.53 H new ATOM 277 N SER A 17 11.969 -3.125 2.326 1.00 44.31 N ATOM 278 CA SER A 17 13.083 -3.792 1.661 1.00 14.20 C ATOM 279 C SER A 17 13.485 -5.057 2.413 1.00 71.14 C ATOM 280 O SER A 17 13.966 -6.020 1.816 1.00 12.34 O ATOM 281 CB SER A 17 14.281 -2.846 1.553 1.00 34.25 C ATOM 282 OG SER A 17 15.500 -3.546 1.732 1.00 10.32 O ATOM 0 H SER A 17 12.125 -2.136 2.520 1.00 44.31 H new ATOM 0 HA SER A 17 12.760 -4.073 0.659 1.00 14.20 H new ATOM 0 HB2 SER A 17 14.277 -2.359 0.578 1.00 34.25 H new ATOM 0 HB3 SER A 17 14.196 -2.059 2.303 1.00 34.25 H new ATOM 0 HG SER A 17 16.251 -2.920 1.657 1.00 10.32 H new ATOM 288 N ASN A 18 13.284 -5.047 3.726 1.00 10.53 N ATOM 289 CA ASN A 18 13.626 -6.192 4.561 1.00 31.51 C ATOM 290 C ASN A 18 12.412 -7.092 4.774 1.00 62.13 C ATOM 291 O ASN A 18 12.209 -7.632 5.861 1.00 20.12 O ATOM 292 CB ASN A 18 14.169 -5.722 5.912 1.00 51.11 C ATOM 293 CG ASN A 18 14.896 -6.824 6.658 1.00 3.31 C ATOM 294 OD1 ASN A 18 15.429 -7.753 6.051 1.00 35.11 O ATOM 295 ND2 ASN A 18 14.922 -6.724 7.982 1.00 31.21 N ATOM 0 H ASN A 18 12.886 -4.258 4.235 1.00 10.53 H new ATOM 0 HA ASN A 18 14.397 -6.766 4.047 1.00 31.51 H new ATOM 0 HB2 ASN A 18 14.848 -4.884 5.756 1.00 51.11 H new ATOM 0 HB3 ASN A 18 13.345 -5.355 6.524 1.00 51.11 H new ATOM 0 HD21 ASN A 18 15.397 -7.435 8.538 1.00 31.21 H new ATOM 0 HD22 ASN A 18 14.467 -5.936 8.443 1.00 31.21 H new ATOM 302 N VAL A 19 11.608 -7.249 3.727 1.00 61.01 N ATOM 303 CA VAL A 19 10.415 -8.084 3.798 1.00 61.43 C ATOM 304 C VAL A 19 10.696 -9.489 3.275 1.00 52.32 C ATOM 305 O VAL A 19 11.373 -9.661 2.262 1.00 41.00 O ATOM 306 CB VAL A 19 9.253 -7.472 2.994 1.00 14.01 C ATOM 307 CG1 VAL A 19 9.564 -7.491 1.505 1.00 21.14 C ATOM 308 CG2 VAL A 19 7.956 -8.212 3.285 1.00 30.24 C ATOM 0 H VAL A 19 11.761 -6.809 2.820 1.00 61.01 H new ATOM 0 HA VAL A 19 10.130 -8.140 4.849 1.00 61.43 H new ATOM 0 HB VAL A 19 9.130 -6.434 3.301 1.00 14.01 H new ATOM 0 HG11 VAL A 19 8.731 -7.054 0.954 1.00 21.14 H new ATOM 0 HG12 VAL A 19 10.468 -6.913 1.315 1.00 21.14 H new ATOM 0 HG13 VAL A 19 9.716 -8.520 1.178 1.00 21.14 H new ATOM 0 HG21 VAL A 19 7.146 -7.766 2.708 1.00 30.24 H new ATOM 0 HG22 VAL A 19 8.065 -9.260 3.007 1.00 30.24 H new ATOM 0 HG23 VAL A 19 7.727 -8.140 4.348 1.00 30.24 H new ATOM 318 N ALA A 20 10.170 -10.490 3.973 1.00 72.04 N ATOM 319 CA ALA A 20 10.361 -11.880 3.577 1.00 4.14 C ATOM 320 C ALA A 20 9.027 -12.554 3.277 1.00 20.22 C ATOM 321 O ALA A 20 8.010 -12.246 3.899 1.00 42.31 O ATOM 322 CB ALA A 20 11.106 -12.640 4.665 1.00 41.10 C ATOM 0 H ALA A 20 9.608 -10.364 4.815 1.00 72.04 H new ATOM 0 HA ALA A 20 10.958 -11.894 2.665 1.00 4.14 H new ATOM 0 HB1 ALA A 20 11.242 -13.677 4.357 1.00 41.10 H new ATOM 0 HB2 ALA A 20 12.080 -12.179 4.829 1.00 41.10 H new ATOM 0 HB3 ALA A 20 10.530 -12.609 5.590 1.00 41.10 H new ATOM 328 N VAL A 21 9.037 -13.476 2.320 1.00 63.15 N ATOM 329 CA VAL A 21 7.828 -14.194 1.937 1.00 74.50 C ATOM 330 C VAL A 21 7.265 -14.988 3.111 1.00 41.20 C ATOM 331 O VAL A 21 6.053 -15.042 3.314 1.00 51.44 O ATOM 332 CB VAL A 21 8.093 -15.155 0.763 1.00 60.14 C ATOM 333 CG1 VAL A 21 6.789 -15.750 0.254 1.00 52.23 C ATOM 334 CG2 VAL A 21 8.833 -14.437 -0.356 1.00 2.03 C ATOM 0 H VAL A 21 9.870 -13.743 1.795 1.00 63.15 H new ATOM 0 HA VAL A 21 7.101 -13.444 1.626 1.00 74.50 H new ATOM 0 HB VAL A 21 8.722 -15.971 1.119 1.00 60.14 H new ATOM 0 HG11 VAL A 21 6.997 -16.426 -0.575 1.00 52.23 H new ATOM 0 HG12 VAL A 21 6.302 -16.301 1.058 1.00 52.23 H new ATOM 0 HG13 VAL A 21 6.132 -14.949 -0.086 1.00 52.23 H new ATOM 0 HG21 VAL A 21 9.012 -15.131 -1.177 1.00 2.03 H new ATOM 0 HG22 VAL A 21 8.231 -13.601 -0.712 1.00 2.03 H new ATOM 0 HG23 VAL A 21 9.786 -14.065 0.019 1.00 2.03 H new ATOM 344 N GLY A 22 8.156 -15.603 3.883 1.00 35.24 N ATOM 345 CA GLY A 22 7.729 -16.386 5.029 1.00 50.33 C ATOM 346 C GLY A 22 8.148 -15.762 6.345 1.00 32.23 C ATOM 347 O GLY A 22 8.593 -14.615 6.384 1.00 71.13 O ATOM 0 H GLY A 22 9.165 -15.573 3.736 1.00 35.24 H new ATOM 0 HA2 GLY A 22 6.644 -16.492 5.009 1.00 50.33 H new ATOM 0 HA3 GLY A 22 8.148 -17.390 4.956 1.00 50.33 H new ATOM 351 N VAL A 23 8.004 -16.519 7.429 1.00 40.31 N ATOM 352 CA VAL A 23 8.370 -16.033 8.754 1.00 22.41 C ATOM 353 C VAL A 23 9.883 -15.911 8.896 1.00 42.43 C ATOM 354 O VAL A 23 10.381 -15.075 9.648 1.00 11.55 O ATOM 355 CB VAL A 23 7.836 -16.963 9.860 1.00 70.33 C ATOM 356 CG1 VAL A 23 6.315 -16.935 9.893 1.00 65.44 C ATOM 357 CG2 VAL A 23 8.347 -18.381 9.656 1.00 61.44 C ATOM 0 H VAL A 23 7.637 -17.470 7.415 1.00 40.31 H new ATOM 0 HA VAL A 23 7.916 -15.048 8.866 1.00 22.41 H new ATOM 0 HB VAL A 23 8.203 -16.604 10.821 1.00 70.33 H new ATOM 0 HG11 VAL A 23 5.956 -17.598 10.680 1.00 65.44 H new ATOM 0 HG12 VAL A 23 5.974 -15.919 10.091 1.00 65.44 H new ATOM 0 HG13 VAL A 23 5.924 -17.268 8.932 1.00 65.44 H new ATOM 0 HG21 VAL A 23 7.960 -19.024 10.446 1.00 61.44 H new ATOM 0 HG22 VAL A 23 8.011 -18.753 8.688 1.00 61.44 H new ATOM 0 HG23 VAL A 23 9.437 -18.383 9.687 1.00 61.44 H new ATOM 367 N GLY A 24 10.611 -16.750 8.165 1.00 33.43 N ATOM 368 CA GLY A 24 12.060 -16.720 8.223 1.00 4.54 C ATOM 369 C GLY A 24 12.683 -18.062 7.894 1.00 54.24 C ATOM 370 O GLY A 24 11.977 -19.024 7.594 1.00 22.11 O ATOM 0 H GLY A 24 10.222 -17.450 7.533 1.00 33.43 H new ATOM 0 HA2 GLY A 24 12.433 -15.970 7.526 1.00 4.54 H new ATOM 0 HA3 GLY A 24 12.374 -16.412 9.220 1.00 4.54 H new ATOM 374 N GLY A 25 14.010 -18.127 7.947 1.00 13.42 N ATOM 375 CA GLY A 25 14.705 -19.365 7.647 1.00 14.15 C ATOM 376 C GLY A 25 15.002 -19.520 6.169 1.00 10.22 C ATOM 377 O GLY A 25 15.609 -18.642 5.555 1.00 70.32 O ATOM 0 H GLY A 25 14.616 -17.344 8.192 1.00 13.42 H new ATOM 0 HA2 GLY A 25 15.639 -19.399 8.208 1.00 14.15 H new ATOM 0 HA3 GLY A 25 14.101 -20.208 7.983 1.00 14.15 H new ATOM 381 N LYS A 26 14.575 -20.640 5.596 1.00 43.23 N ATOM 382 CA LYS A 26 14.799 -20.908 4.180 1.00 30.31 C ATOM 383 C LYS A 26 13.788 -20.159 3.318 1.00 70.42 C ATOM 384 O LYS A 26 12.981 -20.771 2.618 1.00 60.21 O ATOM 385 CB LYS A 26 14.707 -22.411 3.904 1.00 12.22 C ATOM 386 CG LYS A 26 15.846 -23.212 4.510 1.00 2.44 C ATOM 387 CD LYS A 26 15.752 -24.683 4.141 1.00 10.45 C ATOM 388 CE LYS A 26 14.869 -25.446 5.117 1.00 62.34 C ATOM 389 NZ LYS A 26 14.729 -26.878 4.733 1.00 73.31 N ATOM 0 H LYS A 26 14.072 -21.377 6.090 1.00 43.23 H new ATOM 0 HA LYS A 26 15.799 -20.558 3.923 1.00 30.31 H new ATOM 0 HB2 LYS A 26 13.762 -22.786 4.296 1.00 12.22 H new ATOM 0 HB3 LYS A 26 14.693 -22.574 2.826 1.00 12.22 H new ATOM 0 HG2 LYS A 26 16.799 -22.810 4.165 1.00 2.44 H new ATOM 0 HG3 LYS A 26 15.829 -23.106 5.595 1.00 2.44 H new ATOM 0 HD2 LYS A 26 15.351 -24.781 3.132 1.00 10.45 H new ATOM 0 HD3 LYS A 26 16.750 -25.122 4.132 1.00 10.45 H new ATOM 0 HE2 LYS A 26 15.292 -25.378 6.119 1.00 62.34 H new ATOM 0 HE3 LYS A 26 13.884 -24.982 5.155 1.00 62.34 H new ATOM 0 HZ1 LYS A 26 14.120 -27.364 5.422 1.00 73.31 H new ATOM 0 HZ2 LYS A 26 14.302 -26.944 3.787 1.00 73.31 H new ATOM 0 HZ3 LYS A 26 15.667 -27.328 4.722 1.00 73.31 H new ATOM 403 N SER A 27 13.839 -18.832 3.372 1.00 34.31 N ATOM 404 CA SER A 27 12.925 -18.000 2.598 1.00 64.14 C ATOM 405 C SER A 27 13.679 -16.876 1.893 1.00 24.41 C ATOM 406 O SER A 27 14.836 -16.596 2.208 1.00 1.21 O ATOM 407 CB SER A 27 11.843 -17.413 3.505 1.00 10.42 C ATOM 408 OG SER A 27 12.376 -16.407 4.350 1.00 61.50 O ATOM 0 H SER A 27 14.503 -18.310 3.943 1.00 34.31 H new ATOM 0 HA SER A 27 12.453 -18.628 1.842 1.00 64.14 H new ATOM 0 HB2 SER A 27 11.042 -16.994 2.896 1.00 10.42 H new ATOM 0 HB3 SER A 27 11.402 -18.205 4.110 1.00 10.42 H new ATOM 0 HG SER A 27 11.664 -16.046 4.919 1.00 61.50 H new ATOM 414 N LYS A 28 13.016 -16.236 0.937 1.00 15.30 N ATOM 415 CA LYS A 28 13.620 -15.141 0.187 1.00 71.22 C ATOM 416 C LYS A 28 12.900 -13.826 0.468 1.00 22.12 C ATOM 417 O LYS A 28 11.717 -13.814 0.809 1.00 60.25 O ATOM 418 CB LYS A 28 13.585 -15.443 -1.313 1.00 61.20 C ATOM 419 CG LYS A 28 14.959 -15.662 -1.922 1.00 24.05 C ATOM 420 CD LYS A 28 14.898 -16.603 -3.113 1.00 43.11 C ATOM 421 CE LYS A 28 14.674 -18.042 -2.676 1.00 20.33 C ATOM 422 NZ LYS A 28 14.768 -18.991 -3.820 1.00 13.30 N ATOM 0 H LYS A 28 12.059 -16.457 0.663 1.00 15.30 H new ATOM 0 HA LYS A 28 14.657 -15.043 0.508 1.00 71.22 H new ATOM 0 HB2 LYS A 28 12.976 -16.331 -1.482 1.00 61.20 H new ATOM 0 HB3 LYS A 28 13.095 -14.618 -1.830 1.00 61.20 H new ATOM 0 HG2 LYS A 28 15.376 -14.705 -2.235 1.00 24.05 H new ATOM 0 HG3 LYS A 28 15.631 -16.071 -1.168 1.00 24.05 H new ATOM 0 HD2 LYS A 28 14.093 -16.295 -3.780 1.00 43.11 H new ATOM 0 HD3 LYS A 28 15.826 -16.534 -3.680 1.00 43.11 H new ATOM 0 HE2 LYS A 28 15.412 -18.311 -1.920 1.00 20.33 H new ATOM 0 HE3 LYS A 28 13.693 -18.131 -2.210 1.00 20.33 H new ATOM 0 HZ1 LYS A 28 14.609 -19.961 -3.480 1.00 13.30 H new ATOM 0 HZ2 LYS A 28 14.047 -18.751 -4.530 1.00 13.30 H new ATOM 0 HZ3 LYS A 28 15.713 -18.925 -4.249 1.00 13.30 H new ATOM 436 N LYS A 29 13.621 -12.719 0.323 1.00 60.55 N ATOM 437 CA LYS A 29 13.051 -11.398 0.558 1.00 63.10 C ATOM 438 C LYS A 29 12.774 -10.683 -0.760 1.00 53.42 C ATOM 439 O LYS A 29 13.076 -11.201 -1.835 1.00 72.22 O ATOM 440 CB LYS A 29 13.998 -10.557 1.417 1.00 24.52 C ATOM 441 CG LYS A 29 15.425 -10.526 0.897 1.00 41.20 C ATOM 442 CD LYS A 29 16.177 -9.307 1.405 1.00 51.00 C ATOM 443 CE LYS A 29 17.252 -9.694 2.408 1.00 5.25 C ATOM 444 NZ LYS A 29 18.313 -10.535 1.788 1.00 30.32 N ATOM 0 H LYS A 29 14.602 -12.711 0.044 1.00 60.55 H new ATOM 0 HA LYS A 29 12.107 -11.526 1.087 1.00 63.10 H new ATOM 0 HB2 LYS A 29 13.617 -9.537 1.470 1.00 24.52 H new ATOM 0 HB3 LYS A 29 13.999 -10.950 2.434 1.00 24.52 H new ATOM 0 HG2 LYS A 29 15.946 -11.432 1.207 1.00 41.20 H new ATOM 0 HG3 LYS A 29 15.416 -10.521 -0.193 1.00 41.20 H new ATOM 0 HD2 LYS A 29 16.633 -8.783 0.565 1.00 51.00 H new ATOM 0 HD3 LYS A 29 15.476 -8.614 1.870 1.00 51.00 H new ATOM 0 HE2 LYS A 29 17.701 -8.792 2.825 1.00 5.25 H new ATOM 0 HE3 LYS A 29 16.797 -10.236 3.237 1.00 5.25 H new ATOM 0 HZ1 LYS A 29 19.205 -10.406 2.306 1.00 30.32 H new ATOM 0 HZ2 LYS A 29 18.031 -11.535 1.828 1.00 30.32 H new ATOM 0 HZ3 LYS A 29 18.445 -10.252 0.796 1.00 30.32 H new ATOM 458 N PHE A 30 12.198 -9.488 -0.670 1.00 70.21 N ATOM 459 CA PHE A 30 11.880 -8.701 -1.856 1.00 23.21 C ATOM 460 C PHE A 30 12.698 -7.414 -1.889 1.00 45.34 C ATOM 461 O PHE A 30 13.494 -7.147 -0.990 1.00 24.40 O ATOM 462 CB PHE A 30 10.387 -8.371 -1.890 1.00 13.34 C ATOM 463 CG PHE A 30 9.504 -9.586 -1.911 1.00 42.13 C ATOM 464 CD1 PHE A 30 9.718 -10.597 -2.834 1.00 20.20 C ATOM 465 CD2 PHE A 30 8.461 -9.717 -1.009 1.00 22.23 C ATOM 466 CE1 PHE A 30 8.907 -11.716 -2.857 1.00 31.05 C ATOM 467 CE2 PHE A 30 7.647 -10.834 -1.026 1.00 70.01 C ATOM 468 CZ PHE A 30 7.871 -11.835 -1.951 1.00 31.23 C ATOM 0 H PHE A 30 11.942 -9.044 0.212 1.00 70.21 H new ATOM 0 HA PHE A 30 12.133 -9.295 -2.734 1.00 23.21 H new ATOM 0 HB2 PHE A 30 10.137 -7.765 -1.019 1.00 13.34 H new ATOM 0 HB3 PHE A 30 10.177 -7.764 -2.771 1.00 13.34 H new ATOM 0 HD1 PHE A 30 10.528 -10.510 -3.543 1.00 20.20 H new ATOM 0 HD2 PHE A 30 8.282 -8.937 -0.284 1.00 22.23 H new ATOM 0 HE1 PHE A 30 9.083 -12.496 -3.582 1.00 31.05 H new ATOM 0 HE2 PHE A 30 6.837 -10.924 -0.317 1.00 70.01 H new ATOM 0 HZ PHE A 30 7.237 -12.709 -1.966 1.00 31.23 H new ATOM 478 N GLY A 31 12.496 -6.618 -2.935 1.00 42.13 N ATOM 479 CA GLY A 31 13.222 -5.368 -3.068 1.00 61.30 C ATOM 480 C GLY A 31 12.411 -4.299 -3.772 1.00 41.40 C ATOM 481 O GLY A 31 11.225 -4.487 -4.041 1.00 43.02 O ATOM 0 H GLY A 31 11.843 -6.817 -3.693 1.00 42.13 H new ATOM 0 HA2 GLY A 31 13.508 -5.010 -2.079 1.00 61.30 H new ATOM 0 HA3 GLY A 31 14.144 -5.544 -3.622 1.00 61.30 H new ATOM 485 N GLU A 32 13.051 -3.172 -4.069 1.00 65.13 N ATOM 486 CA GLU A 32 12.380 -2.068 -4.744 1.00 11.40 C ATOM 487 C GLU A 32 11.801 -2.519 -6.082 1.00 1.40 C ATOM 488 O GLU A 32 10.640 -2.252 -6.390 1.00 21.31 O ATOM 489 CB GLU A 32 13.353 -0.907 -4.962 1.00 14.21 C ATOM 490 CG GLU A 32 14.149 -0.539 -3.721 1.00 52.32 C ATOM 491 CD GLU A 32 15.637 -0.774 -3.892 1.00 40.21 C ATOM 492 OE1 GLU A 32 16.169 -0.445 -4.973 1.00 54.24 O ATOM 493 OE2 GLU A 32 16.270 -1.287 -2.946 1.00 12.43 O ATOM 0 H GLU A 32 14.033 -3.000 -3.853 1.00 65.13 H new ATOM 0 HA GLU A 32 11.561 -1.732 -4.108 1.00 11.40 H new ATOM 0 HB2 GLU A 32 14.045 -1.169 -5.763 1.00 14.21 H new ATOM 0 HB3 GLU A 32 12.794 -0.033 -5.297 1.00 14.21 H new ATOM 0 HG2 GLU A 32 13.976 0.510 -3.481 1.00 52.32 H new ATOM 0 HG3 GLU A 32 13.787 -1.124 -2.875 1.00 52.32 H new ATOM 500 N GLY A 33 12.621 -3.203 -6.874 1.00 74.41 N ATOM 501 CA GLY A 33 12.173 -3.680 -8.170 1.00 25.01 C ATOM 502 C GLY A 33 11.005 -4.640 -8.063 1.00 42.10 C ATOM 503 