USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1063 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 7 TYR OH : rot 150:sc= -2.32! USER MOD Set 1.2: A 103 HIS : no HE2:sc= -1.02 K(o=-3.3,f=-4.5) USER MOD Set 2.1: A 36 SER OG : rot -88:sc= -1.14 USER MOD Set 2.2: A 80 TYR OH : rot 30:sc= -0.136 USER MOD Single : A 6 LYS NZ :NH3+ 156:sc= -0.116 (180deg=-0.166) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -26:sc= 0.0551 USER MOD Single : A 29 LYS NZ :NH3+ -151:sc= -0.53 (180deg=-1.12) USER MOD Single : A 34 TYR OH : rot -96:sc= 0.221 USER MOD Single : A 38 SER OG : rot 35:sc= -0.746 USER MOD Single : A 47 THR OG1 : rot 180:sc= -1.56 USER MOD Single : A 49 GLN : amide:sc= -0.0322 K(o=-0.032,f=-0.64) USER MOD Single : A 54 TYR OH : rot 97:sc= 0.0494 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -2.09 K(o=-2.1,f=-3.8) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -146:sc= -0.0868 (180deg=-0.587) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 68 CYS SG : rot -159:sc= -0.661 USER MOD Single : A 69 THR OG1 : rot -170:sc= -0.45 USER MOD Single : A 83 LYS NZ :NH3+ 139:sc= 0.448 (180deg=-2.4!) USER MOD Single : A 84 MET CE :methyl -124:sc= -2.78 (180deg=-5.73!) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.383 X(o=-0.38,f=-0.087) USER MOD Single : A 99 LYS NZ :NH3+ -162:sc= -1.2 (180deg=-1.34) USER MOD Single : A 101 SER OG : rot -78:sc= 1.04 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot -10:sc= 1.01 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.0799 USER MOD Single : A 119 SER OG : rot 180:sc= -0.135 USER MOD Single : A 124 THR OG1 : rot 100:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 130 THR OG1 : rot 104:sc= -1.11! USER MOD Single : A 133 LYS NZ :NH3+ -125:sc= -0.55 (180deg=-2.06!) USER MOD Single : A 139 GLN : amide:sc= -0.306 K(o=-0.31,f=-1.9!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -3.932 11.600 3.381 1.00 0.00 N ATOM 22 CA LEU A 4 -4.464 10.815 2.276 1.00 0.00 C ATOM 23 C LEU A 4 -5.192 11.703 1.270 1.00 0.00 C ATOM 24 O LEU A 4 -5.240 11.399 0.078 1.00 0.00 O ATOM 25 CB LEU A 4 -5.416 9.736 2.804 1.00 0.00 C ATOM 26 CG LEU A 4 -5.188 9.299 4.257 1.00 0.00 C ATOM 27 CD1 LEU A 4 -3.708 9.068 4.541 1.00 0.00 C ATOM 28 CD2 LEU A 4 -5.783 10.313 5.229 1.00 0.00 C ATOM 0 HA LEU A 4 -3.626 10.338 1.768 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.438 10.103 2.711 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.332 8.859 2.163 1.00 0.00 H new ATOM 0 HG LEU A 4 -5.702 8.349 4.404 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -3.580 8.760 5.579 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.328 8.288 3.881 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.156 9.991 4.366 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.609 9.981 6.253 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.311 11.284 5.077 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.855 10.400 5.053 1.00 0.00 H new ATOM 40 N ASP A 5 -5.758 12.803 1.759 1.00 0.00 N ATOM 41 CA ASP A 5 -6.482 13.734 0.902 1.00 0.00 C ATOM 42 C ASP A 5 -5.532 14.438 -0.062 1.00 0.00 C ATOM 43 O ASP A 5 -5.804 14.533 -1.258 1.00 0.00 O ATOM 44 CB ASP A 5 -7.225 14.768 1.751 1.00 0.00 C ATOM 45 CG ASP A 5 -8.321 14.144 2.594 1.00 0.00 C ATOM 46 OD1 ASP A 5 -8.771 13.030 2.253 1.00 0.00 O ATOM 47 OD2 ASP A 5 -8.729 14.770 3.594 1.00 0.00 O ATOM 0 H ASP A 5 -5.729 13.070 2.743 1.00 0.00 H new ATOM 0 HA ASP A 5 -7.206 13.165 0.319 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -6.515 15.277 2.402 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.659 15.526 1.099 1.00 0.00 H new ATOM 52 N LYS A 6 -4.417 14.930 0.468 1.00 0.00 N ATOM 53 CA LYS A 6 -3.427 15.626 -0.345 1.00 0.00 C ATOM 54 C LYS A 6 -2.564 14.635 -1.120 1.00 0.00 C ATOM 55 O LYS A 6 -2.186 14.886 -2.263 1.00 0.00 O ATOM 56 CB LYS A 6 -2.544 16.510 0.536 1.00 0.00 C ATOM 57 CG LYS A 6 -1.888 15.764 1.687 1.00 0.00 C ATOM 58 CD LYS A 6 -0.705 16.536 2.250 1.00 0.00 C ATOM 59 CE LYS A 6 -0.671 16.472 3.769 1.00 0.00 C ATOM 60 NZ LYS A 6 -0.192 15.149 4.258 1.00 0.00 N ATOM 0 H LYS A 6 -4.177 14.860 1.457 1.00 0.00 H new ATOM 0 HA LYS A 6 -3.958 16.254 -1.061 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -1.768 16.963 -0.081 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.147 17.324 0.939 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.621 15.593 2.476 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.555 14.785 1.344 1.00 0.00 H new ATOM 0 HD2 LYS A 6 0.222 16.129 1.847 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -0.762 17.576 1.930 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -0.020 17.258 4.151 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -1.669 16.665 4.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.201 15.254 5.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.987 14.479 4.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 0.545 14.789 3.619 1.00 0.00 H new ATOM 74 N TYR A 7 -2.256 13.506 -0.488 1.00 0.00 N ATOM 75 CA TYR A 7 -1.439 12.477 -1.119 1.00 0.00 C ATOM 76 C TYR A 7 -2.244 11.703 -2.157 1.00 0.00 C ATOM 77 O TYR A 7 -1.721 11.317 -3.202 1.00 0.00 O ATOM 78 CB TYR A 7 -0.888 11.515 -0.064 1.00 0.00 C ATOM 79 CG TYR A 7 0.529 11.830 0.359 1.00 0.00 C ATOM 80 CD1 TYR A 7 1.597 11.598 -0.499 1.00 0.00 C ATOM 81 CD2 TYR A 7 0.798 12.363 1.613 1.00 0.00 C ATOM 82 CE1 TYR A 7 2.893 11.888 -0.118 1.00 0.00 C ATOM 83 CE2 TYR A 7 2.092 12.655 2.002 1.00 0.00 C ATOM 84 CZ TYR A 7 3.135 12.417 1.132 1.00 0.00 C ATOM 85 OH TYR A 7 4.424 12.707 1.514 1.00 0.00 O ATOM 0 H TYR A 7 -2.560 13.282 0.459 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.607 12.968 -1.623 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -1.535 11.541 0.813 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -0.924 10.499 -0.456 1.00 0.00 H new ATOM 0 HD1 TYR A 7 1.411 11.184 -1.479 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -0.017 12.552 2.296 1.00 0.00 H new ATOM 0 HE1 TYR A 7 3.713 11.701 -0.796 1.00 0.00 H new ATOM 0 HE2 TYR A 7 2.285 13.067 2.981 1.00 0.00 H new ATOM 0 HH TYR A 7 4.418 13.459 2.142 1.00 0.00 H new ATOM 135 N ILE A 11 -10.426 10.969 -4.238 1.00 0.00 N ATOM 136 CA ILE A 11 -10.702 9.632 -3.726 1.00 0.00 C ATOM 137 C ILE A 11 -11.921 9.635 -2.810 1.00 0.00 C ATOM 138 O ILE A 11 -11.851 10.091 -1.669 1.00 0.00 O ATOM 139 CB ILE A 11 -9.497 9.065 -2.950 1.00 0.00 C ATOM 140 CG1 ILE A 11 -8.203 9.287 -3.737 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.703 7.587 -2.654 1.00 0.00 C ATOM 142 CD1 ILE A 11 -8.139 8.509 -5.034 1.00 0.00 C ATOM 0 HA ILE A 11 -10.899 8.999 -4.591 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.414 9.594 -2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.099 10.350 -3.956 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.355 9.005 -3.112 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.843 7.202 -2.106 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.603 7.458 -2.053 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.810 7.040 -3.591 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.194 8.716 -5.536 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.211 7.442 -4.822 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.966 8.807 -5.679 1.00 0.00 H new ATOM 154 N GLU A 12 -13.038 9.124 -3.318 1.00 0.00 N ATOM 155 CA GLU A 12 -14.273 9.070 -2.544 1.00 0.00 C ATOM 156 C GLU A 12 -14.416 7.723 -1.844 1.00 0.00 C ATOM 157 O GLU A 12 -14.669 7.662 -0.640 1.00 0.00 O ATOM 158 CB GLU A 12 -15.479 9.317 -3.452 1.00 0.00 C ATOM 159 CG GLU A 12 -15.661 10.775 -3.840 1.00 0.00 C ATOM 160 CD GLU A 12 -16.786 11.446 -3.074 1.00 0.00 C ATOM 161 OE1 GLU A 12 -17.146 10.944 -1.988 1.00 0.00 O ATOM 162 OE2 GLU A 12 -17.305 12.472 -3.560 1.00 0.00 O ATOM 0 H GLU A 12 -13.113 8.742 -4.261 1.00 0.00 H new ATOM 0 HA GLU A 12 -14.233 9.851 -1.785 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.370 8.720 -4.357 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -16.380 8.969 -2.947 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -14.731 11.314 -3.659 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.865 10.840 -4.909 1.00 0.00 H new ATOM 169 N LYS A 13 -14.253 6.645 -2.605 1.00 0.00 N ATOM 170 CA LYS A 13 -14.366 5.296 -2.054 1.00 0.00 C ATOM 171 C LYS A 13 -13.330 4.366 -2.681 1.00 0.00 C ATOM 172 O LYS A 13 -12.720 4.696 -3.698 1.00 0.00 O ATOM 173 CB LYS A 13 -15.772 4.742 -2.295 1.00 0.00 C ATOM 174 CG LYS A 13 -16.863 5.509 -1.565 1.00 0.00 C ATOM 175 CD LYS A 13 -18.033 5.829 -2.482 1.00 0.00 C ATOM 176 CE LYS A 13 -17.653 6.864 -3.528 1.00 0.00 C ATOM 177 NZ LYS A 13 -18.266 6.567 -4.852 1.00 0.00 N ATOM 0 H LYS A 13 -14.043 6.677 -3.603 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.181 5.351 -0.981 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.981 4.759 -3.365 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.801 3.699 -1.981 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -17.215 4.922 -0.716 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -16.451 6.435 -1.164 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -18.370 4.917 -2.976 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -18.870 6.199 -1.890 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.971 7.851 -3.194 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.568 6.896 -3.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -17.982 7.296 -5.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -17.942 5.636 -5.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -19.302 6.561 -4.761 1.00 0.00 H new ATOM 191 N LEU A 14 -13.140 3.203 -2.067 1.00 0.00 N ATOM 192 CA LEU A 14 -12.180 2.223 -2.564 1.00 0.00 C ATOM 193 C LEU A 14 -12.895 1.013 -3.159 1.00 0.00 C ATOM 194 O LEU A 14 -14.093 0.829 -2.956 1.00 0.00 O ATOM 195 CB LEU A 14 -11.242 1.784 -1.443 1.00 0.00 C ATOM 196 CG LEU A 14 -10.324 2.882 -0.903 1.00 0.00 C ATOM 197 CD1 LEU A 14 -10.137 2.734 0.599 1.00 0.00 C ATOM 198 CD2 LEU A 14 -8.980 2.849 -1.614 1.00 0.00 C ATOM 0 H LEU A 14 -13.638 2.916 -1.224 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.592 2.693 -3.352 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.841 1.394 -0.620 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.626 0.962 -1.806 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.793 3.847 -1.096 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.481 3.524 0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -11.105 2.808 1.095 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.691 1.763 0.816 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.339 3.637 -1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.507 1.881 -1.453 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.130 3.006 -2.682 1.00 0.00 H new ATOM 210 N ARG A 15 -12.158 0.200 -3.909 1.00 0.00 N ATOM 211 CA ARG A 15 -12.733 -0.980 -4.548 1.00 0.00 C ATOM 212 C ARG A 15 -12.901 -2.148 -3.576 1.00 0.00 C ATOM 213 O ARG A 15 -13.458 -3.181 -3.945 1.00 0.00 O ATOM 214 CB ARG A 15 -11.868 -1.412 -5.733 1.00 0.00 C ATOM 215 CG ARG A 15 -12.634 -2.183 -6.797 1.00 0.00 C ATOM 216 CD ARG A 15 -12.997 -1.294 -7.977 1.00 0.00 C ATOM 217 NE ARG A 15 -12.871 -1.997 -9.251 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.660 -3.001 -9.626 1.00 0.00 C ATOM 219 NH1 ARG A 15 -14.636 -3.421 -8.829 1.00 0.00 N ATOM 220 NH2 ARG A 15 -13.476 -3.585 -10.803 1.00 0.00 N ATOM 0 H ARG A 15 -11.163 0.336 -4.089 1.00 0.00 H new ATOM 0 HA ARG A 15 -13.727 -0.701 -4.898 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -11.422 -0.528 -6.188 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.048 -2.031 -5.367 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -12.031 -3.022 -7.144 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -13.542 -2.601 -6.362 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -14.020 -0.936 -7.860 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -12.351 -0.416 -7.982 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.134 -1.701 -9.891 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -14.784 -2.974 -7.924 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -15.238 -4.191 -9.122 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -12.730 -3.264 -11.420 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.081 -4.355 -11.091 1.00 0.00 H new ATOM 234 N ARG A 16 -12.424 -1.971 -2.342 1.00 0.00 N ATOM 235 CA ARG A 16 -12.514 -3.004 -1.294 1.00 0.00 C ATOM 236 C ARG A 16 -12.769 -4.397 -1.873 1.00 0.00 C ATOM 237 O ARG A 16 -13.729 -5.072 -1.499 1.00 0.00 O ATOM 238 CB ARG A 16 -13.624 -2.646 -0.296 1.00 0.00 C ATOM 239 CG ARG A 16 -13.205 -2.746 1.164 1.00 0.00 C ATOM 240 CD ARG A 16 -12.550 -4.081 1.483 1.00 0.00 C ATOM 241 NE ARG A 16 -13.344 -4.871 2.421 1.00 0.00 N ATOM 242 CZ ARG A 16 -14.377 -5.631 2.064 1.00 0.00 C ATOM 243 NH1 ARG A 16 -14.746 -5.712 0.792 1.00 0.00 N ATOM 244 NH2 ARG A 16 -15.044 -6.315 2.984 1.00 0.00 N ATOM 0 H ARG A 16 -11.965 -1.113 -2.036 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.551 -3.031 -0.784 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -13.964 -1.630 -0.496 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -14.475 -3.306 -0.464 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -12.512 -1.938 1.398 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -14.079 -2.610 1.801 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -12.411 -4.646 0.561 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -11.559 -3.907 1.903 1.00 0.00 H new ATOM 0 HE ARG A 16 -13.092 -4.838 3.409 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -14.237 -5.190 0.079 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -15.539 -6.297 0.527 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -14.765 -6.258 3.964 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -15.836 -6.898 2.712 1.00 0.00 H new ATOM 258 N GLY A 17 -11.911 -4.822 -2.795 1.00 0.00 N ATOM 259 CA GLY A 17 -12.077 -6.127 -3.411 1.00 0.00 C ATOM 260 C GLY A 17 -13.478 -6.325 -3.961 1.00 0.00 C ATOM 261 O GLY A 17 -13.835 -5.746 -4.987 1.00 0.00 O ATOM 0 H GLY A 17 -11.107 -4.289 -3.126 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -11.352 -6.242 -4.217 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -11.863 -6.904 -2.677 1.00 0.00 H new ATOM 265 N ASP A 18 -14.273 -7.141 -3.275 1.00 0.00 N ATOM 266 CA ASP A 18 -15.637 -7.411 -3.691 1.00 0.00 C ATOM 267 C ASP A 18 -16.412 -6.115 -3.909 1.00 0.00 C ATOM 268 O ASP A 18 -16.766 -5.769 -5.036 1.00 0.00 O ATOM 269 CB ASP A 18 -16.349 -8.277 -2.650 1.00 0.00 C ATOM 270 CG ASP A 18 -16.246 -9.758 -2.963 1.00 0.00 C ATOM 271 OD1 ASP A 18 -15.268 -10.392 -2.517 1.00 0.00 O ATOM 272 OD2 ASP A 18 -17.146 -10.281 -3.653 1.00 0.00 O ATOM 0 H ASP A 18 -13.990 -7.627 -2.424 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.598 -7.950 -4.638 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.920 -8.085 -1.667 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.400 -7.991 -2.600 1.00 0.00 H new ATOM 277 N GLY A 19 -16.666 -5.403 -2.818 1.00 0.00 N ATOM 278 CA GLY A 19 -17.392 -4.148 -2.894 1.00 0.00 C ATOM 279 C GLY A 19 -16.555 -2.971 -2.432 1.00 0.00 C ATOM 280 O GLY A 19 -15.330 -3.063 -2.375 1.00 0.00 O ATOM 0 H GLY A 19 -16.381 -5.674 -1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.716 -3.980 -3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.292 -4.214 -2.282 1.00 0.00 H new ATOM 284 N GLU A 20 -17.211 -1.859 -2.117 1.00 0.00 N ATOM 285 CA GLU A 20 -16.517 -0.660 -1.671 1.00 0.00 C ATOM 286 C GLU A 20 -16.859 -0.318 -0.223 1.00 0.00 C ATOM 287 O GLU A 20 -17.954 -0.618 0.253 1.00 0.00 O ATOM 288 CB GLU A 20 -16.889 0.508 -2.582 1.00 0.00 C ATOM 289 CG GLU A 20 -18.223 1.158 -2.244 1.00 0.00 C ATOM 290 CD GLU A 20 -18.644 2.193 -3.269 1.00 0.00 C ATOM 291 OE1 GLU A 20 -18.092 2.178 -4.389 1.00 0.00 O ATOM 292 OE2 GLU A 20 -19.527 3.016 -2.952 1.00 0.00 O ATOM 0 H GLU A 20 -18.226 -1.765 -2.163 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.444 -0.847 -1.723 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -16.105 1.263 -2.526 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.919 0.156 -3.613 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -18.991 0.388 -2.175 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -18.155 1.630 -1.264 1.00 0.00 H new ATOM 299 N VAL A 21 -15.922 0.329 0.467 1.00 0.00 N ATOM 300 CA VAL A 21 -16.142 0.729 1.854 1.00 0.00 C ATOM 301 C VAL A 21 -15.839 2.210 2.049 1.00 0.00 C ATOM 302 O VAL A 21 -14.949 2.763 1.403 1.00 0.00 O ATOM 303 CB VAL A 21 -15.285 -0.089 2.836 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.832 -1.500 2.978 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.830 -0.108 2.391 1.00 0.00 C ATOM 0 H VAL A 21 -15.009 0.586 0.091 1.00 0.00 H new ATOM 0 HA VAL A 21 -17.193 0.536 2.067 1.00 0.00 H new ATOM 0 HB VAL A 21 -15.331 0.389 3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -15.212 -2.062 3.677 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.855 -1.458 3.353 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.822 -1.994 2.006 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.241 -0.691 3.098 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.758 -0.558 1.401 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.447 0.912 2.354 1.00 0.00 H new ATOM 315 N GLU A 22 -16.589 2.846 2.941 1.00 0.00 N ATOM 316 CA GLU A 22 -16.406 4.266 3.223 1.00 0.00 C ATOM 317 C GLU A 22 -14.970 4.563 3.640 1.00 0.00 C ATOM 318 O GLU A 22 -14.387 3.844 4.452 1.00 0.00 O ATOM 319 CB GLU A 22 -17.365 4.722 4.326 1.00 0.00 C ATOM 320 CG GLU A 22 -17.525 3.714 5.455 1.00 0.00 C ATOM 321 CD GLU A 22 -18.829 2.946 5.370 1.00 0.00 C ATOM 322 OE1 GLU A 22 -19.854 3.555 4.997 1.00 0.00 O ATOM 323 OE2 GLU A 22 -18.826 1.735 5.677 1.00 0.00 O ATOM 0 H GLU A 22 -17.330 2.401 3.482 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.624 4.816 2.307 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.006 5.664 4.740 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -18.343 4.919 3.886 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -16.692 3.012 5.431 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.476 4.234 6.411 1.00 0.00 H new ATOM 330 N VAL A 23 -14.408 5.633 3.086 1.00 0.00 N ATOM 331 CA VAL A 23 -13.044 6.032 3.408 1.00 0.00 C ATOM 332 C VAL A 23 -12.879 6.228 4.915 1.00 0.00 C ATOM 333 O VAL A 23 -11.790 6.056 5.460 1.00 0.00 O ATOM 334 CB VAL A 23 -12.655 7.333 2.676 1.00 0.00 C ATOM 335 CG1 VAL A 23 -11.288 7.825 3.130 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.677 7.120 1.170 1.00 0.00 C ATOM 0 H VAL A 23 -14.877 6.239 2.412 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.383 5.232 3.075 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.388 8.099 2.928 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.037 8.743 2.599 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.309 8.020 4.202 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.538 7.065 2.914 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.400 8.047 0.667 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.968 6.337 0.903 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.679 6.824 0.859 1.00 0.00 H new ATOM 346 N LYS A 24 -13.975 6.585 5.578 1.00 0.00 N ATOM 347 CA LYS A 24 -13.972 6.802 7.022 1.00 0.00 C ATOM 348 C LYS A 24 -13.366 5.609 7.755 1.00 0.00 C ATOM 349 O LYS A 24 -12.821 5.752 8.849 1.00 0.00 O ATOM 350 CB LYS A 24 -15.395 7.053 7.524 1.00 0.00 C ATOM 351 CG LYS A 24 -15.469 7.370 9.008 1.00 0.00 C ATOM 352 CD LYS A 24 -16.707 6.762 9.647 1.00 0.00 C ATOM 353 CE LYS A 24 -16.394 5.429 10.306 1.00 0.00 C ATOM 354 NZ LYS A 24 -16.551 4.290 9.360 1.00 0.00 N ATOM 0 H LYS A 24 -14.882 6.731 5.135 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.359 7.680 7.228 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.829 7.880 6.962 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -16.005 6.173 7.318 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -14.577 6.991 9.507 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.478 8.451 9.150 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.110 7.451 10.389 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.478 6.623 8.889 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -15.374 5.444 10.689 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.054 5.284 11.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -16.328 3.399 9.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -17.531 4.259 9.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -15.903 4.415 8.556 1.00 0.00 H new ATOM 368 N SER A 25 -13.467 4.430 7.148 1.00 0.00 N ATOM 369 CA SER A 25 -12.931 3.211 7.748 1.00 0.00 C ATOM 370 C SER A 25 -11.422 3.314 7.967 1.00 0.00 C ATOM 371 O SER A 25 -10.845 2.544 8.734 1.00 0.00 O ATOM 372 CB SER A 25 -13.246 2.003 6.864 1.00 0.00 C ATOM 373 OG SER A 25 -12.992 0.789 7.548 1.00 0.00 O ATOM 0 H SER A 25 -13.915 4.292 6.242 1.00 0.00 H new ATOM 0 HA SER A 25 -13.407 3.082 8.720 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.291 2.038 6.555 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.643 2.046 5.957 1.00 0.00 H new ATOM 0 HG SER A 25 -12.309 0.937 8.235 1.00 0.00 H new ATOM 379 N LEU A 26 -10.786 4.276 7.301 1.00 0.00 N ATOM 380 CA LEU A 26 -9.348 4.482 7.438 1.00 0.00 C ATOM 381 C LEU A 26 -9.075 5.764 8.217 1.00 0.00 C ATOM 382 O LEU A 26 -8.252 6.588 7.818 1.00 0.00 O ATOM 383 CB LEU A 26 -8.676 4.548 6.062 1.00 0.00 C ATOM 384 CG LEU A 26 -9.218 3.575 5.006 1.00 0.00 C ATOM 385 CD1 LEU A 26 -8.219 3.414 3.871 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.541 2.223 5.625 1.00 0.00 C ATOM 0 H LEU A 26 -11.245 4.924 6.661 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.929 3.637 7.985 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.776 5.563 5.678 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.610 4.359 6.190 1.00 0.00 H new ATOM 0 HG LEU A 26 -10.141 3.992 4.603 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.618 2.721 3.130 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.041 4.382 3.403 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.281 3.023 4.265 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.923 1.552 4.855 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.637 1.797 6.061 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.294 2.349 6.403 1.00 0.00 H new ATOM 398 N ALA A 27 -9.781 5.922 9.331 1.00 0.00 N ATOM 399 CA ALA A 27 -9.645 7.084 10.175 1.00 0.00 C ATOM 400 C ALA A 27 -8.911 6.745 11.453 1.00 0.00 C ATOM 401 O ALA A 27 -9.509 6.401 12.474 1.00 0.00 O ATOM 402 CB ALA A 27 -11.000 7.643 10.492 1.00 0.00 C ATOM 0 H ALA A 27 -10.463 5.242 9.667 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.061 7.832 9.638 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -10.892 8.520 11.130 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.502 7.926 9.567 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.593 6.889 11.010 1.00 0.00 H new ATOM 408 N GLY A 28 -7.616 6.857 11.369 1.00 0.00 N ATOM 409 CA GLY A 28 -6.751 6.579 12.501 1.00 0.00 C ATOM 410 C GLY A 28 -6.153 5.185 12.465 1.00 0.00 C ATOM 411 O GLY A 28 -6.271 4.425 13.425 1.00 0.00 O ATOM 0 H GLY A 28 -7.123 7.142 10.522 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -5.945 7.313 12.524 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.319 6.700 13.423 1.00 0.00 H new ATOM 415 N LYS A 29 -5.498 4.859 11.356 1.00 0.00 N ATOM 416 CA LYS A 29 -4.864 3.559 11.191 1.00 0.00 C ATOM 417 C LYS A 29 -3.621 3.683 10.314 1.00 0.00 C ATOM 418 O LYS A 29 -3.229 4.787 9.936 1.00 0.00 O ATOM 419 CB LYS A 29 -5.854 2.560 10.587 1.00 0.00 C ATOM 420 CG LYS A 29 -6.115 2.758 9.099 1.00 0.00 C ATOM 421 CD LYS A 29 -6.788 1.539 8.487 1.00 0.00 C ATOM 422 CE LYS A 29 -8.113 1.230 9.168 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.917 0.242 8.399 1.00 0.00 N ATOM 0 H LYS A 29 -5.393 5.482 10.555 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.557 3.191 12.170 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.476 1.550 10.746 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.800 2.635 11.123 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.745 3.635 8.952 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.173 2.952 8.585 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.956 1.711 7.424 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.126 0.677 8.570 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.925 0.843 10.170 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.685 2.151 9.