USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 817 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.44) USER MOD Set 1.2: A 116 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= -0.256 USER MOD Single : A 35 SER OG : rot -51:sc= 0.691 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -0.831! C(o=-0.83!,f=-3.1!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.681) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.174 USER MOD Single : A 86 HIS : no HD1:sc= -1.91 K(o=-1.9,f=-4.9!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 CYS SG : rot 180:sc= -0.537 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 7:sc= 0.987 USER MOD Single : A 95 CYS SG : rot -82:sc= -0.153 USER MOD Single : A 99 SER OG : rot 180:sc=-0.00729 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= -2.91! C(o=-2.9!,f=-2!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HD1:sc= -0.176 K(o=-0.18,f=-4.6!) USER MOD Single : A 110 GLN : amide:sc= -3.01! C(o=-3!,f=-2.9!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.319 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc=-0.00473 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 31 5.616 -12.227 -18.347 1.00 0.00 N ATOM 2 CA GLY A 31 4.188 -12.281 -18.602 1.00 0.00 C ATOM 3 C GLY A 31 3.621 -10.934 -19.005 1.00 0.00 C ATOM 4 O GLY A 31 3.616 -10.582 -20.185 1.00 0.00 O ATOM 0 HA2 GLY A 31 3.990 -13.006 -19.391 1.00 0.00 H new ATOM 0 HA3 GLY A 31 3.675 -12.635 -17.708 1.00 0.00 H new ATOM 8 N SER A 32 3.139 -10.179 -18.023 1.00 0.00 N ATOM 9 CA SER A 32 2.561 -8.866 -18.281 1.00 0.00 C ATOM 10 C SER A 32 3.638 -7.872 -18.704 1.00 0.00 C ATOM 11 O SER A 32 4.825 -8.082 -18.453 1.00 0.00 O ATOM 12 CB SER A 32 1.835 -8.351 -17.037 1.00 0.00 C ATOM 13 OG SER A 32 2.733 -8.189 -15.953 1.00 0.00 O ATOM 0 H SER A 32 3.137 -10.455 -17.041 1.00 0.00 H new ATOM 0 HA SER A 32 1.844 -8.966 -19.096 1.00 0.00 H new ATOM 0 HB2 SER A 32 1.355 -7.399 -17.261 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.045 -9.049 -16.758 1.00 0.00 H new ATOM 0 HG SER A 32 2.245 -7.857 -15.171 1.00 0.00 H new ATOM 19 N SER A 33 3.215 -6.788 -19.347 1.00 0.00 N ATOM 20 CA SER A 33 4.143 -5.762 -19.808 1.00 0.00 C ATOM 21 C SER A 33 3.433 -4.422 -19.974 1.00 0.00 C ATOM 22 O SER A 33 2.341 -4.351 -20.535 1.00 0.00 O ATOM 23 CB SER A 33 4.782 -6.181 -21.133 1.00 0.00 C ATOM 24 OG SER A 33 5.442 -7.428 -21.009 1.00 0.00 O ATOM 0 H SER A 33 2.236 -6.598 -19.560 1.00 0.00 H new ATOM 0 HA SER A 33 4.924 -5.649 -19.056 1.00 0.00 H new ATOM 0 HB2 SER A 33 4.015 -6.247 -21.905 1.00 0.00 H new ATOM 0 HB3 SER A 33 5.493 -5.420 -21.454 1.00 0.00 H new ATOM 0 HG SER A 33 5.841 -7.674 -21.870 1.00 0.00 H new ATOM 30 N GLY A 34 4.063 -3.360 -19.480 1.00 0.00 N ATOM 31 CA GLY A 34 3.477 -2.036 -19.582 1.00 0.00 C ATOM 32 C GLY A 34 4.441 -1.019 -20.161 1.00 0.00 C ATOM 33 O GLY A 34 4.439 -0.769 -21.367 1.00 0.00 O ATOM 0 H GLY A 34 4.968 -3.393 -19.011 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.585 -2.084 -20.207 1.00 0.00 H new ATOM 0 HA3 GLY A 34 3.156 -1.707 -18.594 1.00 0.00 H new ATOM 37 N SER A 35 5.265 -0.430 -19.301 1.00 0.00 N ATOM 38 CA SER A 35 6.235 0.569 -19.733 1.00 0.00 C ATOM 39 C SER A 35 5.534 1.769 -20.362 1.00 0.00 C ATOM 40 O SER A 35 5.973 2.292 -21.387 1.00 0.00 O ATOM 41 CB SER A 35 7.219 -0.042 -20.732 1.00 0.00 C ATOM 42 OG SER A 35 8.227 0.887 -21.090 1.00 0.00 O ATOM 0 H SER A 35 5.280 -0.627 -18.300 1.00 0.00 H new ATOM 0 HA SER A 35 6.785 0.909 -18.855 1.00 0.00 H new ATOM 0 HB2 SER A 35 7.677 -0.931 -20.298 1.00 0.00 H new ATOM 0 HB3 SER A 35 6.683 -0.363 -21.625 1.00 0.00 H new ATOM 0 HG SER A 35 7.811 1.731 -21.364 1.00 0.00 H new ATOM 48 N SER A 36 4.441 2.201 -19.741 1.00 0.00 N ATOM 49 CA SER A 36 3.676 3.337 -20.241 1.00 0.00 C ATOM 50 C SER A 36 4.170 4.641 -19.620 1.00 0.00 C ATOM 51 O SER A 36 3.871 4.944 -18.466 1.00 0.00 O ATOM 52 CB SER A 36 2.188 3.148 -19.942 1.00 0.00 C ATOM 53 OG SER A 36 1.638 2.104 -20.727 1.00 0.00 O ATOM 0 H SER A 36 4.065 1.781 -18.891 1.00 0.00 H new ATOM 0 HA SER A 36 3.818 3.392 -21.320 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.052 2.922 -18.884 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.653 4.077 -20.141 1.00 0.00 H new ATOM 0 HG SER A 36 0.686 2.002 -20.516 1.00 0.00 H new ATOM 59 N GLY A 37 4.928 5.409 -20.396 1.00 0.00 N ATOM 60 CA GLY A 37 5.452 6.670 -19.906 1.00 0.00 C ATOM 61 C GLY A 37 5.939 6.579 -18.473 1.00 0.00 C ATOM 62 O GLY A 37 6.229 5.490 -17.977 1.00 0.00 O ATOM 0 H GLY A 37 5.189 5.180 -21.355 1.00 0.00 H new ATOM 0 HA2 GLY A 37 6.274 6.991 -20.546 1.00 0.00 H new ATOM 0 HA3 GLY A 37 4.677 7.433 -19.975 1.00 0.00 H new ATOM 66 N VAL A 38 6.030 7.725 -17.807 1.00 0.00 N ATOM 67 CA VAL A 38 6.486 7.770 -16.422 1.00 0.00 C ATOM 68 C VAL A 38 5.347 8.147 -15.481 1.00 0.00 C ATOM 69 O VAL A 38 4.440 8.900 -15.835 1.00 0.00 O ATOM 70 CB VAL A 38 7.639 8.776 -16.244 1.00 0.00 C ATOM 71 CG1 VAL A 38 8.821 8.394 -17.122 1.00 0.00 C ATOM 72 CG2 VAL A 38 7.167 10.188 -16.554 1.00 0.00 C ATOM 0 H VAL A 38 5.794 8.635 -18.203 1.00 0.00 H new ATOM 0 HA VAL A 38 6.844 6.771 -16.173 1.00 0.00 H new ATOM 0 HB VAL A 38 7.966 8.748 -15.205 1.00 0.00 H new ATOM 0 HG11 VAL A 38 9.626 9.116 -16.983 1.00 0.00 H new ATOM 0 HG12 VAL A 38 9.173 7.400 -16.846 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.512 8.392 -18.167 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.995 10.885 -16.423 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.812 10.235 -17.584 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.355 10.457 -15.878 1.00 0.00 H new ATOM 82 N PRO A 39 5.395 7.612 -14.252 1.00 0.00 N ATOM 83 CA PRO A 39 4.375 7.879 -13.233 1.00 0.00 C ATOM 84 C PRO A 39 4.432 9.313 -12.718 1.00 0.00 C ATOM 85 O PRO A 39 5.508 9.838 -12.434 1.00 0.00 O ATOM 86 CB PRO A 39 4.725 6.895 -12.114 1.00 0.00 C ATOM 87 CG PRO A 39 6.182 6.632 -12.284 1.00 0.00 C ATOM 88 CD PRO A 39 6.447 6.707 -13.762 1.00 0.00 C ATOM 0 HA PRO A 39 3.365 7.758 -13.626 1.00 0.00 H new ATOM 0 HB2 PRO A 39 4.511 7.319 -11.133 1.00 0.00 H new ATOM 0 HB3 PRO A 39 4.144 5.976 -12.198 1.00 0.00 H new ATOM 0 HG2 PRO A 39 6.777 7.368 -11.743 1.00 0.00 H new ATOM 0 HG3 PRO A 39 6.450 5.652 -11.889 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.443 7.097 -13.972 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.384 5.726 -14.232 1.00 0.00 H new ATOM 96 N MET A 40 3.266 9.941 -12.599 1.00 0.00 N ATOM 97 CA MET A 40 3.184 11.315 -12.116 1.00 0.00 C ATOM 98 C MET A 40 2.320 11.399 -10.862 1.00 0.00 C ATOM 99 O MET A 40 1.193 10.904 -10.838 1.00 0.00 O ATOM 100 CB MET A 40 2.615 12.227 -13.204 1.00 0.00 C ATOM 101 CG MET A 40 3.669 12.765 -14.159 1.00 0.00 C ATOM 102 SD MET A 40 4.541 14.197 -13.495 1.00 0.00 S ATOM 103 CE MET A 40 4.635 15.239 -14.949 1.00 0.00 C ATOM 0 H MET A 40 2.366 9.521 -12.830 1.00 0.00 H new ATOM 0 HA MET A 40 4.191 11.647 -11.865 1.00 0.00 H new ATOM 0 HB2 MET A 40 1.867 11.676 -13.774 1.00 0.00 H new ATOM 0 HB3 MET A 40 2.102 13.065 -12.732 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.389 11.977 -14.381 1.00 0.00 H new ATOM 0 HG3 MET A 40 3.194 13.038 -15.101 1.00 0.00 H new ATOM 0 HE1 MET A 40 5.150 16.167 -14.699 1.00 0.00 H new ATOM 0 HE2 MET A 40 5.184 14.719 -15.734 1.00 0.00 H new ATOM 0 HE3 MET A 40 3.628 15.466 -15.300 1.00 0.00 H new ATOM 113 N LYS A 41 2.855 12.030 -9.822 1.00 0.00 N ATOM 114 CA LYS A 41 2.133 12.180 -8.564 1.00 0.00 C ATOM 115 C LYS A 41 1.900 13.653 -8.243 1.00 0.00 C ATOM 116 O LYS A 41 2.248 14.532 -9.032 1.00 0.00 O ATOM 117 CB LYS A 41 2.908 11.515 -7.425 1.00 0.00 C ATOM 118 CG LYS A 41 4.323 12.042 -7.263 1.00 0.00 C ATOM 119 CD LYS A 41 5.163 11.124 -6.391 1.00 0.00 C ATOM 120 CE LYS A 41 6.460 11.795 -5.963 1.00 0.00 C ATOM 121 NZ LYS A 41 7.344 10.863 -5.210 1.00 0.00 N ATOM 0 H LYS A 41 3.786 12.446 -9.826 1.00 0.00 H new ATOM 0 HA LYS A 41 1.164 11.692 -8.669 1.00 0.00 H new ATOM 0 HB2 LYS A 41 2.365 11.664 -6.492 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.948 10.440 -7.603 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.790 12.142 -8.243 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.293 13.038 -6.821 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.592 10.836 -5.508 1.00 0.00 H new ATOM 0 HD3 LYS A 41 5.389 10.208 -6.937 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.986 12.163 -6.844 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.233 12.662 -5.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.217 11.358 -4.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 6.852 10.531 -4.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 7.582 10.048 -5.811 1.00 0.00 H new ATOM 135 N ASP A 42 1.312 13.915 -7.082 1.00 0.00 N ATOM 136 CA ASP A 42 1.035 15.282 -6.656 1.00 0.00 C ATOM 137 C ASP A 42 2.061 15.749 -5.627 1.00 0.00 C ATOM 138 O ASP A 42 2.698 14.935 -4.957 1.00 0.00 O ATOM 139 CB ASP A 42 -0.374 15.382 -6.070 1.00 0.00 C ATOM 140 CG ASP A 42 -1.431 15.585 -7.138 1.00 0.00 C ATOM 141 OD1 ASP A 42 -1.129 16.246 -8.153 1.00 0.00 O ATOM 142 OD2 ASP A 42 -2.561 15.085 -6.958 1.00 0.00 O ATOM 0 H ASP A 42 1.018 13.199 -6.418 1.00 0.00 H new ATOM 0 HA ASP A 42 1.103 15.929 -7.531 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.597 14.474 -5.510 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.412 16.210 -5.363 1.00 0.00 H new ATOM 147 N HIS A 43 2.216 17.063 -5.507 1.00 0.00 N ATOM 148 CA HIS A 43 3.165 17.638 -4.560 1.00 0.00 C ATOM 149 C HIS A 43 2.762 17.316 -3.124 1.00 0.00 C ATOM 150 O HIS A 43 3.613 17.052 -2.275 1.00 0.00 O ATOM 151 CB HIS A 43 3.253 19.153 -4.749 1.00 0.00 C ATOM 152 CG HIS A 43 1.917 19.830 -4.786 1.00 0.00 C ATOM 153 ND1 HIS A 43 1.409 20.548 -3.724 1.00 0.00 N ATOM 154 CD2 HIS A 43 0.985 19.898 -5.765 1.00 0.00 C ATOM 155 CE1 HIS A 43 0.221 21.026 -4.047 1.00 0.00 C ATOM 156 NE2 HIS A 43 -0.060 20.647 -5.281 1.00 0.00 N ATOM 0 H HIS A 43 1.697 17.750 -6.054 1.00 0.00 H new ATOM 0 HA HIS A 43 4.144 17.198 -4.752 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.845 19.578 -3.938 1.00 0.00 H new ATOM 0 HB3 HIS A 43 3.785 19.365 -5.677 1.00 0.00 H new ATOM 0 HD1 HIS A 43 1.878 20.688 -2.829 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.051 19.447 -6.744 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -0.413 21.625 -3.410 1.00 0.00 H new ATOM 165 N ASP A 44 1.460 17.340 -2.861 1.00 0.00 N ATOM 166 CA ASP A 44 0.944 17.050 -1.528 1.00 0.00 C ATOM 167 C ASP A 44 0.257 15.688 -1.495 1.00 0.00 C ATOM 168 O ASP A 44 -0.762 15.512 -0.828 1.00 0.00 O ATOM 169 CB ASP A 44 -0.034 18.140 -1.088 1.00 0.00 C ATOM 170 CG ASP A 44 0.666 19.321 -0.444 1.00 0.00 C ATOM 171 OD1 ASP A 44 1.423 20.018 -1.151 1.00 0.00 O ATOM 172 OD2 ASP A 44 0.457 19.547 0.766 1.00 0.00 O ATOM 0 H ASP A 44 0.743 17.557 -3.553 1.00 0.00 H new ATOM 0 HA ASP A 44 1.786 17.028 -0.836 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.602 18.485 -1.952 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -0.751 17.718 -0.384 1.00 0.00 H new ATOM 177 N ALA A 45 0.820 14.729 -2.222 1.00 0.00 N ATOM 178 CA ALA A 45 0.262 13.384 -2.276 1.00 0.00 C ATOM 179 C ALA A 45 0.334 12.705 -0.913 1.00 0.00 C ATOM 180 O ALA A 45 0.828 13.284 0.055 1.00 0.00 O ATOM 181 CB ALA A 45 0.990 12.552 -3.321 1.00 0.00 C ATOM 0 H ALA A 45 1.663 14.859 -2.782 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.788 13.464 -2.558 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.563 11.550 -3.350 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.883 13.021 -4.299 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.047 12.488 -3.063 1.00 0.00 H new ATOM 187 N ILE A 46 -0.163 11.474 -0.843 1.00 0.00 N ATOM 188 CA ILE A 46 -0.155 10.717 0.403 1.00 0.00 C ATOM 189 C ILE A 46 0.193 9.253 0.154 1.00 0.00 C ATOM 190 O ILE A 46 -0.308 8.636 -0.786 1.00 0.00 O ATOM 191 CB ILE A 46 -1.516 10.796 1.119 1.00 0.00 C ATOM 192 CG1 ILE A 46 -1.954 12.254 1.270 1.00 0.00 C ATOM 193 CG2 ILE A 46 -1.440 10.116 2.478 1.00 0.00 C ATOM 194 CD1 ILE A 46 -3.356 12.410 1.816 1.00 0.00 C ATOM 0 H ILE A 46 -0.576 10.980 -1.634 1.00 0.00 H new ATOM 0 HA ILE A 46 0.607 11.166 1.040 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.258 10.275 0.515 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.256 12.768 1.931 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.894 12.745 0.299 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.410 10.180 2.972 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.169 9.069 2.346 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.687 10.611 3.091 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.599 13.469 1.896 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.064 11.925 1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.416 11.948 2.801 1.00 0.00 H new ATOM 206 N LYS A 47 1.052 8.702 1.004 1.00 0.00 N ATOM 207 CA LYS A 47 1.466 7.310 0.879 1.00 0.00 C ATOM 208 C LYS A 47 0.697 6.425 1.855 1.00 0.00 C ATOM 209 O LYS A 47 0.929 6.469 3.064 1.00 0.00 O ATOM 210 CB LYS A 47 2.969 7.178 1.131 1.00 0.00 C ATOM 211 CG LYS A 47 3.479 5.750 1.035 1.00 0.00 C ATOM 212 CD LYS A 47 4.993 5.706 0.915 1.00 0.00 C ATOM 213 CE LYS A 47 5.667 6.001 2.247 1.00 0.00 C ATOM 214 NZ LYS A 47 7.102 6.362 2.074 1.00 0.00 N ATOM 0 H LYS A 47 1.475 9.199 1.788 1.00 0.00 H new ATOM 0 HA LYS A 47 1.244 6.981 -0.136 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.505 7.796 0.411 1.00 0.00 H new ATOM 0 HB3 LYS A 47 3.199 7.571 2.121 1.00 0.00 H new ATOM 0 HG2 LYS A 47 3.167 5.191 1.917 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.030 5.260 0.171 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.302 4.723 0.559 1.00 0.00 H new ATOM 0 HD3 LYS A 47 5.321 6.432 0.171 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.145 6.817 2.746 1.00 0.00 H new ATOM 0 HE3 LYS A 47 5.587 5.129 2.