O GLY A 33 10.218 -4.776 -8.998 1.00 54.12 O ATOM 0 H GLY A 33 13.587 -3.435 -6.642 1.00 74.41 H new ATOM 0 HA2 GLY A 33 11.884 -2.829 -8.787 1.00 25.01 H new ATOM 0 HA3 GLY A 33 13.001 -4.175 -8.677 1.00 25.01 H new ATOM 507 N ASN A 34 10.893 -5.309 -6.920 1.00 5.31 N ATOM 508 CA ASN A 34 9.814 -6.263 -6.695 1.00 72.12 C ATOM 509 C ASN A 34 8.506 -5.542 -6.384 1.00 1.40 C ATOM 510 O ASN A 34 7.467 -5.835 -6.975 1.00 73.02 O ATOM 511 CB ASN A 34 10.173 -7.210 -5.548 1.00 14.20 C ATOM 512 CG ASN A 34 9.660 -8.618 -5.779 1.00 21.30 C ATOM 513 OD1 ASN A 34 8.584 -8.985 -5.306 1.00 41.41 O ATOM 514 ND2 ASN A 34 10.431 -9.416 -6.509 1.00 50.22 N ATOM 0 H ASN A 34 11.537 -5.208 -6.135 1.00 5.31 H new ATOM 0 HA ASN A 34 9.680 -6.843 -7.608 1.00 72.12 H new ATOM 0 HB2 ASN A 34 11.256 -7.236 -5.427 1.00 14.20 H new ATOM 0 HB3 ASN A 34 9.758 -6.823 -4.617 1.00 14.20 H new ATOM 0 HD21 ASN A 34 10.139 -10.375 -6.697 1.00 50.22 H new ATOM 0 HD22 ASN A 34 11.315 -9.070 -6.881 1.00 50.22 H new ATOM 521 N PHE A 35 8.566 -4.596 -5.452 1.00 54.02 N ATOM 522 CA PHE A 35 7.386 -3.832 -5.062 1.00 24.23 C ATOM 523 C PHE A 35 6.742 -3.168 -6.275 1.00 71.31 C ATOM 524 O PHE A 35 5.522 -3.200 -6.438 1.00 41.34 O ATOM 525 CB PHE A 35 7.760 -2.771 -4.024 1.00 62.43 C ATOM 526 CG PHE A 35 8.568 -3.311 -2.879 1.00 62.41 C ATOM 527 CD1 PHE A 35 8.208 -4.496 -2.258 1.00 33.14 C ATOM 528 CD2 PHE A 35 9.688 -2.635 -2.425 1.00 5.35 C ATOM 529 CE1 PHE A 35 8.949 -4.995 -1.203 1.00 41.31 C ATOM 530 CE2 PHE A 35 10.434 -3.129 -1.371 1.00 1.43 C ATOM 531 CZ PHE A 35 10.064 -4.311 -0.760 1.00 3.21 C ATOM 0 H PHE A 35 9.418 -4.340 -4.953 1.00 54.02 H new ATOM 0 HA PHE A 35 6.666 -4.522 -4.623 1.00 24.23 H new ATOM 0 HB2 PHE A 35 8.324 -1.978 -4.514 1.00 62.43 H new ATOM 0 HB3 PHE A 35 6.848 -2.319 -3.634 1.00 62.43 H new ATOM 0 HD1 PHE A 35 7.338 -5.036 -2.602 1.00 33.14 H new ATOM 0 HD2 PHE A 35 9.982 -1.711 -2.900 1.00 5.35 H new ATOM 0 HE1 PHE A 35 8.656 -5.919 -0.726 1.00 41.31 H new ATOM 0 HE2 PHE A 35 11.305 -2.591 -1.026 1.00 1.43 H new ATOM 0 HZ PHE A 35 10.646 -4.700 0.063 1.00 3.21 H new ATOM 541 N ARG A 36 7.570 -2.567 -7.123 1.00 25.41 N ATOM 542 CA ARG A 36 7.082 -1.894 -8.320 1.00 63.24 C ATOM 543 C ARG A 36 6.516 -2.901 -9.317 1.00 52.13 C ATOM 544 O ARG A 36 5.411 -2.725 -9.832 1.00 23.22 O ATOM 545 CB ARG A 36 8.208 -1.091 -8.974 1.00 41.14 C ATOM 546 CG ARG A 36 8.920 -0.149 -8.017 1.00 52.01 C ATOM 547 CD ARG A 36 10.231 0.354 -8.602 1.00 34.43 C ATOM 548 NE ARG A 36 10.777 1.472 -7.838 1.00 41.32 N ATOM 549 CZ ARG A 36 10.324 2.717 -7.932 1.00 52.31 C ATOM 550 NH1 ARG A 36 9.321 3.001 -8.752 1.00 43.21 N ATOM 551 NH2 ARG A 36 10.873 3.681 -7.204 1.00 41.44 N ATOM 0 H ARG A 36 8.582 -2.533 -7.003 1.00 25.41 H new ATOM 0 HA ARG A 36 6.284 -1.213 -8.024 1.00 63.24 H new ATOM 0 HB2 ARG A 36 8.936 -1.782 -9.399 1.00 41.14 H new ATOM 0 HB3 ARG A 36 7.797 -0.512 -9.801 1.00 41.14 H new ATOM 0 HG2 ARG A 36 8.273 0.698 -7.790 1.00 52.01 H new ATOM 0 HG3 ARG A 36 9.114 -0.663 -7.076 1.00 52.01 H new ATOM 0 HD2 ARG A 36 10.955 -0.460 -8.621 1.00 34.43 H new ATOM 0 HD3 ARG A 36 10.072 0.664 -9.635 1.00 34.43 H new ATOM 0 HE ARG A 36 11.549 1.287 -7.197 1.00 41.32 H new ATOM 0 HH11 ARG A 36 8.896 2.262 -9.312 1.00 43.21 H new ATOM 0 HH12 ARG A 36 8.975 3.958 -8.822 1.00 43.21 H new ATOM 0 HH21 ARG A 36 11.644 3.466 -6.571 1.00 41.44 H new ATOM 0 HH22 ARG A 36 10.524 4.637 -7.277 1.00 41.44 H new ATOM 565 N TRP A 37 7.279 -3.954 -9.585 1.00 3.10 N ATOM 566 CA TRP A 37 6.853 -4.988 -10.521 1.00 24.41 C ATOM 567 C TRP A 37 5.479 -5.530 -10.145 1.00 54.10 C ATOM 568 O TRP A 37 4.724 -5.983 -11.005 1.00 32.33 O ATOM 569 CB TRP A 37 7.873 -6.128 -10.552 1.00 21.01 C ATOM 570 CG TRP A 37 7.420 -7.309 -11.356 1.00 40.21 C ATOM 571 CD1 TRP A 37 7.780 -7.614 -12.638 1.00 31.44 C ATOM 572 CD2 TRP A 37 6.521 -8.340 -10.933 1.00 4.11 C ATOM 573 NE1 TRP A 37 7.159 -8.773 -13.037 1.00 20.44 N ATOM 574 CE2 TRP A 37 6.382 -9.239 -12.009 1.00 3.43 C ATOM 575 CE3 TRP A 37 5.822 -8.593 -9.750 1.00 5.24 C ATOM 576 CZ2 TRP A 37 5.572 -10.369 -11.934 1.00 42.54 C ATOM 577 CZ3 TRP A 37 5.019 -9.714 -9.677 1.00 74.45 C ATOM 578 CH2 TRP A 37 4.899 -10.591 -10.764 1.00 23.42 C ATOM 0 H TRP A 37 8.196 -4.115 -9.168 1.00 3.10 H new ATOM 0 HA TRP A 37 6.788 -4.541 -11.513 1.00 24.41 H new ATOM 0 HB2 TRP A 37 8.811 -5.756 -10.964 1.00 21.01 H new ATOM 0 HB3 TRP A 37 8.079 -6.450 -9.531 1.00 21.01 H new ATOM 0 HD1 TRP A 37 8.453 -7.030 -13.248 1.00 31.44 H new ATOM 0 HE1 TRP A 37 7.260 -9.215 -13.951 1.00 20.44 H new ATOM 0 HE3 TRP A 37 5.908 -7.923 -8.907 1.00 5.24 H new ATOM 0 HZ2 TRP A 37 5.478 -11.046 -12.770 1.00 42.54 H new ATOM 0 HZ3 TRP A 37 4.474 -9.919 -8.767 1.00 74.45 H new ATOM 0 HH2 TRP A 37 4.263 -11.459 -10.676 1.00 23.42 H new ATOM 589 N ALA A 38 5.160 -5.479 -8.856 1.00 34.41 N ATOM 590 CA ALA A 38 3.874 -5.963 -8.367 1.00 62.15 C ATOM 591 C ALA A 38 2.771 -4.942 -8.622 1.00 73.03 C ATOM 592 O ALA A 38 1.829 -5.206 -9.370 1.00 73.12 O ATOM 593 CB ALA A 38 3.962 -6.289 -6.884 1.00 21.01 C ATOM 0 H ALA A 38 5.774 -5.107 -8.131 1.00 34.41 H new ATOM 0 HA ALA A 38 3.624 -6.873 -8.913 1.00 62.15 H new ATOM 0 HB1 ALA A 38 2.995 -6.649 -6.533 1.00 21.01 H new ATOM 0 HB2 ALA A 38 4.716 -7.060 -6.725 1.00 21.01 H new ATOM 0 HB3 ALA A 38 4.238 -5.392 -6.330 1.00 21.01 H new ATOM 599 N ILE A 39 2.893 -3.777 -7.996 1.00 2.31 N ATOM 600 CA ILE A 39 1.906 -2.717 -8.156 1.00 13.51 C ATOM 601 C ILE A 39 1.672 -2.401 -9.629 1.00 52.13 C ATOM 602 O ILE A 39 0.544 -2.135 -10.046 1.00 45.52 O ATOM 603 CB ILE A 39 2.339 -1.430 -7.429 1.00 52.52 C ATOM 604 CG1 ILE A 39 1.304 -0.323 -7.644 1.00 73.43 C ATOM 605 CG2 ILE A 39 3.709 -0.982 -7.916 1.00 21.12 C ATOM 606 CD1 ILE A 39 0.846 0.334 -6.361 1.00 72.50 C ATOM 0 H ILE A 39 3.666 -3.543 -7.373 1.00 2.31 H new ATOM 0 HA ILE A 39 0.979 -3.080 -7.713 1.00 13.51 H new ATOM 0 HB ILE A 39 2.404 -1.639 -6.361 1.00 52.52 H new ATOM 0 HG12 ILE A 39 1.728 0.437 -8.300 1.00 73.43 H new ATOM 0 HG13 ILE A 39 0.438 -0.741 -8.158 1.00 73.43 H new ATOM 0 HG21 ILE A 39 4.001 -0.071 -7.393 1.00 21.12 H new ATOM 0 HG22 ILE A 39 4.440 -1.765 -7.717 1.00 21.12 H new ATOM 0 HG23 ILE A 39 3.669 -0.788 -8.988 1.00 21.12 H new ATOM 0 HD11 ILE A 39 0.114 1.108 -6.590 1.00 72.50 H new ATOM 0 HD12 ILE A 39 0.392 -0.414 -5.711 1.00 72.50 H new ATOM 0 HD13 ILE A 39 1.702 0.782 -5.856 1.00 72.50 H new ATOM 618 N ARG A 40 2.744 -2.434 -10.413 1.00 63.34 N ATOM 619 CA ARG A 40 2.656 -2.152 -11.841 1.00 60.51 C ATOM 620 C ARG A 40 1.931 -3.278 -12.574 1.00 2.24 C ATOM 621 O ARG A 40 0.974 -3.037 -13.309 1.00 64.32 O ATOM 622 CB ARG A 40 4.054 -1.962 -12.432 1.00 70.04 C ATOM 623 CG ARG A 40 4.067 -1.878 -13.950 1.00 41.10 C ATOM 624 CD ARG A 40 4.605 -3.156 -14.574 1.00 73.12 C ATOM 625 NE ARG A 40 4.059 -3.385 -15.909 1.00 51.34 N ATOM 626 CZ ARG A 40 4.404 -4.411 -16.678 1.00 71.44 C ATOM 627 NH1 ARG A 40 5.289 -5.300 -16.247 1.00 14.54 N ATOM 628 NH2 ARG A 40 3.863 -4.552 -17.882 1.00 42.50 N ATOM 0 H ARG A 40 3.684 -2.653 -10.084 1.00 63.34 H new ATOM 0 HA ARG A 40 2.086 -1.232 -11.970 1.00 60.51 H new ATOM 0 HB2 ARG A 40 4.492 -1.052 -12.022 1.00 70.04 H new ATOM 0 HB3 ARG A 40 4.688 -2.791 -12.117 1.00 70.04 H new ATOM 0 HG2 ARG A 40 3.057 -1.692 -14.314 1.00 41.10 H new ATOM 0 HG3 ARG A 40 4.680 -1.033 -14.263 1.00 41.10 H new ATOM 0 HD2 ARG A 40 5.692 -3.102 -14.631 1.00 73.12 H new ATOM 0 HD3 ARG A 40 4.362 -4.003 -13.933 1.00 73.12 H new ATOM 0 HE ARG A 40 3.375 -2.720 -16.271 1.00 51.34 H new ATOM 0 HH11 ARG A 40 5.707 -5.197 -15.322 1.00 14.54 H new ATOM 0 HH12 ARG A 40 5.552 -6.087 -16.840 1.00 14.54 H new ATOM 0 HH21 ARG A 40 3.181 -3.872 -18.218 1.00 42.50 H new ATOM 0 HH22 ARG A 40 4.129 -5.341 -18.472 1.00 42.50 H new ATOM 642 N MET A 41 2.395 -4.506 -12.367 1.00 74.11 N ATOM 643 CA MET A 41 1.790 -5.668 -13.007 1.00 72.45 C ATOM 644 C MET A 41 0.283 -5.697 -12.771 1.00 41.42 C ATOM 645 O MET A 41 -0.475 -6.196 -13.602 1.00 14.13 O ATOM 646 CB MET A 41 2.425 -6.956 -12.480 1.00 31.34 C ATOM 647 CG MET A 41 1.809 -8.219 -13.059 1.00 34.42 C ATOM 648 SD MET A 41 2.094 -8.382 -14.832 1.00 2.33 S ATOM 649 CE MET A 41 0.841 -9.584 -15.268 1.00 34.42 C ATOM 0 H MET A 41 3.187 -4.722 -11.762 1.00 74.11 H new ATOM 0 HA MET A 41 1.970 -5.595 -14.079 1.00 72.45 H new ATOM 0 HB2 MET A 41 3.491 -6.945 -12.707 1.00 31.34 H new ATOM 0 HB3 MET A 41 2.330 -6.980 -11.394 1.00 31.34 H new ATOM 0 HG2 MET A 41 2.223 -9.088 -12.547 1.00 34.42 H new ATOM 0 HG3 MET A 41 0.736 -8.217 -12.866 1.00 34.42 H new ATOM 0 HE1 MET A 41 1.161 -10.139 -16.150 1.00 34.42 H new ATOM 0 HE2 MET A 41 0.695 -10.275 -14.438 1.00 34.42 H new ATOM 0 HE3 MET A 41 -0.096 -9.071 -15.482 1.00 34.42 H new ATOM 659 N ALA A 42 -0.143 -5.158 -11.634 1.00 12.14 N ATOM 660 CA ALA A 42 -1.559 -5.120 -11.290 1.00 31.34 C ATOM 661 C ALA A 42 -2.293 -4.058 -12.101 1.00 11.12 C ATOM 662 O ALA A 42 -3.316 -4.337 -12.725 1.00 1.22 O ATOM 663 CB ALA A 42 -1.734 -4.864 -9.800 1.00 42.20 C ATOM 0 H ALA A 42 0.472 -4.741 -10.935 1.00 12.14 H new ATOM 0 HA ALA A 42 -1.993 -6.090 -11.534 1.00 31.34 H new ATOM 0 HB1 ALA A 42 -2.796 -4.838 -9.558 1.00 42.20 H new ATOM 0 HB2 ALA A 42 -1.252 -5.662 -9.235 1.00 42.20 H new ATOM 0 HB3 ALA A 42 -1.279 -3.908 -9.539 1.00 42.20 H new ATOM 669 N ASN A 43 -1.764 -2.839 -12.087 1.00 10.34 N ATOM 670 CA ASN A 43 -2.370 -1.734 -12.820 1.00 53.24 C ATOM 671 C ASN A 43 -2.551 -2.093 -14.292 1.00 51.52 C ATOM 672 O ASN A 43 -3.443 -1.574 -14.964 1.00 0.11 O ATOM 673 CB ASN A 43 -1.509 -0.476 -12.693 1.00 11.35 C ATOM 674 CG ASN A 43 -1.840 0.328 -11.450 1.00 31.33 C ATOM 675 OD1 ASN A 43 -2.804 0.031 -10.744 1.00 54.51 O ATOM 676 ND2 ASN A 43 -1.039 1.351 -11.176 1.00 53.23 N ATOM 0 H ASN A 43 -0.917 -2.592 -11.576 1.00 10.34 H new ATOM 0 HA ASN A 43 -3.351 -1.539 -12.388 1.00 53.24 H new ATOM 0 HB2 ASN A 43 -0.457 -0.760 -12.669 1.00 11.35 H new ATOM 0 HB3 ASN A 43 -1.651 0.149 -13.575 1.00 11.35 H new ATOM 0 HD21 ASN A 43 -1.211 1.927 -10.352 1.00 53.23 H new ATOM 0 HD22 ASN A 43 -0.251 1.561 -11.789 1.00 53.23 H new ATOM 683 N VAL A 44 -1.698 -2.984 -14.787 1.00 54.05 N ATOM 684 CA VAL A 44 -1.764 -3.414 -16.179 1.00 74.01 C ATOM 685 C VAL A 44 -2.793 -4.525 -16.363 1.00 3.51 C ATOM 686 O VAL A 44 -3.760 -4.371 -17.108 1.00 74.41 O ATOM 687 CB VAL A 44 -0.395 -3.910 -16.679 1.00 5.11 C ATOM 688 CG1 VAL A 44 -0.467 -4.284 -18.151 1.00 63.14 C ATOM 689 CG2 VAL A 44 0.673 -2.853 -16.441 1.00 25.24 C ATOM 0 H VAL A 44 -0.953 -3.422 -14.245 1.00 54.05 H new ATOM 0 HA VAL A 44 -2.063 -2.545 -16.765 1.00 74.01 H new ATOM 0 HB VAL A 44 -0.123 -4.803 -16.115 1.00 5.11 H new ATOM 0 HG11 VAL A 44 0.510 -4.632 -18.486 1.00 63.14 H new ATOM 0 HG12 VAL A 44 -1.202 -5.077 -18.289 1.00 63.14 H new ATOM 0 HG13 VAL A 44 -0.761 -3.411 -18.734 1.00 63.14 H new ATOM 0 HG21 VAL A 44 1.634 -3.220 -16.800 1.00 25.24 H new ATOM 0 HG22 VAL A 44 0.409 -1.942 -16.978 1.00 25.24 H new ATOM 0 HG23 VAL A 44 0.742 -2.639 -15.374 1.00 25.24 H new ATOM 699 N SER A 45 -2.576 -5.643 -15.678 1.00 74.00 N ATOM 700 CA SER A 45 -3.483 -6.782 -15.768 1.00 42.20 C ATOM 701 C SER A 45 -4.920 -6.356 -15.481 1.00 24.51 C ATOM 702 O SER A 45 -5.856 -6.797 -16.149 1.00 1.31 O ATOM 703 CB SER A 45 -3.058 -7.877 -14.789 1.00 22.54 C ATOM 704 OG SER A 45 -4.179 -8.611 -14.326 1.00 43.02 O ATOM 0 H SER A 45 -1.781 -5.785 -15.055 1.00 74.00 H new ATOM 0 HA SER A 45 -3.435 -7.174 -16.784 1.00 42.20 H new ATOM 0 HB2 SER A 45 -2.354 -8.551 -15.276 1.00 22.54 H new ATOM 0 HB3 SER A 45 -2.537 -7.430 -13.942 1.00 22.54 H new ATOM 0 HG SER A 45 -3.880 -9.306 -13.703 1.00 43.02 H new ATOM 710 N THR A 46 -5.087 -5.496 -14.481 1.00 60.30 N ATOM 711 CA THR A 46 -6.408 -5.011 -14.103 1.00 74.42 C ATOM 712 C THR A 46 -6.893 -3.931 -15.063 1.00 61.13 C ATOM 713 O THR A 46 -8.095 -3.719 -15.220 1.00 23.53 O ATOM 714 CB THR A 46 -6.411 -4.447 -12.670 1.00 30.11 C ATOM 715 OG1 THR A 46 -5.669 -3.223 -12.624 1.00 32.22 O ATOM 716 CG2 THR A 46 -5.810 -5.447 -11.694 1.00 34.25 C ATOM 0 H THR A 46 -4.323 -5.121 -13.918 1.00 60.30 H new ATOM 0 HA THR A 46 -7.083 -5.865 -14.151 1.00 74.42 H new ATOM 0 HB THR A 46 -7.444 -4.256 -12.380 1.00 30.11 H new ATOM 0 HG1 THR A 46 -4.720 -3.410 -12.779 1.00 32.22 H new ATOM 0 HG21 THR A 46 -5.823 -5.027 -10.688 1.00 34.25 H new ATOM 0 HG22 THR A 46 -6.394 -6.367 -11.710 1.00 34.25 H new ATOM 0 HG23 THR A 46 -4.782 -5.665 -11.983 1.00 34.25 H new ATOM 724 N GLY A 47 -5.949 -3.250 -15.706 1.00 1.44 N ATOM 725 CA GLY A 47 -6.300 -2.199 -16.643 1.00 72.33 C ATOM 726 C GLY A 47 -5.345 -2.127 -17.818 1.00 23.31 C ATOM 727 O GLY A 47 -5.535 -2.810 -18.824 1.00 74.04 O ATOM 0 H GLY A 47 -4.947 -3.408 -15.595 1.00 1.44 H new ATOM 0 HA2 GLY A 47 -7.312 -2.368 -17.011 1.00 72.33 H new ATOM 0 HA3 GLY A 47 -6.305 -1.241 -16.124 1.00 72.33 H new ATOM 731 N ARG A 48 -4.315 -1.297 -17.691 1.00 22.12 N ATOM 732 CA ARG A 48 -3.328 -1.136 -18.752 1.00 23.24 C ATOM 733 C ARG A 48 -2.247 -0.140 -18.342 1.00 23.31 C ATOM 734 O ARG A 48 -2.546 0.972 -17.909 1.00 34.43 O ATOM 735 CB ARG A 48 -4.005 -0.668 -20.041 1.00 31.20 C ATOM 736 CG ARG A 48 -3.554 -1.429 -21.277 1.00 31.41 C ATOM 737 CD ARG A 48 -4.739 -1.984 -22.052 1.00 64.44 C ATOM 738 NE ARG A 48 -5.634 -0.927 -22.515 1.00 63.21 N ATOM 739 CZ ARG A 48 -6.775 -1.158 -23.155 1.00 22.04 C ATOM 740 NH1 ARG A 48 -7.158 -2.402 -23.405 1.00 71.35 N ATOM 741 NH2 ARG A 48 -7.536 -0.143 -23.544 1.00 64.01 N ATOM 0 H ARG A 48 -4.142 -0.726 -16.864 1.00 22.12 H new ATOM 0 HA ARG A 48 -2.859 -2.104 -18.927 1.00 23.24 H new ATOM 0 HB2 ARG A 48 -5.085 -0.774 -19.933 1.00 31.20 H new ATOM 0 HB3 ARG A 48 -3.801 0.393 -20.184 1.00 31.20 H new ATOM 0 HG2 ARG A 48 -2.974 -0.768 -21.921 1.00 31.41 H new ATOM 0 HG3 ARG A 48 -2.895 -2.246 -20.983 1.00 31.41 H new ATOM 0 HD2 ARG A 48 -4.377 -2.554 -22.908 1.00 64.44 H new ATOM 0 HD3 ARG A 48 -5.293 -2.677 -21.419 1.00 64.44 H new ATOM 0 HE ARG A 48 -5.369 0.042 -22.337 1.00 63.21 H new ATOM 0 HH11 ARG A 48 -6.576 -3.185 -23.106 1.00 71.35 H new ATOM 0 HH12 ARG A 48 -8.035 -2.577 -23.897 1.00 71.35 H new ATOM 0 HH21 ARG A 48 -7.245 0.816 -23.352 1.00 64.01 H new ATOM 0 HH22 ARG A 48 -8.412 -0.321 -24.035 1.00 64.01 H new ATOM 755 N GLU A 49 -0.989 -0.549 -18.482 1.00 13.31 N ATOM 756 CA GLU A 49 0.136 0.308 -18.125 1.00 35.22 C ATOM 757 C GLU A 49 0.123 0.629 -16.633 1.00 31.40 C ATOM 758 O GLU A 49 -0.897 0.505 -15.954 1.00 63.42 O ATOM 759 CB GLU A 49 0.096 1.604 -18.937 1.00 1.13 C ATOM 760 CG GLU A 49 1.117 1.649 -20.061 1.00 2.50 C ATOM 761 CD GLU A 49 0.554 2.245 -21.337 1.00 2.02 C ATOM 762 OE1 GLU A 49 0.649 3.478 -21.509 1.00 43.01 O ATOM 763 OE2 GLU A 49 0.018 1.477 -22.163 1.00 65.12 O ATOM 0 H GLU A 49 -0.724 -1.467 -18.839 1.00 13.31 H new ATOM 0 HA GLU A 49 1.056 -0.229 -18.356 1.00 35.22 H new ATOM 0 HB2 GLU A 49 -0.902 1.728 -19.358 1.00 1.13 H new ATOM 0 HB3 GLU A 49 0.267 2.447 -18.268 1.00 1.13 H new ATOM 0 HG2 GLU A 49 1.979 2.234 -19.741 1.00 2.50 H new ATOM 0 HG3 GLU A 49 1.474 0.639 -20.263 1.00 2.50 H new ATOM 770 N PRO A 50 1.283 1.051 -16.109 1.00 64.42 N ATOM 771 CA PRO A 50 1.433 1.398 -14.693 1.00 33.02 C ATOM 772 C PRO A 50 0.690 2.679 -14.329 1.00 34.34 C ATOM 773 O PRO A 50 -0.045 2.723 -13.343 1.00 20.33 O ATOM 774 CB PRO A 50 2.943 1.592 -14.532 1.00 74.35 C ATOM 775 CG PRO A 50 3.424 1.960 -15.893 1.00 70.14 C ATOM 776 CD PRO A 50 2.539 1.222 -16.859 1.00 71.14 C ATOM 0 HA PRO A 50 1.016 0.631 -14.040 1.00 33.02 H new ATOM 0 HB2 PRO A 50 3.167 2.375 -13.808 1.00 74.35 H new ATOM 0 HB3 PRO A 50 3.423 0.681 -14.175 1.00 74.35 H new ATOM 0 HG2 PRO A 50 3.362 3.037 -16.051 1.00 70.14 H new ATOM 0 HG3 PRO A 50 4.468 1.678 -16.027 1.00 70.14 H new ATOM 0 HD2 PRO A 50 2.385 1.789 -17.777 1.00 71.14 H new ATOM 0 HD3 PRO A 50 2.969 0.263 -17.146 1.00 71.14 H new ATOM 784 N GLY A 51 0.886 3.720 -15.132 1.00 14.24 N ATOM 785 CA GLY A 51 0.227 4.988 -14.877 1.00 34.23 C ATOM 786 C GLY A 51 0.733 5.661 -13.617 1.00 13.34 C ATOM 787 O GLY A 51 1.660 6.470 -13.666 1.00 71.32 O ATOM 0 H GLY A 51 1.489 3.708 -15.954 1.00 14.24 H new ATOM 0 HA2 GLY A 51 0.382 5.652 -15.727 1.00 34.23 H new ATOM 0 HA3 GLY A 51 -0.847 4.825 -14.792 1.00 34.23 H new ATOM 791 N ASP A 52 0.122 5.330 -12.484 1.00 61.54 N ATOM 792 CA ASP A 52 0.516 5.909 -11.205 1.00 71.42 C ATOM 793 C ASP A 52 0.220 4.946 -10.059 1.00 43.21 C ATOM 794 O ASP A 52 -0.119 3.784 -10.284 1.00 22.14 O ATOM 795 CB ASP A 52 -0.212 7.234 -10.975 1.00 70.14 C ATOM 796 CG ASP A 52 -0.088 8.175 -12.157 1.00 51.14 C ATOM 797 OD1 ASP A 52 0.936 8.884 -12.246 1.00 61.43 O ATOM 798 OD2 ASP A 52 -1.016 8.204 -12.993 1.00 61.23 O ATOM 0 H ASP A 52 -0.648 4.664 -12.426 1.00 61.54 H new ATOM 0 HA ASP A 52 1.590 6.094 -11.233 1.00 71.42 H new ATOM 0 HB2 ASP A 52 -1.266 7.037 -10.780 1.00 70.14 H new ATOM 0 HB3 ASP A 52 0.192 7.717 -10.085 1.00 70.14 H new ATOM 803 N ILE A 53 0.352 5.438 -8.832 1.00 22.43 N ATOM 804 CA ILE A 53 0.099 4.621 -7.651 1.00 42.11 C ATOM 805 C ILE A 53 -1.063 5.178 -6.836 1.00 2.41 C ATOM 806 O ILE A 53 -1.385 6.365 -6.899 1.00 0.01 O ATOM 807 CB ILE A 53 1.346 4.531 -6.751 1.00 71.55 C ATOM 808 CG1 ILE A 53 1.980 5.913 -6.581 1.00 61.51 C ATOM 809 CG2 ILE A 53 2.351 3.549 -7.336 1.00 53.10 C ATOM 810 CD1 ILE A 53 2.612 6.124 -5.223 1.00 64.13 C ATOM 0 H ILE A 53 0.632 6.398 -8.629 1.00 22.43 H new ATOM 0 HA ILE A 53 -0.155 3.623 -8.007 1.00 42.11 H new ATOM 0 HB ILE A 53 1.042 4.168 -5.769 1.00 71.55 H new ATOM 0 HG12 ILE A 53 2.738 6.053 -7.352 1.00 61.51 H new ATOM 0 HG13 ILE A 53 1.218 6.676 -6.741 1.00 61.51 H new ATOM 0 HG21 ILE A 53 3.227 3.496 -6.689 1.00 53.10 H new ATOM 0 HG22 ILE A 53 1.894 2.562 -7.410 1.00 53.10 H new ATOM 0 HG23 ILE A 53 2.653 3.885 -8.328 1.00 53.10 H new ATOM 0 HD11 ILE A 53 3.042 7.125 -5.173 1.00 64.13 H new ATOM 0 HD12 ILE A 53 1.853 6.016 -4.448 1.00 64.13 H new ATOM 0 HD13 ILE A 53 3.397 5.384 -5.068 1.00 64.13 H new ATOM 822 N PRO A 54 -1.707 4.304 -6.050 1.00 34.53 N ATOM 823 CA PRO A 54 -2.842 4.686 -5.204 1.00 74.34 C ATOM 824 C PRO A 54 -2.423 5.574 -4.038 1.00 53.54 C ATOM 825 O PRO A 54 -2.187 5.091 -2.932 1.00 32.22 O ATOM 826 CB PRO A 54 -3.370 3.344 -4.691 1.00 71.31 C ATOM 827 CG PRO A 54 -2.195 2.429 -4.744 1.00 52.30 C ATOM 828 CD PRO A 54 -1.377 2.874 -5.925 1.00 74.20 C ATOM 0 HA PRO A 54 -3.581 5.269 -5.753 1.00 74.34 H new ATOM 0 HB2 PRO A 54 -3.757 3.433 -3.676 1.00 71.31 H new ATOM 0 HB3 PRO A 54 -4.186 2.976 -5.312 1.00 71.31 H new ATOM 0 HG2 PRO A 54 -1.614 2.486 -3.823 1.00 52.30 H new ATOM 0 HG3 PRO A 54 -2.512 1.392 -4.857 1.00 52.30 H new ATOM 0 HD2 PRO A 54 -0.311 2.721 -5.756 1.00 74.20 H new ATOM 0 HD3 PRO A 54 -1.639 2.321 -6.827 1.00 74.20 H new ATOM 836 N GLU A 55 -2.334 6.876 -4.294 1.00 63.15 N ATOM 837 CA GLU A 55 -1.943 7.831 -3.265 1.00 5.24 C ATOM 838 C GLU A 55 -2.852 7.719 -2.044 1.00 61.53 C ATOM 839 O GLU A 55 -2.453 8.043 -0.925 1.00 43.24 O ATOM 840 CB GLU A 55 -1.987 9.257 -3.817 1.00 43.43 C ATOM 841 CG GLU A 55 -3.319 9.624 -4.450 1.00 65.34 C ATOM 842 CD GLU A 55 -3.167 10.155 -5.863 1.00 23.43 C ATOM 843 OE1 GLU A 55 -2.614 9.426 -6.713 1.00 74.15 O ATOM 844 OE2 GLU A 55 -3.599 11.298 -6.117 1.00 75.11 O ATOM 0 H GLU A 55 -2.527 7.292 -5.205 1.00 63.15 H new ATOM 0 HA GLU A 55 -0.923 7.598 -2.960 1.00 5.24 H new ATOM 0 HB2 GLU A 55 -1.773 9.957 -3.009 1.00 43.43 H new ATOM 0 HB3 GLU A 55 -1.197 9.375 -4.559 1.00 43.43 H new ATOM 0 HG2 GLU A 55 -3.965 8.746 -4.463 1.00 65.34 H new ATOM 0 HG3 GLU A 55 -3.815 10.375 -3.835 1.00 65.34 H new ATOM 851 N THR A 56 -4.078 7.256 -2.268 1.00 52.30 N ATOM 852 CA THR A 56 -5.045 7.102 -1.189 1.00 35.01 C ATOM 853 C THR A 56 -5.135 5.650 -0.735 1.00 34.34 C ATOM 854 O THR A 56 -5.000 4.727 -1.539 1.00 41.14 O ATOM 855 CB THR A 56 -6.445 7.582 -1.616 1.00 74.14 C ATOM 856 OG1 THR A 56 -7.031 6.639 -2.522 1.00 10.54 O ATOM 857 CG2 THR A 56 -6.370 8.949 -2.279 1.00 2.33 C ATOM 0 H THR A 56 -4.424 6.981 -3.187 1.00 52.30 H new ATOM 0 HA THR A 56 -4.695 7.718 -0.361 1.00 35.01 H new ATOM 0 HB THR A 56 -7.065 7.662 -0.723 1.00 74.14 H new ATOM 0 HG1 THR A 56 -7.975 6.863 -2.663 1.00 10.54 H new ATOM 0 HG21 THR A 56 -7.371 9.267 -2.572 1.00 2.33 H new ATOM 0 HG22 THR A 56 -5.951 9.671 -1.578 1.00 2.33 H new ATOM 0 HG23 THR A 56 -5.735 8.890 -3.163 1.00 2.33 H new ATOM 865 N LEU A 57 -5.365 5.453 0.559 1.00 72.41 N ATOM 866 CA LEU A 57 -5.474 4.111 1.121 1.00 73.32 C ATOM 867 C LEU A 57 -6.688 3.380 0.555 1.00 41.41 C ATOM 868 O LEU A 57 -6.631 2.182 0.280 1.00 61.33 O ATOM 869 CB LEU A 57 -5.573 4.182 2.646 1.00 63.53 C ATOM 870 CG LEU A 57 -4.451 3.493 3.423 1.00 23.34 C ATOM 871 CD1 LEU A 57 -4.729 3.542 4.918 1.00 42.03 C ATOM 872 CD2 LEU A 57 -4.284 2.054 2.957 1.00 32.32 C ATOM 0 H LEU A 57 -5.480 6.205 1.238 1.00 72.41 H new ATOM 0 HA LEU A 57 -4.578 3.555 0.846 1.00 73.32 H new ATOM 0 HB2 LEU A 57 -5.601 5.231 2.940 1.00 63.53 H new ATOM 0 HB3 LEU A 57 -6.522 3.741 2.950 1.00 63.53 H new ATOM 0 HG LEU A 57 -3.521 4.027 3.229 1.00 23.34 H new ATOM 0 HD11 LEU A 57 -3.920 3.047 5.455 1.00 42.03 H new ATOM 0 HD12 LEU A 57 -4.797 4.581 5.242 1.00 42.03 H new ATOM 0 HD13 LEU A 57 -5.670 3.034 5.130 1.00 42.03 H new ATOM 0 HD21 LEU A 57 -3.481 1.580 3.521 1.00 32.32 H new ATOM 0 HD22 LEU A 57 -5.213 1.509 3.120 1.00 32.32 H new ATOM 0 HD23 LEU A 57 -4.038 2.042 1.895 1.00 32.32 H new ATOM 884 N ASP A 58 -7.784 4.111 0.382 1.00 63.03 N ATOM 885 CA ASP A 58 -9.011 3.534 -0.155 1.00 23.31 C ATOM 886 C ASP A 58 -8.781 2.975 -1.556 1.00 21.44 C ATOM 887 O ASP A 58 -9.227 1.873 -1.875 1.00 21.14 O ATOM 888 CB ASP A 58 -10.122 4.584 -0.188 1.00 30.15 C ATOM 889 CG ASP A 58 -10.231 5.353 1.115 1.00 64.43 C ATOM 890 OD1 ASP A 58 -9.933 4.766 2.177 1.00 52.32 O ATOM 891 OD2 ASP A 58 -10.612 6.541 1.072 1.00 70.32 O ATOM 0 H ASP A 58 -7.848 5.104 0.606 1.00 63.03 H new ATOM 0 HA ASP A 58 -9.314 2.716 0.498 1.00 23.31 H new ATOM 0 HB2 ASP A 58 -9.934 5.282 -1.004 1.00 30.15 H new ATOM 0 HB3 ASP A 58 -11.073 4.096 -0.399 1.00 30.15 H new ATOM 896 N GLN A 59 -8.083 3.742 -2.387 1.00 15.44 N ATOM 897 CA GLN A 59 -7.797 3.324 -3.754 1.00 24.25 C ATOM 898 C GLN A 59 -6.966 2.045 -3.768 1.00 74.42 C ATOM 899 O GLN A 59 -7.331 1.063 -4.416 1.00 70.43 O ATOM 900 CB GLN A 59 -7.059 4.433 -4.505 1.00 1.30 C ATOM 901 CG GLN A 59 -7.976 5.527 -5.028 1.00 43.23 C ATOM 902 CD GLN A 59 -8.154 5.469 -6.533 1.00 35.34 C ATOM 903 OE1 GLN A 59 -7.910 4.437 -7.159 1.00 3.12 O ATOM 904 NE2 GLN A 59 -8.584 6.579 -7.122 1.00 23.34 N ATOM 0 H GLN A 59 -7.705 4.656 -2.138 1.00 15.44 H new ATOM 0 HA GLN A 59 -8.746 3.126 -4.253 1.00 24.25 H new ATOM 0 HB2 GLN A 59 -6.317 4.878 -3.842 1.00 1.30 H new ATOM 0 HB3 GLN A 59 -6.516 3.994 -5.342 1.00 1.30 H new ATOM 0 HG2 GLN A 59 -8.950 5.440 -4.547 1.00 43.23 H new ATOM 0 HG3 GLN A 59 -7.570 6.500 -4.751 1.00 43.23 H new ATOM 0 HE21 GLN A 59 -8.774 7.412 -6.564 1.00 23.34 H new ATOM 0 HE22 GLN A 59 -8.724 6.599 -8.132 1.00 23.34 H new ATOM 913 N LEU A 60 -5.849 2.063 -3.051 1.00 24.53 N ATOM 914 CA LEU A 60 -4.965 0.904 -2.981 1.00 73.51 C ATOM 915 C LEU A 60 -5.734 -0.342 -2.552 1.00 11.01 C ATOM 916 O LEU A 60 -5.474 -1.442 -3.039 1.00 33.41 O ATOM 917 CB LEU A 60 -3.818 1.170 -2.005 1.00 42.04 C ATOM 918 CG LEU A 60 -2.874 -0.004 -1.742 1.00 35.21 C ATOM 919 CD1 LEU A 60 -1.582 0.163 -2.526 1.00 74.44 C ATOM 920 CD2 LEU A 60 -2.584 -0.132 -0.254 1.00 12.45 C ATOM 0 H LEU A 60 -5.533 2.867 -2.509 1.00 24.53 H new ATOM 0 HA LEU A 60 -4.554 0.731 -3.976 1.00 73.51 H new ATOM 0 HB2 LEU A 60 -3.230 2.005 -2.386 1.00 42.04 H new ATOM 0 HB3 LEU A 60 -4.244 1.488 -1.053 1.00 42.04 H new ATOM 0 HG LEU A 60 -3.362 -0.919 -2.077 1.00 35.21 H new ATOM 0 HD11 LEU A 60 -0.923 -0.682 -2.326 1.00 74.44 H new ATOM 0 HD12 LEU A 60 -1.806 0.204 -3.592 1.00 74.44 H new ATOM 0 HD13 LEU A 60 -1.089 1.087 -2.223 1.00 74.44 H new ATOM 0 HD21 LEU A 60 -1.911 -0.972 -0.086 1.00 12.45 H new ATOM 0 HD22 LEU A 60 -2.117 0.785 0.106 1.00 12.45 H new ATOM 0 HD23 LEU A 60 -3.516 -0.300 0.285 1.00 12.45 H new ATOM 932 N ARG A 61 -6.683 -0.160 -1.639 1.00 24.21 N ATOM 933 CA ARG A 61 -7.490 -1.269 -1.145 1.00 31.01 C ATOM 934 C ARG A 61 -8.311 -1.888 -2.272 1.00 73.02 C ATOM 935 O ARG A 61 -8.328 -3.107 -2.446 1.00 21.45 O ATOM 936 CB ARG A 61 -8.418 -0.793 -0.026 1.00 21.24 C ATOM 937 CG ARG A 61 -8.039 -1.325 1.347 1.00 73.41 C ATOM 938 CD ARG A 61 -8.735 -0.552 2.456 1.00 40.52 C ATOM 939 NE ARG A 61 -9.622 -1.403 3.244 1.00 10.20 N ATOM 940 CZ ARG A 61 -10.414 -0.946 4.208 1.00 70.13 C ATOM 941 NH1 ARG A 61 -10.430 0.347 4.500 1.00 4.03 N ATOM 942 NH2 ARG A 61 -11.193 -1.783 4.881 1.00 60.44 N ATOM 0 H ARG A 61 -6.912 0.745 -1.227 1.00 24.21 H new ATOM 0 HA ARG A 61 -6.816 -2.029 -0.750 1.00 31.01 H new ATOM 0 HB2 ARG A 61 -8.411 0.297 0.001 1.00 21.24 H new ATOM 0 HB3 ARG A 61 -9.438 -1.100 -0.256 1.00 21.24 H new ATOM 0 HG2 ARG A 61 -8.304 -2.380 1.416 1.00 73.41 H new ATOM 0 HG3 ARG A 61 -6.959 -1.259 1.479 1.00 73.41 H new ATOM 0 HD2 ARG A 61 -7.987 -0.104 3.110 1.00 40.52 H new ATOM 0 HD3 ARG A 61 -9.309 0.266 2.022 1.00 40.52 H new ATOM 0 HE ARG A 61 -9.634 -2.403 3.043 1.00 10.20 H new ATOM 0 HH11 ARG A 61 -9.833 0.994 3.984 1.00 4.03 H new ATOM 0 HH12 ARG A 61 -11.039 0.695 5.241 1.00 4.03 H new ATOM 0 HH21 ARG A 61 -11.184 -2.778 4.659 1.00 60.44 H new ATOM 0 HH22 ARG A 61 -11.801 -1.431 5.621 1.00 60.44 H new ATOM 956 N LEU