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.929 0.408 8.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.717 0.347 7.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.667 -0.721 8.703 1.00 0.00 H new ATOM 437 N LEU A 30 -3.010 2.550 9.984 1.00 0.00 N ATOM 438 CA LEU A 30 -1.820 2.552 9.144 1.00 0.00 C ATOM 439 C LEU A 30 -2.161 2.038 7.752 1.00 0.00 C ATOM 440 O LEU A 30 -2.201 0.830 7.518 1.00 0.00 O ATOM 441 CB LEU A 30 -0.717 1.698 9.770 1.00 0.00 C ATOM 442 CG LEU A 30 0.678 1.905 9.178 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.237 3.257 9.588 1.00 0.00 C ATOM 444 CD2 LEU A 30 1.610 0.784 9.613 1.00 0.00 C ATOM 0 H LEU A 30 -3.317 1.625 10.284 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.455 3.576 9.062 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.677 1.910 10.838 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.988 0.648 9.664 1.00 0.00 H new ATOM 0 HG LEU A 30 0.599 1.885 8.091 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.230 3.386 9.157 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.579 4.047 9.227 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.303 3.309 10.675 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.599 0.946 9.184 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.684 0.774 10.700 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.216 -0.172 9.267 1.00 0.00 H new ATOM 456 N VAL A 31 -2.416 2.963 6.834 1.00 0.00 N ATOM 457 CA VAL A 31 -2.766 2.602 5.468 1.00 0.00 C ATOM 458 C VAL A 31 -1.518 2.386 4.622 1.00 0.00 C ATOM 459 O VAL A 31 -0.772 3.325 4.346 1.00 0.00 O ATOM 460 CB VAL A 31 -3.648 3.676 4.800 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.297 3.121 3.542 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.704 4.189 5.770 1.00 0.00 C ATOM 0 H VAL A 31 -2.387 3.967 7.012 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.331 1.672 5.526 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.013 4.516 4.519 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.916 3.891 3.082 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.523 2.810 2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.917 2.263 3.801 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.314 4.946 5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.339 3.362 6.088 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.216 4.627 6.641 1.00 0.00 H new ATOM 472 N PHE A 32 -1.300 1.141 4.215 1.00 0.00 N ATOM 473 CA PHE A 32 -0.143 0.795 3.399 1.00 0.00 C ATOM 474 C PHE A 32 -0.502 0.823 1.918 1.00 0.00 C ATOM 475 O PHE A 32 -1.664 0.662 1.548 1.00 0.00 O ATOM 476 CB PHE A 32 0.379 -0.594 3.779 1.00 0.00 C ATOM 477 CG PHE A 32 1.373 -0.598 4.913 1.00 0.00 C ATOM 478 CD1 PHE A 32 1.553 0.523 5.713 1.00 0.00 C ATOM 479 CD2 PHE A 32 2.124 -1.730 5.182 1.00 0.00 C ATOM 480 CE1 PHE A 32 2.463 0.511 6.753 1.00 0.00 C ATOM 481 CE2 PHE A 32 3.036 -1.747 6.221 1.00 0.00 C ATOM 482 CZ PHE A 32 3.206 -0.625 7.007 1.00 0.00 C ATOM 0 H PHE A 32 -1.910 0.354 4.437 1.00 0.00 H new ATOM 0 HA PHE A 32 0.637 1.533 3.585 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.467 -1.225 4.052 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.844 -1.046 2.903 1.00 0.00 H new ATOM 0 HD1 PHE A 32 0.975 1.415 5.520 1.00 0.00 H new ATOM 0 HD2 PHE A 32 1.996 -2.612 4.572 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.593 1.390 7.367 1.00 0.00 H new ATOM 0 HE2 PHE A 32 3.615 -2.637 6.417 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.918 -0.636 7.819 1.00 0.00 H new ATOM 492 N PHE A 33 0.503 1.020 1.073 1.00 0.00 N ATOM 493 CA PHE A 33 0.289 1.058 -0.366 1.00 0.00 C ATOM 494 C PHE A 33 1.412 0.327 -1.089 1.00 0.00 C ATOM 495 O PHE A 33 2.532 0.828 -1.188 1.00 0.00 O ATOM 496 CB PHE A 33 0.205 2.503 -0.867 1.00 0.00 C ATOM 497 CG PHE A 33 -0.411 3.454 0.119 1.00 0.00 C ATOM 498 CD1 PHE A 33 0.316 3.910 1.204 1.00 0.00 C ATOM 499 CD2 PHE A 33 -1.716 3.890 -0.042 1.00 0.00 C ATOM 500 CE1 PHE A 33 -0.245 4.785 2.113 1.00 0.00 C ATOM 501 CE2 PHE A 33 -2.284 4.766 0.864 1.00 0.00 C ATOM 502 CZ PHE A 33 -1.547 5.214 1.944 1.00 0.00 C ATOM 0 H PHE A 33 1.472 1.156 1.360 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.657 0.560 -0.579 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.208 2.850 -1.114 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -0.376 2.524 -1.789 1.00 0.00 H new ATOM 0 HD1 PHE A 33 1.334 3.578 1.342 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.296 3.542 -0.884 1.00 0.00 H new ATOM 0 HE1 PHE A 33 0.334 5.134 2.955 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.302 5.100 0.728 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.988 5.898 2.654 1.00 0.00 H new ATOM 512 N TYR A 34 1.103 -0.859 -1.593 1.00 0.00 N ATOM 513 CA TYR A 34 2.081 -1.663 -2.308 1.00 0.00 C ATOM 514 C TYR A 34 2.006 -1.406 -3.811 1.00 0.00 C ATOM 515 O TYR A 34 1.000 -1.700 -4.456 1.00 0.00 O ATOM 516 CB TYR A 34 1.878 -3.149 -1.989 1.00 0.00 C ATOM 517 CG TYR A 34 0.827 -3.846 -2.828 1.00 0.00 C ATOM 518 CD1 TYR A 34 1.153 -4.408 -4.056 1.00 0.00 C ATOM 519 CD2 TYR A 34 -0.485 -3.954 -2.385 1.00 0.00 C ATOM 520 CE1 TYR A 34 0.201 -5.054 -4.820 1.00 0.00 C ATOM 521 CE2 TYR A 34 -1.442 -4.602 -3.143 1.00 0.00 C ATOM 522 CZ TYR A 34 -1.094 -5.149 -4.360 1.00 0.00 C ATOM 523 OH TYR A 34 -2.045 -5.795 -5.117 1.00 0.00 O ATOM 0 H TYR A 34 0.180 -1.286 -1.519 1.00 0.00 H new ATOM 0 HA TYR A 34 3.078 -1.374 -1.976 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.828 -3.667 -2.121 1.00 0.00 H new ATOM 0 HB3 TYR A 34 1.605 -3.246 -0.938 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.168 -4.339 -4.419 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -0.762 -3.525 -1.433 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.471 -5.483 -5.774 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -2.458 -4.680 -2.784 1.00 0.00 H new ATOM 0 HH TYR A 34 -2.541 -5.138 -5.649 1.00 0.00 H new ATOM 533 N PHE A 35 3.079 -0.843 -4.356 1.00 0.00 N ATOM 534 CA PHE A 35 3.140 -0.532 -5.781 1.00 0.00 C ATOM 535 C PHE A 35 3.709 -1.706 -6.574 1.00 0.00 C ATOM 536 O PHE A 35 4.761 -2.242 -6.227 1.00 0.00 O ATOM 537 CB PHE A 35 3.991 0.718 -6.012 1.00 0.00 C ATOM 538 CG PHE A 35 3.457 1.943 -5.325 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.746 2.188 -3.993 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.664 2.847 -6.013 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.256 3.312 -3.359 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.170 3.974 -5.383 1.00 0.00 C ATOM 543 CZ PHE A 35 2.466 4.208 -4.054 1.00 0.00 C ATOM 0 H PHE A 35 3.918 -0.592 -3.833 1.00 0.00 H new ATOM 0 HA PHE A 35 2.125 -0.343 -6.131 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.005 0.527 -5.661 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.056 0.911 -7.083 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.362 1.491 -3.444 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.429 2.669 -7.052 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.490 3.491 -2.320 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.553 4.671 -5.930 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.081 5.088 -3.560 1.00 0.00 H new ATOM 553 N SER A 36 3.012 -2.106 -7.638 1.00 0.00 N ATOM 554 CA SER A 36 3.465 -3.220 -8.465 1.00 0.00 C ATOM 555 C SER A 36 2.571 -3.393 -9.688 1.00 0.00 C ATOM 556 O SER A 36 1.448 -2.888 -9.725 1.00 0.00 O ATOM 557 CB SER A 36 3.486 -4.513 -7.648 1.00 0.00 C ATOM 558 OG SER A 36 4.309 -5.490 -8.260 1.00 0.00 O ATOM 0 H SER A 36 2.138 -1.678 -7.944 1.00 0.00 H new ATOM 0 HA SER A 36 4.476 -2.996 -8.807 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.850 -4.305 -6.642 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.472 -4.899 -7.547 1.00 0.00 H new ATOM 0 HG SER A 36 3.779 -6.009 -8.901 1.00 0.00 H new ATOM 564 N ALA A 37 3.073 -4.113 -10.686 1.00 0.00 N ATOM 565 CA ALA A 37 2.320 -4.358 -11.905 1.00 0.00 C ATOM 566 C ALA A 37 2.287 -5.848 -12.226 1.00 0.00 C ATOM 567 O ALA A 37 3.021 -6.636 -11.631 1.00 0.00 O ATOM 568 CB ALA A 37 2.929 -3.576 -13.061 1.00 0.00 C ATOM 0 H ALA A 37 4.001 -4.537 -10.672 1.00 0.00 H new ATOM 0 HA ALA A 37 1.295 -4.020 -11.755 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.358 -3.766 -13.970 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.904 -2.510 -12.833 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.962 -3.891 -13.209 1.00 0.00 H new ATOM 574 N SER A 38 1.439 -6.231 -13.170 1.00 0.00 N ATOM 575 CA SER A 38 1.332 -7.628 -13.568 1.00 0.00 C ATOM 576 C SER A 38 2.187 -7.903 -14.802 1.00 0.00 C ATOM 577 O SER A 38 2.064 -8.953 -15.433 1.00 0.00 O ATOM 578 CB SER A 38 -0.128 -7.991 -13.851 1.00 0.00 C ATOM 579 OG SER A 38 -0.875 -6.845 -14.222 1.00 0.00 O ATOM 0 H SER A 38 0.818 -5.597 -13.673 1.00 0.00 H new ATOM 0 HA SER A 38 1.697 -8.246 -12.747 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.174 -8.733 -14.648 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.571 -8.447 -12.966 1.00 0.00 H new ATOM 0 HG SER A 38 -0.309 -6.241 -14.747 1.00 0.00 H new ATOM 585 N TRP A 39 3.053 -6.950 -15.145 1.00 0.00 N ATOM 586 CA TRP A 39 3.923 -7.088 -16.305 1.00 0.00 C ATOM 587 C TRP A 39 5.397 -7.013 -15.909 1.00 0.00 C ATOM 588 O TRP A 39 6.257 -7.563 -16.597 1.00 0.00 O ATOM 589 CB TRP A 39 3.602 -6.004 -17.338 1.00 0.00 C ATOM 590 CG TRP A 39 4.034 -4.630 -16.921 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.286 -3.699 -16.258 1.00 0.00 C ATOM 592 CD2 TRP A 39 5.317 -4.031 -17.141 1.00 0.00 C ATOM 593 NE1 TRP A 39 4.025 -2.559 -16.052 1.00 0.00 N ATOM 594 CE2 TRP A 39 5.276 -2.739 -16.584 1.00 0.00 C ATOM 595 CE3 TRP A 39 6.497 -4.463 -17.753 1.00 0.00 C ATOM 596 CZ2 TRP A 39 6.368 -1.875 -16.623 1.00 0.00 C ATOM 597 CZ3 TRP A 39 7.580 -3.606 -17.790 1.00 0.00 C ATOM 598 CH2 TRP A 39 7.509 -2.326 -17.228 1.00 0.00 C ATOM 0 H TRP A 39 3.168 -6.075 -14.634 1.00 0.00 H new ATOM 0 HA TRP A 39 3.741 -8.069 -16.744 1.00 0.00 H new ATOM 0 HB2 TRP A 39 4.087 -6.258 -18.281 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.528 -5.997 -17.523 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.263 -3.839 -15.942 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.697 -1.716 -15.580 1.00 0.00 H new ATOM 0 HE3 TRP A 39 6.561 -5.449 -18.189 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 6.316 -0.886 -16.