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 7.526 6.556 3.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 7.606 5.573 1.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 7.177 7.210 1.476 1.00 0.00 H new ATOM 228 N LEU A 48 -0.218 5.621 1.324 1.00 0.00 N ATOM 229 CA LEU A 48 -1.020 4.724 2.148 1.00 0.00 C ATOM 230 C LEU A 48 -0.217 3.492 2.553 1.00 0.00 C ATOM 231 O LEU A 48 0.533 2.935 1.750 1.00 0.00 O ATOM 232 CB LEU A 48 -2.282 4.299 1.395 1.00 0.00 C ATOM 233 CG LEU A 48 -3.339 5.385 1.192 1.00 0.00 C ATOM 234 CD1 LEU A 48 -4.379 4.933 0.177 1.00 0.00 C ATOM 235 CD2 LEU A 48 -4.001 5.739 2.515 1.00 0.00 C ATOM 0 H LEU A 48 -0.423 5.572 0.326 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.307 5.261 3.052 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.987 3.920 0.417 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.741 3.470 1.934 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.847 6.277 0.805 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.124 5.718 0.045 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.892 4.730 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.867 4.027 0.535 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.750 6.513 2.351 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.480 4.853 2.931 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.248 6.105 3.212 1.00 0.00 H new ATOM 247 N PHE A 49 -0.380 3.070 3.803 1.00 0.00 N ATOM 248 CA PHE A 49 0.329 1.903 4.314 1.00 0.00 C ATOM 249 C PHE A 49 -0.651 0.807 4.721 1.00 0.00 C ATOM 250 O PHE A 49 -1.517 1.017 5.570 1.00 0.00 O ATOM 251 CB PHE A 49 1.202 2.293 5.509 1.00 0.00 C ATOM 252 CG PHE A 49 1.572 1.131 6.386 1.00 0.00 C ATOM 253 CD1 PHE A 49 2.563 0.243 6.000 1.00 0.00 C ATOM 254 CD2 PHE A 49 0.928 0.926 7.596 1.00 0.00 C ATOM 255 CE1 PHE A 49 2.905 -0.828 6.804 1.00 0.00 C ATOM 256 CE2 PHE A 49 1.266 -0.143 8.404 1.00 0.00 C ATOM 257 CZ PHE A 49 2.257 -1.020 8.009 1.00 0.00 C ATOM 0 H PHE A 49 -0.997 3.519 4.480 1.00 0.00 H new ATOM 0 HA PHE A 49 0.967 1.518 3.518 1.00 0.00 H new ATOM 0 HB2 PHE A 49 2.113 2.767 5.144 1.00 0.00 H new ATOM 0 HB3 PHE A 49 0.674 3.036 6.107 1.00 0.00 H new ATOM 0 HD1 PHE A 49 3.074 0.389 5.060 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.153 1.609 7.911 1.00 0.00 H new ATOM 0 HE1 PHE A 49 3.678 -1.514 6.491 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.755 -0.292 9.344 1.00 0.00 H new ATOM 0 HZ PHE A 49 2.525 -1.854 8.641 1.00 0.00 H new ATOM 267 N VAL A 50 -0.507 -0.365 4.109 1.00 0.00 N ATOM 268 CA VAL A 50 -1.378 -1.495 4.407 1.00 0.00 C ATOM 269 C VAL A 50 -0.680 -2.503 5.313 1.00 0.00 C ATOM 270 O VAL A 50 0.491 -2.823 5.116 1.00 0.00 O ATOM 271 CB VAL A 50 -1.834 -2.207 3.120 1.00 0.00 C ATOM 272 CG1 VAL A 50 -2.745 -3.380 3.452 1.00 0.00 C ATOM 273 CG2 VAL A 50 -2.531 -1.228 2.188 1.00 0.00 C ATOM 0 H VAL A 50 0.205 -0.556 3.404 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.252 -1.094 4.920 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.953 -2.595 2.609 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.057 -3.871 2.530 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.208 -4.092 4.078 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.624 -3.018 3.986 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.846 -1.748 1.284 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.404 -0.808 2.688 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.843 -0.425 1.923 1.00 0.00 H new ATOM 283 N GLY A 51 -1.408 -3.001 6.308 1.00 0.00 N ATOM 284 CA GLY A 51 -0.842 -3.969 7.229 1.00 0.00 C ATOM 285 C GLY A 51 -1.736 -5.178 7.422 1.00 0.00 C ATOM 286 O GLY A 51 -1.783 -5.756 8.507 1.00 0.00 O ATOM 0 H GLY A 51 -2.380 -2.751 6.493 1.00 0.00 H new ATOM 0 HA2 GLY A 51 0.129 -4.295 6.857 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -0.670 -3.491 8.193 1.00 0.00 H new ATOM 290 N GLN A 52 -2.448 -5.560 6.366 1.00 0.00 N ATOM 291 CA GLN A 52 -3.346 -6.707 6.426 1.00 0.00 C ATOM 292 C GLN A 52 -3.155 -7.612 5.213 1.00 0.00 C ATOM 293 O GLN A 52 -4.123 -8.109 4.638 1.00 0.00 O ATOM 294 CB GLN A 52 -4.801 -6.239 6.502 1.00 0.00 C ATOM 295 CG GLN A 52 -5.218 -5.772 7.888 1.00 0.00 C ATOM 296 CD GLN A 52 -5.305 -6.910 8.885 1.00 0.00 C ATOM 297 OE1 GLN A 52 -5.994 -7.904 8.652 1.00 0.00 O ATOM 298 NE2 GLN A 52 -4.604 -6.772 10.004 1.00 0.00 N ATOM 0 H GLN A 52 -2.420 -5.092 5.460 1.00 0.00 H new ATOM 0 HA GLN A 52 -3.107 -7.277 7.324 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -4.950 -5.424 5.793 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.453 -7.055 6.191 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -4.503 -5.032 8.248 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -6.186 -5.275 7.824 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.046 -5.932 10.156 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.623 -7.506 10.712 1.00 0.00 H new ATOM 307 N ILE A 53 -1.900 -7.822 4.831 1.00 0.00 N ATOM 308 CA ILE A 53 -1.581 -8.668 3.688 1.00 0.00 C ATOM 309 C ILE A 53 -0.916 -9.966 4.133 1.00 0.00 C ATOM 310 O ILE A 53 0.190 -9.973 4.674 1.00 0.00 O ATOM 311 CB ILE A 53 -0.655 -7.945 2.692 1.00 0.00 C ATOM 312 CG1 ILE A 53 -1.254 -6.595 2.294 1.00 0.00 C ATOM 313 CG2 ILE A 53 -0.421 -8.810 1.463 1.00 0.00 C ATOM 314 CD1 ILE A 53 -0.242 -5.633 1.711 1.00 0.00 C ATOM 0 H ILE A 53 -1.087 -7.418 5.296 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.525 -8.897 3.193 1.00 0.00 H new ATOM 0 HB ILE A 53 0.306 -7.767 3.175 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -2.048 -6.760 1.566 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.714 -6.138 3.170 1.00 0.00 H new ATOM 0 HG21 ILE A 53 0.235 -8.285 0.768 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.044 -9.749 1.762 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.374 -9.016 0.976 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.737 -4.697 1.452 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.540 -5.439 2.445 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.201 -6.069 0.816 1.00 0.00 H new ATOM 326 N PRO A 54 -1.603 -11.094 3.899 1.00 0.00 N ATOM 327 CA PRO A 54 -1.098 -12.420 4.265 1.00 0.00 C ATOM 328 C PRO A 54 0.087 -12.847 3.405 1.00 0.00 C ATOM 329 O PRO A 54 0.596 -12.066 2.601 1.00 0.00 O ATOM 330 CB PRO A 54 -2.297 -13.338 4.018 1.00 0.00 C ATOM 331 CG PRO A 54 -3.111 -12.630 2.990 1.00 0.00 C ATOM 332 CD PRO A 54 -2.927 -11.162 3.257 1.00 0.00 C ATOM 0 HA PRO A 54 -0.729 -12.446 5.290 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.979 -14.319 3.664 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -2.867 -13.499 4.933 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -2.780 -12.888 1.984 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.162 -12.911 3.062 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -2.957 -10.579 2.336 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -3.709 -10.771 3.907 1.00 0.00 H new ATOM 340 N ARG A 55 0.520 -14.092 3.578 1.00 0.00 N ATOM 341 CA ARG A 55 1.645 -14.622 2.818 1.00 0.00 C ATOM 342 C ARG A 55 1.158 -15.482 1.655 1.00 0.00 C ATOM 343 O ARG A 55 0.514 -16.510 1.857 1.00 0.00 O ATOM 344 CB ARG A 55 2.560 -15.445 3.726 1.00 0.00 C ATOM 345 CG ARG A 55 3.251 -14.622 4.802 1.00 0.00 C ATOM 346 CD ARG A 55 2.301 -14.284 5.940 1.00 0.00 C ATOM 347 NE ARG A 55 3.012 -13.808 7.124 1.00 0.00 N ATOM 348 CZ ARG A 55 2.412 -13.239 8.163 1.00 0.00 C ATOM 349 NH1 ARG A 55 1.096 -13.076 8.165 1.00 0.00 N ATOM 350 NH2 ARG A 55 3.128 -12.833 9.204 1.00 0.00 N ATOM 0 H ARG A 55 0.108 -14.752 4.238 1.00 0.00 H new ATOM 0 HA ARG A 55 2.207 -13.780 2.415 1.00 0.00 H new ATOM 0 HB2 ARG A 55 1.974 -16.231 4.202 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.317 -15.937 3.115 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.106 -15.175 5.192 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.639 -13.702 4.365 1.00 0.00 H new ATOM 0 HD2 ARG A 55 1.596 -13.521 5.609 1.00 0.00 H new ATOM 0 HD3 ARG A 55 1.717 -15.167 6.199 1.00 0.00 H new ATOM 0 HE ARG A 55 4.026 -13.919 7.154 1.00 0.00 H new ATOM 0 HH11 ARG A 55 0.542 -13.388 7.367 1.00 0.00 H new ATOM 0 HH12 ARG A 55 0.637 -12.639 8.964 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.140 -12.958 9.207 1.00 0.00 H new ATOM 0 HH22 ARG A 55 2.666 -12.396 10.002 1.00 0.00 H new ATOM 364 N GLY A 56 1.471 -15.052 0.436 1.00 0.00 N ATOM 365 CA GLY A 56 1.057 -15.794 -0.741 1.00 0.00 C ATOM 366 C GLY A 56 0.790 -14.892 -1.930 1.00 0.00 C ATOM 367 O GLY A 56 0.993 -15.289 -3.078 1.00 0.00 O ATOM 0 H GLY A 56 2.003 -14.204 0.243 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.831 -16.516 -1.003 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.156 -16.362 -0.510 1.00 0.00 H new ATOM 371 N LEU A 57 0.331 -13.676 -1.656 1.00 0.00 N ATOM 372 CA LEU A 57 0.033 -12.715 -2.713 1.00 0.00 C ATOM 373 C LEU A 57 1.162 -11.700 -2.860 1.00 0.00 C ATOM 374 O LEU A 57 2.105 -11.687 -2.069 1.00 0.00 O ATOM 375 CB LEU A 57 -1.282 -11.992 -2.416 1.00 0.00 C ATOM 376 CG LEU A 57 -2.478 -12.885 -2.083 1.00 0.00 C ATOM 377 CD1 LEU A 57 -3.665 -12.044 -1.639 1.00 0.00 C ATOM 378 CD2 LEU A 57 -2.852 -13.745 -3.282 1.00 0.00 C ATOM 0 H LEU A 57 0.157 -13.332 -0.712 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.064 -13.262 -3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.119 -11.311 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.540 -11.380 -3.280 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.197 -13.544 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.507 -12.697 -1.406 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.394 -11.471 -0.752 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.947 -11.361 -2.440 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.705 -14.374 -3.027 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.113 -13.103 -4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.006 -14.375 -3.556 1.00 0.00 H new ATOM 390 N ASP A 58 1.058 -10.851 -3.876 1.00 0.00 N ATOM 391 CA ASP A 58 2.069 -9.830 -4.126 1.00 0.00 C ATOM 392 C ASP A 58 1.435 -8.569 -4.706 1.00 0.00 C ATOM 393 O ASP A 58 0.214 -8.473 -4.820 1.00 0.00 O ATOM 394 CB ASP A 58 3.139 -10.363 -5.079 1.00 0.00 C ATOM 395 CG ASP A 58 3.563 -11.778 -4.739 1.00 0.00 C ATOM 396 OD1 ASP A 58 4.058 -11.995 -3.614 1.00 0.00 O ATOM 397 OD2 ASP A 58 3.401 -12.669 -5.600 1.00 0.00 O ATOM 0 H ASP A 58 0.284 -10.849 -4.540 1.00 0.00 H new ATOM 0 HA ASP A 58 2.536 -9.576 -3.175 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.758 -10.336 -6.100 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.010 -9.708 -5.046 1.00 0.00 H new ATOM 402 N GLU A 59 