A 62 -8.992 -1.040 -3.036 1.00 22.24 N ATOM 957 CA LEU A 62 -9.816 -1.503 -4.147 1.00 31.34 C ATOM 958 C LEU A 62 -8.955 -2.125 -5.241 1.00 70.33 C ATOM 959 O LEU A 62 -9.434 -2.931 -6.040 1.00 4.13 O ATOM 960 CB LEU A 62 -10.632 -0.343 -4.721 1.00 25.44 C ATOM 961 CG LEU A 62 -11.521 -0.676 -5.919 1.00 64.42 C ATOM 962 CD1 LEU A 62 -12.443 -1.841 -5.593 1.00 3.23 C ATOM 963 CD2 LEU A 62 -12.327 0.543 -6.340 1.00 53.31 C ATOM 0 H LEU A 62 -8.990 -0.028 -2.906 1.00 22.24 H new ATOM 0 HA LEU A 62 -10.497 -2.266 -3.769 1.00 31.34 H new ATOM 0 HB2 LEU A 62 -11.262 0.060 -3.928 1.00 25.44 H new ATOM 0 HB3 LEU A 62 -9.943 0.449 -5.014 1.00 25.44 H new ATOM 0 HG LEU A 62 -10.881 -0.969 -6.751 1.00 64.42 H new ATOM 0 HD11 LEU A 62 -13.068 -2.063 -6.458 1.00 3.23 H new ATOM 0 HD12 LEU A 62 -11.846 -2.718 -5.341 1.00 3.23 H new ATOM 0 HD13 LEU A 62 -13.076 -1.578 -4.746 1.00 3.23 H new ATOM 0 HD21 LEU A 62 -12.954 0.287 -7.194 1.00 53.31 H new ATOM 0 HD22 LEU A 62 -12.957 0.867 -5.511 1.00 53.31 H new ATOM 0 HD23 LEU A 62 -11.649 1.350 -6.617 1.00 53.31 H new ATOM 975 N VAL A 63 -7.681 -1.747 -5.271 1.00 61.33 N ATOM 976 CA VAL A 63 -6.752 -2.270 -6.266 1.00 24.34 C ATOM 977 C VAL A 63 -6.439 -3.740 -6.006 1.00 45.40 C ATOM 978 O VAL A 63 -6.724 -4.602 -6.837 1.00 55.34 O ATOM 979 CB VAL A 63 -5.435 -1.471 -6.279 1.00 12.23 C ATOM 980 CG1 VAL A 63 -4.466 -2.054 -7.296 1.00 53.31 C ATOM 981 CG2 VAL A 63 -5.707 -0.003 -6.569 1.00 41.54 C ATOM 0 H VAL A 63 -7.269 -1.081 -4.618 1.00 61.33 H new ATOM 0 HA VAL A 63 -7.238 -2.171 -7.236 1.00 24.34 H new ATOM 0 HB VAL A 63 -4.976 -1.544 -5.293 1.00 12.23 H new ATOM 0 HG11 VAL A 63 -3.542 -1.476 -7.291 1.00 53.31 H new ATOM 0 HG12 VAL A 63 -4.248 -3.090 -7.038 1.00 53.31 H new ATOM 0 HG13 VAL A 63 -4.913 -2.014 -8.289 1.00 53.31 H new ATOM 0 HG21 VAL A 63 -4.766 0.547 -6.575 1.00 41.54 H new ATOM 0 HG22 VAL A 63 -6.189 0.092 -7.542 1.00 41.54 H new ATOM 0 HG23 VAL A 63 -6.361 0.405 -5.799 1.00 41.54 H new ATOM 991 N ILE A 64 -5.850 -4.018 -4.848 1.00 11.34 N ATOM 992 CA ILE A 64 -5.500 -5.383 -4.478 1.00 23.41 C ATOM 993 C ILE A 64 -6.711 -6.305 -4.566 1.00 54.03 C ATOM 994 O ILE A 64 -6.602 -7.450 -5.007 1.00 54.21 O ATOM 995 CB ILE A 64 -4.921 -5.450 -3.052 1.00 53.21 C ATOM 996 CG1 ILE A 64 -4.628 -6.901 -2.664 1.00 52.42 C ATOM 997 CG2 ILE A 64 -5.884 -4.815 -2.060 1.00 0.41 C ATOM 998 CD1 ILE A 64 -3.992 -7.044 -1.299 1.00 75.52 C ATOM 0 H ILE A 64 -5.605 -3.316 -4.150 1.00 11.34 H new ATOM 0 HA ILE A 64 -4.741 -5.716 -5.186 1.00 23.41 H new ATOM 0 HB ILE A 64 -3.985 -4.892 -3.029 1.00 53.21 H new ATOM 0 HG12 ILE A 64 -5.558 -7.469 -2.684 1.00 52.42 H new ATOM 0 HG13 ILE A 64 -3.969 -7.343 -3.411 1.00 52.42 H new ATOM 0 HG21 ILE A 64 -5.461 -4.870 -1.057 1.00 0.41 H new ATOM 0 HG22 ILE A 64 -6.047 -3.771 -2.329 1.00 0.41 H new ATOM 0 HG23 ILE A 64 -6.834 -5.348 -2.083 1.00 0.41 H new ATOM 0 HD11 ILE A 64 -3.812 -8.099 -1.090 1.00 75.52 H new ATOM 0 HD12 ILE A 64 -3.045 -6.504 -1.280 1.00 75.52 H new ATOM 0 HD13 ILE A 64 -4.659 -6.633 -0.542 1.00 75.52 H new ATOM 1010 N CYS A 65 -7.865 -5.798 -4.146 1.00 51.14 N ATOM 1011 CA CYS A 65 -9.099 -6.575 -4.179 1.00 61.20 C ATOM 1012 C CYS A 65 -9.530 -6.851 -5.616 1.00 10.12 C ATOM 1013 O CYS A 65 -9.902 -7.973 -5.958 1.00 72.43 O ATOM 1014 CB CYS A 65 -10.211 -5.837 -3.433 1.00 11.03 C ATOM 1015 SG CYS A 65 -11.821 -6.657 -3.508 1.00 22.13 S ATOM 0 H CYS A 65 -7.972 -4.852 -3.779 1.00 51.14 H new ATOM 0 HA CYS A 65 -8.912 -7.529 -3.686 1.00 61.20 H new ATOM 0 HB2 CYS A 65 -9.921 -5.725 -2.388 1.00 11.03 H new ATOM 0 HB3 CYS A 65 -10.307 -4.833 -3.847 1.00 11.03 H new ATOM 0 HG CYS A 65 -12.695 -5.958 -2.847 1.00 22.13 H new ATOM 1021 N ASP A 66 -9.479 -5.820 -6.451 1.00 43.44 N ATOM 1022 CA ASP A 66 -9.865 -5.950 -7.852 1.00 25.13 C ATOM 1023 C ASP A 66 -8.982 -6.969 -8.566 1.00 3.21 C ATOM 1024 O ASP A 66 -9.475 -7.829 -9.297 1.00 45.11 O ATOM 1025 CB ASP A 66 -9.774 -4.596 -8.556 1.00 40.52 C ATOM 1026 CG ASP A 66 -9.977 -4.707 -10.054 1.00 72.44 C ATOM 1027 OD1 ASP A 66 -10.784 -5.560 -10.482 1.00 40.41 O ATOM 1028 OD2 ASP A 66 -9.330 -3.942 -10.799 1.00 71.22 O ATOM 0 H ASP A 66 -9.174 -4.884 -6.183 1.00 43.44 H new ATOM 0 HA ASP A 66 -10.896 -6.301 -7.888 1.00 25.13 H new ATOM 0 HB2 ASP A 66 -10.523 -3.922 -8.140 1.00 40.52 H new ATOM 0 HB3 ASP A 66 -8.799 -4.151 -8.356 1.00 40.52 H new ATOM 1033 N LEU A 67 -7.675 -6.866 -8.350 1.00 40.44 N ATOM 1034 CA LEU A 67 -6.722 -7.777 -8.974 1.00 73.43 C ATOM 1035 C LEU A 67 -6.860 -9.184 -8.402 1.00 32.43 C ATOM 1036 O LEU A 67 -6.991 -10.156 -9.145 1.00 34.51 O ATOM 1037 CB LEU A 67 -5.293 -7.270 -8.772 1.00 54.03 C ATOM 1038 CG LEU A 67 -4.179 -8.175 -9.300 1.00 11.43 C ATOM 1039 CD1 LEU A 67 -3.895 -7.874 -10.763 1.00 52.02 C ATOM 1040 CD2 LEU A 67 -2.918 -8.009 -8.465 1.00 3.12 C ATOM 0 H LEU A 67 -7.251 -6.161 -7.747 1.00 40.44 H new ATOM 0 HA LEU A 67 -6.939 -7.815 -10.041 1.00 73.43 H new ATOM 0 HB2 LEU A 67 -5.202 -6.297 -9.254 1.00 54.03 H new ATOM 0 HB3 LEU A 67 -5.132 -7.113 -7.705 1.00 54.03 H new ATOM 0 HG LEU A 67 -4.510 -9.211 -9.221 1.00 11.43 H new ATOM 0 HD11 LEU A 67 -3.100 -8.528 -11.121 1.00 52.02 H new ATOM 0 HD12 LEU A 67 -4.797 -8.044 -11.351 1.00 52.02 H new ATOM 0 HD13 LEU A 67 -3.585 -6.834 -10.867 1.00 52.02 H new ATOM 0 HD21 LEU A 67 -2.135 -8.660 -8.854 1.00 3.12 H new ATOM 0 HD22 LEU A 67 -2.584 -6.972 -8.512 1.00 3.12 H new ATOM 0 HD23 LEU A 67 -3.130 -8.275 -7.429 1.00 3.12 H new ATOM 1052 N GLN A 68 -6.831 -9.284 -7.077 1.00 14.14 N ATOM 1053 CA GLN A 68 -6.955 -10.572 -6.405 1.00 23.30 C ATOM 1054 C GLN A 68 -8.281 -11.241 -6.750 1.00 71.31 C ATOM 1055 O GLN A 68 -8.391 -12.467 -6.733 1.00 12.33 O ATOM 1056 CB GLN A 68 -6.839 -10.395 -4.890 1.00 45.41 C ATOM 1057 CG GLN A 68 -6.964 -11.695 -4.114 1.00 33.44 C ATOM 1058 CD GLN A 68 -6.701 -11.518 -2.631 1.00 71.02 C ATOM 1059 OE1 GLN A 68 -6.008 -10.587 -2.219 1.00 72.40 O ATOM 1060 NE2 GLN A 68 -7.254 -12.412 -1.820 1.00 74.23 N ATOM 0 H GLN A 68 -6.723 -8.489 -6.448 1.00 14.14 H new ATOM 0 HA GLN A 68 -6.144 -11.213 -6.752 1.00 23.30 H new ATOM 0 HB2 GLN A 68 -5.878 -9.935 -4.659 1.00 45.41 H new ATOM 0 HB3 GLN A 68 -7.612 -9.705 -4.553 1.00 45.41 H new ATOM 0 HG2 GLN A 68 -7.965 -12.103 -4.255 1.00 33.44 H new ATOM 0 HG3 GLN A 68 -6.262 -12.424 -4.519 1.00 33.44 H new ATOM 0 HE21 GLN A 68 -7.821 -13.168 -2.205 1.00 74.23 H new ATOM 0 HE22 GLN A 68 -7.112 -12.343 -0.812 1.00 74.23 H new ATOM 1069 N GLU A 69 -9.285 -10.428 -7.063 1.00 1.11 N ATOM 1070 CA GLU A 69 -10.604 -10.942 -7.411 1.00 32.52 C ATOM 1071 C GLU A 69 -10.581 -11.620 -8.778 1.00 41.42 C ATOM 1072 O GLU A 69 -10.851 -12.815 -8.895 1.00 41.03 O ATOM 1073 CB GLU A 69 -11.635 -9.811 -7.407 1.00 64.32 C ATOM 1074 CG GLU A 69 -13.029 -10.256 -7.816 1.00 24.41 C ATOM 1075 CD GLU A 69 -14.121 -9.469 -7.118 1.00 44.01 C ATOM 1076 OE1 GLU A 69 -14.068 -9.352 -5.876 1.00 65.41 O ATOM 1077 OE2 GLU A 69 -15.028 -8.969 -7.815 1.00 53.11 O ATOM 0 H GLU A 69 -9.210 -9.411 -7.083 1.00 1.11 H new ATOM 0 HA GLU A 69 -10.886 -11.683 -6.662 1.00 32.52 H new ATOM 0 HB2 GLU A 69 -11.680 -9.376 -6.409 1.00 64.32 H new ATOM 0 HB3 GLU A 69 -11.301 -9.024 -8.083 1.00 64.32 H new ATOM 0 HG2 GLU A 69 -13.140 -10.146 -8.895 1.00 24.41 H new ATOM 0 HG3 GLU A 69 -13.149 -11.316 -7.590 1.00 24.41 H new ATOM 1084 N ARG A 70 -10.257 -10.846 -9.809 1.00 61.33 N ATOM 1085 CA ARG A 70 -10.200 -11.370 -11.169 1.00 0.12 C ATOM 1086 C ARG A 70 -9.135 -12.457 -11.289 1.00 14.53 C ATOM 1087 O ARG A 70 -9.380 -13.519 -11.861 1.00 52.41 O ATOM 1088 CB ARG A 70 -9.907 -10.242 -12.160 1.00 71.55 C ATOM 1089 CG ARG A 70 -11.152 -9.673 -12.820 1.00 74.14 C ATOM 1090 CD ARG A 70 -11.179 -9.972 -14.311 1.00 60.12 C ATOM 1091 NE ARG A 70 -12.529 -9.887 -14.863 1.00 4.45 N ATOM 1092 CZ ARG A 70 -12.816 -10.109 -16.140 1.00 41.02 C ATOM 1093 NH1 ARG A 70 -11.853 -10.429 -16.994 1.00 11.13 N ATOM 1094 NH2 ARG A 70 -14.069 -10.012 -16.566 1.00 42.14 N ATOM 0 H ARG A 70 -10.030 -9.855 -9.729 1.00 61.33 H new ATOM 0 HA ARG A 70 -11.170 -11.809 -11.404 1.00 0.12 H new ATOM 0 HB2 ARG A 70 -9.383 -9.440 -11.640 1.00 71.55 H new ATOM 0 HB3 ARG A 70 -9.234 -10.614 -12.933 1.00 71.55 H new ATOM 0 HG2 ARG A 70 -12.040 -10.093 -12.348 1.00 74.14 H new ATOM 0 HG3 ARG A 70 -11.188 -8.595 -12.663 1.00 74.14 H new ATOM 0 HD2 ARG A 70 -10.529 -9.270 -14.833 1.00 60.12 H new ATOM 0 HD3 ARG A 70 -10.777 -10.970 -14.488 1.00 60.12 H new ATOM 0 HE ARG A 70 -13.293 -9.644 -14.233 1.00 4.45 H new ATOM 0 HH11 ARG A 70 -10.889 -10.505 -16.670 1.00 11.13 H new ATOM 0 HH12 ARG A 70 -12.077 -10.599 -17.975 1.00 11.13 H new ATOM 0 HH21 ARG A 70 -14.812 -9.767 -15.912 1.00 42.14 H new ATOM 0 HH22 ARG A 70 -14.289 -10.183 -17.547 1.00 42.14 H new ATOM 1108 N ARG A 71 -7.954 -12.183 -10.746 1.00 2.44 N ATOM 1109 CA ARG A 71 -6.852 -13.136 -10.793 1.00 44.33 C ATOM 1110 C ARG A 71 -7.264 -14.474 -10.187 1.00 5.11 C ATOM 1111 O ARG A 71 -6.993 -15.532 -10.753 1.00 65.05 O ATOM 1112 CB ARG A 71 -5.636 -12.579 -10.050 1.00 22.40 C ATOM 1113 CG ARG A 71 -4.946 -11.438 -10.779 1.00 12.32 C ATOM 1114 CD ARG A 71 -4.320 -11.907 -12.083 1.00 3.34 C ATOM 1115 NE ARG A 71 -5.104 -11.498 -13.245 1.00 1.11 N ATOM 1116 CZ ARG A 71 -4.883 -11.947 -14.475 1.00 44.34 C ATOM 1117 NH1 ARG A 71 -3.906 -12.814 -14.703 1.00 32.44 N ATOM 1118 NH2 ARG A 71 -5.639 -11.528 -15.482 1.00 12.32 N ATOM 0 H ARG A 71 -7.735 -11.309 -10.268 1.00 2.44 H new ATOM 0 HA ARG A 71 -6.588 -13.297 -11.838 1.00 44.33 H new ATOM 0 HB2 ARG A 71 -5.950 -12.232 -9.065 1.00 22.40 H new ATOM 0 HB3 ARG A 71 -4.918 -13.384 -9.891 1.00 22.40 H new ATOM 0 HG2 ARG A 71 -5.667 -10.647 -10.984 1.00 12.32 H new ATOM 0 HG3 ARG A 71 -4.176 -11.008 -10.138 1.00 12.32 H new ATOM 0 HD2 ARG A 71 -3.311 -11.503 -12.166 1.00 3.34 H new ATOM 0 HD3 ARG A 71 -4.229 -12.993 -12.071 1.00 3.34 H new ATOM 0 HE ARG A 71 -5.863 -10.831 -13.104 1.00 1.11 H new ATOM 0 HH11 ARG A 71 -3.322 -13.138 -13.932 1.00 32.44 H new ATOM 0 HH12 ARG A 71 -3.739 -13.157 -15.649 1.00 32.44 H new ATOM 0 HH21 ARG A 71 -6.391 -10.860 -15.312 1.00 12.32 H new ATOM 0 HH22 ARG A 71 -5.468 -11.874 -16.426 1.00 12.32 H new ATOM 1132 N GLU A 72 -7.919 -14.418 -9.032 1.00 1.34 N ATOM 1133 CA GLU A 72 -8.366 -15.626 -8.348 1.00 54.25 C ATOM 1134 C GLU A 72 -9.291 -16.446 -9.243 1.00 61.25 C ATOM 1135 O GLU A 72 -9.113 -17.654 -9.399 1.00 24.54 O ATOM 1136 CB GLU A 72 -9.086 -15.266 -7.047 1.00 51.41 C ATOM 1137 CG GLU A 72 -9.711 -16.460 -6.347 1.00 34.14 C ATOM 1138 CD GLU A 72 -9.547 -16.405 -4.840 1.00 41.02 C ATOM 1139 OE1 GLU A 72 -8.390 -16.346 -4.372 1.00 74.12 O ATOM 1140 OE2 GLU A 72 -10.573 -16.421 -4.130 1.00 15.03 O ATOM 0 H GLU A 72 -8.152 -13.550 -8.550 1.00 1.34 H new ATOM 0 HA GLU A 72 -7.487 -16.227 -8.114 1.00 54.25 H new ATOM 0 HB2 GLU A 72 -8.378 -14.788 -6.370 1.00 51.41 H new ATOM 0 HB3 GLU A 72 -9.864 -14.534 -7.263 1.00 51.41 H new ATOM 0 HG2 GLU A 72 -10.772 -16.505 -6.592 1.00 34.14 H new ATOM 0 HG3 GLU A 72 -9.257 -17.376 -6.725 1.00 34.14 H new ATOM 1147 N LYS A 73 -10.280 -15.781 -9.830 1.00 51.22 N ATOM 1148 CA LYS A 73 -11.233 -16.446 -10.710 1.00 55.35 C ATOM 1149 C LYS A 73 -10.513 -17.185 -11.833 1.00 71.33 C ATOM 1150 O LYS A 73 -10.913 -18.282 -12.224 1.00 52.15 O ATOM 1151 CB LYS A 73 -12.210 -15.426 -11.301 1.00 71.33 C ATOM 1152 CG LYS A 73 -13.050 -14.713 -10.257 1.00 14.35 C ATOM 1153 CD LYS A 73 -14.400 -15.386 -10.072 1.00 12.43 C ATOM 1154 CE LYS A 73 -14.701 -15.636 -8.602 1.00 74.31 C ATOM 1155 NZ LYS A 73 -15.561 -16.837 -8.409 1.00 55.41 N ATOM 0 H LYS A 73 -10.442 -14.781 -9.712 1.00 51.22 H new ATOM 0 HA LYS A 73 -11.789 -17.173 -10.119 1.00 55.35 H new ATOM 0 HB2 LYS A 73 -11.649 -14.686 -11.871 1.00 71.33 H new ATOM 0 HB3 LYS A 73 -12.872 -15.934 -12.003 1.00 71.33 H new ATOM 0 HG2 LYS A 73 -12.516 -14.699 -9.307 1.00 14.35 H new ATOM 0 HG3 LYS A 73 -13.198 -13.675 -10.555 1.00 14.35 H new ATOM 0 HD2 LYS A 73 -15.182 -14.761 -10.503 1.00 12.43 H new ATOM 0 HD3 LYS A 73 -14.413 -16.332 -10.613 1.00 12.43 H new ATOM 0 HE2 LYS A 73 -13.766 -15.767 -8.057 1.00 74.31 H new ATOM 0 HE3 LYS A 73 -15.197 -14.762 -8.179 1.00 74.31 H new ATOM 0 HZ1 LYS A 73 -15.744 -16.974 -7.394 1.00 55.41 H new ATOM 0 HZ2 LYS A 73 -16.463 -16.702 -8.908 1.00 55.41 H new ATOM 0 HZ3 LYS A 73 -15.077 -17.675 -8.790 1.00 55.41 H new ATOM 1169 N PHE A 74 -9.448 -16.579 -12.347 1.00 40.10 N ATOM 1170 CA PHE A 74 -8.671 -17.181 -13.425 1.00 14.43 C ATOM 1171 C PHE A 74 -7.771 -18.292 -12.892 1.00 15.32 C ATOM 1172 O PHE A 74 -7.413 -19.218 -13.618 1.00 53.54 O ATOM 1173 CB PHE A 74 -7.826 -16.117 -14.128 1.00 5.23 C ATOM 1174 CG PHE A 74 -7.145 -16.617 -15.370 1.00 52.40 C ATOM 