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 8.497 -3.929 -18.260 1.00 0.00 H new ATOM 0 HH2 TRP A 39 8.374 -1.681 -17.273 1.00 0.00 H new ATOM 609 N CYS A 40 5.691 -6.329 -14.802 1.00 0.00 N ATOM 610 CA CYS A 40 7.072 -6.193 -14.341 1.00 0.00 C ATOM 611 C CYS A 40 7.758 -7.559 -14.256 1.00 0.00 C ATOM 612 O CYS A 40 7.107 -8.576 -14.022 1.00 0.00 O ATOM 613 CB CYS A 40 7.125 -5.485 -12.981 1.00 0.00 C ATOM 614 SG CYS A 40 5.785 -5.935 -11.827 1.00 0.00 S ATOM 0 H CYS A 40 4.999 -5.865 -14.214 1.00 0.00 H new ATOM 0 HA CYS A 40 7.608 -5.585 -15.069 1.00 0.00 H new ATOM 0 HB2 CYS A 40 8.082 -5.708 -12.509 1.00 0.00 H new ATOM 0 HB3 CYS A 40 7.095 -4.408 -13.147 1.00 0.00 H new ATOM 619 N PRO A 41 9.087 -7.603 -14.463 1.00 0.00 N ATOM 620 CA PRO A 41 9.847 -8.857 -14.419 1.00 0.00 C ATOM 621 C PRO A 41 9.682 -9.592 -13.087 1.00 0.00 C ATOM 622 O PRO A 41 9.345 -10.775 -13.066 1.00 0.00 O ATOM 623 CB PRO A 41 11.301 -8.418 -14.622 1.00 0.00 C ATOM 624 CG PRO A 41 11.217 -7.077 -15.269 1.00 0.00 C ATOM 625 CD PRO A 41 9.947 -6.445 -14.771 1.00 0.00 C ATOM 0 HA PRO A 41 9.502 -9.563 -15.175 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.833 -8.364 -13.672 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.842 -9.125 -15.250 1.00 0.00 H new ATOM 0 HG2 PRO A 41 12.082 -6.466 -15.011 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.205 -7.170 -16.355 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.123 -5.830 -13.889 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.497 -5.799 -15.525 1.00 0.00 H new ATOM 633 N PRO A 42 9.912 -8.904 -11.952 1.00 0.00 N ATOM 634 CA PRO A 42 9.776 -9.515 -10.629 1.00 0.00 C ATOM 635 C PRO A 42 8.302 -9.720 -10.244 1.00 0.00 C ATOM 636 O PRO A 42 7.642 -10.596 -10.802 1.00 0.00 O ATOM 637 CB PRO A 42 10.489 -8.518 -9.709 1.00 0.00 C ATOM 638 CG PRO A 42 10.358 -7.199 -10.394 1.00 0.00 C ATOM 639 CD PRO A 42 10.313 -7.484 -11.871 1.00 0.00 C ATOM 0 HA PRO A 42 10.205 -10.515 -10.572 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.031 -8.496 -8.720 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.536 -8.788 -9.570 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.454 -6.683 -10.071 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.199 -6.550 -10.150 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.598 -6.838 -12.380 1.00 0.00 H new ATOM 0 HD3 PRO A 42 11.283 -7.316 -12.339 1.00 0.00 H new ATOM 647 N CYS A 43 7.782 -8.911 -9.309 1.00 0.00 N ATOM 648 CA CYS A 43 6.372 -9.016 -8.878 1.00 0.00 C ATOM 649 C CYS A 43 5.870 -10.457 -8.922 1.00 0.00 C ATOM 650 O CYS A 43 5.282 -10.893 -9.912 1.00 0.00 O ATOM 651 CB CYS A 43 5.478 -8.132 -9.754 1.00 0.00 C ATOM 652 SG CYS A 43 6.067 -7.912 -11.467 1.00 0.00 S ATOM 0 H CYS A 43 8.311 -8.178 -8.836 1.00 0.00 H new ATOM 0 HA CYS A 43 6.324 -8.673 -7.844 1.00 0.00 H new ATOM 0 HB2 CYS A 43 4.478 -8.564 -9.781 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.389 -7.152 -9.286 1.00 0.00 H new ATOM 657 N ARG A 44 6.108 -11.190 -7.839 1.00 0.00 N ATOM 658 CA ARG A 44 5.682 -12.583 -7.744 1.00 0.00 C ATOM 659 C ARG A 44 6.161 -13.211 -6.438 1.00 0.00 C ATOM 660 O ARG A 44 5.464 -14.031 -5.841 1.00 0.00 O ATOM 661 CB ARG A 44 6.212 -13.390 -8.934 1.00 0.00 C ATOM 662 CG ARG A 44 5.165 -14.283 -9.578 1.00 0.00 C ATOM 663 CD ARG A 44 5.757 -15.117 -10.702 1.00 0.00 C ATOM 664 NE ARG A 44 6.776 -16.046 -10.219 1.00 0.00 N ATOM 665 CZ ARG A 44 8.065 -15.735 -10.085 1.00 0.00 C ATOM 666 NH1 ARG A 44 8.502 -14.520 -10.396 1.00 0.00 N ATOM 667 NH2 ARG A 44 8.921 -16.644 -9.638 1.00 0.00 N ATOM 0 H ARG A 44 6.595 -10.842 -7.013 1.00 0.00 H new ATOM 0 HA ARG A 44 4.592 -12.602 -7.760 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.602 -12.702 -9.684 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.048 -14.006 -8.601 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.734 -14.941 -8.824 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.353 -13.670 -9.968 1.00 0.00 H new ATOM 0 HD2 ARG A 44 4.962 -15.676 -11.195 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.195 -14.457 -11.451 1.00 0.00 H new ATOM 0 HE ARG A 44 6.483 -16.990 -9.969 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.849 -13.816 -10.741 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.490 -14.291 -10.290 1.00 0.00 H new ATOM 0 HH21 ARG A 44 8.592 -17.579 -9.397 1.00 0.00 H new ATOM 0 HH22 ARG A 44 9.908 -16.408 -9.535 1.00 0.00 H new ATOM 681 N GLY A 45 7.355 -12.822 -6.003 1.00 0.00 N ATOM 682 CA GLY A 45 7.908 -13.360 -4.775 1.00 0.00 C ATOM 683 C GLY A 45 7.457 -12.598 -3.544 1.00 0.00 C ATOM 684 O GLY A 45 6.685 -13.113 -2.736 1.00 0.00 O ATOM 0 H GLY A 45 7.949 -12.144 -6.479 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.615 -14.405 -4.677 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.996 -13.338 -4.832 1.00 0.00 H new ATOM 688 N PHE A 46 7.945 -11.370 -3.396 1.00 0.00 N ATOM 689 CA PHE A 46 7.591 -10.541 -2.249 1.00 0.00 C ATOM 690 C PHE A 46 6.090 -10.244 -2.225 1.00 0.00 C ATOM 691 O PHE A 46 5.328 -10.976 -1.605 1.00 0.00 O ATOM 692 CB PHE A 46 8.401 -9.238 -2.264 1.00 0.00 C ATOM 693 CG PHE A 46 7.955 -8.238 -1.234 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.785 -8.614 0.088 1.00 0.00 C ATOM 695 CD2 PHE A 46 7.704 -6.922 -1.591 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.373 -7.697 1.037 1.00 0.00 C ATOM 697 CE2 PHE A 46 7.292 -6.001 -0.647 1.00 0.00 C ATOM 698 CZ PHE A 46 7.126 -6.390 0.668 1.00 0.00 C ATOM 0 H PHE A 46 8.586 -10.928 -4.055 1.00 0.00 H new ATOM 0 HA PHE A 46 7.835 -11.093 -1.342 1.00 0.00 H new ATOM 0 HB2 PHE A 46 9.453 -9.472 -2.099 1.00 0.00 H new ATOM 0 HB3 PHE A 46 8.327 -8.786 -3.253 1.00 0.00 H new ATOM 0 HD1 PHE A 46 7.977 -9.636 0.381 1.00 0.00 H new ATOM 0 HD2 PHE A 46 7.832 -6.613 -2.618 1.00 0.00 H new ATOM 0 HE1 PHE A 46 7.245 -8.003 2.065 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.100 -4.978 -0.937 1.00 0.00 H new ATOM 0 HZ PHE A 46 6.803 -5.672 1.407 1.00 0.00 H new ATOM 708 N THR A 47 5.687 -9.162 -2.903 1.00 0.00 N ATOM 709 CA THR A 47 4.284 -8.720 -2.986 1.00 0.00 C ATOM 710 C THR A 47 3.353 -9.394 -1.960 1.00 0.00 C ATOM 711 O THR A 47 2.972 -8.769 -0.970 1.00 0.00 O ATOM 712 CB THR A 47 3.750 -8.910 -4.408 1.00 0.00 C ATOM 713 OG1 THR A 47 4.522 -9.866 -5.111 1.00 0.00 O ATOM 714 CG2 THR A 47 3.752 -7.634 -5.221 1.00 0.00 C ATOM 0 H THR A 47 6.331 -8.560 -3.416 1.00 0.00 H new ATOM 0 HA THR A 47 4.285 -7.660 -2.732 1.00 0.00 H new ATOM 0 HB THR A 47 2.720 -9.246 -4.287 1.00 0.00 H new ATOM 0 HG1 THR A 47 4.163 -9.974 -6.017 1.00 0.00 H new ATOM 0 HG21 THR A 47 3.362 -7.837 -6.218 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.125 -6.889 -4.731 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.771 -7.255 -5.300 1.00 0.00 H new ATOM 722 N PRO A 48 2.950 -10.668 -2.179 1.00 0.00 N ATOM 723 CA PRO A 48 2.040 -11.380 -1.260 1.00 0.00 C ATOM 724 C PRO A 48 2.708 -11.862 0.032 1.00 0.00 C ATOM 725 O PRO A 48 2.131 -12.663 0.768 1.00 0.00 O ATOM 726 CB PRO A 48 1.599 -12.582 -2.092 1.00 0.00 C ATOM 727 CG PRO A 48 2.773 -12.862 -2.958 1.00 0.00 C ATOM 728 CD PRO A 48 3.317 -11.513 -3.337 1.00 0.00 C ATOM 0 HA PRO A 48 1.236 -10.728 -0.919 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.354 -13.437 -1.462 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.711 -12.356 -2.682 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.520 -13.453 -2.428 1.00 0.00 H new ATOM 0 HG3 PRO A 48 2.483 -13.432 -3.841 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.396 -11.541 -3.490 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.874 -11.144 -4.262 1.00 0.00 H new ATOM 736 N GLN A 49 3.915 -11.385 0.305 1.00 0.00 N ATOM 737 CA GLN A 49 4.641 -11.784 1.505 1.00 0.00 C ATOM 738 C GLN A 49 4.099 -11.066 2.735 1.00 0.00 C ATOM 739 O GLN A 49 4.155 -11.588 3.848 1.00 0.00 O ATOM 740 CB GLN A 49 6.134 -11.489 1.350 1.00 0.00 C ATOM 741 CG GLN A 49 7.031 -12.550 1.967 1.00 0.00 C ATOM 742 CD GLN A 49 7.060 -13.832 1.157 1.00 0.00 C ATOM 743 OE1 GLN A 49 7.194 -13.804 -0.066 1.00 0.00 O ATOM 744 NE2 GLN A 49 6.933 -14.965 1.839 1.00 0.00 N ATOM 0 H GLN A 49 4.413 -10.721 -0.288 1.00 0.00 H new ATOM 0 HA GLN A 49 4.501 -12.857 1.639 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.370 -11.398 0.290 1.00 0.00 H new ATOM 0 HB3 GLN A 49 6.355 -10.526 1.810 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.044 -12.157 2.055 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.685 -12.770 2.977 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.824 -14.941 2.853 1.00 0.00 H new ATOM 0 HE22 GLN A 49 6.944 -15.859 1.349 1.00 0.00 H new ATOM 753 N LEU A 50 3.584 -9.860 2.527 1.00 0.00 N ATOM 754 CA LEU A 50 3.045 -9.061 3.609 1.00 0.00 C ATOM 755 C LEU A 50 1.693 -9.602 4.076 1.00 0.00 C ATOM 756 O LEU A 50 1.300 -9.390 5.224 1.00 0.00 O ATOM 757 CB LEU A 50 2.989 -7.592 3.167 1.00 0.00 C ATOM 758 CG LEU A 50 1.650 -6.857 3.296 1.00 0.00 C ATOM 759 CD1 LEU A 50 1.652 -5.946 4.515 1.00 0.00 C ATOM 760 CD2 LEU A 50 1.399 -6.060 2.031 1.00 0.00 C ATOM 0 H LEU A 50 3.531 -9.416 1.610 1.00 0.00 H new ATOM 0 HA LEU A 50 3.699 -9.123 4.479 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.731 -7.040 3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.298 -7.545 2.123 1.00 0.00 H new ATOM 0 HG LEU A 50 0.850 -7.585 3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.693 -5.434 4.588 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.815 -6.541 5.414 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.450 -5.210 4.418 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.448 -5.534 2.115 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.202 -5.337 1.891 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.366 -6.735 1.176 1.00 0.00 H new ATOM 772 N ILE A 51 0.982 -10.302 3.190 1.00 0.00 N ATOM 773 CA ILE A 51 -0.321 -10.864 3.539 1.00 0.00 C ATOM 774 C ILE A 51 -0.234 -11.659 4.841 1.00 0.00 C ATOM 775 O ILE A 51 -1.114 -11.565 5.697 1.00 0.00 O ATOM 776 CB ILE A 51 -0.857 -11.793 2.426 1.00 0.00 C ATOM 777 CG1 ILE A 51 -1.135 -11.002 1.147 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.118 -12.512 2.886 1.00 0.00 C ATOM 779 CD1 ILE A 51 -0.875 -11.791 -0.117 1.00 0.00 C ATOM 0 H ILE A 51 1.284 -10.491 2.234 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.006 -10.025 3.661 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.092 -12.539 2.211 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -2.173 -10.671 1.152 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -0.515 -10.106 1.141 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -2.479 -13.161 2.088 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.893 -13.112 3.768 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.886 -11.779 3.132 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -1.093 -11.169 -0.985 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.170 -12.100 -0.145 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.515 -12.673 -0.133 1.00 0.00 H new ATOM 791 N GLU A 52 0.832 -12.439 4.983 1.00 0.00 N ATOM 792 CA GLU A 52 1.031 -13.246 6.180 1.00 0.00 C ATOM 793 C GLU A 52 1.175 -12.359 7.413 1.00 0.00 C ATOM 794 O GLU A 52 0.490 -12.557 8.415 1.00 0.00 O ATOM 795 CB GLU A 52 2.268 -14.131 6.026 1.00 0.00 C ATOM 796 CG GLU A 52 1.982 -15.461 5.349 1.00 0.00 C ATOM 797 CD GLU A 52 1.152 -16.389 6.214 1.00 0.00 C ATOM 798 OE1 GLU A 52 1.120 -16.182 7.446 1.00 0.00 O ATOM 799 OE2 GLU A 52 0.531 -17.321 5.660 1.00 0.00 O ATOM 0 H GLU A 52 1.570 -12.529 4.285 1.00 0.00 H new ATOM 0 HA GLU A 52 0.155 -13.881 6.310 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.020 -13.593 5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.696 -14.318 7.011 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.459 -15.281 4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.925 -15.948 5.101 1.00 0.00 H new ATOM 806 N PHE A 53 2.066 -11.375 7.329 1.00 0.00 N ATOM 807 CA PHE A 53 2.291 -10.454 8.438 1.00 0.00 C ATOM 808 C PHE A 53 1.049 -9.606 8.688 1.00 0.00 C ATOM 809 O PHE A 53 0.765 -9.217 9.821 1.00 0.00 O ATOM 810 CB PHE A 53 3.495 -9.553 8.148 1.00 0.00 C ATOM 811 CG PHE A 53 3.683 -8.449 9.154 1.00 0.00 C ATOM 812 CD1 PHE A 53 4.384 -8.673 10.329 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.154 -7.189 8.923 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.553 -7.661 11.255 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.321 -6.173 9.845 1.00 0.00 C ATOM 816 CZ PHE A 53 4.021 -6.409 11.013 1.00 0.00 C ATOM 0 H PHE A 53 2.642 -11.195 6.507 1.00 0.00 H new ATOM 0 HA PHE A 53 2.499 -11.039 9.334 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.397 -10.165 8.121 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.378 -9.113 7.157 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.803 -9.649 10.523 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.605 -6.999 8.012 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.100 -7.849 12.167 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.905 -5.195 9.653 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.152 -5.617 11.735 1.00 0.00 H new ATOM 826 N TYR A 54 0.314 -9.317 7.619 1.00 0.00 N ATOM 827 CA TYR A 54 -0.896 -8.511 7.716 1.00 0.00 C ATOM 828 C TYR A 54 -2.048 -9.311 8.315 1.00 0.00 C ATOM 829 O TYR A 54 -2.637 -8.913 9.316 1.00 0.00 O ATOM 830 CB TYR A 54 -1.290 -7.982 6.335 1.00 0.00 C ATOM 831 CG TYR A 54 -2.556 -7.153 6.340 1.00 0.00 C ATOM 832 CD1 TYR A 54 -2.510 -5.783 6.567 1.00 0.00 C ATOM 833 CD2 TYR A 54 -3.795 -7.741 6.120 1.00 0.00 C ATOM 834 CE1 TYR A 54 -3.664 -5.023 6.573 1.00 0.00 C ATOM 835 CE2 TYR A 54 -4.953 -6.988 6.125 