2.275 -7.605 -5.070 1.00 0.00 N ATOM 403 CA GLU A 59 1.796 -6.349 -5.637 1.00 0.00 C ATOM 404 C GLU A 59 0.984 -6.599 -6.904 1.00 0.00 C ATOM 405 O GLU A 59 0.190 -5.756 -7.320 1.00 0.00 O ATOM 406 CB GLU A 59 2.974 -5.422 -5.947 1.00 0.00 C ATOM 407 CG GLU A 59 3.871 -5.157 -4.750 1.00 0.00 C ATOM 408 CD GLU A 59 5.004 -6.159 -4.636 1.00 0.00 C ATOM 409 OE1 GLU A 59 4.764 -7.270 -4.120 1.00 0.00 O ATOM 410 OE2 GLU A 59 6.130 -5.831 -5.065 1.00 0.00 O ATOM 0 H GLU A 59 3.289 -7.669 -4.983 1.00 0.00 H new ATOM 0 HA GLU A 59 1.150 -5.870 -4.901 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.570 -5.861 -6.747 1.00 0.00 H new ATOM 0 HB3 GLU A 59 2.590 -4.472 -6.320 1.00 0.00 H new ATOM 0 HG2 GLU A 59 4.286 -4.152 -4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 59 3.273 -5.185 -3.839 1.00 0.00 H new ATOM 417 N GLN A 60 1.191 -7.762 -7.512 1.00 0.00 N ATOM 418 CA GLN A 60 0.479 -8.123 -8.733 1.00 0.00 C ATOM 419 C GLN A 60 -0.966 -8.503 -8.428 1.00 0.00 C ATOM 420 O GLN A 60 -1.795 -8.609 -9.333 1.00 0.00 O ATOM 421 CB GLN A 60 1.186 -9.282 -9.438 1.00 0.00 C ATOM 422 CG GLN A 60 2.487 -8.880 -10.112 1.00 0.00 C ATOM 423 CD GLN A 60 3.137 -10.029 -10.858 1.00 0.00 C ATOM 424 OE1 GLN A 60 3.591 -11.000 -10.252 1.00 0.00 O ATOM 425 NE2 GLN A 60 3.183 -9.925 -12.181 1.00 0.00 N ATOM 0 H GLN A 60 1.845 -8.470 -7.180 1.00 0.00 H new ATOM 0 HA GLN A 60 0.476 -7.255 -9.392 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.391 -10.068 -8.711 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.515 -9.706 -10.185 1.00 0.00 H new ATOM 0 HG2 GLN A 60 2.294 -8.063 -10.807 1.00 0.00 H new ATOM 0 HG3 GLN A 60 3.180 -8.502 -9.360 1.00 0.00 H new ATOM 0 HE21 GLN A 60 2.794 -9.102 -12.642 1.00 0.00 H new ATOM 0 HE22 GLN A 60 3.607 -10.668 -12.737 1.00 0.00 H new ATOM 434 N ASP A 61 -1.262 -8.707 -7.149 1.00 0.00 N ATOM 435 CA ASP A 61 -2.608 -9.075 -6.725 1.00 0.00 C ATOM 436 C ASP A 61 -3.270 -7.930 -5.965 1.00 0.00 C ATOM 437 O ASP A 61 -4.487 -7.918 -5.776 1.00 0.00 O ATOM 438 CB ASP A 61 -2.564 -10.327 -5.848 1.00 0.00 C ATOM 439 CG ASP A 61 -3.911 -11.018 -5.758 1.00 0.00 C ATOM 440 OD1 ASP A 61 -4.929 -10.314 -5.595 1.00 0.00 O ATOM 441 OD2 ASP A 61 -3.946 -12.264 -5.850 1.00 0.00 O ATOM 0 H ASP A 61 -0.588 -8.624 -6.388 1.00 0.00 H new ATOM 0 HA ASP A 61 -3.199 -9.285 -7.616 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -1.828 -11.023 -6.250 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.231 -10.054 -4.847 1.00 0.00 H new ATOM 446 N LEU A 62 -2.462 -6.969 -5.530 1.00 0.00 N ATOM 447 CA LEU A 62 -2.969 -5.819 -4.790 1.00 0.00 C ATOM 448 C LEU A 62 -3.282 -4.660 -5.731 1.00 0.00 C ATOM 449 O LEU A 62 -4.236 -3.913 -5.518 1.00 0.00 O ATOM 450 CB LEU A 62 -1.951 -5.376 -3.737 1.00 0.00 C ATOM 451 CG LEU A 62 -1.561 -6.426 -2.697 1.00 0.00 C ATOM 452 CD1 LEU A 62 -0.385 -5.941 -1.863 1.00 0.00 C ATOM 453 CD2 LEU A 62 -2.749 -6.759 -1.804 1.00 0.00 C ATOM 0 H LEU A 62 -1.453 -6.964 -5.677 1.00 0.00 H new ATOM 0 HA LEU A 62 -3.892 -6.117 -4.292 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -1.047 -5.049 -4.250 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.353 -4.508 -3.214 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.259 -7.333 -3.220 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.122 -6.702 -1.128 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.469 -5.754 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.659 -5.020 -1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -2.453 -7.508 -1.070 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.081 -5.857 -1.289 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -3.564 -7.150 -2.413 1.00 0.00 H new ATOM 465 N LYS A 63 -2.472 -4.518 -6.775 1.00 0.00 N ATOM 466 CA LYS A 63 -2.663 -3.453 -7.752 1.00 0.00 C ATOM 467 C LYS A 63 -4.106 -3.420 -8.247 1.00 0.00 C ATOM 468 O LYS A 63 -4.734 -2.365 -8.334 1.00 0.00 O ATOM 469 CB LYS A 63 -1.711 -3.641 -8.935 1.00 0.00 C ATOM 470 CG LYS A 63 -0.401 -2.887 -8.788 1.00 0.00 C ATOM 471 CD LYS A 63 0.701 -3.515 -9.625 1.00 0.00 C ATOM 472 CE LYS A 63 0.750 -2.916 -11.022 1.00 0.00 C ATOM 473 NZ LYS A 63 -0.350 -3.430 -11.885 1.00 0.00 N ATOM 0 H LYS A 63 -1.677 -5.128 -6.966 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.443 -2.503 -7.264 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.498 -4.703 -9.053 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -2.209 -3.312 -9.847 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.542 -1.849 -9.090 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -0.102 -2.876 -7.740 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.662 -3.369 -9.132 1.00 0.00 H new ATOM 0 HD3 LYS A 63 0.538 -4.591 -9.695 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.681 -1.830 -10.954 1.00 0.00 H new ATOM 0 HE3 LYS A 63 1.711 -3.146 -11.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -0.076 -3.345 -12.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.531 -4.429 -11.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -1.213 -2.875 -11.715 1.00 0.00 H new ATOM 487 N PRO A 64 -4.645 -4.603 -8.577 1.00 0.00 N ATOM 488 CA PRO A 64 -6.021 -4.736 -9.066 1.00 0.00 C ATOM 489 C PRO A 64 -7.020 -3.975 -8.202 1.00 0.00 C ATOM 490 O PRO A 64 -7.772 -3.135 -8.697 1.00 0.00 O ATOM 491 CB PRO A 64 -6.282 -6.242 -8.986 1.00 0.00 C ATOM 492 CG PRO A 64 -4.933 -6.867 -9.093 1.00 0.00 C ATOM 493 CD PRO A 64 -3.955 -5.901 -8.498 1.00 0.00 C ATOM 0 HA PRO A 64 -6.139 -4.322 -10.067 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -6.769 -6.510 -8.048 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -6.937 -6.574 -9.792 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -4.906 -7.819 -8.563 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -4.685 -7.075 -10.134 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -3.712 -6.162 -7.468 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -3.017 -5.889 -9.053 1.00 0.00 H new ATOM 501 N LEU A 65 -7.023 -4.275 -6.908 1.00 0.00 N ATOM 502 CA LEU A 65 -7.931 -3.618 -5.973 1.00 0.00 C ATOM 503 C LEU A 65 -7.680 -2.114 -5.936 1.00 0.00 C ATOM 504 O LEU A 65 -8.606 -1.316 -6.076 1.00 0.00 O ATOM 505 CB LEU A 65 -7.766 -4.209 -4.571 1.00 0.00 C ATOM 506 CG LEU A 65 -8.371 -5.596 -4.353 1.00 0.00 C ATOM 507 CD1 LEU A 65 -8.065 -6.096 -2.949 1.00 0.00 C ATOM 508 CD2 LEU A 65 -9.873 -5.567 -4.595 1.00 0.00 C ATOM 0 H LEU A 65 -6.408 -4.968 -6.482 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.952 -3.789 -6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -6.701 -4.259 -4.342 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.215 -3.522 -3.854 1.00 0.00 H new ATOM 0 HG LEU A 65 -7.921 -6.284 -5.069 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -8.503 -7.084 -2.811 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.985 -6.155 -2.811 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.487 -5.407 -2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.287 -6.563 -4.435 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.339 -4.865 -3.904 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.070 -5.252 -5.620 1.00 0.00 H new ATOM 520 N PHE A 66 -6.420 -1.734 -5.748 1.00 0.00 N ATOM 521 CA PHE A 66 -6.046 -0.326 -5.693 1.00 0.00 C ATOM 522 C PHE A 66 -6.370 0.374 -7.010 1.00 0.00 C ATOM 523 O PHE A 66 -6.562 1.589 -7.048 1.00 0.00 O ATOM 524 CB PHE A 66 -4.555 -0.184 -5.380 1.00 0.00 C ATOM 525 CG PHE A 66 -4.171 -0.726 -4.033 1.00 0.00 C ATOM 526 CD1 PHE A 66 -4.909 -0.404 -2.906 1.00 0.00 C ATOM 527 CD2 PHE A 66 -3.073 -1.559 -3.895 1.00 0.00 C ATOM 528 CE1 PHE A 66 -4.557 -0.901 -1.665 1.00 0.00 C ATOM 529 CE2 PHE A 66 -2.716 -2.060 -2.657 1.00 0.00 C ATOM 530 CZ PHE A 66 -3.460 -1.731 -1.541 1.00 0.00 C ATOM 0 H PHE A 66 -5.641 -2.382 -5.631 1.00 0.00 H new ATOM 0 HA PHE A 66 -6.623 0.147 -4.898 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -3.980 -0.701 -6.148 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -4.280 0.870 -5.431 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -5.769 0.243 -2.998 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -2.489 -1.820 -4.765 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -5.139 -0.641 -0.793 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -1.857 -2.708 -2.563 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.184 -2.122 -0.573 1.00 0.00 H new ATOM 540 N GLU A 67 -6.427 -0.403 -8.088 1.00 0.00 N ATOM 541 CA GLU A 67 -6.726 0.143 -9.406 1.00 0.00 C ATOM 542 C GLU A 67 -8.229 0.332 -9.589 1.00 0.00 C ATOM 543 O GLU A 67 -8.681 0.829 -10.620 1.00 0.00 O ATOM 544 CB GLU A 67 -6.180 -0.779 -10.499 1.00 0.00 C ATOM 545 CG GLU A 67 -4.728 -0.507 -10.855 1.00 0.00 C ATOM 546 CD GLU A 67 -4.241 -1.360 -12.011 1.00 0.00 C ATOM 547 OE1 GLU A 67 -4.459 -2.589 -11.973 1.00 0.00 O ATOM 548 OE2 GLU A 67 -3.643 -0.798 -12.952 1.00 0.00 O ATOM 0 H GLU A 67 -6.270 -1.411 -8.074 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.243 1.117 -9.486 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.277 -1.814 -10.172 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -6.792 -0.669 -11.394 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.612 0.546 -11.111 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.103 -0.694 -9.982 1.00 0.00 H new ATOM 555 N GLU A 68 -8.997 -0.070 -8.581 1.00 0.00 N ATOM 556 CA GLU A 68 -10.449 0.054 -8.632 1.00 0.00 C ATOM 557 C GLU A 68 -10.885 1.480 -8.308 1.00 0.00 C ATOM 558 O GLU A 68 -11.972 1.912 -8.693 1.00 0.00 O ATOM 559 CB GLU A 68 -11.101 -0.925 -7.653 1.00 0.00 C ATOM 560 CG GLU A 68 -10.774 -2.381 -7.939 1.00 0.00 C ATOM 561 CD GLU A 68 -11.475 -3.334 -6.990 1.00 0.00 C ATOM 562 OE1 GLU A 68 -11.218 -3.251 -5.771 1.00 0.00 O ATOM 563 OE2 GLU A 68 -12.279 -4.161 -7.466 1.00 0.00 O ATOM 0 H GLU A 68 -8.638 -0.484 -7.720 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.773 -0.185 -9.645 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -10.779 -0.681 -6.640 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.182 -0.791 -7.685 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.060 -2.619 -8.964 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -9.697 -2.529 -7.866 1.00 0.00 H new ATOM 570 N PHE A 69 -10.030 2.207 -7.597 1.00 0.00 N ATOM 571 CA PHE A 69 -10.326 3.584 -7.220 1.00 0.00 C ATOM 572 C PHE A 69 -9.615 4.567 -8.146 1.00 0.00 C ATOM 573 O PHE A 69 -10.201 5.553 -8.590 1.00 0.00 O ATOM 574 CB PHE A 69 -9.909 3.839 -5.770 1.00 0.00 C ATOM 575 CG PHE A 69 -10.604 2.948 -4.781 1.00 0.00 C ATOM 576 CD1 PHE A 69 -11.840 3.299 -4.261 1.00 0.00 C ATOM 577 CD2 PHE A 69 -10.023 1.759 -4.371 1.00 0.00 C ATOM 578 CE1 PHE A 69 -12.481 2.481 -3.350 1.00 0.00 C ATOM 579 CE2 PHE A 69 -10.660 0.936 -3.461 1.00 0.00 C ATOM 580 CZ PHE A 69 -11.891 1.298 -2.950 1.00 0.00 C ATOM 0 H PHE A 69 -9.126 1.865 -7.270 1.00 0.00 H new ATOM 0 HA PHE A 69 -11.401 3.737 -7.314 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -8.832 3.698 -5.680 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.116 4.879 -5.518 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -12.307 4.222 -4.571 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -9.060 1.471 -4.767 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -13.443 2.767 -2.951 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -10.196 0.012 -3.150 1.00 0.00 H new ATOM 0 HZ PHE A 69 -12.391 0.657 -2.239 1.00 0.00 H new ATOM 590 N GLY A 70 -8.346 4.290 -8.431 1.00 0.00 N ATOM 591 CA GLY A 70 -7.575 5.158 -9.302 1.00 0.00 C ATOM 592 C GLY A 70 -6.219 4.576 -9.648 1.00 0.00 C ATOM 593 O GLY A 70 -5.732 3.673 -8.967 1.00 0.00 O ATOM 0 H GLY A 70 -7.838 3.480 -8.074 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -8.135 5.337 -10.220 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -7.439 6.125 -8.818 1.00 0.00 H new ATOM 597 N ARG A 71 -5.609 5.091 -10.710 1.00 0.00 N ATOM 598 CA ARG A 71 -4.303 4.614 -11.147 1.00 0.00 C ATOM 599 C ARG A 71 -3.288 4.690 -10.010 1.00 0.00 C ATOM 600 O ARG A 71 -3.287 5.641 -9.228 1.00 0.00 O ATOM 601 CB ARG A 71 -3.810 5.434 -12.341 1.00 0.00 C ATOM 602 CG ARG A 71 -2.829 4.688 -13.230 1.00 0.00 C ATOM 603 CD ARG A 71 -3.520 3.588 -14.020 1.00 0.00 C ATOM 604 NE ARG A 71 -4.364 4.125 -15.084 1.00 0.00 N ATOM 605 CZ ARG A 