1175 CD1 PHE A 74 -7.878 -17.205 -16.388 1.00 51.54 C ATOM 1176 CD2 PHE A 74 -5.773 -16.499 -15.519 1.00 43.12 C ATOM 1177 CE1 PHE A 74 -7.255 -17.665 -17.533 1.00 72.11 C ATOM 1178 CE2 PHE A 74 -5.144 -16.957 -16.662 1.00 35.23 C ATOM 1179 CZ PHE A 74 -5.886 -17.542 -17.669 1.00 74.24 C ATOM 0 H PHE A 74 -9.103 -15.671 -12.035 1.00 40.10 H new ATOM 0 HA PHE A 74 -9.367 -17.615 -14.143 1.00 14.43 H new ATOM 0 HB2 PHE A 74 -8.463 -15.272 -14.388 1.00 5.23 H new ATOM 0 HB3 PHE A 74 -7.072 -15.746 -13.434 1.00 5.23 H new ATOM 0 HD1 PHE A 74 -8.948 -17.305 -16.286 1.00 51.54 H new ATOM 0 HD2 PHE A 74 -5.188 -16.044 -14.733 1.00 43.12 H new ATOM 0 HE1 PHE A 74 -7.838 -18.120 -18.320 1.00 72.11 H new ATOM 0 HE2 PHE A 74 -4.074 -16.857 -16.767 1.00 35.23 H new ATOM 0 HZ PHE A 74 -5.397 -17.903 -18.562 1.00 74.24 H new ATOM 1189 N GLY A 75 -7.409 -18.191 -11.616 1.00 72.34 N ATOM 1190 CA GLY A 75 -6.554 -19.193 -11.007 1.00 42.02 C ATOM 1191 C GLY A 75 -5.463 -18.581 -10.151 1.00 42.23 C ATOM 1192 O GLY A 75 -5.241 -17.371 -10.189 1.00 3.42 O ATOM 0 H GLY A 75 -7.692 -17.434 -10.994 1.00 72.34 H new ATOM 0 HA2 GLY A 75 -7.161 -19.860 -10.395 1.00 42.02 H new ATOM 0 HA3 GLY A 75 -6.100 -19.802 -11.788 1.00 42.02 H new ATOM 1196 N SER A 76 -4.781 -19.418 -9.376 1.00 60.12 N ATOM 1197 CA SER A 76 -3.711 -18.951 -8.503 1.00 23.34 C ATOM 1198 C SER A 76 -2.350 -19.123 -9.171 1.00 30.41 C ATOM 1199 O SER A 76 -2.154 -20.029 -9.982 1.00 13.25 O ATOM 1200 CB SER A 76 -3.739 -19.711 -7.175 1.00 74.11 C ATOM 1201 OG SER A 76 -2.906 -19.088 -6.213 1.00 35.03 O ATOM 0 H SER A 76 -4.951 -20.423 -9.335 1.00 60.12 H new ATOM 0 HA SER A 76 -3.870 -17.890 -8.310 1.00 23.34 H new ATOM 0 HB2 SER A 76 -4.761 -19.757 -6.800 1.00 74.11 H new ATOM 0 HB3 SER A 76 -3.411 -20.738 -7.333 1.00 74.11 H new ATOM 0 HG SER A 76 -2.943 -19.592 -5.373 1.00 35.03 H new ATOM 1207 N SER A 77 -1.413 -18.247 -8.824 1.00 65.23 N ATOM 1208 CA SER A 77 -0.071 -18.299 -9.393 1.00 4.44 C ATOM 1209 C SER A 77 0.910 -17.494 -8.545 1.00 14.33 C ATOM 1210 O SER A 77 0.533 -16.515 -7.899 1.00 60.23 O ATOM 1211 CB SER A 77 -0.080 -17.765 -10.826 1.00 53.33 C ATOM 1212 OG SER A 77 0.309 -16.403 -10.866 1.00 4.20 O ATOM 0 H SER A 77 -1.558 -17.493 -8.152 1.00 65.23 H new ATOM 0 HA SER A 77 0.252 -19.340 -9.403 1.00 4.44 H new ATOM 0 HB2 SER A 77 0.596 -18.358 -11.442 1.00 53.33 H new ATOM 0 HB3 SER A 77 -1.078 -17.874 -11.252 1.00 53.33 H new ATOM 0 HG SER A 77 0.296 -16.086 -11.793 1.00 4.20 H new ATOM 1218 N LYS A 78 2.170 -17.913 -8.551 1.00 64.11 N ATOM 1219 CA LYS A 78 3.207 -17.233 -7.785 1.00 5.43 C ATOM 1220 C LYS A 78 3.225 -15.740 -8.098 1.00 53.11 C ATOM 1221 O LYS A 78 3.462 -14.915 -7.217 1.00 2.32 O ATOM 1222 CB LYS A 78 4.578 -17.844 -8.087 1.00 14.23 C ATOM 1223 CG LYS A 78 5.368 -18.209 -6.842 1.00 63.24 C ATOM 1224 CD LYS A 78 6.848 -18.367 -7.148 1.00 43.44 C ATOM 1225 CE LYS A 78 7.468 -19.495 -6.339 1.00 31.32 C ATOM 1226 NZ LYS A 78 7.932 -19.029 -5.003 1.00 25.42 N ATOM 0 H LYS A 78 2.498 -18.722 -9.079 1.00 64.11 H new ATOM 0 HA LYS A 78 2.984 -17.362 -6.726 1.00 5.43 H new ATOM 0 HB2 LYS A 78 4.442 -18.738 -8.696 1.00 14.23 H new ATOM 0 HB3 LYS A 78 5.158 -17.138 -8.682 1.00 14.23 H new ATOM 0 HG2 LYS A 78 5.232 -17.437 -6.084 1.00 63.24 H new ATOM 0 HG3 LYS A 78 4.981 -19.138 -6.423 1.00 63.24 H new ATOM 0 HD2 LYS A 78 6.981 -18.565 -8.212 1.00 43.44 H new ATOM 0 HD3 LYS A 78 7.367 -17.434 -6.930 1.00 43.44 H new ATOM 0 HE2 LYS A 78 6.738 -20.294 -6.211 1.00 31.32 H new ATOM 0 HE3 LYS A 78 8.309 -19.917 -6.889 1.00 31.32 H new ATOM 0 HZ1 LYS A 78 8.348 -19.827 -4.482 1.00 25.42 H new ATOM 0 HZ2 LYS A 78 8.647 -18.284 -5.124 1.00 25.42 H new ATOM 0 HZ3 LYS A 78 7.125 -18.650 -4.468 1.00 25.42 H new ATOM 1240 N GLU A 79 2.970 -15.401 -9.358 1.00 62.43 N ATOM 1241 CA GLU A 79 2.956 -14.007 -9.786 1.00 62.51 C ATOM 1242 C GLU A 79 1.820 -13.243 -9.113 1.00 31.11 C ATOM 1243 O GLU A 79 2.009 -12.125 -8.634 1.00 12.44 O ATOM 1244 CB GLU A 79 2.814 -13.919 -11.307 1.00 61.00 C ATOM 1245 CG GLU A 79 4.122 -14.121 -12.053 1.00 43.43 C ATOM 1246 CD GLU A 79 4.328 -15.557 -12.492 1.00 61.42 C ATOM 1247 OE1 GLU A 79 4.264 -16.456 -11.627 1.00 72.23 O ATOM 1248 OE2 GLU A 79 4.554 -15.783 -13.699 1.00 73.13 O ATOM 0 H GLU A 79 2.770 -16.072 -10.100 1.00 62.43 H new ATOM 0 HA GLU A 79 3.902 -13.553 -9.490 1.00 62.51 H new ATOM 0 HB2 GLU A 79 2.096 -14.668 -11.640 1.00 61.00 H new ATOM 0 HB3 GLU A 79 2.403 -12.944 -11.569 1.00 61.00 H new ATOM 0 HG2 GLU A 79 4.141 -13.471 -12.928 1.00 43.43 H new ATOM 0 HG3 GLU A 79 4.951 -13.818 -11.413 1.00 43.43 H new ATOM 1255 N ILE A 80 0.641 -13.854 -9.082 1.00 34.43 N ATOM 1256 CA ILE A 80 -0.526 -13.232 -8.467 1.00 63.43 C ATOM 1257 C ILE A 80 -0.350 -13.106 -6.958 1.00 34.42 C ATOM 1258 O ILE A 80 -0.446 -12.013 -6.400 1.00 54.25 O ATOM 1259 CB ILE A 80 -1.809 -14.032 -8.759 1.00 33.02 C ATOM 1260 CG1 ILE A 80 -2.026 -14.158 -10.268 1.00 52.21 C ATOM 1261 CG2 ILE A 80 -3.008 -13.367 -8.099 1.00 75.43 C ATOM 1262 CD1 ILE A 80 -3.014 -15.238 -10.649 1.00 33.04 C ATOM 0 H ILE A 80 0.468 -14.779 -9.475 1.00 34.43 H new ATOM 0 HA ILE A 80 -0.621 -12.238 -8.903 1.00 63.43 H new ATOM 0 HB ILE A 80 -1.698 -15.033 -8.343 1.00 33.02 H new ATOM 0 HG12 ILE A 80 -2.377 -13.202 -10.657 1.00 52.21 H new ATOM 0 HG13 ILE A 80 -1.070 -14.366 -10.748 1.00 52.21 H new ATOM 0 HG21 ILE A 80 -3.908 -13.943 -8.314 1.00 75.43 H new ATOM 0 HG22 ILE A 80 -2.853 -13.325 -7.021 1.00 75.43 H new ATOM 0 HG23 ILE A 80 -3.123 -12.356 -8.489 1.00 75.43 H new ATOM 0 HD11 ILE A 80 -3.118 -15.270 -11.734 1.00 33.04 H new ATOM 0 HD12 ILE A 80 -2.655 -16.203 -10.290 1.00 33.04 H new ATOM 0 HD13 ILE A 80 -3.982 -15.021 -10.198 1.00 33.04 H new ATOM 1274 N ASP A 81 -0.091 -14.232 -6.302 1.00 32.20 N ATOM 1275 CA ASP A 81 0.101 -14.248 -4.856 1.00 71.14 C ATOM 1276 C ASP A 81 1.168 -13.241 -4.439 1.00 63.30 C ATOM 1277 O ASP A 81 1.060 -12.607 -3.390 1.00 43.32 O ATOM 1278 CB ASP A 81 0.494 -15.650 -4.388 1.00 73.11 C ATOM 1279 CG ASP A 81 0.446 -15.791 -2.879 1.00 75.34 C ATOM 1280 OD1 ASP A 81 -0.606 -15.472 -2.287 1.00 53.34 O ATOM 1281 OD2 ASP A 81 1.460 -16.221 -2.291 1.00 0.54 O ATOM 0 H ASP A 81 -0.009 -15.145 -6.748 1.00 32.20 H new ATOM 0 HA ASP A 81 -0.841 -13.968 -4.386 1.00 71.14 H new ATOM 0 HB2 ASP A 81 -0.176 -16.382 -4.840 1.00 73.11 H new ATOM 0 HB3 ASP A 81 1.500 -15.879 -4.740 1.00 73.11 H new ATOM 1286 N MET A 82 2.199 -13.102 -5.267 1.00 13.43 N ATOM 1287 CA MET A 82 3.286 -12.172 -4.983 1.00 13.21 C ATOM 1288 C MET A 82 2.781 -10.732 -4.971 1.00 33.50 C ATOM 1289 O MET A 82 2.968 -10.007 -3.995 1.00 22.34 O ATOM 1290 CB MET A 82 4.400 -12.325 -6.020 1.00 1.02 C ATOM 1291 CG MET A 82 5.430 -13.381 -5.653 1.00 62.03 C ATOM 1292 SD MET A 82 6.564 -13.745 -7.007 1.00 42.52 S ATOM 1293 CE MET A 82 8.089 -14.017 -6.108 1.00 1.32 C ATOM 0 H MET A 82 2.304 -13.621 -6.139 1.00 13.43 H new ATOM 0 HA MET A 82 3.683 -12.407 -3.996 1.00 13.21 H new ATOM 0 HB2 MET A 82 3.957 -12.580 -6.983 1.00 1.02 H new ATOM 0 HB3 MET A 82 4.903 -11.366 -6.145 1.00 1.02 H new ATOM 0 HG2 MET A 82 6.000 -13.042 -4.788 1.00 62.03 H new ATOM 0 HG3 MET A 82 4.917 -14.296 -5.358 1.00 62.03 H new ATOM 0 HE1 MET A 82 8.888 -14.253 -6.810 1.00 1.32 H new ATOM 0 HE2 MET A 82 8.349 -13.116 -5.552 1.00 1.32 H new ATOM 0 HE3 MET A 82 7.959 -14.847 -5.414 1.00 1.32 H new ATOM 1303 N ALA A 83 2.140 -10.326 -6.062 1.00 11.21 N ATOM 1304 CA ALA A 83 1.607 -8.974 -6.175 1.00 52.14 C ATOM 1305 C ALA A 83 0.740 -8.623 -4.971 1.00 0.30 C ATOM 1306 O ALA A 83 0.752 -7.487 -4.496 1.00 42.30 O ATOM 1307 CB ALA A 83 0.809 -8.828 -7.463 1.00 2.52 C ATOM 0 H ALA A 83 1.977 -10.914 -6.880 1.00 11.21 H new ATOM 0 HA ALA A 83 2.447 -8.280 -6.199 1.00 52.14 H new ATOM 0 HB1 ALA A 83 0.417 -7.814 -7.535 1.00 2.52 H new ATOM 0 HB2 ALA A 83 1.456 -9.028 -8.317 1.00 2.52 H new ATOM 0 HB3 ALA A 83 -0.018 -9.538 -7.461 1.00 2.52 H new ATOM 1313 N ILE A 84 -0.011 -9.604 -4.482 1.00 53.34 N ATOM 1314 CA ILE A 84 -0.884 -9.397 -3.333 1.00 64.21 C ATOM 1315 C ILE A 84 -0.074 -9.216 -2.054 1.00 2.41 C ATOM 1316 O ILE A 84 -0.261 -8.245 -1.320 1.00 40.12 O ATOM 1317 CB ILE A 84 -1.858 -10.575 -3.147 1.00 74.04 C ATOM 1318 CG1 ILE A 84 -2.688 -10.784 -4.416 1.00 63.12 C ATOM 1319 CG2 ILE A 84 -2.765 -10.329 -1.950 1.00 44.14 C ATOM 1320 CD1 ILE A 84 -3.429 -12.102 -4.443 1.00 61.42 C ATOM 0 H ILE A 84 -0.033 -10.550 -4.863 1.00 53.34 H new ATOM 0 HA ILE A 84 -1.456 -8.490 -3.530 1.00 64.21 H new ATOM 0 HB ILE A 84 -1.279 -11.479 -2.960 1.00 74.04 H new ATOM 0 HG12 ILE A 84 -3.407 -9.970 -4.508 1.00 63.12 H new ATOM 0 HG13 ILE A 84 -2.031 -10.728 -5.284 1.00 63.12 H new ATOM 0 HG21 ILE A 84 -3.448 -11.170 -1.832 1.00 44.14 H new ATOM 0 HG22 ILE A 84 -2.159 -10.224 -1.050 1.00 44.14 H new ATOM 0 HG23 ILE A 84 -3.339 -9.416 -2.110 1.00 44.14 H new ATOM 0 HD11 ILE A 84 -3.996 -12.182 -5.371 1.00 61.42 H new ATOM 0 HD12 ILE A 84 -2.714 -12.923 -4.383 1.00 61.42 H new ATOM 0 HD13 ILE A 84 -4.112 -12.153 -3.595 1.00 61.42 H new ATOM 1332 N VAL A 85 0.829 -10.156 -1.793 1.00 11.11 N ATOM 1333 CA VAL A 85 1.670 -10.099 -0.604 1.00 4.34 C ATOM 1334 C VAL A 85 2.474 -8.804 -0.561 1.00 13.34 C ATOM 1335 O VAL A 85 2.604 -8.174 0.490 1.00 34.51 O ATOM 1336 CB VAL A 85 2.640 -11.294 -0.544 1.00 42.23 C ATOM 1337 CG1 VAL A 85 3.528 -11.200 0.687 1.00 64.30 C ATOM 1338 CG2 VAL A 85 1.870 -12.606 -0.558 1.00 0.51 C ATOM 0 H VAL A 85 0.997 -10.966 -2.390 1.00 11.11 H new ATOM 0 HA VAL A 85 1.003 -10.138 0.257 1.00 4.34 H new ATOM 0 HB VAL A 85 3.280 -11.265 -1.426 1.00 42.23 H new ATOM 0 HG11 VAL A 85 4.206 -12.053 0.712 1.00 64.30 H new ATOM 0 HG12 VAL A 85 4.107 -10.277 0.649 1.00 64.30 H new ATOM 0 HG13 VAL A 85 2.908 -11.203 1.584 1.00 64.30 H new ATOM 0 HG21 VAL A 85 2.571 -13.440 -0.515 1.00 0.51 H new ATOM 0 HG22 VAL A 85 1.205 -12.647 0.304 1.00 0.51 H new ATOM 0 HG23 VAL A 85 1.282 -12.673 -1.473 1.00 0.51 H new ATOM 1348 N THR A 86 3.012 -8.409 -1.710 1.00 61.14 N ATOM 1349 CA THR A 86 3.804 -7.189 -1.805 1.00 33.12 C ATOM 1350 C THR A 86 2.979 -5.967 -1.418 1.00 31.13 C ATOM 1351 O THR A 86 3.393 -5.166 -0.579 1.00 2.21 O ATOM 1352 CB THR A 86 4.360 -6.989 -3.227 1.00 62.12 C ATOM 1353 OG1 THR A 86 3.310 -7.137 -4.189 1.00 61.54 O ATOM 1354 CG2 THR A 86 5.468 -7.989 -3.520 1.00 64.22 C ATOM 0 H THR A 86 2.914 -8.917 -2.589 1.00 61.14 H new ATOM 0 HA THR A 86 4.636 -7.298 -1.110 1.00 33.12 H new ATOM 0 HB THR A 86 4.773 -5.983 -3.294 1.00 62.12 H new ATOM 0 HG1 THR A 86 2.503 -7.471 -3.744 1.00 61.54 H new ATOM 0 HG21 THR A 86 5.845 -7.829 -4.530 1.00 64.22 H new ATOM 0 HG22 THR A 86 6.279 -7.854 -2.804 1.00 64.22 H new ATOM 0 HG23 THR A 86 5.075 -9.002 -3.436 1.00 64.22 H new ATOM 1362 N LEU A 87 1.809 -5.830 -2.033 1.00 4.44 N ATOM 1363 CA LEU A 87 0.925 -4.704 -1.751 1.00 73.34 C ATOM 1364 C LEU A 87 0.563 -4.653 -0.271 1.00 34.15 C ATOM 1365 O LEU A 87 0.345 -3.579 0.290 1.00 5.31 O ATOM 1366 CB LEU A 87 -0.347 -4.806 -2.596 1.00 23.32 C ATOM 1367 CG LEU A 87 -0.190 -4.498 -4.085 1.00 41.41 C ATOM 1368 CD1 LEU A 87 -1.282 -5.184 -4.890 1.00 53.24 C ATOM 1369 CD2 LEU A 87 -0.213 -2.995 -4.324 1.00 11.23 C ATOM 0 H LEU A 87 1.451 -6.484 -2.729 1.00 4.44 H new ATOM 0 HA LEU A 87 1.453 -3.786 -2.008 1.00 73.34 H new ATOM 0 HB2 LEU A 87 -0.747 -5.815 -2.494 1.00 23.32 H new ATOM 0 HB3 LEU A 87 -1.090 -4.125 -2.181 1.00 23.32 H new ATOM 0 HG LEU A 87 0.774 -4.884 -4.417 1.00 41.41 H new ATOM 0 HD11 LEU A 87 -1.154 -4.953 -5.948 1.00 53.24 H new ATOM 0 HD12 LEU A 87 -1.219 -6.262 -4.744 1.00 53.24 H new ATOM 0 HD13 LEU A 87 -2.257 -4.829 -4.557 1.00 53.24 H new ATOM 0 HD21 LEU A 87 -0.100 -2.794 -5.389 1.00 11.23 H new ATOM 0 HD22 LEU A 87 -1.162 -2.586 -3.976 1.00 11.23 H new ATOM 0 HD23 LEU A 87 0.606 -2.527 -3.778 1.00 11.23 H new ATOM 1381 N LYS A 88 0.501 -5.822 0.359 1.00 41.41 N ATOM 1382 CA LYS A 88 0.169 -5.911 1.776 1.00 61.52 C ATOM 1383 C LYS A 88 1.330 -5.427 2.638 1.00 22.24 C ATOM 1384 O LYS A 88 1.216 -4.426 3.345 1.00 1.41 O ATOM 1385 CB LYS A 88 -0.189 -7.352 2.146 1.00 31.44 C ATOM 1386 CG LYS A 88 -1.655 -7.689 1.932 1.00 24.13 C ATOM 1387 CD LYS A 88 -2.159 -8.671 2.976 1.00 73.51 C ATOM 1388 CE LYS A 88 -3.081 -9.713 2.361 1.00 72.31 C ATOM 1389 NZ LYS A 88 -4.110 -10.184 3.329 1.00 30.31 N ATOM 0 H LYS A 88 0.676 -6.721 -0.090 1.00 41.41 H new ATOM 0 HA LYS A 88 -0.692 -5.269 1.964 1.00 61.52 H new ATOM 0 HB2 LYS A 88 0.422 -8.033 1.553 1.00 31.44 H new ATOM 0 HB3 LYS A 88 0.066 -7.524 3.192 1.00 31.44 H new ATOM 0 HG2 LYS A 88 -2.249 -6.776 1.973 1.00 24.13 H new ATOM 0 HG3 LYS A 88 -1.790 -8.113 0.937 1.00 24.13 H new ATOM 0 HD2 LYS A 88 -1.312 -9.167 3.449 1.00 73.51 H new