1.00 0.00 C ATOM 836 CZ TYR A 54 -4.882 -5.630 6.352 1.00 0.00 C ATOM 837 OH TYR A 54 -6.033 -4.876 6.358 1.00 0.00 O ATOM 0 H TYR A 54 0.536 -9.630 6.674 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.687 -7.670 8.378 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.473 -7.379 5.940 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.421 -8.825 5.656 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -1.558 -5.305 6.741 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.854 -8.805 5.942 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -3.612 -3.959 6.750 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -5.909 -7.460 5.952 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.280 -4.649 5.437 1.00 0.00 H new ATOM 847 N ASP A 55 -2.369 -10.436 7.691 1.00 0.00 N ATOM 848 CA ASP A 55 -3.460 -11.286 8.154 1.00 0.00 C ATOM 849 C ASP A 55 -3.276 -11.707 9.612 1.00 0.00 C ATOM 850 O ASP A 55 -4.248 -12.012 10.302 1.00 0.00 O ATOM 851 CB ASP A 55 -3.572 -12.528 7.268 1.00 0.00 C ATOM 852 CG ASP A 55 -4.840 -13.315 7.533 1.00 0.00 C ATOM 853 OD1 ASP A 55 -5.835 -12.706 7.978 1.00 0.00 O ATOM 854 OD2 ASP A 55 -4.838 -14.542 7.296 1.00 0.00 O ATOM 0 H ASP A 55 -1.889 -10.783 6.861 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.379 -10.703 8.088 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.547 -12.227 6.221 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.707 -13.170 7.436 1.00 0.00 H new ATOM 859 N LYS A 56 -2.029 -11.751 10.067 1.00 0.00 N ATOM 860 CA LYS A 56 -1.734 -12.170 11.430 1.00 0.00 C ATOM 861 C LYS A 56 -1.720 -11.006 12.427 1.00 0.00 C ATOM 862 O LYS A 56 -1.709 -11.233 13.637 1.00 0.00 O ATOM 863 CB LYS A 56 -0.391 -12.899 11.476 1.00 0.00 C ATOM 864 CG LYS A 56 -0.315 -14.092 10.537 1.00 0.00 C ATOM 865 CD LYS A 56 -0.901 -15.342 11.174 1.00 0.00 C ATOM 866 CE LYS A 56 -2.394 -15.452 10.911 1.00 0.00 C ATOM 867 NZ LYS A 56 -2.827 -16.868 10.753 1.00 0.00 N ATOM 0 H LYS A 56 -1.209 -11.502 9.513 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.539 -12.840 11.730 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.403 -12.197 11.223 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.205 -13.237 12.495 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.852 -13.866 9.616 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.724 -14.275 10.263 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.395 -16.224 10.781 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.720 -15.323 12.249 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.942 -14.994 11.734 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.646 -14.893 10.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.851 -16.900 10.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.323 -17.298 9.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -2.610 -17.396 11.622 1.00 0.00 H new ATOM 881 N PHE A 57 -1.706 -9.767 11.937 1.00 0.00 N ATOM 882 CA PHE A 57 -1.676 -8.614 12.834 1.00 0.00 C ATOM 883 C PHE A 57 -2.686 -7.537 12.431 1.00 0.00 C ATOM 884 O PHE A 57 -2.737 -6.472 13.046 1.00 0.00 O ATOM 885 CB PHE A 57 -0.250 -8.035 12.903 1.00 0.00 C ATOM 886 CG PHE A 57 0.022 -6.880 11.972 1.00 0.00 C ATOM 887 CD1 PHE A 57 -0.511 -6.849 10.692 1.00 0.00 C ATOM 888 CD2 PHE A 57 0.814 -5.824 12.387 1.00 0.00 C ATOM 889 CE1 PHE A 57 -0.256 -5.784 9.847 1.00 0.00 C ATOM 890 CE2 PHE A 57 1.072 -4.758 11.546 1.00 0.00 C ATOM 891 CZ PHE A 57 0.536 -4.737 10.275 1.00 0.00 C ATOM 0 H PHE A 57 -1.715 -9.538 10.943 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.968 -8.960 13.826 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.057 -7.710 13.925 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.459 -8.833 12.683 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.132 -7.665 10.352 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.236 -5.833 13.381 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.676 -5.771 8.852 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.693 -3.942 11.884 1.00 0.00 H new ATOM 0 HZ PHE A 57 0.735 -3.904 9.617 1.00 0.00 H new ATOM 901 N HIS A 58 -3.474 -7.803 11.393 1.00 0.00 N ATOM 902 CA HIS A 58 -4.451 -6.833 10.927 1.00 0.00 C ATOM 903 C HIS A 58 -5.423 -6.441 12.038 1.00 0.00 C ATOM 904 O HIS A 58 -5.656 -5.259 12.281 1.00 0.00 O ATOM 905 CB HIS A 58 -5.221 -7.374 9.714 1.00 0.00 C ATOM 906 CG HIS A 58 -6.269 -8.388 10.057 1.00 0.00 C ATOM 907 ND1 HIS A 58 -6.038 -9.746 10.039 1.00 0.00 N ATOM 908 CD2 HIS A 58 -7.562 -8.234 10.430 1.00 0.00 C ATOM 909 CE1 HIS A 58 -7.142 -10.385 10.385 1.00 0.00 C ATOM 910 NE2 HIS A 58 -8.081 -9.489 10.628 1.00 0.00 N ATOM 0 H HIS A 58 -3.453 -8.675 10.865 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.905 -5.939 10.625 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.694 -6.540 9.196 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.512 -7.821 9.017 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -8.087 -7.298 10.549 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -7.257 -11.457 10.457 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -9.037 -9.696 10.916 1.00 0.00 H new ATOM 919 N GLU A 59 -5.992 -7.441 12.703 1.00 0.00 N ATOM 920 CA GLU A 59 -6.947 -7.202 13.779 1.00 0.00 C ATOM 921 C GLU A 59 -6.314 -6.443 14.939 1.00 0.00 C ATOM 922 O GLU A 59 -6.851 -5.439 15.407 1.00 0.00 O ATOM 923 CB GLU A 59 -7.497 -8.534 14.285 1.00 0.00 C ATOM 924 CG GLU A 59 -6.428 -9.583 14.551 1.00 0.00 C ATOM 925 CD GLU A 59 -6.141 -9.759 16.030 1.00 0.00 C ATOM 926 OE1 GLU A 59 -6.443 -8.830 16.808 1.00 0.00 O ATOM 927 OE2 GLU A 59 -5.614 -10.826 16.410 1.00 0.00 O ATOM 0 H GLU A 59 -5.808 -8.427 12.515 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.754 -6.590 13.376 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.056 -8.359 15.204 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.202 -8.926 13.552 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -6.747 -10.537 14.130 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -5.509 -9.299 14.037 1.00 0.00 H new ATOM 934 N SER A 60 -5.179 -6.941 15.402 1.00 0.00 N ATOM 935 CA SER A 60 -4.467 -6.328 16.519 1.00 0.00 C ATOM 936 C SER A 60 -4.154 -4.858 16.250 1.00 0.00 C ATOM 937 O SER A 60 -4.757 -3.967 16.848 1.00 0.00 O ATOM 938 CB SER A 60 -3.170 -7.090 16.799 1.00 0.00 C ATOM 939 OG SER A 60 -3.439 -8.408 17.244 1.00 0.00 O ATOM 0 H SER A 60 -4.727 -7.772 15.021 1.00 0.00 H new ATOM 0 HA SER A 60 -5.117 -6.380 17.392 1.00 0.00 H new ATOM 0 HB2 SER A 60 -2.563 -7.125 15.895 1.00 0.00 H new ATOM 0 HB3 SER A 60 -2.589 -6.560 17.553 1.00 0.00 H new ATOM 0 HG SER A 60 -2.594 -8.875 17.414 1.00 0.00 H new ATOM 945 N LYS A 61 -3.199 -4.615 15.360 1.00 0.00 N ATOM 946 CA LYS A 61 -2.791 -3.253 15.025 1.00 0.00 C ATOM 947 C LYS A 61 -3.880 -2.503 14.252 1.00 0.00 C ATOM 948 O LYS A 61 -3.790 -1.289 14.069 1.00 0.00 O ATOM 949 CB LYS A 61 -1.493 -3.279 14.215 1.00 0.00 C ATOM 950 CG LYS A 61 -0.278 -2.809 15.006 1.00 0.00 C ATOM 951 CD LYS A 61 0.815 -3.869 15.061 1.00 0.00 C ATOM 952 CE LYS A 61 0.292 -5.190 15.677 1.00 0.00 C ATOM 953 NZ LYS A 61 1.380 -6.195 15.826 1.00 0.00 N ATOM 0 H LYS A 61 -2.692 -5.343 14.856 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.626 -2.719 15.961 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.316 -4.294 13.859 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.610 -2.648 13.334 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.120 -1.901 14.553 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.584 -2.551 16.020 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.191 -4.059 14.056 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.654 -3.498 15.650 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.152 -4.987 16.652 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.497 -5.599 15.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 0.995 -7.149 15.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.125 -6.007 15.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 1.782 -6.132 16.783 1.00 0.00 H new ATOM 967 N ASN A 62 -4.909 -3.221 13.805 1.00 0.00 N ATOM 968 CA ASN A 62 -6.007 -2.607 13.063 1.00 0.00 C ATOM 969 C ASN A 62 -5.491 -1.711 11.937 1.00 0.00 C ATOM 970 O ASN A 62 -5.630 -0.489 11.991 1.00 0.00 O ATOM 971 CB ASN A 62 -6.884 -1.799 14.017 1.00 0.00 C ATOM 972 CG ASN A 62 -8.324 -1.710 13.547 1.00 0.00 C ATOM 973 OD1 ASN A 62 -8.969 -2.726 13.292 1.00 0.00 O ATOM 974 ND2 ASN A 62 -8.832 -0.490 13.427 1.00 0.00 N ATOM 0 H ASN A 62 -5.005 -4.227 13.944 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.597 -3.403 12.609 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.856 -2.255 15.006 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.475 -0.794 14.118 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -9.794 -0.367 13.112 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -8.260 0.325 13.650 1.00 0.00 H new ATOM 981 N PHE A 63 -4.902 -2.329 10.916 1.00 0.00 N ATOM 982 CA PHE A 63 -4.369 -1.590 9.773 1.00 0.00 C ATOM 983 C PHE A 63 -5.019 -2.054 8.473 1.00 0.00 C ATOM 984 O PHE A 63 -5.749 -3.046 8.451 1.00 0.00 O ATOM 985 CB PHE A 63 -2.850 -1.755 9.676 1.00 0.00 C ATOM 986 CG PHE A 63 -2.085 -1.196 10.848 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.641 -0.227 11.669 1.00 0.00 C ATOM 988 CD2 PHE A 63 -0.799 -1.637 11.119 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.933 0.287 12.738 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.085 -1.125 12.186 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.654 -0.162 12.996 1.00 0.00 C ATOM 0 H PHE A 63 -4.781 -3.340 10.856 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.600 -0.536 9.926 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.618 -2.816 9.579 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.502 -1.268 8.765 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.641 0.131 11.470 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.349 -2.390 10.489 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.380 1.039 13.371 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.916 -1.477 12.386 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.098 0.239 13.831 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.753 -1.328 7.390 1.00 0.00 N ATOM 1002 CA GLU A 64 -5.308 -1.656 6.092 1.00 0.00 C ATOM 1003 C GLU A 64 -4.279 -1.410 4.995 1.00 0.00 C ATOM 1004 O GLU A 64 -3.540 -0.427 5.023 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.559 -0.821 5.824 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.501 -1.437 4.805 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.849 -2.879 5.123 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -8.701 -3.103 6.007 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -7.268 -3.784 4.487 1.00 0.00 O ATOM 0 H GLU A 64 -4.152 -0.504 7.393 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.578 -2.712 6.092 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.096 -0.678 6.761 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -6.257 0.167 5.475 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -8.417 -0.848 4.761 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.043 -1.388 3.817 1.00 0.00 H new ATOM 1016 N VAL A 65 -4.242 -2.315 4.036 1.00 0.00 N ATOM 1017 CA VAL A 65 -3.312 -2.222 2.913 1.00 0.00 C ATOM 1018 C VAL A 65 -4.054 -1.965 1.604 1.00 0.00 C ATOM 1019 O VAL A 65 -4.936 -2.732 1.219 1.00 0.00 O ATOM 1020 CB VAL A 65 -2.475 -3.510 2.767 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.479 -3.384 1.617 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.762 -3.835 4.071 1.00 0.00 C ATOM 0 H VAL A 65 -4.850 -3.134 4.008 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.647 -1.385 3.123 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.151 -4.333 2.535 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.901 -4.304 1.534 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -2.018 -3.209 0.686 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.806 -2.548 1.809 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.177 -4.746 3.948 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.100 -3.012 4.338 