71 -5.300 3.419 -15.707 1.00 0.00 C ATOM 606 NH1 ARG A 71 -5.511 2.153 -15.375 1.00 0.00 N ATOM 607 NH2 ARG A 71 -6.028 3.979 -16.665 1.00 0.00 N ATOM 0 H ARG A 71 -5.998 5.839 -11.284 1.00 0.00 H new ATOM 0 HA ARG A 71 -4.407 3.572 -11.449 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.668 5.741 -12.939 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -3.335 6.344 -11.974 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.354 5.388 -13.917 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -2.037 4.256 -12.618 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.770 2.926 -14.452 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -4.127 2.984 -13.346 1.00 0.00 H new ATOM 0 HE ARG A 71 -4.227 5.096 -15.364 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -4.954 1.719 -14.639 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -6.231 1.613 -15.855 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -5.869 4.953 -16.923 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -6.747 3.436 -17.143 1.00 0.00 H new ATOM 621 N ILE A 72 -2.427 3.682 -9.925 1.00 0.00 N ATOM 622 CA ILE A 72 -1.407 3.635 -8.884 1.00 0.00 C ATOM 623 C ILE A 72 -0.108 4.278 -9.358 1.00 0.00 C ATOM 624 O ILE A 72 0.180 4.310 -10.554 1.00 0.00 O ATOM 625 CB ILE A 72 -1.120 2.188 -8.442 1.00 0.00 C ATOM 626 CG1 ILE A 72 -2.396 1.528 -7.917 1.00 0.00 C ATOM 627 CG2 ILE A 72 -0.030 2.165 -7.380 1.00 0.00 C ATOM 628 CD1 ILE A 72 -2.348 0.017 -7.938 1.00 0.00 C ATOM 0 H ILE A 72 -2.415 2.887 -10.564 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.797 4.195 -8.034 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.771 1.623 -9.306 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.575 1.863 -6.895 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.242 1.865 -8.516 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.162 1.135 -7.078 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.883 2.600 -7.786 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.353 2.743 -6.514 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.286 -0.382 -7.552 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.201 -0.328 -8.961 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.523 -0.329 -7.316 1.00 0.00 H new ATOM 640 N TYR A 73 0.673 4.787 -8.412 1.00 0.00 N ATOM 641 CA TYR A 73 1.942 5.430 -8.732 1.00 0.00 C ATOM 642 C TYR A 73 3.113 4.491 -8.457 1.00 0.00 C ATOM 643 O TYR A 73 4.094 4.472 -9.199 1.00 0.00 O ATOM 644 CB TYR A 73 2.105 6.717 -7.921 1.00 0.00 C ATOM 645 CG TYR A 73 3.326 7.522 -8.303 1.00 0.00 C ATOM 646 CD1 TYR A 73 4.590 7.157 -7.858 1.00 0.00 C ATOM 647 CD2 TYR A 73 3.215 8.649 -9.108 1.00 0.00 C ATOM 648 CE1 TYR A 73 5.709 7.890 -8.204 1.00 0.00 C ATOM 649 CE2 TYR A 73 4.329 9.388 -9.460 1.00 0.00 C ATOM 650 CZ TYR A 73 5.573 9.004 -9.005 1.00 0.00 C ATOM 651 OH TYR A 73 6.684 9.738 -9.352 1.00 0.00 O ATOM 0 H TYR A 73 0.450 4.767 -7.417 1.00 0.00 H new ATOM 0 HA TYR A 73 1.938 5.676 -9.794 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.217 7.335 -8.053 1.00 0.00 H new ATOM 0 HB3 TYR A 73 2.163 6.465 -6.862 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.700 6.285 -7.231 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.242 8.953 -9.465 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.685 7.592 -7.849 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.226 10.261 -10.088 1.00 0.00 H new ATOM 0 HH TYR A 73 6.415 10.490 -9.920 1.00 0.00 H new ATOM 661 N GLU A 74 3.000 3.713 -7.384 1.00 0.00 N ATOM 662 CA GLU A 74 4.049 2.772 -7.011 1.00 0.00 C ATOM 663 C GLU A 74 3.607 1.902 -5.838 1.00 0.00 C ATOM 664 O GLU A 74 3.017 2.392 -4.874 1.00 0.00 O ATOM 665 CB GLU A 74 5.333 3.522 -6.648 1.00 0.00 C ATOM 666 CG GLU A 74 6.501 2.607 -6.321 1.00 0.00 C ATOM 667 CD GLU A 74 7.311 2.234 -7.547 1.00 0.00 C ATOM 668 OE1 GLU A 74 6.703 2.015 -8.616 1.00 0.00 O ATOM 669 OE2 GLU A 74 8.553 2.161 -7.438 1.00 0.00 O ATOM 0 H GLU A 74 2.194 3.716 -6.759 1.00 0.00 H new ATOM 0 HA GLU A 74 4.244 2.126 -7.867 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.612 4.171 -7.478 1.00 0.00 H new ATOM 0 HB3 GLU A 74 5.137 4.167 -5.792 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.151 3.098 -5.597 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.125 1.699 -5.848 1.00 0.00 H new ATOM 676 N LEU A 75 3.895 0.608 -5.927 1.00 0.00 N ATOM 677 CA LEU A 75 3.527 -0.332 -4.874 1.00 0.00 C ATOM 678 C LEU A 75 4.713 -1.211 -4.490 1.00 0.00 C ATOM 679 O LEU A 75 5.320 -1.862 -5.342 1.00 0.00 O ATOM 680 CB LEU A 75 2.357 -1.206 -5.330 1.00 0.00 C ATOM 681 CG LEU A 75 1.737 -2.107 -4.262 1.00 0.00 C ATOM 682 CD1 LEU A 75 1.427 -1.309 -3.005 1.00 0.00 C ATOM 683 CD2 LEU A 75 0.478 -2.777 -4.794 1.00 0.00 C ATOM 0 H LEU A 75 4.382 0.186 -6.717 1.00 0.00 H new ATOM 0 HA LEU A 75 3.225 0.242 -3.998 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.577 -0.556 -5.726 1.00 0.00 H new ATOM 0 HB3 LEU A 75 2.698 -1.834 -6.153 1.00 0.00 H new ATOM 0 HG LEU A 75 2.458 -2.884 -4.007 1.00 0.00 H new ATOM 0 HD11 LEU A 75 0.986 -1.967 -2.256 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.347 -0.877 -2.612 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.725 -0.511 -3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 75 0.050 -3.414 -4.020 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.247 -2.015 -5.078 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.728 -3.382 -5.665 1.00 0.00 H new ATOM 695 N THR A 76 5.038 -1.227 -3.201 1.00 0.00 N ATOM 696 CA THR A 76 6.151 -2.027 -2.703 1.00 0.00 C ATOM 697 C THR A 76 5.766 -2.771 -1.430 1.00 0.00 C ATOM 698 O THR A 76 5.094 -2.222 -0.557 1.00 0.00 O ATOM 699 CB THR A 76 7.388 -1.153 -2.420 1.00 0.00 C ATOM 700 OG1 THR A 76 7.958 -0.698 -3.652 1.00 0.00 O ATOM 701 CG2 THR A 76 8.430 -1.931 -1.631 1.00 0.00 C ATOM 0 H THR A 76 4.546 -0.695 -2.483 1.00 0.00 H new ATOM 0 HA THR A 76 6.396 -2.749 -3.482 1.00 0.00 H new ATOM 0 HB THR A 76 7.072 -0.295 -1.827 1.00 0.00 H new ATOM 0 HG1 THR A 76 8.743 -0.142 -3.464 1.00 0.00 H new ATOM 0 HG21 THR A 76 9.294 -1.294 -1.443 1.00 0.00 H new ATOM 0 HG22 THR A 76 8.002 -2.252 -0.681 1.00 0.00 H new ATOM 0 HG23 THR A 76 8.741 -2.805 -2.203 1.00 0.00 H new ATOM 709 N VAL A 77 6.198 -4.024 -1.329 1.00 0.00 N ATOM 710 CA VAL A 77 5.900 -4.844 -0.161 1.00 0.00 C ATOM 711 C VAL A 77 7.103 -4.928 0.772 1.00 0.00 C ATOM 712 O VAL A 77 8.207 -5.276 0.351 1.00 0.00 O ATOM 713 CB VAL A 77 5.479 -6.268 -0.567 1.00 0.00 C ATOM 714 CG1 VAL A 77 5.291 -7.141 0.664 1.00 0.00 C ATOM 715 CG2 VAL A 77 4.208 -6.230 -1.402 1.00 0.00 C ATOM 0 H VAL A 77 6.756 -4.493 -2.042 1.00 0.00 H new ATOM 0 HA VAL A 77 5.072 -4.364 0.360 1.00 0.00 H new ATOM 0 HB VAL A 77 6.273 -6.703 -1.174 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.994 -8.144 0.357 1.00 0.00 H new ATOM 0 HG12 VAL A 77 6.228 -7.194 1.219 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.517 -6.712 1.300 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.925 -7.245 -1.680 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.405 -5.775 -0.822 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.382 -5.642 -2.303 1.00 0.00 H new ATOM 725 N LEU A 78 6.883 -4.607 2.043 1.00 0.00 N ATOM 726 CA LEU A 78 7.949 -4.647 3.038 1.00 0.00 C ATOM 727 C LEU A 78 8.268 -6.084 3.436 1.00 0.00 C ATOM 728 O LEU A 78 7.370 -6.871 3.739 1.00 0.00 O ATOM 729 CB LEU A 78 7.550 -3.840 4.274 1.00 0.00 C ATOM 730 CG LEU A 78 7.472 -2.324 4.089 1.00 0.00 C ATOM 731 CD1 LEU A 78 6.531 -1.709 5.113 1.00 0.00 C ATOM 732 CD2 LEU A 78 8.857 -1.702 4.194 1.00 0.00 C ATOM 0 H LEU A 78 5.976 -4.316 2.408 1.00 0.00 H new ATOM 0 HA LEU A 78 8.842 -4.205 2.596 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.578 -4.195 4.617 1.00 0.00 H new ATOM 0 HB3 LEU A 78 8.265 -4.053 5.069 1.00 0.00 H new ATOM 0 HG LEU A 78 7.078 -2.119 3.094 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.488 -0.630 4.966 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.534 -2.132 4.991 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.896 -1.924 6.117 1.00 0.00 H new ATOM 0 HD21 LEU A 78 8.782 -0.623 4.060 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.279 -1.917 5.176 1.00 0.00 H new ATOM 0 HD23 LEU A 78 9.503 -2.120 3.422 1.00 0.00 H new ATOM 744 N LYS A 79 9.554 -6.421 3.437 1.00 0.00 N ATOM 745 CA LYS A 79 9.994 -7.762 3.801 1.00 0.00 C ATOM 746 C LYS A 79 11.176 -7.704 4.763 1.00 0.00 C ATOM 747 O LYS A 79 11.845 -6.677 4.878 1.00 0.00 O ATOM 748 CB LYS A 79 10.379 -8.553 2.549 1.00 0.00 C ATOM 749 CG LYS A 79 9.221 -8.779 1.592 1.00 0.00 C ATOM 750 CD LYS A 79 9.694 -9.369 0.274 1.00 0.00 C ATOM 751 CE LYS A 79 8.554 -9.486 -0.725 1.00 0.00 C ATOM 752 NZ LYS A 79 7.635 -10.608 -0.389 1.00 0.00 N ATOM 0 H LYS A 79 10.310 -5.783 3.189 1.00 0.00 H new ATOM 0 HA LYS A 79 9.166 -8.266 4.300 1.00 0.00 H new ATOM 0 HB2 LYS A 79 11.174 -8.023 2.025 1.00 0.00 H new ATOM 0 HB3 LYS A 79 10.784 -9.519 2.850 1.00 0.00 H new ATOM 0 HG2 LYS A 79 8.494 -9.448 2.051 1.00 0.00 H new ATOM 0 HG3 LYS A 79 8.711 -7.834 1.406 1.00 0.00 H new ATOM 0 HD2 LYS A 79 10.483 -8.743 -0.144 1.00 0.00 H new ATOM 0 HD3 LYS A 79 10.128 -10.353 0.450 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.993 -8.552 -0.747 1.00 0.00 H new ATOM 0 HE3 LYS A 79 8.961 -9.637 -1.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.872 -10.654 -1.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.164 -11.503 -0.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 7.226 -10.451 0.554 1.00 0.00 H new ATOM 766 N ASP A 80 11.430 -8.813 5.450 1.00 0.00 N ATOM 767 CA ASP A 80 12.534 -8.889 6.399 1.00 0.00 C ATOM 768 C ASP A 80 13.876 -8.798 5.680 1.00 0.00 C ATOM 769 O ASP A 80 13.929 -8.705 4.454 1.00 0.00 O ATOM 770 CB ASP A 80 12.457 -10.189 7.200 1.00 0.00 C ATOM 771 CG ASP A 80 13.139 -10.079 8.550 1.00 0.00 C ATOM 772 OD1 ASP A 80 12.483 -9.623 9.511 1.00 0.00 O ATOM 773 OD2 ASP A 80 14.327 -10.449 8.646 1.00 0.00 O ATOM 0 H ASP A 80 10.886 -9.672 5.367 1.00 0.00 H new ATOM 0 HA ASP A 80 12.451 -8.045 7.083 1.00 0.00 H new ATOM 0 HB2 ASP A 80 11.412 -10.461 7.345 1.00 0.00 H new ATOM 0 HB3 ASP A 80 12.919 -10.993 6.627 1.00 0.00 H new ATOM 778 N ARG A 81 14.958 -8.824 6.452 1.00 0.00 N ATOM 779 CA ARG A 81 16.300 -8.742 5.889 1.00 0.00 C ATOM 780 C ARG A 81 17.076 -10.031 6.145 1.00 0.00 C ATOM 781 O ARG A 81 17.828 -10.496 5.287 1.00 0.00 O ATOM 782 CB ARG A 81 17.055 -7.553 6.485 1.00 0.00 C ATOM 783 CG ARG A 81 16.877 -6.263 5.701 1.00 0.00 C ATOM 784 CD ARG A 81 17.589 -6.325 4.358 1.00 0.00 C ATOM 785 NE ARG A 81 19.000 -5.965 4.470 1.00 0.00 N ATOM 786 CZ ARG A 81 19.434 -4.713 4.564 1.00 0.00 C ATOM 787 NH1 ARG A 81 18.571 -3.707 4.560 1.00 0.00 N ATOM 788 NH2 ARG A 81 20.734 -4.466 4.663 1.00 0.00 N ATOM 0 H ARG A 81 14.931 -8.901 7.469 1.00 0.00 H new ATOM 0 HA ARG A 81 16.207 -8.601 4.812 1.00 0.00 H new ATOM 0 HB2 ARG A 81 16.717 -7.395 7.509 1.00 0.00 H new ATOM 0 HB3 ARG A 81 18.117 -7.795 6.534 1.00 0.00 H new ATOM 0 HG2 ARG A 81 15.815 -6.076 5.543 1.00 0.00 H new ATOM 0 HG3 ARG A 81 17.265 -5.426 6.282 1.00 0.00 H new ATOM 0 HD2 ARG A 81 17.503 -7.331 3.948 1.00 0.00 H new ATOM 0 HD3 ARG A 81 17.098 -5.652 3.656 1.00 0.00 H new ATOM 0 HE ARG A 81 19.690 -6.716 4.476 1.00 0.00 H new ATOM 0 HH11 ARG A 81 17.571 -3.893 4.485 1.00 0.00 H new ATOM 0 HH12 ARG A 81 18.907 -2.747 4.632 1.00 0.00 H new ATOM 0 HH21 ARG A 81 21.401 -5.238 4.667 1.00 0.00 H new ATOM 0 HH22 ARG A 81 21.066 -3.504 4.735 1.00 0.00 H new ATOM 802 N LEU A 82 16.890 -10.602 7.329 1.00 0.00 N ATOM 803 CA LEU A 82 17.573 -11.837 7.699 1.00 0.00 C ATOM 804 C LEU A 82 16.938 -13.039 7.006 1.00 0.00 C ATOM 805 O LEU A 82 17.623 -13.997 6.647 1.00 0.00 O ATOM 806 CB LEU A 82 17.535 -12.030 9.216 1.00 0.00 C ATOM 807 CG LEU A 82 18.550 -11.217 10.021 1.00 0.00 C ATOM 808 CD1 LEU A 82 18.098 -11.081 11.467 1.00 0.00 C ATOM 809 CD2 LEU A 82 19.927 -11.862 9.949 1.00 0.00 C ATOM 0 H LEU A 82 16.272 -10.230 8.050 1.00 0.00 H new ATOM 0 HA LEU A 82 18.611 -11.760 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 82 16.535 -11.778 9.569 1.00 0.00 H new ATOM 0 HB3 LEU A 82 17.692 -13.087 9.432 1.00 0.00 H new ATOM 0 HG LEU A 82 18.615 -10.219 9.587 1.00 0.00 H new ATOM 0 HD11 LEU A 82 18.832 -10.500 