ATOM 0 HD3 LYS A 88 -2.690 -8.130 3.759 1.00 73.51 H new ATOM 0 HE2 LYS A 88 -3.573 -9.291 1.485 1.00 72.31 H new ATOM 0 HE3 LYS A 88 -2.491 -10.562 2.017 1.00 72.31 H new ATOM 0 HZ1 LYS A 88 -4.718 -10.893 2.872 1.00 30.31 H new ATOM 0 HZ2 LYS A 88 -3.641 -10.610 4.154 1.00 30.31 H new ATOM 0 HZ3 LYS A 88 -4.690 -9.378 3.638 1.00 30.31 H new ATOM 1403 N VAL A 89 2.448 -6.144 2.575 1.00 50.22 N ATOM 1404 CA VAL A 89 3.631 -5.785 3.348 1.00 31.41 C ATOM 1405 C VAL A 89 4.055 -4.348 3.069 1.00 42.01 C ATOM 1406 O VAL A 89 4.520 -3.641 3.964 1.00 74.41 O ATOM 1407 CB VAL A 89 4.810 -6.727 3.039 1.00 42.54 C ATOM 1408 CG1 VAL A 89 4.490 -8.147 3.480 1.00 43.34 C ATOM 1409 CG2 VAL A 89 5.151 -6.684 1.557 1.00 53.34 C ATOM 0 H VAL A 89 2.559 -6.977 1.997 1.00 50.22 H new ATOM 0 HA VAL A 89 3.364 -5.883 4.400 1.00 31.41 H new ATOM 0 HB VAL A 89 5.681 -6.387 3.599 1.00 42.54 H new ATOM 0 HG11 VAL A 89 5.335 -8.797 3.253 1.00 43.34 H new ATOM 0 HG12 VAL A 89 4.299 -8.160 4.553 1.00 43.34 H new ATOM 0 HG13 VAL A 89 3.606 -8.502 2.950 1.00 43.34 H new ATOM 0 HG21 VAL A 89 5.986 -7.355 1.356 1.00 53.34 H new ATOM 0 HG22 VAL A 89 4.285 -6.998 0.975 1.00 53.34 H new ATOM 0 HG23 VAL A 89 5.427 -5.668 1.277 1.00 53.34 H new ATOM 1419 N PHE A 90 3.892 -3.921 1.821 1.00 3.52 N ATOM 1420 CA PHE A 90 4.259 -2.566 1.423 1.00 31.50 C ATOM 1421 C PHE A 90 3.263 -1.549 1.972 1.00 75.51 C ATOM 1422 O PHE A 90 3.626 -0.418 2.290 1.00 2.21 O ATOM 1423 CB PHE A 90 4.325 -2.461 -0.102 1.00 52.20 C ATOM 1424 CG PHE A 90 4.487 -1.053 -0.599 1.00 11.31 C ATOM 1425 CD1 PHE A 90 5.412 -0.201 -0.017 1.00 15.32 C ATOM 1426 CD2 PHE A 90 3.714 -0.581 -1.648 1.00 2.02 C ATOM 1427 CE1 PHE A 90 5.563 1.096 -0.472 1.00 25.41 C ATOM 1428 CE2 PHE A 90 3.862 0.714 -2.107 1.00 40.14 C ATOM 1429 CZ PHE A 90 4.787 1.554 -1.518 1.00 32.20 C ATOM 0 H PHE A 90 3.509 -4.493 1.068 1.00 3.52 H new ATOM 0 HA PHE A 90 5.242 -2.345 1.839 1.00 31.50 H new ATOM 0 HB2 PHE A 90 5.158 -3.064 -0.464 1.00 52.20 H new ATOM 0 HB3 PHE A 90 3.416 -2.886 -0.527 1.00 52.20 H new ATOM 0 HD1 PHE A 90 6.022 -0.554 0.801 1.00 15.32 H new ATOM 0 HD2 PHE A 90 2.988 -1.232 -2.112 1.00 2.02 H new ATOM 0 HE1 PHE A 90 6.287 1.750 -0.010 1.00 25.41 H new ATOM 0 HE2 PHE A 90 3.254 1.069 -2.926 1.00 40.14 H new ATOM 0 HZ PHE A 90 4.903 2.567 -1.875 1.00 32.20 H new ATOM 1439 N ALA A 91 2.004 -1.962 2.079 1.00 13.11 N ATOM 1440 CA ALA A 91 0.955 -1.089 2.590 1.00 13.44 C ATOM 1441 C ALA A 91 1.181 -0.763 4.063 1.00 74.10 C ATOM 1442 O ALA A 91 1.061 0.389 4.480 1.00 53.00 O ATOM 1443 CB ALA A 91 -0.410 -1.732 2.393 1.00 11.25 C ATOM 0 H ALA A 91 1.686 -2.896 1.819 1.00 13.11 H new ATOM 0 HA ALA A 91 0.989 -0.155 2.029 1.00 13.44 H new ATOM 0 HB1 ALA A 91 -1.184 -1.069 2.779 1.00 11.25 H new ATOM 0 HB2 ALA A 91 -0.580 -1.907 1.331 1.00 11.25 H new ATOM 0 HB3 ALA A 91 -0.446 -2.681 2.928 1.00 11.25 H new ATOM 1449 N VAL A 92 1.508 -1.786 4.847 1.00 55.40 N ATOM 1450 CA VAL A 92 1.751 -1.608 6.274 1.00 54.14 C ATOM 1451 C VAL A 92 3.147 -1.052 6.528 1.00 22.20 C ATOM 1452 O VAL A 92 3.303 0.014 7.123 1.00 63.22 O ATOM 1453 CB VAL A 92 1.590 -2.934 7.040 1.00 64.43 C ATOM 1454 CG1 VAL A 92 1.656 -2.696 8.541 1.00 41.25 C ATOM 1455 CG2 VAL A 92 0.286 -3.616 6.657 1.00 74.24 C ATOM 0 H VAL A 92 1.611 -2.746 4.518 1.00 55.40 H new ATOM 0 HA VAL A 92 1.009 -0.896 6.636 1.00 54.14 H new ATOM 0 HB VAL A 92 2.413 -3.594 6.765 1.00 64.43 H new ATOM 0 HG11 VAL A 92 1.540 -3.645 9.065 1.00 41.25 H new ATOM 0 HG12 VAL A 92 2.619 -2.255 8.797 1.00 41.25 H new ATOM 0 HG13 VAL A 92 0.856 -2.018 8.837 1.00 41.25 H new ATOM 0 HG21 VAL A 92 0.189 -4.551 7.208 1.00 74.24 H new ATOM 0 HG22 VAL A 92 -0.552 -2.963 6.901 1.00 74.24 H new ATOM 0 HG23 VAL A 92 0.284 -3.823 5.587 1.00 74.24 H new ATOM 1465 N ALA A 93 4.160 -1.782 6.073 1.00 44.00 N ATOM 1466 CA ALA A 93 5.545 -1.361 6.249 1.00 53.11 C ATOM 1467 C ALA A 93 5.799 -0.016 5.578 1.00 51.54 C ATOM 1468 O ALA A 93 6.757 0.683 5.907 1.00 33.33 O ATOM 1469 CB ALA A 93 6.492 -2.416 5.696 1.00 14.13 C ATOM 0 H ALA A 93 4.048 -2.668 5.580 1.00 44.00 H new ATOM 0 HA ALA A 93 5.731 -1.246 7.317 1.00 53.11 H new ATOM 0 HB1 ALA A 93 7.522 -2.088 5.834 1.00 14.13 H new ATOM 0 HB2 ALA A 93 6.337 -3.357 6.224 1.00 14.13 H new ATOM 0 HB3 ALA A 93 6.296 -2.559 4.633 1.00 14.13 H new ATOM 1475 N GLY A 94 4.934 0.342 4.633 1.00 43.21 N ATOM 1476 CA GLY A 94 5.084 1.603 3.929 1.00 35.25 C ATOM 1477 C GLY A 94 4.228 2.704 4.525 1.00 64.31 C ATOM 1478 O GLY A 94 4.743 3.628 5.156 1.00 25.41 O ATOM 0 H GLY A 94 4.133 -0.218 4.343 1.00 43.21 H new ATOM 0 HA2 GLY A 94 6.130 1.907 3.953 1.00 35.25 H new ATOM 0 HA3 GLY A 94 4.816 1.465 2.881 1.00 35.25 H new ATOM 1482 N LEU A 95 2.919 2.608 4.323 1.00 31.34 N ATOM 1483 CA LEU A 95 1.990 3.605 4.844 1.00 73.42 C ATOM 1484 C LEU A 95 2.087 3.699 6.363 1.00 31.01 C ATOM 1485 O LEU A 95 2.163 4.793 6.924 1.00 34.24 O ATOM 1486 CB LEU A 95 0.557 3.259 4.434 1.00 62.44 C ATOM 1487 CG LEU A 95 0.358 2.844 2.975 1.00 23.34 C ATOM 1488 CD1 LEU A 95 -1.110 2.563 2.696 1.00 60.21 C ATOM 1489 CD2 LEU A 95 0.885 3.920 2.038 1.00 40.41 C ATOM 0 H LEU A 95 2.477 1.850 3.802 1.00 31.34 H new ATOM 0 HA LEU A 95 2.259 4.573 4.421 1.00 73.42 H new ATOM 0 HB2 LEU A 95 0.203 2.450 5.073 1.00 62.44 H new ATOM 0 HB3 LEU A 95 -0.076 4.123 4.635 1.00 62.44 H new ATOM 0 HG LEU A 95 0.922 1.928 2.797 1.00 23.34 H new ATOM 0 HD11 LEU A 95 -1.232 2.269 1.653 1.00 60.21 H new ATOM 0 HD12 LEU A 95 -1.456 1.757 3.343 1.00 60.21 H new ATOM 0 HD13 LEU A 95 -1.696 3.461 2.891 1.00 60.21 H new ATOM 0 HD21 LEU A 95 0.735 3.608 1.004 1.00 40.41 H new ATOM 0 HD22 LEU A 95 0.349 4.852 2.217 1.00 40.41 H new ATOM 0 HD23 LEU A 95 1.949 4.072 2.220 1.00 40.41 H new ATOM 1501 N LEU A 96 2.087 2.546 7.023 1.00 14.34 N ATOM 1502 CA LEU A 96 2.177 2.498 8.479 1.00 42.14 C ATOM 1503 C LEU A 96 3.633 2.522 8.935 1.00 74.24 C ATOM 1504 O LEU A 96 3.919 2.506 10.131 1.00 74.30 O ATOM 1505 CB LEU A 96 1.484 1.243 9.011 1.00 24.51 C ATOM 1506 CG LEU A 96 0.266 1.476 9.905 1.00 52.23 C ATOM 1507 CD1 LEU A 96 0.677 2.160 11.200 1.00 73.25 C ATOM 1508 CD2 LEU A 96 -0.782 2.302 9.173 1.00 61.04 C ATOM 0 H LEU A 96 2.026 1.632 6.574 1.00 14.34 H new ATOM 0 HA LEU A 96 1.676 3.379 8.879 1.00 42.14 H new ATOM 0 HB2 LEU A 96 1.174 0.635 8.161 1.00 24.51 H new ATOM 0 HB3 LEU A 96 2.214 0.659 9.571 1.00 24.51 H new ATOM 0 HG LEU A 96 -0.170 0.508 10.152 1.00 52.23 H new ATOM 0 HD11 LEU A 96 -0.203 2.318 11.823 1.00 73.25 H new ATOM 0 HD12 LEU A 96 1.391 1.532 11.732 1.00 73.25 H new ATOM 0 HD13 LEU A 96 1.138 3.121 10.973 1.00 73.25 H new ATOM 0 HD21 LEU A 96 -1.642 2.458 9.824 1.00 61.04 H new ATOM 0 HD22 LEU A 96 -0.357 3.267 8.896 1.00 61.04 H new ATOM 0 HD23 LEU A 96 -1.099 1.774 8.274 1.00 61.04 H new ATOM 1520 N ASN A 97 4.548 2.562 7.972 1.00 3.32 N ATOM 1521 CA ASN A 97 5.975 2.590 8.275 1.00 13.20 C ATOM 1522 C ASN A 97 6.351 1.460 9.228 1.00 34.22 C ATOM 1523 O ASN A 97 7.283 1.587 10.021 1.00 11.42 O ATOM 1524 CB ASN A 97 6.361 3.938 8.887 1.00 10.21 C ATOM 1525 CG ASN A 97 6.016 5.105 7.981 1.00 34.45 C ATOM 1526 OD1 ASN A 97 6.250 5.058 6.774 1.00 71.32 O ATOM 1527 ND2 ASN A 97 5.456 6.159 8.563 1.00 52.13 N ATOM 0 H ASN A 97 4.328 2.576 6.976 1.00 3.32 H new ATOM 0 HA ASN A 97 6.522 2.452 7.342 1.00 13.20 H new ATOM 0 HB2 ASN A 97 5.850 4.060 9.842 1.00 10.21 H new ATOM 0 HB3 ASN A 97 7.431 3.947 9.094 1.00 10.21 H new ATOM 0 HD21 ASN A 97 5.201 6.974 8.005 1.00 52.13 H new ATOM 0 HD22 ASN A 97 5.281 6.153 9.568 1.00 52.13 H new ATOM 1534 N MET A 98 5.619 0.354 9.144 1.00 75.23 N ATOM 1535 CA MET A 98 5.876 -0.800 9.998 1.00 44.15 C ATOM 1536 C MET A 98 7.185 -1.481 9.610 1.00 71.41 C ATOM 1537 O MET A 98 7.697 -1.285 8.507 1.00 33.30 O ATOM 1538 CB MET A 98 4.721 -1.798 9.905 1.00 71.31 C ATOM 1539 CG MET A 98 3.842 -1.828 11.145 1.00 5.21 C ATOM 1540 SD MET A 98 4.247 -3.194 12.251 1.00 41.44 S ATOM 1541 CE MET A 98 4.202 -2.368 13.839 1.00 34.14 C ATOM 0 H MET A 98 4.843 0.232 8.493 1.00 75.23 H new ATOM 0 HA MET A 98 5.960 -0.449 11.026 1.00 44.15 H new ATOM 0 HB2 MET A 98 4.106 -1.550 9.040 1.00 71.31 H new ATOM 0 HB3 MET A 98 5.126 -2.795 9.733 1.00 71.31 H new ATOM 0 HG2 MET A 98 3.948 -0.886 11.683 1.00 5.21 H new ATOM 0 HG3 MET A 98 2.798 -1.907 10.843 1.00 5.21 H new ATOM 0 HE1 MET A 98 4.433 -3.084 14.628 1.00 34.14 H new ATOM 0 HE2 MET A 98 4.938 -1.564 13.852 1.00 34.14 H new ATOM 0 HE3 MET A 98 3.208 -1.953 14.005 1.00 34.14 H new ATOM 1551 N THR A 99 7.723 -2.283 10.524 1.00 70.22 N ATOM 1552 CA THR A 99 8.972 -2.992 10.278 1.00 63.30 C ATOM 1553 C THR A 99 8.738 -4.494 10.157 1.00 53.33 C ATOM 1554 O THR A 99 9.436 -5.294 10.779 1.00 3.32 O ATOM 1555 CB THR A 99 9.996 -2.733 11.400 1.00 75.13 C ATOM 1556 OG1 THR A 99 9.356 -2.828 12.678 1.00 63.35 O ATOM 1557 CG2 THR A 99 10.631 -1.359 11.246 1.00 73.41 C ATOM 0 H THR A 99 7.313 -2.457 11.441 1.00 70.22 H new ATOM 0 HA THR A 99 9.370 -2.612 9.337 1.00 63.30 H new ATOM 0 HB THR A 99 10.779 -3.488 11.329 1.00 75.13 H new ATOM 0 HG1 THR A 99 10.013 -2.664 13.386 1.00 63.35 H new ATOM 0 HG21 THR A 99 11.350 -1.198 12.049 1.00 73.41 H new ATOM 0 HG22 THR A 99 11.141 -1.300 10.285 1.00 73.41 H new ATOM 0 HG23 THR A 99 9.857 -0.593 11.294 1.00 73.41 H new ATOM 1565 N VAL A 100 7.750 -4.871 9.351 1.00 41.53 N ATOM 1566 CA VAL A 100 7.425 -6.277 9.146 1.00 15.04 C ATOM 1567 C VAL A 100 8.371 -6.919 8.138 1.00 75.10 C ATOM 1568 O VAL A 100 8.478 -6.468 6.998 1.00 73.55 O ATOM 1569 CB VAL A 100 5.975 -6.452 8.657 1.00 34.12 C ATOM 1570 CG1 VAL A 100 4.991 -6.071 9.753 1.00 3.04 C ATOM 1571 CG2 VAL A 100 5.733 -5.627 7.402 1.00 32.03 C ATOM 0 H VAL A 100 7.161 -4.222 8.830 1.00 41.53 H new ATOM 0 HA VAL A 100 7.538 -6.772 10.111 1.00 15.04 H new ATOM 0 HB VAL A 100 5.818 -7.502 8.410 1.00 34.12 H new ATOM 0 HG11 VAL A 100 3.972 -6.201 9.389 1.00 3.04 H new ATOM 0 HG12 VAL A 100 5.150 -6.709 10.622 1.00 3.04 H new ATOM 0 HG13 VAL A 100 5.145 -5.029 10.034 1.00 3.04 H new ATOM 0 HG21 VAL A 100 4.704 -5.763 7.070 1.00 32.03 H new ATOM 0 HG22 VAL A 100 5.908 -4.573 7.620 1.00 32.03 H new ATOM 0 HG23 VAL A 100 6.413 -5.953 6.615 1.00 32.03 H new ATOM 1581 N SER A 101 9.055 -7.975 8.566 1.00 20.01 N ATOM 1582 CA SER A 101 9.995 -8.678 7.702 1.00 64.25 C ATOM 1583 C SER A 101 9.422 -10.019 7.252 1.00 2.21 C ATOM 1584 O SER A 101 10.148 -10.887 6.767 1.00 21.41 O ATOM 1585 CB SER A 101 11.324 -8.897 8.428 1.00 12.33 C ATOM 1586 OG SER A 101 12.091 -7.706 8.457 1.00 43.21 O ATOM 0 H SER A 101 8.976 -8.362 9.506 1.00 20.01 H new ATOM 0 HA SER A 101 10.168 -8.062 6.820 1.00 64.25 H new ATOM 0 HB2 SER A 101 11.134 -9.236 9.446 1.00 12.33 H new ATOM 0 HB3 SER A 101 11.889 -9.685 7.930 1.00 12.33 H new ATOM 0 HG SER A 101 12.069 -7.281 7.574 1.00 43.21 H new ATOM 1592 N THR A 102 8.113 -10.181 7.417 1.00 11.30 N ATOM 1593 CA THR A 102 7.441 -11.415 7.030 1.00 13.43 C ATOM 1594 C THR A 102 6.031 -11.136 6.521 1.00 61.40 C ATOM 1595 O THR A 102 5.274 -10.389 7.139 1.00 11.12 O ATOM 1596 CB THR A 102 7.363 -12.405 8.208 1.00 53.32 C ATOM 1597 OG1 THR A 102 6.387 -11.961 9.157 1.00 2.34 O ATOM 1598 CG2 THR A 102 8.716 -12.542 8.890 1.00 73.25 C ATOM 0 H THR A 102 7.497 -9.473 7.816 1.00 11.30 H new ATOM 0 HA THR A 102 8.032 -11.860 6.230 1.00 13.43 H new ATOM 0 HB THR A 102 7.071 -13.380 7.817 1.00 53.32 H new ATOM 0 HG1 THR A 102 6.342 -12.596 9.902 1.00 2.34 H new ATOM 0 HG21 THR A 102 8.636 -13.246 9.718 1.00 73.25 H new ATOM 0 HG22 THR A 102 9.450 -12.908 8.172 1.00 73.25 H new ATOM 0 HG23 THR A 102 9.033 -11.570 9.269 1.00 73.25 H new ATOM 1606 N ALA A 103 5.685 -11.743 5.390 1.00 31.24 N ATOM 1607 CA ALA A 103 4.365 -11.563 4.800 1.00 54.42 C ATOM 1608 C ALA A 103 3.265 -11.884 5.806 1.00 55.52 C ATOM 1609 O ALA A 103 2.170 -11.325 5.742 1.00 73.34 O ATOM 1610 CB ALA A 103 4.218 -12.431 3.559 1.00 21.54 C ATOM 0 H ALA A 103 6.301 -12.363 4.865 1.00 31.24 H new ATOM 0 HA ALA A 103 4.263 -10.517 4.512 1.00 54.42 H new ATOM 0 HB1 ALA A 103 3.227 -12.286 3.129 1.00 21.54 H new ATOM 0 HB2 ALA A 103 4.976 -12.151 2.827 1.00 21.54 H new ATOM 0 HB3 ALA A 103 4.346 -13.479 3.831 1.00 21.54 H new ATOM 1616 N ALA A 104 3.563 -12.787 6.734 1.00 50.31 N ATOM 1617 CA ALA A 104 2.599 -13.181 7.754 1.00 4.32 C ATOM 1618 C ALA A 104 2.328 -12.036 8.724 1.00 2.14 C ATOM 1619 O ALA A 104 1.178 -11.747 9.052 1.00 53.44 O ATOM 1620 CB ALA A 104 3.098 -14.406 8.506 1.00 3.44 C ATOM 0 H ALA A 104 4.464 -13.260 6.801 1.00 50.31 H new ATOM 0 HA ALA A 104 1.662 -13.431 7.257 1.00 4.32 H new ATOM 0 HB1 ALA A 104 2.368 -14.689 9.265 1.00 3.44 H new ATOM 0 HB2 ALA A 104 3.234 -15.231 7.807 1.00 3.44 H new ATOM 0 HB3 ALA A 104 4.049 -14.176 8.986 1.00 