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.498 -3.980 4.862 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.683 -0.887 0.920 1.00 0.00 N ATOM 1033 CA VAL A 66 -4.306 -0.538 -0.352 1.00 0.00 C ATOM 1034 C VAL A 66 -3.405 -0.937 -1.518 1.00 0.00 C ATOM 1035 O VAL A 66 -2.185 -0.795 -1.442 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.607 0.970 -0.438 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -5.387 1.289 -1.704 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -5.366 1.436 0.796 1.00 0.00 C ATOM 0 H VAL A 66 -2.955 -0.241 1.225 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.247 -1.086 -0.412 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.660 1.508 -0.478 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.590 2.359 -1.746 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.802 0.996 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.329 0.741 -1.699 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.569 2.504 0.716 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.308 0.892 0.871 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.766 1.246 1.686 1.00 0.00 H new ATOM 1048 N PHE A 67 -4.004 -1.445 -2.594 1.00 0.00 N ATOM 1049 CA PHE A 67 -3.232 -1.867 -3.756 1.00 0.00 C ATOM 1050 C PHE A 67 -2.934 -0.697 -4.689 1.00 0.00 C ATOM 1051 O PHE A 67 -3.825 0.070 -5.053 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.976 -2.965 -4.524 1.00 0.00 C ATOM 1053 CG PHE A 67 -3.529 -3.118 -5.956 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -2.181 -3.124 -6.277 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -4.457 -3.252 -6.977 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -1.766 -3.262 -7.588 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -4.048 -3.390 -8.290 1.00 0.00 C ATOM 1058 CZ PHE A 67 -2.701 -3.396 -8.596 1.00 0.00 C ATOM 0 H PHE A 67 -5.012 -1.573 -2.683 1.00 0.00 H new ATOM 0 HA PHE A 67 -2.283 -2.260 -3.391 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.837 -3.914 -4.007 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -5.044 -2.746 -4.508 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.446 -3.020 -5.493 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -5.512 -3.249 -6.744 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.712 -3.265 -7.824 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -4.781 -3.493 -9.076 1.00 0.00 H new ATOM 0 HZ PHE A 67 -2.379 -3.505 -9.621 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.674 -0.595 -5.094 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.241 0.444 -6.014 1.00 0.00 C ATOM 1070 C CYS A 68 -0.669 -0.202 -7.269 1.00 0.00 C ATOM 1071 O CYS A 68 0.413 -0.786 -7.240 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.194 1.346 -5.363 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.892 2.697 -4.383 1.00 0.00 S ATOM 0 H CYS A 68 -0.930 -1.226 -4.796 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.100 1.061 -6.278 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.445 0.739 -4.722 1.00 0.00 H new ATOM 0 HB3 CYS A 68 0.442 1.767 -6.141 1.00 0.00 H new ATOM 0 HG CYS A 68 -0.007 3.640 -4.251 1.00 0.00 H new ATOM 1079 N THR A 69 -1.410 -0.120 -8.363 1.00 0.00 N ATOM 1080 CA THR A 69 -0.976 -0.725 -9.615 1.00 0.00 C ATOM 1081 C THR A 69 0.102 0.109 -10.301 1.00 0.00 C ATOM 1082 O THR A 69 0.244 1.305 -10.046 1.00 0.00 O ATOM 1083 CB THR A 69 -2.168 -0.922 -10.557 1.00 0.00 C ATOM 1084 OG1 THR A 69 -1.839 -1.828 -11.595 1.00 0.00 O ATOM 1085 CG2 THR A 69 -2.637 0.361 -11.203 1.00 0.00 C ATOM 0 H THR A 69 -2.310 0.357 -8.411 1.00 0.00 H new ATOM 0 HA THR A 69 -0.545 -1.697 -9.376 1.00 0.00 H new ATOM 0 HB THR A 69 -2.971 -1.310 -9.931 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.548 -1.822 -12.271 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.483 0.151 -11.857 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.942 1.067 -10.431 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.824 0.792 -11.788 1.00 0.00 H new ATOM 1093 N TRP A 70 0.851 -0.543 -11.178 1.00 0.00 N ATOM 1094 CA TRP A 70 1.922 0.110 -11.925 1.00 0.00 C ATOM 1095 C TRP A 70 1.994 -0.431 -13.353 1.00 0.00 C ATOM 1096 O TRP A 70 3.078 -0.575 -13.920 1.00 0.00 O ATOM 1097 CB TRP A 70 3.263 -0.099 -11.217 1.00 0.00 C ATOM 1098 CG TRP A 70 3.766 1.129 -10.523 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.334 1.630 -9.330 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.796 2.012 -10.982 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.034 2.769 -9.017 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.937 3.026 -10.015 1.00 0.00 C ATOM 1103 CE3 TRP A 70 5.614 2.045 -12.116 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.861 4.059 -10.148 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 6.531 3.070 -12.246 1.00 0.00 C ATOM 1106 CH2 TRP A 70 6.649 4.065 -11.266 1.00 0.00 C ATOM 0 H TRP A 70 0.737 -1.534 -11.393 1.00 0.00 H new ATOM 0 HA TRP A 70 1.706 1.177 -11.971 1.00 0.00 H new ATOM 0 HB2 TRP A 70 3.159 -0.903 -10.488 1.00 0.00 H new ATOM 0 HB3 TRP A 70 4.004 -0.424 -11.947 1.00 0.00 H new ATOM 0 HD1 TRP A 70 2.556 1.195 -8.721 1.00 0.00 H new ATOM 0 HE1 TRP A 70 3.903 3.333 -8.177 1.00 0.00 H new ATOM 0 HE3 TRP A 70 5.530 1.283 -12.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.952 4.828 -9.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 7.168 3.105 -13.118 1.00 0.00 H new ATOM 0 HH2 TRP A 70 7.377 4.852 -11.396 1.00 0.00 H new ATOM 1117 N ASP A 71 0.833 -0.733 -13.928 1.00 0.00 N ATOM 1118 CA ASP A 71 0.761 -1.264 -15.283 1.00 0.00 C ATOM 1119 C ASP A 71 0.475 -0.155 -16.291 1.00 0.00 C ATOM 1120 O ASP A 71 0.274 1.001 -15.918 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.327 -2.335 -15.372 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.135 -3.438 -14.349 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.237 -3.148 -13.138 1.00 0.00 O ATOM 1124 OD2 ASP A 71 0.116 -4.590 -14.759 1.00 0.00 O ATOM 0 H ASP A 71 -0.073 -0.618 -13.473 1.00 0.00 H new ATOM 0 HA ASP A 71 1.727 -1.709 -15.523 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.303 -1.872 -15.224 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.327 -2.767 -16.373 1.00 0.00 H new ATOM 1129 N GLU A 72 0.456 -0.517 -17.569 1.00 0.00 N ATOM 1130 CA GLU A 72 0.190 0.441 -18.633 1.00 0.00 C ATOM 1131 C GLU A 72 -1.188 0.206 -19.243 1.00 0.00 C ATOM 1132 O GLU A 72 -1.827 1.135 -19.736 1.00 0.00 O ATOM 1133 CB GLU A 72 1.264 0.341 -19.718 1.00 0.00 C ATOM 1134 CG GLU A 72 1.483 -1.073 -20.229 1.00 0.00 C ATOM 1135 CD GLU A 72 2.727 -1.718 -19.650 1.00 0.00 C ATOM 1136 OE1 GLU A 72 3.125 -1.336 -18.528 1.00 0.00 O ATOM 1137 OE2 GLU A 72 3.304 -2.602 -20.316 1.00 0.00 O ATOM 0 H GLU A 72 0.622 -1.470 -17.893 1.00 0.00 H new ATOM 0 HA GLU A 72 0.211 1.442 -18.201 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.984 0.981 -20.555 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.204 0.725 -19.323 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.614 -1.683 -19.982 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.561 -1.054 -21.316 1.00 0.00 H new ATOM 1144 N GLU A 73 -1.641 -1.044 -19.204 1.00 0.00 N ATOM 1145 CA GLU A 73 -2.945 -1.403 -19.751 1.00 0.00 C ATOM 1146 C GLU A 73 -3.868 -1.929 -18.657 1.00 0.00 C ATOM 1147 O GLU A 73 -3.410 -2.365 -17.600 1.00 0.00 O ATOM 1148 CB GLU A 73 -2.787 -2.455 -20.851 1.00 0.00 C ATOM 1149 CG GLU A 73 -3.786 -2.303 -21.986 1.00 0.00 C ATOM 1150 CD GLU A 73 -3.331 -2.986 -23.260 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -2.115 -3.241 -23.394 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -4.188 -3.267 -24.123 1.00 0.00 O ATOM 0 H GLU A 73 -1.124 -1.825 -18.799 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.392 -0.505 -20.177 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.777 -2.396 -21.257 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -2.896 -3.447 -20.412 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.745 -2.719 -21.678 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.947 -1.243 -22.184 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.170 -1.884 -18.918 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.161 -2.354 -17.957 1.00 0.00 C ATOM 1161 C GLU A 74 -6.166 -3.879 -17.872 1.00 0.00 C ATOM 1162 O GLU A 74 -6.550 -4.452 -16.853 1.00 0.00 O ATOM 1163 CB GLU A 74 -7.553 -1.851 -18.343 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.633 -0.342 -18.500 1.00 0.00 C ATOM 1165 CD GLU A 74 -8.748 0.090 -19.432 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -8.538 0.059 -20.663 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.830 0.459 -18.931 1.00 0.00 O ATOM 0 H GLU A 74 -5.564 -1.526 -19.788 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.894 -1.957 -16.978 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.853 -2.322 -19.279 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.268 -2.167 -17.583 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.786 0.114 -17.522 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -6.682 0.031 -18.880 1.00 0.00 H new ATOM 1174 N ASP A 75 -5.743 -4.532 -18.952 1.00 0.00 N ATOM 1175 CA ASP A 75 -5.705 -5.990 -19.000 1.00 0.00 C ATOM 1176 C ASP A 75 -4.878 -6.561 -17.851 1.00 0.00 C ATOM 1177 O ASP A 75 -5.271 -7.543 -17.221 1.00 0.00 O ATOM 1178 CB ASP A 75 -5.130 -6.461 -20.337 1.00 0.00 C ATOM 1179 CG ASP A 75 -5.263 -7.958 -20.529 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -6.107 -8.573 -19.843 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -4.524 -8.518 -21.365 1.00 0.00 O ATOM 0 H ASP A 75 -5.422 -4.074 -19.805 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.728 -6.354 -18.899 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.641 -5.946 -21.151 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.078 -6.182 -20.395 1.00 0.00 H new ATOM 1186 N GLY A 76 -3.732 -5.944 -17.583 1.00 0.00 N ATOM 1187 CA GLY A 76 -2.874 -6.413 -16.509 1.00 0.00 C ATOM 1188 C GLY A 76 -3.532 -6.295 -15.148 1.00 0.00 C ATOM 1189 O GLY A 76 -3.655 -7.282 -14.424 1.00 0.00 O ATOM 0 H GLY A 76 -3.382 -5.130 -18.088 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.606 -7.454 -16.691 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.947 -5.840 -16.512 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.958 -5.085 -14.803 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.612 -4.832 -13.521 1.00 0.00 C ATOM 1195 C PHE A 77 -5.770 -5.805 -13.290 1.00 0.00 C ATOM 1196 O PHE A 77 -6.129 -6.097 -12.149 1.00 0.00 O ATOM 1197 CB PHE A 77 -5.115 -3.382 -13.473 1.00 0.00 C ATOM 1198 CG PHE A 77 -6.100 -3.104 -12.370 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -7.434 -3.451 -12.512 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -5.692 -2.492 -11.196 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -8.343 -3.192 -11.503 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -6.597 -2.231 -10.184 1.00 0.00 C ATOM 1203 CZ PHE A 77 -7.924 -2.582 -10.338 1.00 0.00 C ATOM 0 H PHE A 77 -3.862 -4.260 -15.395 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.883 -4.987 -12.725 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.259 -2.717 -13.356 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.580 -3.139 -14.429 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -7.767 -3.929 -13.421 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -4.656 -2.216 -11.070 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -9.380 -3.467 -11.626 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -6.267 -1.753 -9.274 1.00 0.00 H new ATOM 0 HZ PHE A 77 -8.632 -2.380 -9.548 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.351 -6.295 -14.378 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.473 -7.226 -14.297 1.00 0.00 C ATOM 1215 C ALA A 78 -7.012 -8.628 -13.950 1.00 0.00 C ATOM 1216 O ALA A 78 -7.461 -9.219 -12.969 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.161 -7.271 -15.629 1.00 0.00 C ATOM 0 H ALA A 78 -6.064 -6.064 -15.329 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.146 -6.878 -13.513 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.001 -7.963 -15.581 