12.025 1.00 0.00 H new ATOM 0 HD12 LEU A 82 17.133 -10.575 11.501 1.00 0.00 H new ATOM 0 HD13 LEU A 82 18.004 -12.071 11.913 1.00 0.00 H new ATOM 0 HD21 LEU A 82 20.637 -11.270 10.527 1.00 0.00 H new ATOM 0 HD22 LEU A 82 19.878 -12.871 10.358 1.00 0.00 H new ATOM 0 HD23 LEU A 82 20.254 -11.907 8.910 1.00 0.00 H new ATOM 821 N THR A 83 15.623 -12.981 6.819 1.00 0.00 N ATOM 822 CA THR A 83 14.895 -14.063 6.169 1.00 0.00 C ATOM 823 C THR A 83 14.446 -13.661 4.769 1.00 0.00 C ATOM 824 O THR A 83 14.436 -14.479 3.851 1.00 0.00 O ATOM 825 CB THR A 83 13.661 -14.484 6.990 1.00 0.00 C ATOM 826 OG1 THR A 83 12.779 -13.368 7.155 1.00 0.00 O ATOM 827 CG2 THR A 83 14.075 -15.015 8.355 1.00 0.00 C ATOM 0 H THR A 83 15.040 -12.195 7.109 1.00 0.00 H new ATOM 0 HA THR A 83 15.581 -14.907 6.099 1.00 0.00 H new ATOM 0 HB THR A 83 13.146 -15.278 6.449 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.996 -13.644 7.676 1.00 0.00 H new ATOM 0 HG21 THR A 83 13.187 -15.306 8.917 1.00 0.00 H new ATOM 0 HG22 THR A 83 14.724 -15.882 8.227 1.00 0.00 H new ATOM 0 HG23 THR A 83 14.611 -14.238 8.900 1.00 0.00 H new ATOM 835 N GLY A 84 14.076 -12.393 4.613 1.00 0.00 N ATOM 836 CA GLY A 84 13.632 -11.904 3.321 1.00 0.00 C ATOM 837 C GLY A 84 12.250 -12.407 2.954 1.00 0.00 C ATOM 838 O GLY A 84 11.920 -12.536 1.775 1.00 0.00 O ATOM 0 H GLY A 84 14.076 -11.696 5.358 1.00 0.00 H new ATOM 0 HA2 GLY A 84 13.628 -10.814 3.330 1.00 0.00 H new ATOM 0 HA3 GLY A 84 14.343 -12.213 2.555 1.00 0.00 H new ATOM 842 N LEU A 85 11.439 -12.693 3.967 1.00 0.00 N ATOM 843 CA LEU A 85 10.084 -13.186 3.746 1.00 0.00 C ATOM 844 C LEU A 85 9.070 -12.050 3.832 1.00 0.00 C ATOM 845 O LEU A 85 9.413 -10.924 4.193 1.00 0.00 O ATOM 846 CB LEU A 85 9.741 -14.270 4.770 1.00 0.00 C ATOM 847 CG LEU A 85 10.284 -15.668 4.475 1.00 0.00 C ATOM 848 CD1 LEU A 85 10.209 -16.543 5.716 1.00 0.00 C ATOM 849 CD2 LEU A 85 9.519 -16.305 3.324 1.00 0.00 C ATOM 0 H LEU A 85 11.696 -12.592 4.949 1.00 0.00 H new ATOM 0 HA LEU A 85 10.038 -13.614 2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 85 10.117 -13.954 5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 85 8.656 -14.333 4.852 1.00 0.00 H new ATOM 0 HG LEU A 85 11.330 -15.576 4.183 1.00 0.00 H new ATOM 0 HD11 LEU A 85 10.600 -17.534 5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 85 10.802 -16.095 6.513 1.00 0.00 H new ATOM 0 HD13 LEU A 85 9.171 -16.628 6.039 1.00 0.00 H new ATOM 0 HD21 LEU A 85 9.919 -17.300 3.128 1.00 0.00 H new ATOM 0 HD22 LEU A 85 8.464 -16.383 3.587 1.00 0.00 H new ATOM 0 HD23 LEU A 85 9.625 -15.689 2.431 1.00 0.00 H new ATOM 861 N HIS A 86 7.819 -12.354 3.501 1.00 0.00 N ATOM 862 CA HIS A 86 6.754 -11.358 3.543 1.00 0.00 C ATOM 863 C HIS A 86 6.398 -11.004 4.984 1.00 0.00 C ATOM 864 O HIS A 86 5.820 -11.814 5.709 1.00 0.00 O ATOM 865 CB HIS A 86 5.514 -11.875 2.812 1.00 0.00 C ATOM 866 CG HIS A 86 4.570 -10.791 2.393 1.00 0.00 C ATOM 867 ND1 HIS A 86 3.973 -9.926 3.285 1.00 0.00 N ATOM 868 CD2 HIS A 86 4.123 -10.431 1.167 1.00 0.00 C ATOM 869 CE1 HIS A 86 3.197 -9.083 2.627 1.00 0.00 C ATOM 870 NE2 HIS A 86 3.271 -9.368 1.339 1.00 0.00 N ATOM 0 H HIS A 86 7.518 -13.281 3.201 1.00 0.00 H new ATOM 0 HA HIS A 86 7.112 -10.458 3.044 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.829 -12.432 1.930 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.986 -12.575 3.460 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.387 -10.894 0.228 1.00 0.00 H new ATOM 0 HE1 HIS A 86 2.603 -8.295 3.067 1.00 0.00 H new ATOM 0 HE2 HIS A 86 2.776 -8.878 0.594 1.00 0.00 H new ATOM 879 N LYS A 87 6.748 -9.790 5.394 1.00 0.00 N ATOM 880 CA LYS A 87 6.466 -9.327 6.747 1.00 0.00 C ATOM 881 C LYS A 87 4.963 -9.270 7.001 1.00 0.00 C ATOM 882 O LYS A 87 4.472 -9.798 7.998 1.00 0.00 O ATOM 883 CB LYS A 87 7.085 -7.947 6.976 1.00 0.00 C ATOM 884 CG LYS A 87 8.535 -7.997 7.425 1.00 0.00 C ATOM 885 CD LYS A 87 9.246 -6.680 7.163 1.00 0.00 C ATOM 886 CE LYS A 87 8.998 -5.680 8.281 1.00 0.00 C ATOM 887 NZ LYS A 87 10.145 -4.745 8.454 1.00 0.00 N ATOM 0 H LYS A 87 7.228 -9.108 4.807 1.00 0.00 H new ATOM 0 HA LYS A 87 6.908 -10.037 7.446 1.00 0.00 H new ATOM 0 HB2 LYS A 87 7.019 -7.371 6.053 1.00 0.00 H new ATOM 0 HB3 LYS A 87 6.499 -7.415 7.726 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.579 -8.230 8.489 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.052 -8.801 6.901 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.317 -6.857 7.063 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.902 -6.262 6.217 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.094 -5.110 8.065 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.822 -6.215 9.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.937 -4.079 9.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.002 -5.286 8.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.298 -4.216 7.572 1.00 0.00 H new ATOM 901 N GLY A 88 4.238 -8.628 6.090 1.00 0.00 N ATOM 902 CA GLY A 88 2.798 -8.516 6.234 1.00 0.00 C ATOM 903 C GLY A 88 2.305 -7.094 6.047 1.00 0.00 C ATOM 904 O GLY A 88 1.447 -6.624 6.795 1.00 0.00 O ATOM 0 H GLY A 88 4.622 -8.184 5.256 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.312 -9.165 5.505 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.506 -8.871 7.222 1.00 0.00 H new ATOM 908 N CYS A 89 2.850 -6.408 5.048 1.00 0.00 N ATOM 909 CA CYS A 89 2.463 -5.030 4.767 1.00 0.00 C ATOM 910 C CYS A 89 3.107 -4.537 3.475 1.00 0.00 C ATOM 911 O CYS A 89 4.073 -5.124 2.988 1.00 0.00 O ATOM 912 CB CYS A 89 2.860 -4.119 5.929 1.00 0.00 C ATOM 913 SG CYS A 89 4.558 -4.353 6.503 1.00 0.00 S ATOM 0 H CYS A 89 3.561 -6.783 4.420 1.00 0.00 H new ATOM 0 HA CYS A 89 1.380 -5.001 4.646 1.00 0.00 H new ATOM 0 HB2 CYS A 89 2.731 -3.081 5.623 1.00 0.00 H new ATOM 0 HB3 CYS A 89 2.179 -4.293 6.762 1.00 0.00 H new ATOM 0 HG CYS A 89 4.800 -3.537 7.485 1.00 0.00 H new ATOM 919 N ALA A 90 2.565 -3.456 2.925 1.00 0.00 N ATOM 920 CA ALA A 90 3.087 -2.884 1.690 1.00 0.00 C ATOM 921 C ALA A 90 2.800 -1.388 1.614 1.00 0.00 C ATOM 922 O ALA A 90 1.751 -0.923 2.059 1.00 0.00 O ATOM 923 CB ALA A 90 2.494 -3.599 0.485 1.00 0.00 C ATOM 0 H ALA A 90 1.765 -2.958 3.315 1.00 0.00 H new ATOM 0 HA ALA A 90 4.168 -3.021 1.684 1.00 0.00 H new ATOM 0 HB1 ALA A 90 2.893 -3.161 -0.430 1.00 0.00 H new ATOM 0 HB2 ALA A 90 2.755 -4.657 0.525 1.00 0.00 H new ATOM 0 HB3 ALA A 90 1.409 -3.492 0.496 1.00 0.00 H new ATOM 929 N PHE A 91 3.740 -0.639 1.048 1.00 0.00 N ATOM 930 CA PHE A 91 3.589 0.806 0.915 1.00 0.00 C ATOM 931 C PHE A 91 2.975 1.167 -0.435 1.00 0.00 C ATOM 932 O PHE A 91 3.601 0.992 -1.481 1.00 0.00 O ATOM 933 CB PHE A 91 4.944 1.498 1.073 1.00 0.00 C ATOM 934 CG PHE A 91 5.310 1.781 2.502 1.00 0.00 C ATOM 935 CD1 PHE A 91 4.424 2.437 3.341 1.00 0.00 C ATOM 936 CD2 PHE A 91 6.540 1.390 3.006 1.00 0.00 C ATOM 937 CE1 PHE A 91 4.758 2.700 4.656 1.00 0.00 C ATOM 938 CE2 PHE A 91 6.880 1.649 4.321 1.00 0.00 C ATOM 939 CZ PHE A 91 5.987 2.304 5.147 1.00 0.00 C ATOM 0 H PHE A 91 4.614 -1.008 0.674 1.00 0.00 H new ATOM 0 HA PHE A 91 2.919 1.150 1.703 1.00 0.00 H new ATOM 0 HB2 PHE A 91 5.717 0.873 0.626 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.931 2.436 0.517 1.00 0.00 H new ATOM 0 HD1 PHE A 91 3.461 2.747 2.963 1.00 0.00 H new ATOM 0 HD2 PHE A 91 7.241 0.877 2.364 1.00 0.00 H new ATOM 0 HE1 PHE A 91 4.059 3.214 5.299 1.00 0.00 H new ATOM 0 HE2 PHE A 91 7.842 1.340 4.702 1.00 0.00 H new ATOM 0 HZ PHE A 91 6.249 2.506 6.175 1.00 0.00 H new ATOM 949 N LEU A 92 1.746 1.670 -0.403 1.00 0.00 N ATOM 950 CA LEU A 92 1.045 2.055 -1.623 1.00 0.00 C ATOM 951 C LEU A 92 1.085 3.568 -1.818 1.00 0.00 C ATOM 952 O LEU A 92 0.879 4.333 -0.876 1.00 0.00 O ATOM 953 CB LEU A 92 -0.406 1.573 -1.575 1.00 0.00 C ATOM 954 CG LEU A 92 -1.348 2.178 -2.616 1.00 0.00 C ATOM 955 CD1 LEU A 92 -1.058 1.605 -3.995 1.00 0.00 C ATOM 956 CD2 LEU A 92 -2.799 1.931 -2.229 1.00 0.00 C ATOM 0 H LEU A 92 1.214 1.821 0.454 1.00 0.00 H new ATOM 0 HA LEU A 92 1.549 1.584 -2.467 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.412 0.490 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.806 1.787 -0.584 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.179 3.254 -2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.738 2.047 -4.723 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.029 1.832 -4.275 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.199 0.524 -3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -3.456 2.368 -2.981 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.982 0.858 -2.168 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.000 2.389 -1.261 1.00 0.00 H new ATOM 968 N THR A 93 1.348 3.993 -3.050 1.00 0.00 N ATOM 969 CA THR A 93 1.413 5.414 -3.370 1.00 0.00 C ATOM 970 C THR A 93 0.516 5.752 -4.556 1.00 0.00 C ATOM 971 O THR A 93 0.749 5.291 -5.674 1.00 0.00 O ATOM 972 CB THR A 93 2.855 5.852 -3.690 1.00 0.00 C ATOM 973 OG1 THR A 93 3.706 5.595 -2.568 1.00 0.00 O ATOM 974 CG2 THR A 93 2.905 7.331 -4.043 1.00 0.00 C ATOM 0 H THR A 93 1.519 3.374 -3.842 1.00 0.00 H new ATOM 0 HA THR A 93 1.064 5.953 -2.489 1.00 0.00 H new ATOM 0 HB THR A 93 3.204 5.278 -4.548 1.00 0.00 H new ATOM 0 HG1 THR A 93 4.621 5.875 -2.780 1.00 0.00 H new ATOM 0 HG21 THR A 93 3.933 7.618 -4.265 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.280 7.518 -4.916 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.538 7.919 -3.201 1.00 0.00 H new ATOM 982 N TYR A 94 -0.509 6.558 -4.305 1.00 0.00 N ATOM 983 CA TYR A 94 -1.442 6.957 -5.352 1.00 0.00 C ATOM 984 C TYR A 94 -0.949 8.208 -6.074 1.00 0.00 C ATOM 985 O TYR A 94 -0.232 9.027 -5.499 1.00 0.00 O ATOM 986 CB TYR A 94 -2.829 7.210 -4.759 1.00 0.00 C ATOM 987 CG TYR A 94 -3.690 5.969 -4.683 1.00 0.00 C ATOM 988 CD1 TYR A 94 -4.353 5.491 -5.806 1.00 0.00 C ATOM 989 CD2 TYR A 94 -3.842 5.276 -3.488 1.00 0.00 C ATOM 990 CE1 TYR A 94 -5.142 4.358 -5.742 1.00 0.00 C ATOM 991 CE2 TYR A 94 -4.627 4.142 -3.415 1.00 0.00 C ATOM 992 CZ TYR A 94 -5.275 3.687 -4.544 1.00 0.00 C ATOM 993 OH TYR A 94 -6.060 2.559 -4.475 1.00 0.00 O ATOM 0 H TYR A 94 -0.715 6.948 -3.385 1.00 0.00 H new ATOM 0 HA TYR A 94 -1.506 6.144 -6.075 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.717 7.626 -3.758 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -3.341 7.961 -5.361 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -4.250 6.014 -6.745 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -3.338 5.630 -2.601 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -5.651 4.000 -6.625 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -4.733 3.614 -2.479 1.00 0.00 H new ATOM 0 HH TYR A 94 -6.356 2.311 -5.376 1.00 0.00 H new ATOM 1003 N CYS A 95 -1.341 8.347 -7.335 1.00 0.00 N ATOM 1004 CA CYS A 95 -0.940 9.497 -8.137 1.00 0.00 C ATOM 1005 C CYS A 95 -1.574 10.779 -7.605 1.00 0.00 C ATOM 1006 O CYS A 95 -0.924 11.821 -7.533 1.00 0.00 O ATOM 1007 CB CYS A 95 -1.334 9.288 -9.600 1.00 0.00 C ATOM 1008 SG CYS A 95 -3.101 8.997 -9.854 1.00 0.00 S ATOM 0 H CYS A 95 -1.936 7.678 -7.824 1.00 0.00 H new ATOM 0 HA CYS A 95 0.144 9.594 -8.071 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -1.035 10.165 -10.175 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -0.776 8.440 -9.998 1.00 0.00 H new ATOM 0 HG CYS A 95 -3.370 7.744 -9.635 1.00 0.00 H new ATOM 1014 N ALA A 96 -2.848 10.693 -7.236 1.00 0.00 N ATOM 1015 CA ALA A 96 -3.570 11.845 -6.710 1.00 0.00 C ATOM 1016 C ALA A 96 -3.941 11.639 -5.246 1.00 0.00 C ATOM 1017 O ALA A 96 -3.930 10.514 -4.745 1.00 0.00 O ATOM 1018 CB ALA A 96 -4.817 12.110 -7.541 1.00 0.00 C ATOM 0 H ALA A 96 -3.401 9.838 -7.292 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.914 12.713 -6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -5.347 12.973 -7.137 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.530 12.311 -8.573 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.468 11.237 -7.508 1.00 0.00 H new ATOM 1024 N ARG A 97 -4.268 12.732 -4.564 1.00 0.00 N ATOM 1025 CA ARG A 97 -4.641 12.670 -3.155 1.00 0.00 C ATOM 1026 C ARG A 97 -6.002 12.003 -2.982 1.00 0.00 C ATOM 1027 O ARG A 97 -6.171 11.125 -2.136 1.00 0.00 O ATOM 1028 CB ARG A 97 -4.669 14.075 -2.552 1.00 0.00 C ATOM 1029 CG ARG A 97 -5.726 14.980 -3.163 1.00 0.00 C ATOM 1030 CD ARG