3.44 H new ATOM 1626 N ALA A 105 3.395 -11.388 9.181 1.00 20.55 N ATOM 1627 CA ALA A 105 3.271 -10.274 10.113 1.00 23.53 C ATOM 1628 C ALA A 105 2.520 -9.109 9.479 1.00 32.10 C ATOM 1629 O ALA A 105 1.773 -8.400 10.152 1.00 1.45 O ATOM 1630 CB ALA A 105 4.647 -9.825 10.584 1.00 54.33 C ATOM 0 H ALA A 105 4.355 -11.616 8.921 1.00 20.55 H new ATOM 0 HA ALA A 105 2.697 -10.615 10.975 1.00 23.53 H new ATOM 0 HB1 ALA A 105 4.540 -8.993 11.279 1.00 54.33 H new ATOM 0 HB2 ALA A 105 5.149 -10.653 11.084 1.00 54.33 H new ATOM 0 HB3 ALA A 105 5.239 -9.507 9.726 1.00 54.33 H new ATOM 1636 N ALA A 106 2.723 -8.917 8.180 1.00 50.02 N ATOM 1637 CA ALA A 106 2.063 -7.838 7.455 1.00 63.23 C ATOM 1638 C ALA A 106 0.552 -8.041 7.424 1.00 63.34 C ATOM 1639 O ALA A 106 -0.208 -7.174 7.853 1.00 70.31 O ATOM 1640 CB ALA A 106 2.614 -7.740 6.040 1.00 52.53 C ATOM 0 H ALA A 106 3.339 -9.494 7.608 1.00 50.02 H new ATOM 0 HA ALA A 106 2.266 -6.904 7.978 1.00 63.23 H new ATOM 0 HB1 ALA A 106 2.113 -6.930 5.510 1.00 52.53 H new ATOM 0 HB2 ALA A 106 3.685 -7.540 6.080 1.00 52.53 H new ATOM 0 HB3 ALA A 106 2.440 -8.680 5.516 1.00 52.53 H new ATOM 1646 N GLU A 107 0.125 -9.192 6.912 1.00 13.53 N ATOM 1647 CA GLU A 107 -1.296 -9.506 6.824 1.00 33.34 C ATOM 1648 C GLU A 107 -1.952 -9.453 8.202 1.00 64.25 C ATOM 1649 O GLU A 107 -3.123 -9.099 8.330 1.00 63.41 O ATOM 1650 CB GLU A 107 -1.497 -10.891 6.205 1.00 54.22 C ATOM 1651 CG GLU A 107 -0.858 -12.014 7.004 1.00 42.11 C ATOM 1652 CD GLU A 107 -1.215 -13.387 6.469 1.00 30.11 C ATOM 1653 OE1 GLU A 107 -2.311 -13.886 6.801 1.00 2.24 O ATOM 1654 OE2 GLU A 107 -0.400 -13.963 5.719 1.00 4.00 O ATOM 0 H GLU A 107 0.742 -9.921 6.553 1.00 13.53 H new ATOM 0 HA GLU A 107 -1.768 -8.758 6.187 1.00 33.34 H new ATOM 0 HB2 GLU A 107 -2.565 -11.086 6.111 1.00 54.22 H new ATOM 0 HB3 GLU A 107 -1.083 -10.893 5.197 1.00 54.22 H new ATOM 0 HG2 GLU A 107 0.225 -11.893 6.991 1.00 42.11 H new ATOM 0 HG3 GLU A 107 -1.174 -11.940 8.044 1.00 42.11 H new ATOM 1661 N ASN A 108 -1.186 -9.808 9.229 1.00 73.55 N ATOM 1662 CA ASN A 108 -1.692 -9.803 10.596 1.00 0.24 C ATOM 1663 C ASN A 108 -2.050 -8.387 11.038 1.00 5.13 C ATOM 1664 O ASN A 108 -3.182 -8.118 11.439 1.00 63.33 O ATOM 1665 CB ASN A 108 -0.653 -10.399 11.549 1.00 75.34 C ATOM 1666 CG ASN A 108 -1.290 -11.169 12.690 1.00 51.31 C ATOM 1667 OD1 ASN A 108 -1.856 -10.580 13.611 1.00 40.40 O ATOM 1668 ND2 ASN A 108 -1.200 -12.492 12.634 1.00 62.42 N ATOM 0 H ASN A 108 -0.213 -10.102 9.140 1.00 73.55 H new ATOM 0 HA ASN A 108 -2.595 -10.413 10.625 1.00 0.24 H new ATOM 0 HB2 ASN A 108 0.009 -11.062 10.992 1.00 75.34 H new ATOM 0 HB3 ASN A 108 -0.035 -9.598 11.955 1.00 75.34 H new ATOM 0 HD21 ASN A 108 -1.609 -13.063 13.374 1.00 62.42 H new ATOM 0 HD22 ASN A 108 -0.721 -12.938 11.851 1.00 62.42 H new ATOM 1675 N MET A 109 -1.076 -7.485 10.962 1.00 70.52 N ATOM 1676 CA MET A 109 -1.289 -6.097 11.352 1.00 2.51 C ATOM 1677 C MET A 109 -2.216 -5.391 10.368 1.00 72.23 C ATOM 1678 O MET A 109 -2.861 -4.399 10.709 1.00 65.00 O ATOM 1679 CB MET A 109 0.048 -5.356 11.432 1.00 73.34 C ATOM 1680 CG MET A 109 0.224 -4.555 12.711 1.00 35.35 C ATOM 1681 SD MET A 109 0.645 -2.830 12.399 1.00 71.21 S ATOM 1682 CE MET A 109 -0.723 -2.332 11.355 1.00 45.40 C ATOM 0 H MET A 109 -0.132 -7.691 10.634 1.00 70.52 H new ATOM 0 HA MET A 109 -1.759 -6.091 12.335 1.00 2.51 H new ATOM 0 HB2 MET A 109 0.860 -6.079 11.351 1.00 73.34 H new ATOM 0 HB3 MET A 109 0.133 -4.684 10.578 1.00 73.34 H new ATOM 0 HG2 MET A 109 -0.697 -4.601 13.293 1.00 35.35 H new ATOM 0 HG3 MET A 109 1.007 -5.012 13.316 1.00 35.35 H new ATOM 0 HE1 MET A 109 -0.747 -1.245 11.280 1.00 45.40 H new ATOM 0 HE2 MET A 109 -0.597 -2.762 10.361 1.00 45.40 H new ATOM 0 HE3 MET A 109 -1.659 -2.686 11.788 1.00 45.40 H new ATOM 1692 N TYR A 110 -2.279 -5.909 9.146 1.00 43.20 N ATOM 1693 CA TYR A 110 -3.125 -5.327 8.112 1.00 53.45 C ATOM 1694 C TYR A 110 -4.601 -5.481 8.465 1.00 14.40 C ATOM 1695 O TYR A 110 -5.388 -4.546 8.316 1.00 50.44 O ATOM 1696 CB TYR A 110 -2.842 -5.985 6.760 1.00 24.04 C ATOM 1697 CG TYR A 110 -3.609 -5.368 5.613 1.00 45.51 C ATOM 1698 CD1 TYR A 110 -4.943 -5.686 5.393 1.00 70.05 C ATOM 1699 CD2 TYR A 110 -2.999 -4.467 4.749 1.00 41.33 C ATOM 1700 CE1 TYR A 110 -5.648 -5.125 4.345 1.00 3.01 C ATOM 1701 CE2 TYR A 110 -3.696 -3.900 3.700 1.00 51.44 C ATOM 1702 CZ TYR A 110 -5.020 -4.232 3.502 1.00 71.02 C ATOM 1703 OH TYR A 110 -5.718 -3.670 2.457 1.00 23.40 O ATOM 0 H TYR A 110 -1.754 -6.731 8.848 1.00 43.20 H new ATOM 0 HA TYR A 110 -2.894 -4.264 8.047 1.00 53.45 H new ATOM 0 HB2 TYR A 110 -1.775 -5.918 6.550 1.00 24.04 H new ATOM 0 HB3 TYR A 110 -3.089 -7.045 6.823 1.00 24.04 H new ATOM 0 HD1 TYR A 110 -5.438 -6.384 6.052 1.00 70.05 H new ATOM 0 HD2 TYR A 110 -1.962 -4.206 4.900 1.00 41.33 H new ATOM 0 HE1 TYR A 110 -6.684 -5.384 4.187 1.00 3.01 H new ATOM 0 HE2 TYR A 110 -3.207 -3.200 3.038 1.00 51.44 H new ATOM 0 HH TYR A 110 -6.665 -3.598 2.697 1.00 23.40 H new ATOM 1713 N SER A 111 -4.970 -6.668 8.935 1.00 23.04 N ATOM 1714 CA SER A 111 -6.352 -6.948 9.308 1.00 45.40 C ATOM 1715 C SER A 111 -6.601 -6.597 10.772 1.00 71.13 C ATOM 1716 O SER A 111 -7.694 -6.169 11.140 1.00 14.10 O ATOM 1717 CB SER A 111 -6.680 -8.421 9.061 1.00 33.24 C ATOM 1718 OG SER A 111 -6.917 -8.668 7.686 1.00 11.22 O ATOM 0 H SER A 111 -4.331 -7.452 9.067 1.00 23.04 H new ATOM 0 HA SER A 111 -7.003 -6.330 8.689 1.00 45.40 H new ATOM 0 HB2 SER A 111 -5.855 -9.043 9.408 1.00 33.24 H new ATOM 0 HB3 SER A 111 -7.559 -8.703 9.641 1.00 33.24 H new ATOM 0 HG SER A 111 -7.123 -9.617 7.555 1.00 11.22 H new ATOM 1724 N GLN A 112 -5.579 -6.783 11.601 1.00 42.44 N ATOM 1725 CA GLN A 112 -5.687 -6.487 13.024 1.00 11.03 C ATOM 1726 C GLN A 112 -6.077 -5.030 13.250 1.00 44.24 C ATOM 1727 O GLN A 112 -6.991 -4.734 14.018 1.00 54.53 O ATOM 1728 CB GLN A 112 -4.365 -6.789 13.731 1.00 3.14 C ATOM 1729 CG GLN A 112 -4.214 -8.244 14.145 1.00 73.01 C ATOM 1730 CD GLN A 112 -4.651 -8.493 15.575 1.00 15.40 C ATOM 1731 OE1 GLN A 112 -4.563 -7.607 16.426 1.00 23.22 O ATOM 1732 NE2 GLN A 112 -5.127 -9.702 15.847 1.00 14.02 N ATOM 0 H GLN A 112 -4.667 -7.137 11.312 1.00 42.44 H new ATOM 0 HA GLN A 112 -6.468 -7.122 13.443 1.00 11.03 H new ATOM 0 HB2 GLN A 112 -3.540 -6.520 13.071 1.00 3.14 H new ATOM 0 HB3 GLN A 112 -4.284 -6.158 14.616 1.00 3.14 H new ATOM 0 HG2 GLN A 112 -4.802 -8.871 13.475 1.00 73.01 H new ATOM 0 HG3 GLN A 112 -3.172 -8.544 14.030 1.00 73.01 H new ATOM 0 HE21 GLN A 112 -5.182 -10.406 15.111 1.00 14.02 H new ATOM 0 HE22 GLN A 112 -5.438 -9.927 16.792 1.00 14.02 H new ATOM 1741 N MET A 113 -5.376 -4.124 12.575 1.00 21.02 N ATOM 1742 CA MET A 113 -5.650 -2.697 12.702 1.00 63.23 C ATOM 1743 C MET A 113 -6.531 -2.209 11.557 1.00 74.24 C ATOM 1744 O MET A 113 -6.676 -1.007 11.341 1.00 40.22 O ATOM 1745 CB MET A 113 -4.341 -1.905 12.726 1.00 20.34 C ATOM 1746 CG MET A 113 -3.945 -1.429 14.114 1.00 10.25 C ATOM 1747 SD MET A 113 -3.220 -2.740 15.118 1.00 14.43 S ATOM 1748 CE MET A 113 -2.228 -1.782 16.261 1.00 14.33 C ATOM 0 H MET A 113 -4.615 -4.352 11.935 1.00 21.02 H new ATOM 0 HA MET A 113 -6.181 -2.536 13.640 1.00 63.23 H new ATOM 0 HB2 MET A 113 -3.542 -2.527 12.322 1.00 20.34 H new ATOM 0 HB3 MET A 113 -4.436 -1.041 12.068 1.00 20.34 H new ATOM 0 HG2 MET A 113 -3.232 -0.610 14.023 1.00 10.25 H new ATOM 0 HG3 MET A 113 -4.824 -1.032 14.622 1.00 10.25 H new ATOM 0 HE1 MET A 113 -1.715 -2.454 16.949 1.00 14.33 H new ATOM 0 HE2 MET A 113 -1.492 -1.201 15.705 1.00 14.33 H new ATOM 0 HE3 MET A 113 -2.872 -1.107 16.825 1.00 14.33 H new ATOM 1758 N GLY A 114 -7.119 -3.151 10.825 1.00 61.22 N ATOM 1759 CA GLY A 114 -7.979 -2.797 9.711 1.00 45.44 C ATOM 1760 C GLY A 114 -7.314 -1.830 8.751 1.00 52.34 C ATOM 1761 O GLY A 114 -7.988 -1.039 8.089 1.00 42.22 O ATOM 0 H GLY A 114 -7.015 -4.153 10.984 1.00 61.22 H new ATOM 0 HA2 GLY A 114 -8.262 -3.702 9.173 1.00 45.44 H new ATOM 0 HA3 GLY A 114 -8.898 -2.352 10.092 1.00 45.44 H new ATOM 1765 N LEU A 115 -5.989 -1.891 8.675 1.00 54.43 N ATOM 1766 CA LEU A 115 -5.233 -1.012 7.789 1.00 24.14 C ATOM 1767 C LEU A 115 -5.473 0.453 8.140 1.00 74.21 C ATOM 1768 O LEU A 115 -5.473 1.319 7.265 1.00 75.21 O ATOM 1769 CB LEU A 115 -5.618 -1.270 6.332 1.00 50.43 C ATOM 1770 CG LEU A 115 -4.655 -0.724 5.276 1.00 32.14 C ATOM 1771 CD1 LEU A 115 -3.256 -1.280 5.492 1.00 11.33 C ATOM 1772 CD2 LEU A 115 -5.153 -1.057 3.877 1.00 12.44 C ATOM 0 H LEU A 115 -5.416 -2.539 9.216 1.00 54.43 H new ATOM 0 HA LEU A 115 -4.173 -1.228 7.921 1.00 24.14 H new ATOM 0 HB2 LEU A 115 -5.712 -2.346 6.187 1.00 50.43 H new ATOM 0 HB3 LEU A 115 -6.603 -0.837 6.155 1.00 50.43 H new ATOM 0 HG LEU A 115 -4.613 0.361 5.376 1.00 32.14 H new ATOM 0 HD11 LEU A 115 -2.584 -0.881 4.732 1.00 11.33 H new ATOM 0 HD12 LEU A 115 -2.898 -0.991 6.480 1.00 11.33 H new ATOM 0 HD13 LEU A 115 -3.281 -2.367 5.419 1.00 11.33 H new ATOM 0 HD21 LEU A 115 -4.456 -0.661 3.139 1.00 12.44 H new ATOM 0 HD22 LEU A 115 -5.225 -2.139 3.764 1.00 12.44 H new ATOM 0 HD23 LEU A 115 -6.135 -0.610 3.725 1.00 12.44 H new ATOM 1784 N ASP A 116 -5.676 0.723 9.425 1.00 72.43 N ATOM 1785 CA ASP A 116 -5.915 2.083 9.892 1.00 42.32 C ATOM 1786 C ASP A 116 -4.830 3.029 9.386 1.00 11.44 C ATOM 1787 O ASP A 116 -3.763 2.594 8.952 1.00 73.40 O ATOM 1788 CB ASP A 116 -5.968 2.119 11.420 1.00 73.30 C ATOM 1789 CG ASP A 116 -4.632 1.787 12.054 1.00 62.11 C ATOM 1790 OD1 ASP A 116 -3.738 1.296 11.333 1.00 71.24 O ATOM 1791 OD2 ASP A 116 -4.479 2.019 13.271 1.00 10.12 O ATOM 0 H ASP A 116 -5.680 0.018 10.162 1.00 72.43 H new ATOM 0 HA ASP A 116 -6.875 2.414 9.495 1.00 42.32 H new ATOM 0 HB2 ASP A 116 -6.285 3.109 11.746 1.00 73.30 H new ATOM 0 HB3 ASP A 116 -6.719 1.412 11.771 1.00 73.30 H new ATOM 1796 N THR A 117 -5.110 4.328 9.445 1.00 20.20 N ATOM 1797 CA THR A 117 -4.160 5.336 8.991 1.00 20.35 C ATOM 1798 C THR A 117 -3.063 5.562 10.025 1.00 20.05 C ATOM 1799 O THR A 117 -3.151 5.078 11.154 1.00 14.21 O ATOM 1800 CB THR A 117 -4.860 6.677 8.700 1.00 23.43 C ATOM 1801 OG1 THR A 117 -3.946 7.579 8.068 1.00 44.04 O ATOM 1802 CG2 THR A 117 -5.390 7.300 9.983 1.00 42.13 C ATOM 0 H THR A 117 -5.987 4.706 9.803 1.00 20.20 H new ATOM 0 HA THR A 117 -3.715 4.960 8.070 1.00 20.35 H new ATOM 0 HB THR A 117 -5.701 6.486 8.033 1.00 23.43 H new ATOM 0 HG1 THR A 117 -4.399 8.429 7.885 1.00 44.04 H new ATOM 0 HG21 THR A 117 -5.880 8.246 9.753 1.00 42.13 H new ATOM 0 HG22 THR A 117 -6.107 6.623 10.447 1.00 42.13 H new ATOM 0 HG23 THR A 117 -4.563 7.478 10.670 1.00 42.13 H new ATOM 1810 N ARG A 118 -2.030 6.300 9.633 1.00 1.55 N ATOM 1811 CA ARG A 118 -0.915 6.590 10.527 1.00 11.31 C ATOM 1812 C ARG A 118 -1.404 7.268 11.804 1.00 42.11 C ATOM 1813 O ARG A 118 -2.501 7.823 11.860 1.00 13.23 O ATOM 1814 CB ARG A 118 0.111 7.481 9.825 1.00 40.33 C ATOM 1815 CG ARG A 118 1.228 6.705 9.145 1.00 13.55 C ATOM 1816 CD ARG A 118 2.254 7.638 8.522 1.00 65.11 C ATOM 1817 NE ARG A 118 1.796 8.182 7.247 1.00 41.25 N ATOM 1818 CZ ARG A 118 2.441 9.133 6.579 1.00 71.41 C ATOM 1819 NH1 ARG A 118 3.566 9.641 7.063 1.00 72.31 N ATOM 1820 NH2 ARG A 118 1.961 9.576 5.424 1.00 14.22 N ATOM 0 H ARG A 118 -1.942 6.708 8.702 1.00 1.55 H new ATOM 0 HA ARG A 118 -0.442 5.645 10.796 1.00 11.31 H new ATOM 0 HB2 ARG A 118 -0.400 8.093 9.081 1.00 40.33 H new ATOM 0 HB3 ARG A 118 0.546 8.164 10.555 1.00 40.33 H new ATOM 0 HG2 ARG A 118 1.718 6.057 9.872 1.00 13.55 H new ATOM 0 HG3 ARG A 118 0.807 6.059 8.375 1.00 13.55 H new ATOM 0 HD2 ARG A 118 2.465 8.456 9.210 1.00 65.11 H new ATOM 0 HD3 ARG A 118 3.189 7.099 8.371 1.00 65.11 H new ATOM 0 HE ARG A 118 0.934 7.812 6.847 1.00 41.25 H new ATOM 0 HH11 ARG A 118 3.938 9.302 7.950 1.00 72.31 H new ATOM 0 HH12 ARG A 118 4.059 10.371 6.548 1.00 72.31 H new ATOM 0 HH21 ARG A 118 1.096 9.187 5.048 1.00 14.22 H new ATOM 0 HH22 ARG A 118 2.457 10.306 4.912 1.00 14.22 H new ATOM 1834 N PRO A 119 -0.571 7.222 12.854 1.00 11.34 N ATOM 1835 CA PRO A 119 -0.897 7.827 14.150 1.00 62.24 C ATOM 1836 C PRO A 119 -0.900 9.351 14.094 1.00 61.42 C ATOM 1837 O PRO A 119 -0.250 9.951 13.238 1.00 0.21 O ATOM 1838 CB PRO A 119 0.223 7.327 15.066 1.00 43.43 C ATOM 1839 CG PRO A 119 1.364 7.046 14.150 1.00 21.51 C ATOM 1840 CD PRO A 119 0.753 6.577 12.859 1.00 53.54 C ATOM 0 HA PRO A 119 -1.897 7.554 14.488 1.00 62.24 H new ATOM 0 HB2 PRO A 119 0.489 8.076 15.811 1.00 43.43 H new ATOM 0 HB3 PRO A 119 -0.079 6.431 15.608 1.00 43.43 H new ATOM 0 HG2 PRO A 119 1.968 7.940 13.994 1.00 21.51 H new ATOM 0 HG3 PRO A 119 2.023 6.285 14.569 1.00 21.51 H new ATOM 0 HD2 PRO A 119 1.350 6.879 11.999 1.00 53.54 H new ATOM 0 HD3 PRO A 119 0.671 5.491 12.825 1.00 53.54 H new ATOM 1848 N SER A 120 -1.635 9.970 15.012 