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.525 -6.276 -15.884 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.457 -7.607 -16.391 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.077 -9.137 -14.742 1.00 0.00 N ATOM 1224 CA GLY A 79 -5.531 -10.444 -14.481 1.00 0.00 C ATOM 1225 C GLY A 79 -4.703 -10.396 -13.228 1.00 0.00 C ATOM 1226 O GLY A 79 -4.351 -11.423 -12.647 1.00 0.00 O ATOM 0 H GLY A 79 -5.691 -8.664 -15.559 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.335 -11.171 -14.371 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.919 -10.770 -15.322 1.00 0.00 H new ATOM 1230 N TYR A 80 -4.393 -9.169 -12.818 1.00 0.00 N ATOM 1231 CA TYR A 80 -3.593 -8.941 -11.618 1.00 0.00 C ATOM 1232 C TYR A 80 -4.461 -8.926 -10.359 1.00 0.00 C ATOM 1233 O TYR A 80 -3.944 -8.853 -9.246 1.00 0.00 O ATOM 1234 CB TYR A 80 -2.826 -7.623 -11.733 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.755 -7.449 -10.679 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -0.934 -8.509 -10.313 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.563 -6.225 -10.052 1.00 0.00 C ATOM 1238 CE1 TYR A 80 0.046 -8.354 -9.351 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.585 -6.062 -9.089 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.216 -7.130 -8.743 1.00 0.00 C ATOM 1241 OH TYR A 80 1.191 -6.971 -7.785 1.00 0.00 O ATOM 0 H TYR A 80 -4.683 -8.318 -13.299 1.00 0.00 H new ATOM 0 HA TYR A 80 -2.885 -9.766 -11.533 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.365 -7.566 -12.719 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.531 -6.795 -11.662 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -1.064 -9.470 -10.788 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.188 -5.387 -10.321 1.00 0.00 H new ATOM 0 HE1 TYR A 80 0.675 -9.188 -9.077 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -0.449 -5.104 -8.610 1.00 0.00 H new ATOM 0 HH TYR A 80 1.936 -7.580 -7.972 1.00 0.00 H new ATOM 1251 N PHE A 81 -5.778 -8.992 -10.541 1.00 0.00 N ATOM 1252 CA PHE A 81 -6.713 -8.980 -9.417 1.00 0.00 C ATOM 1253 C PHE A 81 -6.368 -10.052 -8.383 1.00 0.00 C ATOM 1254 O PHE A 81 -6.733 -9.935 -7.213 1.00 0.00 O ATOM 1255 CB PHE A 81 -8.143 -9.187 -9.919 1.00 0.00 C ATOM 1256 CG PHE A 81 -9.188 -8.951 -8.866 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -9.405 -9.884 -7.865 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -9.955 -7.796 -8.879 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -10.365 -9.670 -6.895 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -10.918 -7.577 -7.912 1.00 0.00 C ATOM 1261 CZ PHE A 81 -11.123 -8.515 -6.919 1.00 0.00 C ATOM 0 H PHE A 81 -6.223 -9.054 -11.457 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.633 -8.007 -8.932 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -8.326 -8.516 -10.758 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.243 -10.204 -10.297 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -8.817 -10.789 -7.843 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -9.798 -7.059 -9.653 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -10.523 -10.404 -6.119 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -11.509 -6.674 -7.933 1.00 0.00 H new ATOM 0 HZ PHE A 81 -11.875 -8.346 -6.162 1.00 0.00 H new ATOM 1271 N ALA A 82 -5.667 -11.096 -8.817 1.00 0.00 N ATOM 1272 CA ALA A 82 -5.280 -12.187 -7.924 1.00 0.00 C ATOM 1273 C ALA A 82 -4.589 -11.666 -6.663 1.00 0.00 C ATOM 1274 O ALA A 82 -4.594 -12.327 -5.625 1.00 0.00 O ATOM 1275 CB ALA A 82 -4.373 -13.166 -8.655 1.00 0.00 C ATOM 0 H ALA A 82 -5.355 -11.211 -9.781 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.189 -12.702 -7.614 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -4.091 -13.974 -7.980 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -4.901 -13.579 -9.515 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -3.476 -12.647 -8.994 1.00 0.00 H new ATOM 1281 N LYS A 83 -3.996 -10.481 -6.765 1.00 0.00 N ATOM 1282 CA LYS A 83 -3.298 -9.867 -5.637 1.00 0.00 C ATOM 1283 C LYS A 83 -4.203 -9.763 -4.410 1.00 0.00 C ATOM 1284 O LYS A 83 -5.311 -10.301 -4.393 1.00 0.00 O ATOM 1285 CB LYS A 83 -2.799 -8.473 -6.033 1.00 0.00 C ATOM 1286 CG LYS A 83 -3.899 -7.552 -6.545 1.00 0.00 C ATOM 1287 CD LYS A 83 -4.839 -7.126 -5.426 1.00 0.00 C ATOM 1288 CE LYS A 83 -5.610 -5.862 -5.774 1.00 0.00 C ATOM 1289 NZ LYS A 83 -5.855 -5.733 -7.239 1.00 0.00 N ATOM 0 H LYS A 83 -3.984 -9.924 -7.619 1.00 0.00 H new ATOM 0 HA LYS A 83 -2.451 -10.502 -5.378 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.321 -8.009 -5.170 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.035 -8.576 -6.804 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.452 -6.669 -7.001 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -4.467 -8.061 -7.324 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.542 -7.933 -5.217 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -4.265 -6.960 -4.515 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -6.564 -5.865 -5.247 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -5.055 -4.992 -5.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.822 -5.385 -7.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -5.173 -5.062 -7.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -5.742 -6.662 -7.693 1.00 0.00 H new ATOM 1303 N MET A 84 -3.727 -9.051 -3.391 1.00 0.00 N ATOM 1304 CA MET A 84 -4.489 -8.854 -2.164 1.00 0.00 C ATOM 1305 C MET A 84 -5.694 -7.943 -2.426 1.00 0.00 C ATOM 1306 O MET A 84 -5.531 -6.782 -2.799 1.00 0.00 O ATOM 1307 CB MET A 84 -3.597 -8.239 -1.088 1.00 0.00 C ATOM 1308 CG MET A 84 -2.319 -9.016 -0.831 1.00 0.00 C ATOM 1309 SD MET A 84 -0.898 -8.331 -1.706 1.00 0.00 S ATOM 1310 CE MET A 84 -0.607 -9.606 -2.930 1.00 0.00 C ATOM 0 H MET A 84 -2.812 -8.600 -3.393 1.00 0.00 H new ATOM 0 HA MET A 84 -4.850 -9.823 -1.818 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.339 -7.221 -1.382 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.161 -8.169 -0.158 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.112 -9.023 0.239 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.462 -10.053 -1.135 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.420 -9.963 -2.847 1.00 0.00 H new ATOM 0 HE2 MET A 84 -1.294 -10.435 -2.762 1.00 0.00 H new ATOM 0 HE3 MET A 84 -0.769 -9.197 -3.927 1.00 0.00 H new ATOM 1320 N PRO A 85 -6.922 -8.465 -2.262 1.00 0.00 N ATOM 1321 CA PRO A 85 -8.150 -7.700 -2.517 1.00 0.00 C ATOM 1322 C PRO A 85 -8.557 -6.744 -1.396 1.00 0.00 C ATOM 1323 O PRO A 85 -9.499 -5.969 -1.560 1.00 0.00 O ATOM 1324 CB PRO A 85 -9.204 -8.791 -2.650 1.00 0.00 C ATOM 1325 CG PRO A 85 -8.712 -9.908 -1.796 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.210 -9.853 -1.851 1.00 0.00 C ATOM 0 HA PRO A 85 -8.020 -7.053 -3.384 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -10.180 -8.439 -2.316 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -9.316 -9.107 -3.687 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.068 -9.799 -0.771 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.079 -10.867 -2.161 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.766 -10.084 -0.883 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.809 -10.573 -2.565 1.00 0.00 H new ATOM 1334 N TRP A 86 -7.881 -6.824 -0.253 1.00 0.00 N ATOM 1335 CA TRP A 86 -8.215 -5.979 0.905 1.00 0.00 C ATOM 1336 C TRP A 86 -8.793 -4.612 0.497 1.00 0.00 C ATOM 1337 O TRP A 86 -10.006 -4.421 0.551 1.00 0.00 O ATOM 1338 CB TRP A 86 -7.020 -5.817 1.857 1.00 0.00 C ATOM 1339 CG TRP A 86 -5.668 -5.759 1.194 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.341 -5.184 -0.004 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -4.454 -6.313 1.712 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -3.999 -5.320 -0.245 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.431 -6.021 0.790 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -4.133 -7.024 2.872 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.112 -6.418 0.993 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -2.824 -7.418 3.071 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.829 -7.115 2.136 1.00 0.00 C ATOM 0 H TRP A 86 -7.100 -7.461 -0.098 1.00 0.00 H new ATOM 0 HA TRP A 86 -9.002 -6.504 1.446 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -7.161 -4.905 2.437 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -7.024 -6.648 2.563 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.040 -4.693 -0.665 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.503 -4.959 -1.060 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -4.895 -7.261 3.600 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.340 -6.184 0.274 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -2.565 -7.969 3.963 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.815 -7.438 2.320 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.949 -3.673 0.070 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.422 -2.369 -0.351 1.00 0.00 C ATOM 1360 C LEU A 87 -7.653 -1.924 -1.588 1.00 0.00 C ATOM 1361 O LEU A 87 -6.444 -2.132 -1.679 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.266 -1.340 0.772 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.544 -1.042 1.563 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.278 0.006 2.633 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.651 -0.580 0.626 1.00 0.00 C ATOM 0 H LEU A 87 -6.938 -3.797 0.009 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.483 -2.443 -0.592 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.503 -1.694 1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -7.898 -0.409 0.342 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.868 -1.959 2.055 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.197 0.205 3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.515 -0.361 3.320 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.931 0.926 2.163 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.552 -0.372 1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.335 0.325 0.108 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.860 -1.362 -0.104 1.00 0.00 H new ATOM 1377 N ALA A 88 -8.348 -1.344 -2.555 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.703 -0.915 -3.779 1.00 0.00 C ATOM 1379 C ALA A 88 -8.378 0.307 -4.388 1.00 0.00 C ATOM 1380 O ALA A 88 -9.577 0.521 -4.214 1.00 0.00 O ATOM 1381 CB ALA A 88 -7.727 -2.063 -4.756 1.00 0.00 C ATOM 0 H ALA A 88 -9.351 -1.162 -2.514 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.678 -0.626 -3.549 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.245 -1.760 -5.686 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.193 -2.913 -4.331 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.760 -2.347 -4.958 1.00 0.00 H new ATOM 1387 N VAL A 89 -7.598 1.096 -5.117 1.00 0.00 N ATOM 1388 CA VAL A 89 -8.118 2.289 -5.774 1.00 0.00 C ATOM 1389 C VAL A 89 -8.632 1.944 -7.170 1.00 0.00 C ATOM 1390 O VAL A 89 -7.877 1.452 -8.009 1.00 0.00 O ATOM 1391 CB VAL A 89 -7.044 3.390 -5.894 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.634 4.650 -6.517 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -6.439 3.694 -4.532 1.00 0.00 C ATOM 0 H VAL A 89 -6.603 0.931 -5.268 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.934 2.666 -5.157 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.250 3.028 -6.548 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.861 5.415 -6.593 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.016 4.420 -7.512 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.448 5.018 -5.892 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.683 4.473 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -7.222 4.035 -3.854 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.978 2.792 -4.129 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.924 2.195 -7.447 1.00 0.00 N ATOM 1404 CA PRO A 90 -10.513 1.901 -8.755 1.00 0.00 C ATOM 1405 C PRO A 90 -9.780 2.616 -9.883 1.00 0.00 C ATOM 1406 O PRO A 90 -9.221 3.695 -9.685 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.955 2.413 -8.638 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.959 3.315 -7.450 