A 97 -5.388 16.449 -2.961 1.00 0.00 C ATOM 1031 NE ARG A 97 -6.566 17.303 -3.081 1.00 0.00 N ATOM 1032 CZ ARG A 97 -7.401 17.548 -2.077 1.00 0.00 C ATOM 1033 NH1 ARG A 97 -7.188 17.006 -0.886 1.00 0.00 N ATOM 1034 NH2 ARG A 97 -8.451 18.337 -2.264 1.00 0.00 N ATOM 0 H ARG A 97 -4.282 13.670 -4.964 1.00 0.00 H new ATOM 0 HA ARG A 97 -3.894 12.072 -2.632 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -4.846 13.997 -1.479 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -3.690 14.536 -2.681 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -5.815 14.769 -4.229 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.695 14.764 -2.714 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -4.940 16.586 -1.977 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -4.643 16.754 -3.696 1.00 0.00 H new ATOM 0 HE ARG A 97 -6.758 17.735 -3.985 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -6.381 16.399 -0.739 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -7.831 17.196 -0.117 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -8.618 18.756 -3.179 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -9.092 18.525 -1.493 1.00 0.00 H new ATOM 1048 N ASP A 98 -6.969 12.427 -3.787 1.00 0.00 N ATOM 1049 CA ASP A 98 -8.316 11.870 -3.724 1.00 0.00 C ATOM 1050 C ASP A 98 -8.278 10.347 -3.793 1.00 0.00 C ATOM 1051 O ASP A 98 -8.729 9.662 -2.875 1.00 0.00 O ATOM 1052 CB ASP A 98 -9.174 12.424 -4.862 1.00 0.00 C ATOM 1053 CG ASP A 98 -9.593 13.861 -4.625 1.00 0.00 C ATOM 1054 OD1 ASP A 98 -8.769 14.641 -4.103 1.00 0.00 O ATOM 1055 OD2 ASP A 98 -10.744 14.207 -4.963 1.00 0.00 O ATOM 0 H ASP A 98 -6.846 13.155 -4.491 1.00 0.00 H new ATOM 0 HA ASP A 98 -8.759 12.161 -2.772 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -8.617 12.361 -5.797 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -10.063 11.804 -4.978 1.00 0.00 H new ATOM 1060 N SER A 99 -7.738 9.822 -4.889 1.00 0.00 N ATOM 1061 CA SER A 99 -7.646 8.380 -5.080 1.00 0.00 C ATOM 1062 C SER A 99 -7.209 7.688 -3.793 1.00 0.00 C ATOM 1063 O SER A 99 -7.722 6.626 -3.441 1.00 0.00 O ATOM 1064 CB SER A 99 -6.663 8.055 -6.206 1.00 0.00 C ATOM 1065 OG SER A 99 -7.252 8.275 -7.476 1.00 0.00 O ATOM 0 H SER A 99 -7.358 10.374 -5.658 1.00 0.00 H new ATOM 0 HA SER A 99 -8.635 8.011 -5.353 1.00 0.00 H new ATOM 0 HB2 SER A 99 -5.771 8.672 -6.104 1.00 0.00 H new ATOM 0 HB3 SER A 99 -6.343 7.016 -6.125 1.00 0.00 H new ATOM 0 HG SER A 99 -6.603 8.062 -8.179 1.00 0.00 H new ATOM 1071 N ALA A 100 -6.257 8.298 -3.094 1.00 0.00 N ATOM 1072 CA ALA A 100 -5.751 7.743 -1.845 1.00 0.00 C ATOM 1073 C ALA A 100 -6.810 7.802 -0.749 1.00 0.00 C ATOM 1074 O ALA A 100 -7.106 6.797 -0.103 1.00 0.00 O ATOM 1075 CB ALA A 100 -4.495 8.483 -1.409 1.00 0.00 C ATOM 0 H ALA A 100 -5.821 9.177 -3.372 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.501 6.696 -2.016 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.128 8.058 -0.475 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -3.729 8.384 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -4.727 9.538 -1.261 1.00 0.00 H new ATOM 1081 N LEU A 101 -7.376 8.986 -0.544 1.00 0.00 N ATOM 1082 CA LEU A 101 -8.403 9.177 0.475 1.00 0.00 C ATOM 1083 C LEU A 101 -9.525 8.156 0.315 1.00 0.00 C ATOM 1084 O LEU A 101 -9.926 7.503 1.279 1.00 0.00 O ATOM 1085 CB LEU A 101 -8.972 10.595 0.394 1.00 0.00 C ATOM 1086 CG LEU A 101 -7.954 11.733 0.480 1.00 0.00 C ATOM 1087 CD1 LEU A 101 -8.543 13.019 -0.079 1.00 0.00 C ATOM 1088 CD2 LEU A 101 -7.499 11.933 1.918 1.00 0.00 C ATOM 0 H LEU A 101 -7.142 9.828 -1.069 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.942 9.033 1.452 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -9.518 10.693 -0.544 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.696 10.721 1.199 1.00 0.00 H new ATOM 0 HG LEU A 101 -7.085 11.465 -0.121 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -7.805 13.818 -0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.819 12.869 -1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.429 13.293 0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.775 12.747 1.961 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -8.359 12.180 2.541 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -7.037 11.016 2.284 1.00 0.00 H new ATOM 1100 N LYS A 102 -10.026 8.022 -0.908 1.00 0.00 N ATOM 1101 CA LYS A 102 -11.100 7.079 -1.196 1.00 0.00 C ATOM 1102 C LYS A 102 -10.673 5.652 -0.866 1.00 0.00 C ATOM 1103 O LYS A 102 -11.198 5.036 0.061 1.00 0.00 O ATOM 1104 CB LYS A 102 -11.509 7.173 -2.668 1.00 0.00 C ATOM 1105 CG LYS A 102 -11.938 8.567 -3.092 1.00 0.00 C ATOM 1106 CD LYS A 102 -12.213 8.636 -4.584 1.00 0.00 C ATOM 1107 CE LYS A 102 -13.589 8.083 -4.923 1.00 0.00 C ATOM 1108 NZ LYS A 102 -14.125 8.665 -6.185 1.00 0.00 N ATOM 0 H LYS A 102 -9.705 8.555 -1.716 1.00 0.00 H new ATOM 0 HA LYS A 102 -11.955 7.338 -0.571 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -10.672 6.854 -3.290 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.327 6.478 -2.854 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -12.834 8.856 -2.542 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.159 9.283 -2.831 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -12.142 9.670 -4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -11.451 8.073 -5.122 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -13.531 6.999 -5.019 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -14.277 8.294 -4.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -15.064 8.263 -6.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -14.204 9.697 -6.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -13.482 8.442 -6.971 1.00 0.00 H new ATOM 1122 N ALA A 103 -9.718 5.133 -1.631 1.00 0.00 N ATOM 1123 CA ALA A 103 -9.218 3.781 -1.417 1.00 0.00 C ATOM 1124 C ALA A 103 -8.972 3.514 0.064 1.00 0.00 C ATOM 1125 O ALA A 103 -9.271 2.431 0.566 1.00 0.00 O ATOM 1126 CB ALA A 103 -7.942 3.557 -2.215 1.00 0.00 C ATOM 0 H ALA A 103 -9.275 5.629 -2.405 1.00 0.00 H new ATOM 0 HA ALA A 103 -9.978 3.081 -1.764 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.580 2.543 -2.045 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.147 3.696 -3.276 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -7.183 4.271 -1.896 1.00 0.00 H new ATOM 1132 N GLN A 104 -8.426 4.508 0.757 1.00 0.00 N ATOM 1133 CA GLN A 104 -8.139 4.378 2.180 1.00 0.00 C ATOM 1134 C GLN A 104 -9.417 4.124 2.973 1.00 0.00 C ATOM 1135 O GLN A 104 -9.582 3.067 3.582 1.00 0.00 O ATOM 1136 CB GLN A 104 -7.446 5.639 2.699 1.00 0.00 C ATOM 1137 CG GLN A 104 -7.138 5.596 4.187 1.00 0.00 C ATOM 1138 CD GLN A 104 -7.151 6.971 4.826 1.00 0.00 C ATOM 1139 OE1 GLN A 104 -7.897 7.221 5.774 1.00 0.00 O ATOM 1140 NE2 GLN A 104 -6.323 7.872 4.310 1.00 0.00 N ATOM 0 H GLN A 104 -8.174 5.411 0.356 1.00 0.00 H new ATOM 0 HA GLN A 104 -7.474 3.524 2.314 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.517 5.786 2.148 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -8.079 6.502 2.492 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -7.869 4.960 4.687 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.160 5.138 4.339 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -5.722 7.622 3.524 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -6.288 8.814 4.699 1.00 0.00 H new ATOM 1149 N SER A 105 -10.319 5.100 2.960 1.00 0.00 N ATOM 1150 CA SER A 105 -11.581 4.984 3.681 1.00 0.00 C ATOM 1151 C SER A 105 -12.530 4.027 2.964 1.00 0.00 C ATOM 1152 O SER A 105 -13.626 3.744 3.448 1.00 0.00 O ATOM 1153 CB SER A 105 -12.238 6.357 3.827 1.00 0.00 C ATOM 1154 OG SER A 105 -13.088 6.399 4.961 1.00 0.00 O ATOM 0 H SER A 105 -10.199 5.980 2.458 1.00 0.00 H new ATOM 0 HA SER A 105 -11.369 4.584 4.672 1.00 0.00 H new ATOM 0 HB2 SER A 105 -11.469 7.124 3.917 1.00 0.00 H new ATOM 0 HB3 SER A 105 -12.813 6.586 2.929 1.00 0.00 H new ATOM 0 HG SER A 105 -13.494 7.288 5.032 1.00 0.00 H new ATOM 1160 N ALA A 106 -12.100 3.534 1.808 1.00 0.00 N ATOM 1161 CA ALA A 106 -12.909 2.608 1.024 1.00 0.00 C ATOM 1162 C ALA A 106 -12.503 1.163 1.291 1.00 0.00 C ATOM 1163 O ALA A 106 -13.321 0.248 1.188 1.00 0.00 O ATOM 1164 CB ALA A 106 -12.789 2.927 -0.458 1.00 0.00 C ATOM 0 H ALA A 106 -11.196 3.760 1.393 1.00 0.00 H new ATOM 0 HA ALA A 106 -13.949 2.727 1.327 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.398 2.228 -1.031 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -13.135 3.944 -0.640 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -11.747 2.838 -0.766 1.00 0.00 H new ATOM 1170 N LEU A 107 -11.235 0.963 1.633 1.00 0.00 N ATOM 1171 CA LEU A 107 -10.719 -0.372 1.914 1.00 0.00 C ATOM 1172 C LEU A 107 -10.545 -0.584 3.415 1.00 0.00 C ATOM 1173 O LEU A 107 -10.843 -1.657 3.939 1.00 0.00 O ATOM 1174 CB LEU A 107 -9.384 -0.586 1.199 1.00 0.00 C ATOM 1175 CG LEU A 107 -9.446 -0.673 -0.326 1.00 0.00 C ATOM 1176 CD1 LEU A 107 -8.048 -0.619 -0.922 1.00 0.00 C ATOM 1177 CD2 LEU A 107 -10.163 -1.944 -0.759 1.00 0.00 C ATOM 0 H LEU A 107 -10.545 1.709 1.722 1.00 0.00 H new ATOM 0 HA LEU A 107 -11.442 -1.099 1.544 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.715 0.231 1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -8.935 -1.504 1.577 1.00 0.00 H new ATOM 0 HG LEU A 107 -10.010 0.183 -0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.113 -0.682 -2.008 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.569 0.319 -0.641 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.459 -1.455 -0.544 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -10.198 -1.989 -1.848 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -9.627 -2.813 -0.377 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.179 -1.942 -0.363 1.00 0.00 H new ATOM 1189 N HIS A 108 -10.062 0.447 4.101 1.00 0.00 N ATOM 1190 CA HIS A 108 -9.850 0.375 5.542 1.00 0.00 C ATOM 1191 C HIS A 108 -11.069 -0.221 6.240 1.00 0.00 C ATOM 1192 O HIS A 108 -12.131 0.398 6.290 1.00 0.00 O ATOM 1193 CB HIS A 108 -9.554 1.765 6.106 1.00 0.00 C ATOM 1194 CG HIS A 108 -9.072 1.746 7.524 1.00 0.00 C ATOM 1195 ND1 HIS A 108 -7.778 1.424 7.875 1.00 0.00 N ATOM 1196 CD2 HIS A 108 -9.720 2.013 8.682 1.00 0.00 C ATOM 1197 CE1 HIS A 108 -7.651 1.493 9.188 1.00 0.00 C ATOM 1198 NE2 HIS A 108 -8.814 1.848 9.702 1.00 0.00 N ATOM 0 H HIS A 108 -9.810 1.342 3.682 1.00 0.00 H new ATOM 0 HA HIS A 108 -8.993 -0.273 5.727 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -8.803 2.249 5.482 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -10.457 2.372 6.046 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -10.756 2.302 8.785 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -6.749 1.293 9.746 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -9.008 1.979 10.695 1.00 0.00 H new ATOM 1206 N GLU A 109 -10.907 -1.426 6.778 1.00 0.00 N ATOM 1207 CA GLU A 109 -11.995 -2.105 7.471 1.00 0.00 C ATOM 1208 C GLU A 109 -13.228 -2.209 6.579 1.00 0.00 C ATOM 1209 O GLU A 109 -14.355 -2.019 7.036 1.00 0.00 O ATOM 1210 CB GLU A 109 -12.347 -1.364 8.763 1.00 0.00 C ATOM 1211 CG GLU A 109 -11.168 -1.188 9.705 1.00 0.00 C ATOM 1212 CD GLU A 109 -11.596 -0.827 11.114 1.00 0.00 C ATOM 1213 OE1 GLU A 109 -12.528 -0.010 11.261 1.00 0.00 O ATOM 1214 OE2 GLU A 109 -10.998 -1.363 12.070 1.00 0.00 O ATOM 0 H GLU A 109 -10.033 -1.951 6.747 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.661 -3.113 7.718 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.749 -0.383 8.511 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -13.137 -1.909 9.281 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.587 -2.110 9.731 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.512 -0.409 9.318 1.00 0.00 H new ATOM 1221 N GLN A 110 -13.005 -2.511 5.304 1.00 0.00 N ATOM 1222 CA GLN A 110 -14.098 -2.638 4.347 1.00 0.00 C ATOM 1223 C GLN A 110 -13.983 -3.939 3.559 1.00 0.00 C ATOM 1224 O GLN A 110 -14.968 -4.653 3.371 1.00 0.00 O ATOM 1225 CB GLN A 110 -14.106 -1.446 3.388 1.00 0.00 C ATOM 1226 CG GLN A 110 -15.492 -1.088 2.876 1.00 0.00 C ATOM 1227 CD GLN A 110 -15.589 0.355 2.419 1.00 0.00 C ATOM 1228 OE1 GLN A 110 -16.035 0.636 1.306 1.00 0.00 O ATOM 1229 NE2 GLN A 110 -15.172 1.278 3.277 1.00 0.00 N ATOM 0 H GLN A 110 -12.078 -2.672 4.910 1.00 0.00 H new ATOM 0 HA GLN A 110 -15.035 -2.653 4.904 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -13.680 -0.580 3.894 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -13.460 -1.669 2.539 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -15.750 -1.746 2.047 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -16.224 -1.266 3.664 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -14.810 1.000 4.189 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -15.214 2.265 3.024 1.00 0.00 H new ATOM 1238 N LYS A 111 -12.773 -4.242 3.100 1.00 0.00 N ATOM 1239 CA LYS A 111 -12.527 -5.457 2.333 1.00 0.00 C ATOM 1240 C LYS A 111 -11.961 -6.558 3.224 1.00 0.00 C ATOM 1241 O LYS A 111 -11.678 -6.334 4.402 1.00 0.00 O ATOM 1242 CB LYS A 111 -11.561 -5.171 1.181 1.00 0.00 C ATOM 1243 CG LYS A 111 -12.254 -4.754 -0.105 1.00 0.00 C ATOM 1244 CD LYS A 111 -12.726 -5.960 -0.900 1.00 0.00 C ATOM 1245 CE LYS A 111 -12.729 -5.675 -2.394 1.00 0.00 C ATOM 1246 NZ LYS A 111 -13.734 -6.505 -3.115 1.00 0.00 N ATOM 0 H LYS A 111 -11.947 -3.662 3.246 1.00 0.00 H new ATOM 0 HA LYS A 111 -13.479 -5.798 1.925 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -10.871 -4.384 1.484 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -10.963 -6.062 0.989 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -13.106 -4.116 0.130 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -11.570 -4.162 -0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -12.077 -6.811 -0.692 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -13.730 -6.238 -0.579 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -12.942 -4.619 -2.562 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -11.737 -5.869 -2.