1.00 40.34 N ATOM 1849 CA SER A 120 -1.725 11.425 15.064 1.00 21.24 C ATOM 1850 C SER A 120 -0.355 12.045 15.325 1.00 35.34 C ATOM 1851 O SER A 120 0.510 11.426 15.944 1.00 61.03 O ATOM 1852 CB SER A 120 -2.709 11.857 16.153 1.00 22.24 C ATOM 1853 OG SER A 120 -3.587 12.862 15.678 1.00 72.24 O ATOM 0 H SER A 120 -2.176 9.488 15.729 1.00 40.34 H new ATOM 0 HA SER A 120 -2.086 11.777 14.098 1.00 21.24 H new ATOM 0 HB2 SER A 120 -3.286 10.995 16.489 1.00 22.24 H new ATOM 0 HB3 SER A 120 -2.159 12.229 17.017 1.00 22.24 H new ATOM 0 HG SER A 120 -4.207 13.119 16.392 1.00 72.24 H new ATOM 1859 N MET A 121 -0.168 13.271 14.849 1.00 3.11 N ATOM 1860 CA MET A 121 1.096 13.976 15.032 1.00 52.15 C ATOM 1861 C MET A 121 0.871 15.334 15.688 1.00 14.34 C ATOM 1862 O MET A 121 1.575 16.301 15.397 1.00 52.12 O ATOM 1863 CB MET A 121 1.802 14.158 13.687 1.00 72.15 C ATOM 1864 CG MET A 121 0.914 14.763 12.611 1.00 3.53 C ATOM 1865 SD MET A 121 1.640 16.231 11.857 1.00 44.33 S ATOM 1866 CE MET A 121 2.246 15.554 10.313 1.00 4.03 C ATOM 0 H MET A 121 -0.874 13.797 14.334 1.00 3.11 H new ATOM 0 HA MET A 121 1.727 13.375 15.688 1.00 52.15 H new ATOM 0 HB2 MET A 121 2.675 14.796 13.827 1.00 72.15 H new ATOM 0 HB3 MET A 121 2.167 13.190 13.344 1.00 72.15 H new ATOM 0 HG2 MET A 121 0.726 14.017 11.838 1.00 3.53 H new ATOM 0 HG3 MET A 121 -0.052 15.022 13.045 1.00 3.53 H new ATOM 0 HE1 MET A 121 2.724 16.343 9.732 1.00 4.03 H new ATOM 0 HE2 MET A 121 2.971 14.767 10.520 1.00 4.03 H new ATOM 0 HE3 MET A 121 1.413 15.139 9.746 1.00 4.03 H new ATOM 1876 N LYS A 122 -0.116 15.401 16.576 1.00 25.35 N ATOM 1877 CA LYS A 122 -0.434 16.640 17.276 1.00 23.20 C ATOM 1878 C LYS A 122 0.390 16.771 18.553 1.00 23.40 C ATOM 1879 O LYS A 122 0.864 17.856 18.888 1.00 61.25 O ATOM 1880 CB LYS A 122 -1.926 16.691 17.612 1.00 41.43 C ATOM 1881 CG LYS A 122 -2.775 17.307 16.514 1.00 54.25 C ATOM 1882 CD LYS A 122 -3.870 18.192 17.085 1.00 13.14 C ATOM 1883 CE LYS A 122 -4.568 18.990 15.995 1.00 12.50 C ATOM 1884 NZ LYS A 122 -5.790 19.673 16.503 1.00 10.43 N ATOM 0 H LYS A 122 -0.710 14.611 16.828 1.00 25.35 H new ATOM 0 HA LYS A 122 -0.187 17.473 16.618 1.00 23.20 H new ATOM 0 HB2 LYS A 122 -2.280 15.679 17.810 1.00 41.43 H new ATOM 0 HB3 LYS A 122 -2.064 17.262 18.530 1.00 41.43 H new ATOM 0 HG2 LYS A 122 -2.141 17.894 15.849 1.00 54.25 H new ATOM 0 HG3 LYS A 122 -3.222 16.516 15.912 1.00 54.25 H new ATOM 0 HD2 LYS A 122 -4.600 17.576 17.610 1.00 13.14 H new ATOM 0 HD3 LYS A 122 -3.442 18.874 17.819 1.00 13.14 H new ATOM 0 HE2 LYS A 122 -3.879 19.732 15.590 1.00 12.50 H new ATOM 0 HE3 LYS A 122 -4.838 18.325 15.175 1.00 12.50 H new ATOM 0 HZ1 LYS A 122 -6.237 20.206 15.730 1.00 10.43 H new ATOM 0 HZ2 LYS A 122 -6.459 18.964 16.866 1.00 10.43 H new ATOM 0 HZ3 LYS A 122 -5.529 20.327 17.269 1.00 10.43 H new ATOM 1898 N GLU A 123 0.558 15.658 19.261 1.00 74.23 N ATOM 1899 CA GLU A 123 1.325 15.650 20.500 1.00 23.14 C ATOM 1900 C GLU A 123 2.236 14.428 20.568 1.00 24.43 C ATOM 1901 O GLU A 123 2.548 13.932 21.651 1.00 44.32 O ATOM 1902 CB GLU A 123 0.386 15.667 21.708 1.00 0.22 C ATOM 1903 CG GLU A 123 0.970 16.368 22.923 1.00 12.22 C ATOM 1904 CD GLU A 123 0.202 17.620 23.299 1.00 12.53 C ATOM 1905 OE1 GLU A 123 -0.980 17.498 23.684 1.00 30.43 O ATOM 1906 OE2 GLU A 123 0.782 18.723 23.209 1.00 74.54 O ATOM 0 H GLU A 123 0.173 14.751 18.997 1.00 74.23 H new ATOM 0 HA GLU A 123 1.945 16.546 20.519 1.00 23.14 H new ATOM 0 HB2 GLU A 123 -0.545 16.160 21.427 1.00 0.22 H new ATOM 0 HB3 GLU A 123 0.135 14.641 21.977 1.00 0.22 H new ATOM 0 HG2 GLU A 123 0.972 15.680 23.768 1.00 12.22 H new ATOM 0 HG3 GLU A 123 2.009 16.630 22.722 1.00 12.22 H new ATOM 1913 N ALA A 124 2.659 13.946 19.404 1.00 52.33 N ATOM 1914 CA ALA A 124 3.535 12.784 19.330 1.00 33.42 C ATOM 1915 C ALA A 124 4.868 13.141 18.681 1.00 34.51 C ATOM 1916 O ALA A 124 4.990 14.168 18.016 1.00 73.04 O ATOM 1917 CB ALA A 124 2.856 11.659 18.562 1.00 12.21 C ATOM 0 H ALA A 124 2.409 14.343 18.498 1.00 52.33 H new ATOM 0 HA ALA A 124 3.735 12.446 20.347 1.00 33.42 H new ATOM 0 HB1 ALA A 124 3.522 10.797 18.514 1.00 12.21 H new ATOM 0 HB2 ALA A 124 1.933 11.377 19.069 1.00 12.21 H new ATOM 0 HB3 ALA A 124 2.626 11.996 17.551 1.00 12.21 H new ATOM 1923 N GLY A 125 5.866 12.285 18.880 1.00 33.22 N ATOM 1924 CA GLY A 125 7.177 12.529 18.308 1.00 20.43 C ATOM 1925 C GLY A 125 7.941 11.247 18.042 1.00 73.33 C ATOM 1926 O GLY A 125 8.082 10.404 18.927 1.00 12.31 O ATOM 0 H GLY A 125 5.790 11.427 19.427 1.00 33.22 H new ATOM 0 HA2 GLY A 125 7.066 13.082 17.375 1.00 20.43 H new ATOM 0 HA3 GLY A 125 7.754 13.158 18.985 1.00 20.43 H new ATOM 1930 N GLY A 126 8.434 11.097 16.816 1.00 41.30 N ATOM 1931 CA GLY A 126 9.180 9.905 16.457 1.00 53.23 C ATOM 1932 C GLY A 126 10.278 10.190 15.452 1.00 64.51 C ATOM 1933 O GLY A 126 10.009 10.628 14.333 1.00 23.41 O ATOM 0 H GLY A 126 8.330 11.780 16.065 1.00 41.30 H new ATOM 0 HA2 GLY A 126 9.618 9.470 17.355 1.00 53.23 H new ATOM 0 HA3 GLY A 126 8.497 9.163 16.044 1.00 53.23 H new ATOM 1937 N LYS A 127 11.521 9.942 15.851 1.00 64.33 N ATOM 1938 CA LYS A 127 12.666 10.174 14.978 1.00 21.30 C ATOM 1939 C LYS A 127 13.386 8.866 14.665 1.00 32.32 C ATOM 1940 O LYS A 127 13.477 7.979 15.514 1.00 52.23 O ATOM 1941 CB LYS A 127 13.638 11.160 15.629 1.00 3.02 C ATOM 1942 CG LYS A 127 13.039 12.535 15.871 1.00 21.43 C ATOM 1943 CD LYS A 127 13.101 12.919 17.340 1.00 35.21 C ATOM 1944 CE LYS A 127 11.774 12.663 18.039 1.00 22.31 C ATOM 1945 NZ LYS A 127 10.777 13.728 17.744 1.00 54.15 N ATOM 0 H LYS A 127 11.761 9.580 16.774 1.00 64.33 H new ATOM 0 HA LYS A 127 12.298 10.598 14.044 1.00 21.30 H new ATOM 0 HB2 LYS A 127 13.978 10.748 16.580 1.00 3.02 H new ATOM 0 HB3 LYS A 127 14.518 11.263 14.994 1.00 3.02 H new ATOM 0 HG2 LYS A 127 13.575 13.276 15.277 1.00 21.43 H new ATOM 0 HG3 LYS A 127 12.002 12.546 15.535 1.00 21.43 H new ATOM 0 HD2 LYS A 127 13.889 12.350 17.833 1.00 35.21 H new ATOM 0 HD3 LYS A 127 13.364 13.973 17.431 1.00 35.21 H new ATOM 0 HE2 LYS A 127 11.378 11.698 17.724 1.00 22.31 H new ATOM 0 HE3 LYS A 127 11.936 12.605 19.115 1.00 22.31 H new ATOM 0 HZ1 LYS A 127 9.887 13.517 18.239 1.00 54.15 H new ATOM 0 HZ2 LYS A 127 11.144 14.646 18.068 1.00 54.15 H new ATOM 0 HZ3 LYS A 127 10.603 13.766 16.719 1.00 54.15 H new ATOM 1959 N GLU A 128 13.896 8.754 13.443 1.00 64.11 N ATOM 1960 CA GLU A 128 14.609 7.554 13.020 1.00 35.20 C ATOM 1961 C GLU A 128 15.947 7.912 12.381 1.00 2.23 C ATOM 1962 O GLU A 128 16.143 7.725 11.181 1.00 41.20 O ATOM 1963 CB GLU A 128 13.759 6.751 12.033 1.00 73.30 C ATOM 1964 CG GLU A 128 14.351 5.396 11.682 1.00 53.11 C ATOM 1965 CD GLU A 128 14.360 4.441 12.859 1.00 23.34 C ATOM 1966 OE1 GLU A 128 15.202 4.624 13.764 1.00 33.31 O ATOM 1967 OE2 GLU A 128 13.527 3.511 12.876 1.00 24.43 O ATOM 0 H GLU A 128 13.829 9.479 12.729 1.00 64.11 H new ATOM 0 HA GLU A 128 14.800 6.946 13.904 1.00 35.20 H new ATOM 0 HB2 GLU A 128 12.765 6.605 12.457 1.00 73.30 H new ATOM 0 HB3 GLU A 128 13.633 7.331 11.119 1.00 73.30 H new ATOM 0 HG2 GLU A 128 13.780 4.955 10.865 1.00 53.11 H new ATOM 0 HG3 GLU A 128 15.371 5.532 11.321 1.00 53.11 H new ATOM 1974 N GLU A 129 16.864 8.429 13.193 1.00 24.43 N ATOM 1975 CA GLU A 129 18.184 8.815 12.707 1.00 32.41 C ATOM 1976 C GLU A 129 18.861 7.650 11.990 1.00 42.53 C ATOM 1977 O GLU A 129 18.602 6.486 12.290 1.00 13.14 O ATOM 1978 CB GLU A 129 19.060 9.292 13.867 1.00 13.22 C ATOM 1979 CG GLU A 129 18.445 10.430 14.665 1.00 24.14 C ATOM 1980 CD GLU A 129 17.740 9.949 15.919 1.00 41.04 C ATOM 1981 OE1 GLU A 129 18.427 9.735 16.940 1.00 54.21 O ATOM 1982 OE2 GLU A 129 16.503 9.786 15.878 1.00 12.24 O ATOM 0 H GLU A 129 16.717 8.590 14.189 1.00 24.43 H new ATOM 0 HA GLU A 129 18.057 9.633 11.997 1.00 32.41 H new ATOM 0 HB2 GLU A 129 19.252 8.453 14.535 1.00 13.22 H new ATOM 0 HB3 GLU A 129 20.025 9.614 13.475 1.00 13.22 H new ATOM 0 HG2 GLU A 129 19.226 11.139 14.941 1.00 24.14 H new ATOM 0 HG3 GLU A 129 17.735 10.967 14.037 1.00 24.14 H new ATOM 1989 N GLY A 130 19.731 7.975 11.038 1.00 24.11 N ATOM 1990 CA GLY A 130 20.432 6.946 10.292 1.00 43.42 C ATOM 1991 C GLY A 130 21.288 7.519 9.180 1.00 64.24 C ATOM 1992 O GLY A 130 21.402 8.734 9.017 1.00 20.03 O ATOM 0 H GLY A 130 19.963 8.932 10.770 1.00 24.11 H new ATOM 0 HA2 GLY A 130 21.062 6.373 10.973 1.00 43.42 H new ATOM 0 HA3 GLY A 130 19.707 6.251 9.867 1.00 43.42 H new ATOM 1996 N PRO A 131 21.911 6.631 8.390 1.00 1.02 N ATOM 1997 CA PRO A 131 22.773 7.032 7.275 1.00 64.25 C ATOM 1998 C PRO A 131 21.984 7.648 6.125 1.00 44.35 C ATOM 1999 O PRO A 131 20.757 7.574 6.072 1.00 15.34 O ATOM 2000 CB PRO A 131 23.419 5.716 6.835 1.00 63.52 C ATOM 2001 CG PRO A 131 22.458 4.661 7.261 1.00 34.33 C ATOM 2002 CD PRO A 131 21.821 5.167 8.526 1.00 51.53 C ATOM 0 HA PRO A 131 23.491 7.798 7.570 1.00 64.25 H new ATOM 0 HB2 PRO A 131 23.578 5.694 5.757 1.00 63.52 H new ATOM 0 HB3 PRO A 131 24.393 5.577 7.304 1.00 63.52 H new ATOM 0 HG2 PRO A 131 21.708 4.483 6.491 1.00 34.33 H new ATOM 0 HG3 PRO A 131 22.969 3.714 7.433 1.00 34.33 H new ATOM 0 HD2 PRO A 131 20.787 4.834 8.616 1.00 51.53 H new ATOM 0 HD3 PRO A 131 22.348 4.812 9.412 1.00 51.53 H new ATOM 2010 N PRO A 132 22.704 8.271 5.179 1.00 13.43 N ATOM 2011 CA PRO A 132 22.091 8.912 4.012 1.00 52.11 C ATOM 2012 C PRO A 132 21.504 7.898 3.036 1.00 42.24 C ATOM 2013 O PRO A 132 20.438 8.120 2.463 1.00 13.42 O ATOM 2014 CB PRO A 132 23.258 9.663 3.366 1.00 52.10 C ATOM 2015 CG PRO A 132 24.473 8.919 3.800 1.00 45.15 C ATOM 2016 CD PRO A 132 24.171 8.398 5.177 1.00 12.12 C ATOM 0 HA PRO A 132 21.256 9.554 4.291 1.00 52.11 H new ATOM 0 HB2 PRO A 132 23.168 9.675 2.280 1.00 52.10 H new ATOM 0 HB3 PRO A 132 23.291 10.702 3.695 1.00 52.10 H new ATOM 0 HG2 PRO A 132 24.696 8.102 3.114 1.00 45.15 H new ATOM 0 HG3 PRO A 132 25.346 9.571 3.813 1.00 45.15 H new ATOM 0 HD2 PRO A 132 24.658 7.440 5.360 1.00 12.12 H new ATOM 0 HD3 PRO A 132 24.516 9.084 5.951 1.00 12.12 H new ATOM 2024 N GLN A 133 22.208 6.786 2.851 1.00 34.42 N ATOM 2025 CA GLN A 133 21.755 5.738 1.943 1.00 3.14 C ATOM 2026 C GLN A 133 21.489 6.302 0.551 1.00 24.43 C ATOM 2027 O GLN A 133 20.383 6.749 0.253 1.00 15.03 O ATOM 2028 CB GLN A 133 20.490 5.074 2.488 1.00 74.41 C ATOM 2029 CG GLN A 133 20.269 3.664 1.964 1.00 24.43 C ATOM 2030 CD GLN A 133 20.467 2.607 3.033 1.00 32.31 C ATOM 2031 OE1 GLN A 133 20.003 2.757 4.164 1.00 61.31 O ATOM 2032 NE2 GLN A 133 21.158 1.529 2.680 1.00 0.30 N ATOM 0 H GLN A 133 23.093 6.587 3.317 1.00 34.42 H new ATOM 0 HA GLN A 133 22.545 4.991 1.867 1.00 3.14 H new ATOM 0 HB2 GLN A 133 20.546 5.044 3.576 1.00 74.41 H new ATOM 0 HB3 GLN A 133 19.627 5.688 2.230 1.00 74.41 H new ATOM 0 HG2 GLN A 133 19.259 3.584 1.562 1.00 24.43 H new ATOM 0 HG3 GLN A 133 20.956 3.475 1.139 1.00 24.43 H new ATOM 0 HE21 GLN A 133 21.524 1.446 1.732 1.00 0.30 H new ATOM 0 HE22 GLN A 133 21.322 0.784 3.357 1.00 0.30 H new ATOM 2041 N ALA A 134 22.512 6.277 -0.297 1.00 22.40 N ATOM 2042 CA ALA A 134 22.388 6.783 -1.658 1.00 43.40 C ATOM 2043 C ALA A 134 23.253 5.980 -2.624 1.00 13.12 C ATOM 2044 O ALA A 134 22.740 5.298 -3.511 1.00 54.12 O ATOM 2045 CB ALA A 134 22.766 8.256 -1.709 1.00 53.51 C ATOM 0 H ALA A 134 23.436 5.912 -0.065 1.00 22.40 H new ATOM 0 HA ALA A 134 21.348 6.674 -1.966 1.00 43.40 H new ATOM 0 HB1 ALA A 134 22.669 8.621 -2.731 1.00 53.51 H new ATOM 0 HB2 ALA A 134 22.104 8.824 -1.056 1.00 53.51 H new ATOM 0 HB3 ALA A 134 23.797 8.379 -1.376 1.00 53.51 H new ATOM 2051 N TYR A 135 24.566 6.066 -2.446 1.00 23.32 N ATOM 2052 CA TYR A 135 25.502 5.349 -3.304 1.00 22.11 C ATOM 2053 C TYR A 135 26.136 4.177 -2.560 1.00 12.42 C ATOM 2054 O TYR A 135 26.228 3.071 -3.089 1.00 24.14 O ATOM 2055 CB TYR A 135 26.592 6.296 -3.809 1.00 12.22 C ATOM 2056 CG TYR A 135 27.234 5.846 -5.102 1.00 13.52 C ATOM 2057 CD1 TYR A 135 26.617 6.081 -6.325 1.00 12.24 C ATOM 2058 CD2 TYR A 135 28.456 5.186 -5.101 1.00 0.11 C ATOM 2059 CE1 TYR A 135 27.199 5.672 -7.509 1.00 20.54 C ATOM 2060 CE2 TYR A 135 29.046 4.774 -6.280 1.00 2.20 C ATOM 2061 CZ TYR A 135 28.414 5.019 -7.481 1.00 71.01 C ATOM 2062 OH TYR A 135 28.998 4.609 -8.658 1.00 31.03 O ATOM 0 H TYR A 135 25.007 6.625 -1.715 1.00 23.32 H new ATOM 0 HA TYR A 135 24.947 4.957 -4.156 1.00 22.11 H new ATOM 0 HB2 TYR A 135 26.162 7.287 -3.952 1.00 12.22 H new ATOM 0 HB3 TYR A 135 27.363 6.390 -3.044 1.00 12.22 H new ATOM 0 HD1 TYR A 135 25.666 6.592 -6.350 1.00 12.24 H new ATOM 0 HD2 TYR A 135 28.953 4.992 -4.162 1.00 0.11 H new ATOM 0 HE1 TYR A 135 26.706 5.862 -8.451 1.00 20.54 H new ATOM 0 HE2 TYR A 135 29.997 4.263 -6.261 1.00 2.20 H new ATOM 0 HH TYR A 135 29.850 4.166 -8.463 1.00 31.03 H new TER 2072 TYR A 135