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -13.705 -6.281 -4.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -13.516 -7.512 -2.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -14.684 -6.302 -2.743 1.00 0.00 H new ATOM 1260 N THR A 112 -11.796 -7.748 2.655 1.00 0.00 N ATOM 1261 CA THR A 112 -11.263 -8.883 3.397 1.00 0.00 C ATOM 1262 C THR A 112 -10.625 -9.902 2.460 1.00 0.00 C ATOM 1263 O THR A 112 -11.321 -10.628 1.749 1.00 0.00 O ATOM 1264 CB THR A 112 -12.361 -9.579 4.224 1.00 0.00 C ATOM 1265 OG1 THR A 112 -13.113 -8.606 4.958 1.00 0.00 O ATOM 1266 CG2 THR A 112 -11.755 -10.590 5.185 1.00 0.00 C ATOM 0 H THR A 112 -12.024 -7.950 1.682 1.00 0.00 H new ATOM 0 HA THR A 112 -10.503 -8.490 4.073 1.00 0.00 H new ATOM 0 HB THR A 112 -13.023 -10.106 3.537 1.00 0.00 H new ATOM 0 HG1 THR A 112 -13.810 -9.056 5.480 1.00 0.00 H new ATOM 0 HG21 THR A 112 -12.549 -11.069 5.758 1.00 0.00 H new ATOM 0 HG22 THR A 112 -11.208 -11.346 4.621 1.00 0.00 H new ATOM 0 HG23 THR A 112 -11.073 -10.081 5.866 1.00 0.00 H new ATOM 1274 N LEU A 113 -9.298 -9.952 2.464 1.00 0.00 N ATOM 1275 CA LEU A 113 -8.565 -10.884 1.614 1.00 0.00 C ATOM 1276 C LEU A 113 -8.931 -12.327 1.946 1.00 0.00 C ATOM 1277 O LEU A 113 -9.362 -12.645 3.055 1.00 0.00 O ATOM 1278 CB LEU A 113 -7.058 -10.678 1.779 1.00 0.00 C ATOM 1279 CG LEU A 113 -6.470 -9.445 1.092 1.00 0.00 C ATOM 1280 CD1 LEU A 113 -5.006 -9.274 1.464 1.00 0.00 C ATOM 1281 CD2 LEU A 113 -6.629 -9.549 -0.418 1.00 0.00 C ATOM 0 H LEU A 113 -8.707 -9.358 3.046 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.842 -10.687 0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.834 -10.617 2.844 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.547 -11.561 1.396 1.00 0.00 H new ATOM 0 HG LEU A 113 -7.016 -8.567 1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.605 -8.392 0.966 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -4.917 -9.153 2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -4.446 -10.154 1.150 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -6.205 -8.663 -0.890 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.109 -10.436 -0.778 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -7.687 -9.622 -0.668 1.00 0.00 H new ATOM 1293 N PRO A 114 -8.756 -13.223 0.963 1.00 0.00 N ATOM 1294 CA PRO A 114 -9.059 -14.648 1.128 1.00 0.00 C ATOM 1295 C PRO A 114 -8.083 -15.344 2.070 1.00 0.00 C ATOM 1296 O PRO A 114 -6.937 -15.608 1.709 1.00 0.00 O ATOM 1297 CB PRO A 114 -8.922 -15.206 -0.291 1.00 0.00 C ATOM 1298 CG PRO A 114 -7.986 -14.272 -0.977 1.00 0.00 C ATOM 1299 CD PRO A 114 -8.246 -12.915 -0.384 1.00 0.00 C ATOM 0 HA PRO A 114 -10.042 -14.806 1.571 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -8.529 -16.223 -0.280 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -9.887 -15.242 -0.797 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -6.950 -14.574 -0.822 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -8.159 -14.267 -2.053 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -7.338 -12.314 -0.342 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -8.973 -12.353 -0.970 1.00 0.00 H new ATOM 1307 N GLY A 115 -8.546 -15.639 3.281 1.00 0.00 N ATOM 1308 CA GLY A 115 -7.700 -16.302 4.257 1.00 0.00 C ATOM 1309 C GLY A 115 -7.324 -15.394 5.410 1.00 0.00 C ATOM 1310 O GLY A 115 -6.359 -15.658 6.127 1.00 0.00 O ATOM 0 H GLY A 115 -9.491 -15.431 3.604 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -8.217 -17.180 4.644 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -6.793 -16.656 3.767 1.00 0.00 H new ATOM 1314 N MET A 116 -8.086 -14.320 5.589 1.00 0.00 N ATOM 1315 CA MET A 116 -7.826 -13.370 6.664 1.00 0.00 C ATOM 1316 C MET A 116 -9.088 -13.118 7.484 1.00 0.00 C ATOM 1317 O MET A 116 -10.062 -12.557 6.983 1.00 0.00 O ATOM 1318 CB MET A 116 -7.304 -12.051 6.092 1.00 0.00 C ATOM 1319 CG MET A 116 -5.826 -12.085 5.736 1.00 0.00 C ATOM 1320 SD MET A 116 -4.762 -12.117 7.191 1.00 0.00 S ATOM 1321 CE MET A 116 -4.074 -10.464 7.143 1.00 0.00 C ATOM 0 H MET A 116 -8.888 -14.086 5.004 1.00 0.00 H new ATOM 0 HA MET A 116 -7.068 -13.799 7.319 1.00 0.00 H new ATOM 0 HB2 MET A 116 -7.878 -11.799 5.201 1.00 0.00 H new ATOM 0 HB3 MET A 116 -7.476 -11.256 6.818 1.00 0.00 H new ATOM 0 HG2 MET A 116 -5.624 -12.964 5.123 1.00 0.00 H new ATOM 0 HG3 MET A 116 -5.582 -11.212 5.131 1.00 0.00 H new ATOM 0 HE1 MET A 116 -3.393 -10.329 7.983 1.00 0.00 H new ATOM 0 HE2 MET A 116 -3.531 -10.323 6.209 1.00 0.00 H new ATOM 0 HE3 MET A 116 -4.880 -9.733 7.208 1.00 0.00 H new ATOM 1331 N ASN A 117 -9.063 -13.536 8.745 1.00 0.00 N ATOM 1332 CA ASN A 117 -10.205 -13.356 9.633 1.00 0.00 C ATOM 1333 C ASN A 117 -10.557 -11.878 9.774 1.00 0.00 C ATOM 1334 O ASN A 117 -11.729 -11.515 9.872 1.00 0.00 O ATOM 1335 CB ASN A 117 -9.907 -13.954 11.009 1.00 0.00 C ATOM 1336 CG ASN A 117 -10.158 -15.449 11.056 1.00 0.00 C ATOM 1337 OD1 ASN A 117 -11.291 -15.894 11.241 1.00 0.00 O ATOM 1338 ND2 ASN A 117 -9.099 -16.232 10.889 1.00 0.00 N ATOM 0 H ASN A 117 -8.264 -14.002 9.175 1.00 0.00 H new ATOM 0 HA ASN A 117 -11.058 -13.875 9.196 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -8.868 -13.754 11.272 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -10.526 -13.461 11.758 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -9.206 -17.246 10.911 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -8.178 -15.819 10.738 1.00 0.00 H new ATOM 1345 N ARG A 118 -9.534 -11.030 9.783 1.00 0.00 N ATOM 1346 CA ARG A 118 -9.734 -9.592 9.913 1.00 0.00 C ATOM 1347 C ARG A 118 -9.665 -8.908 8.550 1.00 0.00 C ATOM 1348 O ARG A 118 -9.015 -9.387 7.621 1.00 0.00 O ATOM 1349 CB ARG A 118 -8.685 -8.992 10.851 1.00 0.00 C ATOM 1350 CG ARG A 118 -8.929 -9.305 12.318 1.00 0.00 C ATOM 1351 CD ARG A 118 -10.219 -8.671 12.816 1.00 0.00 C ATOM 1352 NE ARG A 118 -11.367 -9.558 12.643 1.00 0.00 N ATOM 1353 CZ ARG A 118 -12.627 -9.138 12.650 1.00 0.00 C ATOM 1354 NH1 ARG A 118 -12.900 -7.851 12.818 1.00 0.00 N ATOM 1355 NH2 ARG A 118 -13.617 -10.005 12.486 1.00 0.00 N ATOM 0 H ARG A 118 -8.558 -11.314 9.702 1.00 0.00 H new ATOM 0 HA ARG A 118 -10.725 -9.425 10.334 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -7.701 -9.365 10.568 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -8.667 -7.910 10.717 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -8.975 -10.385 12.458 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -8.091 -8.942 12.913 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -10.114 -8.416 13.870 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -10.396 -7.740 12.278 1.00 0.00 H new ATOM 0 HE ARG A 118 -11.191 -10.554 12.510 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -12.141 -7.181 12.942 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -13.869 -7.532 12.823 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -13.411 -10.995 12.354 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -14.584 -9.682 12.492 1.00 0.00 H new ATOM 1369 N PRO A 119 -10.350 -7.762 8.428 1.00 0.00 N ATOM 1370 CA PRO A 119 -10.382 -6.988 7.183 1.00 0.00 C ATOM 1371 C PRO A 119 -9.040 -6.333 6.873 1.00 0.00 C ATOM 1372 O PRO A 119 -8.067 -6.513 7.607 1.00 0.00 O ATOM 1373 CB PRO A 119 -11.447 -5.922 7.455 1.00 0.00 C ATOM 1374 CG PRO A 119 -11.462 -5.772 8.937 1.00 0.00 C ATOM 1375 CD PRO A 119 -11.146 -7.133 9.495 1.00 0.00 C ATOM 0 HA PRO A 119 -10.598 -7.616 6.319 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -11.200 -4.981 6.964 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -12.422 -6.231 7.078 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -10.726 -5.037 9.262 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -12.435 -5.424 9.284 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -10.586 -7.065 10.427 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -12.052 -7.700 9.708 1.00 0.00 H new ATOM 1383 N ILE A 120 -8.995 -5.573 5.784 1.00 0.00 N ATOM 1384 CA ILE A 120 -7.772 -4.891 5.379 1.00 0.00 C ATOM 1385 C ILE A 120 -7.663 -3.521 6.040 1.00 0.00 C ATOM 1386 O ILE A 120 -8.612 -2.738 6.028 1.00 0.00 O ATOM 1387 CB ILE A 120 -7.704 -4.718 3.850 1.00 0.00 C ATOM 1388 CG1 ILE A 120 -6.541 -3.799 3.471 1.00 0.00 C ATOM 1389 CG2 ILE A 120 -9.018 -4.163 3.321 1.00 0.00 C ATOM 1390 CD1 ILE A 120 -6.267 -3.754 1.984 1.00 0.00 C ATOM 0 H ILE A 120 -9.791 -5.414 5.166 1.00 0.00 H new ATOM 0 HA ILE A 120 -6.940 -5.516 5.703 1.00 0.00 H new ATOM 0 HB ILE A 120 -7.535 -5.694 3.395 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -6.756 -2.790 3.823 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -5.641 -4.133 3.988 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -8.954 -4.046 2.239 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -9.828 -4.851 3.565 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -9.215 -3.194 3.780 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -5.430 -3.083 1.788 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -6.021 -4.755 1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -7.152 -3.391 1.462 1.00 0.00 H new ATOM 1402 N GLN A 121 -6.498 -3.239 6.615 1.00 0.00 N ATOM 1403 CA GLN A 121 -6.264 -1.962 7.280 1.00 0.00 C ATOM 1404 C GLN A 121 -5.305 -1.095 6.472 1.00 0.00 C ATOM 1405 O GLN A 121 -4.161 -1.479 6.226 1.00 0.00 O ATOM 1406 CB GLN A 121 -5.704 -2.190 8.685 1.00 0.00 C ATOM 1407 CG GLN A 121 -6.750 -2.645 9.690 1.00 0.00 C ATOM 1408 CD GLN A 121 -6.152 -2.979 11.043 1.00 0.00 C ATOM 1409 OE1 GLN A 121 -4.938 -3.136 11.177 1.00 0.00 O ATOM 1410 NE2 GLN A 121 -7.004 -3.090 12.056 1.00 0.00 N ATOM 0 H GLN A 121 -5.702 -3.877 6.634 1.00 0.00 H new ATOM 0 HA GLN A 121 -7.218 -1.441 7.357 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -4.912 -2.937 8.635 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -5.249 -1.266 9.040 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -7.498 -1.861 9.811 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -7.267 -3.521 9.299 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -8.002 -2.952 11.900 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -6.660 -3.313 12.990 1.00 0.00 H new ATOM 1419 N VAL A 122 -5.778 0.077 6.060 1.00 0.00 N ATOM 1420 CA VAL A 122 -4.962 1.000 5.280 1.00 0.00 C ATOM 1421 C VAL A 122 -5.039 2.414 5.844 1.00 0.00 C ATOM 1422 O VAL A 122 -6.112 3.017 5.894 1.00 0.00 O ATOM 1423 CB VAL A 122 -5.398 1.023 3.803 1.00 0.00 C ATOM 1424 CG1 VAL A 122 -4.464 1.902 2.984 1.00 0.00 C ATOM 1425 CG2 VAL A 122 -5.446 -0.389 3.239 1.00 0.00 C ATOM 0 H VAL A 122 -6.723 0.410 6.254 1.00 0.00 H new ATOM 0 HA VAL A 122 -3.934 0.644 5.342 1.00 0.00 H new ATOM 0 HB VAL A 122 -6.401 1.447 3.745 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.788 1.906 1.943 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.486 2.919 3.375 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.448 1.511 3.047 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -5.756 -0.353 2.195 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.457 -0.842 3.309 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -6.159 -0.984 3.809 1.00 0.00 H new ATOM 1435 N LYS A 123 -3.895 2.939 6.269 1.00 0.00 N ATOM 1436 CA LYS A 123 -3.831 4.284 6.829 1.00 0.00 C ATOM 1437 C LYS A 123 -2.761 5.114 6.128 1.00 0.00 C ATOM 1438 O LYS A 123 -1.753 4.595 5.649 1.00 0.00 O ATOM 1439 CB LYS A 123 -3.541 4.220 8.330 1.00 0.00 C ATOM 1440 CG LYS A 123 -2.269 3.464 8.672 1.00 0.00 C ATOM 1441 CD LYS A 123 -2.185 3.156 10.158 1.00 0.00 C ATOM 1442 CE LYS A 123 -1.314 1.939 10.427 1.00 0.00 C ATOM 1443 NZ LYS A 123 -0.979 1.805 11.871 1.00 0.00 N ATOM 0 H LYS A 123 -2.999 2.453 6.236 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.798 4.763 6.672 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -3.467 5.235 8.721 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -4.383 3.745 8.834 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -2.234 2.534 8.104 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -1.403 4.054 8.372 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -1.780 4.019 10.687 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -3.186 2.982 10.552 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -1.831 1.041 10.089 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -0.395 2.015 9.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -0.384 0.964 12.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -0.463 2.651 12.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -1.855 1.707 12.423 1.00 0.00 H new ATOM 1457 N PRO A 124 -2.981 6.436 6.068 1.00 0.00 N ATOM 1458 CA PRO A 124 -2.045 7.366 5.430 1.00 0.00 C ATOM 1459 C PRO A 124 -0.750 7.519 6.220 1.00 0.00 C ATOM 1460 O PRO A 124 -0.606 8.443 7.020 1.00 0.00 O ATOM 1461 CB PRO A 124 -2.818 8.688 5.408 1.00 0.00 C ATOM 1462 CG PRO A 124 -3.787 8.578 6.534 1.00 0.00 C ATOM 1463 CD PRO A 124 -4.161 7.124 6.619 1.00 0.00 C ATOM 0 HA PRO A 124 -1.736 7.020 4.443 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -2.151 9.539 5.542 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -3.331 8.831 4.457 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -3.341 8.921 7.467 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -4.666 9.197 6.354 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -4.360 6.820 7.646 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -5.060 6.906 6.042 1.00 0.00 H new ATOM 1471 N ALA A 125 0.189 6.607 5.991 1.00 0.00 N ATOM 1472 CA ALA A 125 1.473 6.643 6.680 1.00 0.00 C ATOM 1473 C ALA A 125 1.953 8.077 6.872 1.00 0.00 C ATOM 1474 O ALA A 125 1.929 8.880 5.940 1.00 0.00 O ATOM 1475 CB ALA A 125 2.508 5.836 5.910 1.00 0.00 C ATOM 0 H ALA A 125 0.085 5.834 5.334 1.00 0.00 H new ATOM 0 HA ALA A 125 1.341 6.197 7.666 1.00 0.00 H new ATOM 0 HB1 ALA A 125 3.462 5.872 6.436 1.00 0.00 H new ATOM 0 HB2 ALA A 125 2.176 4.801 5.830 1.00 0.00 H new ATOM 0 HB3 ALA A 125 2.628 6.257 4.912 1.00 0.00 H new ATOM 1481 N ALA A 126 2.389 8.393 8.088 1.00 0.00 N ATOM 1482 CA ALA A 126 2.876 9.730 8.401 1.00 0.00 C ATOM 1483 C ALA A 126 4.345 9.698 8.809 1.00 0.00 C ATOM 1484 O ALA A 126 4.847 8.676 9.277 1.00 0.00 O ATOM 1485 CB ALA A 126 2.034 10.354 9.505 1.00 0.00 C ATOM 0 H ALA A 126 2.414 7.741 8.872 1.00 0.00 H new ATOM 0 HA ALA A 126 2.788 10.341 7.502 1.00 0.00 H new ATOM 0 HB1 ALA A 126 2.409 11.353 9.728 1.00 0.00 H new ATOM 0 HB2 ALA A 126 0.997 10.421 9.177 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.092 9.736 10.401 1.00 0.00 H new ATOM 1491 N SER A 127 5.030 10.823 8.627 1.00 0.00 N ATOM 1492 CA SER A 127 6.443 10.922 8.971 1.00 0.00 C ATOM 1493 C SER A 127 6.627 11.616 10.317 1.00 0.00 C ATOM 1494 O SER A 127 7.318 11.108 11.200 1.00 0.00 O ATOM 1495 CB SER A 127 7.203 11.683 7.883 1.00 0.00 C ATOM 1496 OG SER A 127 6.572 12.917 7.589 1.00 0.00 O ATOM 0 H SER A 127 4.629 11.679 8.243 1.00 0.00 H new ATOM 0 HA SER A 127 6.845 9.912 9.045 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.227 11.863 8.209 1.00 0.00 H new ATOM 0 HB3 SER A 127 7.258 11.075 6.980 1.00 0.00 H new ATOM 0 HG SER A 127 7.078 13.385 6.892 1.00 0.00 H new ATOM 1502 N GLU A 128 6.004 12.781 10.465 1.00 0.00 N ATOM 1503 CA GLU A 128 6.100 13.546 11.702 1.00 0.00 C ATOM 1504 C GLU A 128 5.643 12.711 12.895 1.00 0.00 C ATOM 1505 O GLU A 128 6.278 12.713 13.948 1.00 0.00 O ATOM 1506 CB GLU A 128 5.259 14.821 11.606 1.00 0.00 C ATOM 1507 CG GLU A 128 5.819 15.848 10.636 1.00 0.00 C ATOM 1508 CD GLU A 128 5.041 17.150 10.651 1.00 0.00 C ATOM 1509 OE1 GLU A 128 3.916 17.175 10.111 1.00 0.00 O ATOM 1510 OE2 GLU A 128 5.559 18.143 11.203 1.00 0.00 O ATOM 0 H GLU A 128 5.428 13.215 9.744 1.00 0.00 H new ATOM 0 HA GLU A 128 7.145 13.819 11.850 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.247 14.557 11.298 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.183 15.272 12.596 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.861 16.049 10.887 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.808 15.434 9.628 1.00 0.00 H new ATOM 1517 N GLY A 129 4.534 11.998 12.721 1.00 0.00 N ATOM 1518 CA GLY A 129 4.009 11.169 13.790 1.00 0.00 C ATOM 1519 C GLY A 129 2.755 11.750 14.412 1.00 0.00 C ATOM 1520 O GLY A 129 2.717 12.020 15.612 1.00 0.00 O ATOM 0 H GLY A 129 3.990 11.980 11.858 1.00 0.00 H new ATOM 0 HA2 GLY A 129 3.790 10.175 13.401 1.00 0.00 H new ATOM 0 HA3 GLY A 129 4.771 11.049 14.560 1.00 0.00 H new ATOM 1524 N ARG A 130 1.726 11.944 13.594 1.00 0.00 N ATOM 1525 CA ARG A 130 0.465 12.499 14.070 1.00 0.00 C ATOM 1526 C ARG A 130 -0.623 11.430 14.101 1.00 0.00 C ATOM 1527 O ARG A 130 -0.493 10.379 13.475 1.00 0.00 O ATOM 1528 CB ARG A 130 0.027 13.663 13.179 1.00 0.00 C ATOM 1529 CG ARG A 130 1.052 14.781 13.089 1.00 0.00 C ATOM 1530 CD ARG A 130 0.470 16.019 12.425 1.00 0.00 C ATOM 1531 NE ARG A 130 0.025 15.750 11.060 1.00 0.00 N ATOM 1532 CZ ARG A 130 -0.775 16.559 10.375 1.00 0.00 C ATOM 1533 NH1 ARG A 130 -1.216 17.682 10.924 1.00 0.00 N ATOM 1534 NH2 ARG A 130 -1.136 16.245 9.137 1.00 0.00 N ATOM 0 H ARG A 130 1.741 11.725 12.598 1.00 0.00 H new ATOM 0 HA ARG A 130 0.618 12.865 15.085 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -0.175 13.286 12.177 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -0.909 14.070 13.562 1.00 0.00 H new ATOM 0 HG2 ARG A 130 1.404 15.035 14.089 1.00 0.00 H new ATOM 0 HG3 ARG A 130 1.918 14.437 12.524 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -0.370 16.385 13.015 1.00 0.00 H new ATOM 0 HD3 ARG A 130 1.220 16.810 12.413 1.00 0.00 H new ATOM 0 HE ARG A 130 0.346 14.894 10.608 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -0.941 17.927 11.875 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -1.830 18.301 10.395 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -0.799 15.382 8.711 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -1.750 16.867 8.612 1.00 0.00 H new ATOM 1548 N GLY A 131 -1.697 11.707 14.835 1.00 0.00 N ATOM 1549 CA GLY A 131 -2.792 10.759 14.934 1.00 0.00 C ATOM 1550 C GLY A 131 -3.914 11.065 13.962 1.00 0.00 C ATOM 1551 O GLY A 131 -3.672 11.554 12.859 1.00 0.00 O ATOM 0 H GLY A 131 -1.828 12.570 15.362 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -2.416 9.753 14.745 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -3.184 10.767 15.951 1.00 0.00 H new ATOM 1555 N GLU A 132 -5.145 10.776 14.372 1.00 0.00 N ATOM 1556 CA GLU A 132 -6.308 11.022 13.527 1.00 0.00 C ATOM 1557 C GLU A 132 -7.600 10.884 14.327 1.00 0.00 C ATOM 1558 O GLU A 132 -7.681 10.091 15.265 1.00 0.00 O ATOM 1559 CB GLU A 132 -6.322 10.051 12.345 1.00 0.00 C ATOM 1560 CG GLU A 132 -6.424 8.592 12.756 1.00 0.00 C ATOM 1561 CD GLU A 132 -5.841 7.651 11.719 1.00 0.00 C ATOM 1562 OE1 GLU A 132 -4.671 7.849 11.330 1.00 0.00 O ATOM 1563 OE2 GLU A 132 -6.555 6.717 11.297 1.00 0.00 O ATOM 0 H GLU A 132 -5.363 10.372 15.283 1.00 0.00 H new ATOM 0 HA GLU A 132 -6.241 12.042 13.149 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -7.162 10.296 11.695 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -5.414 10.192 11.759 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -5.905 8.448 13.704 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -7.471 8.338 12.924 1.00 0.00 H new ATOM 1570 N SER A 133 -8.609 11.663 13.950 1.00 0.00 N ATOM 1571 CA SER A 133 -9.896 11.632 14.634 1.00 0.00 C ATOM 1572 C SER A 133 -10.953 12.392 13.838 1.00 0.00 C ATOM 1573 O SER A 133 -10.907 13.617 13.735 1.00 0.00 O ATOM 1574 CB SER A 133 -9.767 12.232 16.035 1.00 0.00 C ATOM 1575 OG SER A 133 -11.021 12.260 16.695 1.00 0.00 O ATOM 0 H SER A 133 -8.560 12.323 13.174 1.00 0.00 H new ATOM 0 HA SER A 133 -10.209 10.591 14.719 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.057 11.647 16.620 1.00 0.00 H new ATOM 0 HB3 SER A 133 -9.366 13.243 15.966 1.00 0.00 H new ATOM 0 HG SER A 133 -10.912 12.646 17.589 1.00 0.00 H new ATOM 1581 N GLY A 134 -11.905 11.655 13.275 1.00 0.00 N ATOM 1582 CA GLY A 134 -12.960 12.275 12.495 1.00 0.00 C ATOM 1583 C GLY A 134 -14.238 11.459 12.496 1.00 0.00 C ATOM 1584 O GLY A 134 -14.483 10.648 11.603 1.00 0.00 O ATOM 0 H GLY A 134 -11.965 10.639 13.345 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.166 13.268 12.894 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -12.618 12.408 11.469 1.00 0.00 H new ATOM 1588 N PRO A 135 -15.079 11.670 13.520 1.00 0.00 N ATOM 1589 CA PRO A 135 -16.352 10.957 13.659 1.00 0.00 C ATOM 1590 C PRO A 135 -17.371 11.380 12.607 1.00 0.00 C ATOM 1591 O PRO A 135 -17.515 12.566 12.309 1.00 0.00 O ATOM 1592 CB PRO A 135 -16.830 11.355 15.058 1.00 0.00 C ATOM 1593 CG PRO A 135 -16.181 12.670 15.320 1.00 0.00 C ATOM 1594 CD PRO A 135 -14.851 12.623 14.620 1.00 0.00 C ATOM 0 HA PRO A 135 -16.234 9.882 13.524 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -17.916 11.435 15.097 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -16.538 10.614 15.802 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -16.792 13.489 14.941 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -16.053 12.836 16.390 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -14.558 13.604 14.247 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -14.058 12.285 15.287 1.00 0.00 H new ATOM 1602 N SER A 136 -18.077 10.403 12.047 1.00 0.00 N ATOM 1603 CA SER A 136 -19.081 10.674 11.025 1.00 0.00 C ATOM 1604 C SER A 136 -20.446 10.140 11.450 1.00 0.00 C ATOM 1605 O SER A 136 -20.561 9.016 11.939 1.00 0.00 O ATOM 1606 CB SER A 136 -18.667 10.045 9.694 1.00 0.00 C ATOM 1607 OG SER A 136 -19.702 10.159 8.732 1.00 0.00 O ATOM 0 H SER A 136 -17.972 9.416 12.284 1.00 0.00 H new ATOM 0 HA SER A 136 -19.155 11.754 10.901 1.00 0.00 H new ATOM 0 HB2 SER A 136 -17.766 10.533 9.323 1.00 0.00 H new ATOM 0 HB3 SER A 136 -18.421 8.994 9.846 1.00 0.00 H new ATOM 0 HG SER A 136 -19.412 9.751 7.890 1.00 0.00 H new ATOM 1613 N SER A 137 -21.479 10.955 11.259 1.00 0.00 N ATOM 1614 CA SER A 137 -22.836 10.568 11.625 1.00 0.00 C ATOM 1615 C SER A 137 -23.389 9.537 10.646 1.00 0.00 C ATOM 1616 O SER A 137 -23.691 9.854 9.496 1.00 0.00 O ATOM 1617 CB SER A 137 -23.748 11.796 11.659 1.00 0.00 C ATOM 1618 OG SER A 137 -23.270 12.760 12.582 1.00 0.00 O ATOM 0 H SER A 137 -21.402 11.887 10.853 1.00 0.00 H new ATOM 0 HA SER A 137 -22.804 10.120 12.618 1.00 0.00 H new ATOM 0 HB2 SER A 137 -23.806 12.238 10.664 1.00 0.00 H new ATOM 0 HB3 SER A 137 -24.759 11.495 11.933 1.00 0.00 H new ATOM 0 HG SER A 137 -23.869 13.536 12.584 1.00 0.00 H new ATOM 1624 N GLY A 138 -23.521 8.298 11.112 1.00 0.00 N ATOM 1625 CA GLY A 138 -24.037 7.238 10.266 1.00 0.00 C ATOM 1626 C GLY A 138 -23.384 7.218 8.898 1.00 0.00 C ATOM 1627 O GLY A 138 -23.786 6.452 8.022 1.00 0.00 O ATOM 0 H GLY A 138 -23.280 8.010 12.060 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -23.878 6.277 10.755 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -25.114 7.362 10.149 1.00 0.00 H new TER 1631 GLY A 138