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.907 2.782 -6.523 1.00 0.00 C ATOM 0 HA PRO A 90 -10.454 0.840 -8.997 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -12.256 2.948 -9.539 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.656 1.588 -8.508 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.740 4.343 -7.740 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.937 3.321 -6.968 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -10.468 3.572 -5.913 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -11.312 2.038 -5.837 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.785 2.011 -11.068 1.00 0.00 N ATOM 1418 CA PHE A 91 -9.118 2.594 -12.228 1.00 0.00 C ATOM 1419 C PHE A 91 -9.486 4.067 -12.385 1.00 0.00 C ATOM 1420 O PHE A 91 -8.704 4.862 -12.904 1.00 0.00 O ATOM 1421 CB PHE A 91 -9.488 1.821 -13.497 1.00 0.00 C ATOM 1422 CG PHE A 91 -8.298 1.363 -14.290 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -7.623 2.243 -15.120 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -7.853 0.054 -14.204 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -6.527 1.825 -15.852 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -6.759 -0.370 -14.932 1.00 0.00 C ATOM 1427 CZ PHE A 91 -6.094 0.516 -15.757 1.00 0.00 C ATOM 0 H PHE A 91 -10.243 1.118 -11.250 1.00 0.00 H new ATOM 0 HA PHE A 91 -8.042 2.524 -12.071 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -10.087 0.953 -13.222 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.113 2.453 -14.128 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.957 3.267 -15.196 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -8.368 -0.643 -13.560 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.010 2.520 -16.497 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.423 -1.394 -14.856 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.238 0.187 -16.327 1.00 0.00 H new ATOM 1437 N ALA A 92 -10.686 4.419 -11.933 1.00 0.00 N ATOM 1438 CA ALA A 92 -11.168 5.793 -12.020 1.00 0.00 C ATOM 1439 C ALA A 92 -10.165 6.788 -11.435 1.00 0.00 C ATOM 1440 O ALA A 92 -10.010 7.894 -11.953 1.00 0.00 O ATOM 1441 CB ALA A 92 -12.509 5.922 -11.316 1.00 0.00 C ATOM 0 H ALA A 92 -11.344 3.770 -11.502 1.00 0.00 H new ATOM 0 HA ALA A 92 -11.289 6.034 -13.076 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.860 6.952 -11.387 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -13.233 5.259 -11.789 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.397 5.648 -10.267 1.00 0.00 H new ATOM 1447 N GLN A 93 -9.490 6.401 -10.352 1.00 0.00 N ATOM 1448 CA GLN A 93 -8.516 7.280 -9.714 1.00 0.00 C ATOM 1449 C GLN A 93 -7.105 6.706 -9.794 1.00 0.00 C ATOM 1450 O GLN A 93 -6.237 7.072 -9.001 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.889 7.517 -8.251 1.00 0.00 C ATOM 1452 CG GLN A 93 -10.371 7.774 -8.031 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.872 8.981 -8.801 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -10.179 9.992 -8.914 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -12.085 8.881 -9.333 1.00 0.00 N ATOM 0 H GLN A 93 -9.600 5.492 -9.903 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.531 8.228 -10.252 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -8.589 6.649 -7.664 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -8.322 8.368 -7.874 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.938 6.893 -8.333 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.557 7.923 -6.967 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.625 8.024 -9.214 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -12.477 9.662 -9.860 1.00 0.00 H new ATOM 1464 N SER A 94 -6.873 5.813 -10.750 1.00 0.00 N ATOM 1465 CA SER A 94 -5.555 5.211 -10.912 1.00 0.00 C ATOM 1466 C SER A 94 -4.491 6.289 -11.103 1.00 0.00 C ATOM 1467 O SER A 94 -3.314 6.071 -10.819 1.00 0.00 O ATOM 1468 CB SER A 94 -5.543 4.245 -12.098 1.00 0.00 C ATOM 1469 OG SER A 94 -5.346 4.936 -13.319 1.00 0.00 O ATOM 0 H SER A 94 -7.573 5.492 -11.419 1.00 0.00 H new ATOM 0 HA SER A 94 -5.326 4.651 -10.005 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.751 3.508 -11.962 1.00 0.00 H new ATOM 0 HB3 SER A 94 -6.485 3.698 -12.134 1.00 0.00 H new ATOM 0 HG SER A 94 -5.341 4.295 -14.060 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.917 7.458 -11.578 1.00 0.00 N ATOM 1476 CA GLU A 95 -4.004 8.573 -11.795 1.00 0.00 C ATOM 1477 C GLU A 95 -3.262 8.912 -10.507 1.00 0.00 C ATOM 1478 O GLU A 95 -2.118 9.365 -10.537 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.768 9.799 -12.298 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.876 10.996 -12.584 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.274 11.729 -13.851 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -5.475 11.720 -14.190 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -3.383 12.313 -14.503 1.00 0.00 O ATOM 0 H GLU A 95 -5.888 7.655 -11.819 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.277 8.279 -12.552 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.307 9.533 -13.207 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.514 10.082 -11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.918 11.686 -11.741 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.842 10.662 -12.671 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.922 8.681 -9.375 1.00 0.00 N ATOM 1491 CA ALA A 96 -3.325 8.951 -8.075 1.00 0.00 C ATOM 1492 C ALA A 96 -2.057 8.136 -7.886 1.00 0.00 C ATOM 1493 O ALA A 96 -1.050 8.639 -7.403 1.00 0.00 O ATOM 1494 CB ALA A 96 -4.304 8.628 -6.960 1.00 0.00 C ATOM 0 H ALA A 96 -4.870 8.307 -9.334 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.075 10.011 -8.036 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.839 8.836 -5.996 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -5.198 9.241 -7.072 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.578 7.574 -7.010 1.00 0.00 H new ATOM 1500 N VAL A 97 -2.125 6.871 -8.271 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.996 5.961 -8.148 1.00 0.00 C ATOM 1502 C VAL A 97 0.222 6.486 -8.893 1.00 0.00 C ATOM 1503 O VAL A 97 1.362 6.266 -8.485 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.374 4.575 -8.685 1.00 0.00 C ATOM 1505 CG1 VAL A 97 -0.179 3.639 -8.641 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.547 4.025 -7.889 1.00 0.00 C ATOM 0 H VAL A 97 -2.960 6.447 -8.676 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.743 5.885 -7.091 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.677 4.661 -9.729 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.468 2.661 -9.026 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.625 4.047 -9.253 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.165 3.536 -7.612 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.816 3.040 -8.271 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.268 3.943 -6.839 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.400 4.697 -7.986 1.00 0.00 H new ATOM 1516 N GLN A 98 -0.037 7.181 -9.982 1.00 0.00 N ATOM 1517 CA GLN A 98 1.022 7.754 -10.804 1.00 0.00 C ATOM 1518 C GLN A 98 1.798 8.811 -10.034 1.00 0.00 C ATOM 1519 O GLN A 98 3.023 8.752 -9.919 1.00 0.00 O ATOM 1520 CB GLN A 98 0.408 8.407 -12.038 1.00 0.00 C ATOM 1521 CG GLN A 98 -0.428 7.458 -12.882 1.00 0.00 C ATOM 1522 CD GLN A 98 0.185 7.191 -14.243 1.00 0.00 C ATOM 1523 OE1 GLN A 98 0.272 6.045 -14.684 1.00 0.00 O ATOM 1524 NE2 GLN A 98 0.615 8.251 -14.916 1.00 0.00 N ATOM 0 H GLN A 98 -0.980 7.367 -10.325 1.00 0.00 H new ATOM 0 HA GLN A 98 1.702 6.952 -11.091 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.216 9.243 -11.723 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.206 8.820 -12.655 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.547 6.514 -12.350 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.425 7.878 -13.013 1.00 0.00 H new ATOM 0 HE21 GLN A 98 0.523 9.183 -14.512 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.037 8.133 -15.837 1.00 0.00 H new ATOM 1533 N LYS A 99 1.062 9.786 -9.527 1.00 0.00 N ATOM 1534 CA LYS A 99 1.649 10.892 -8.776 1.00 0.00 C ATOM 1535 C LYS A 99 1.926 10.517 -7.320 1.00 0.00 C ATOM 1536 O LYS A 99 2.908 10.975 -6.736 1.00 0.00 O ATOM 1537 CB LYS A 99 0.756 12.139 -8.863 1.00 0.00 C ATOM 1538 CG LYS A 99 -0.512 12.073 -8.026 1.00 0.00 C ATOM 1539 CD LYS A 99 -0.796 13.401 -7.342 1.00 0.00 C ATOM 1540 CE LYS A 99 0.045 13.572 -6.087 1.00 0.00 C ATOM 1541 NZ LYS A 99 -0.429 12.700 -4.977 1.00 0.00 N ATOM 0 H LYS A 99 0.048 9.837 -9.621 1.00 0.00 H new ATOM 0 HA LYS A 99 2.611 11.121 -9.234 1.00 0.00 H new ATOM 0 HB2 LYS A 99 1.336 13.007 -8.551 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.479 12.299 -9.905 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -1.355 11.802 -8.661 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.414 11.289 -7.275 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -0.591 14.219 -8.033 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -1.853 13.460 -7.084 1.00 0.00 H new ATOM 0 HE2 LYS A 99 1.085 13.339 -6.313 1.00 0.00 H new ATOM 0 HE3 LYS A 99 0.014 14.614 -5.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -0.049 13.050 -4.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.468 12.714 -4.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -0.101 11.726 -5.136 1.00 0.00 H new ATOM 1555 N LEU A 100 1.068 9.687 -6.734 1.00 0.00 N ATOM 1556 CA LEU A 100 1.252 9.271 -5.347 1.00 0.00 C ATOM 1557 C LEU A 100 2.462 8.348 -5.214 1.00 0.00 C ATOM 1558 O LEU A 100 3.097 8.294 -4.162 1.00 0.00 O ATOM 1559 CB LEU A 100 -0.010 8.580 -4.809 1.00 0.00 C ATOM 1560 CG LEU A 100 0.179 7.815 -3.506 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.542 8.779 -2.394 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -1.083 7.032 -3.165 1.00 0.00 C ATOM 0 H LEU A 100 0.246 9.292 -7.192 1.00 0.00 H new ATOM 0 HA LEU A 100 1.433 10.165 -4.751 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.783 9.334 -4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.379 7.890 -5.568 1.00 0.00 H new ATOM 0 HG LEU A 100 0.994 7.101 -3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.676 8.227 -1.464 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.469 9.294 -2.647 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.257 9.510 -2.270 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.934 6.490 -2.231 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.920 7.721 -3.055 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.299 6.324 -3.965 1.00 0.00 H new ATOM 1574 N SER A 101 2.779 7.627 -6.287 1.00 0.00 N ATOM 1575 CA SER A 101 3.917 6.714 -6.279 1.00 0.00 C ATOM 1576 C SER A 101 5.231 7.486 -6.279 1.00 0.00 C ATOM 1577 O SER A 101 6.126 7.211 -5.479 1.00 0.00 O ATOM 1578 CB SER A 101 3.861 5.781 -7.490 1.00 0.00 C ATOM 1579 OG SER A 101 3.819 6.517 -8.700 1.00 0.00 O ATOM 0 H SER A 101 2.266 7.657 -7.168 1.00 0.00 H new ATOM 0 HA SER A 101 3.865 6.117 -5.368 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.733 5.126 -7.489 1.00 0.00 H new ATOM 0 HB3 SER A 101 2.982 5.141 -7.419 1.00 0.00 H new ATOM 0 HG SER A 101 2.912 6.859 -8.844 1.00 0.00 H new ATOM 1585 N LYS A 102 5.342 8.454 -7.183 1.00 0.00 N ATOM 1586 CA LYS A 102 6.547 9.268 -7.290 1.00 0.00 C ATOM 1587 C LYS A 102 6.783 10.064 -6.009 1.00 0.00 C ATOM 1588 O LYS A 102 7.923 10.340 -5.639 1.00 0.00 O ATOM 1589 CB LYS A 102 6.441 10.219 -8.483 1.00 0.00 C ATOM 1590 CG LYS A 102 7.737 10.356 -9.268 1.00 0.00 C ATOM 1591 CD LYS A 102 7.553 9.965 -10.727 1.00 0.00 C ATOM 1592 CE LYS A 102 7.169 8.501 -10.866 1.00 0.00 C ATOM 1593 NZ LYS A 102 6.873 8.135 -12.278 1.00 0.00 N ATOM 0 H LYS A 102 4.611 8.694 -7.853 1.00 0.00 H new ATOM 0 HA LYS A 102 7.394 8.599 -7.441 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.657 9.864 -9.151 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.136 11.203 -8.127 1.00 0.00 H new ATOM 0 HG2 LYS A 102 8.092 11.385 -9.209 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.505 9.728 -8.816 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.781 10.589 -11.178 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.476 10.154 -11.275 1.00 0.00 H new ATOM 0 HE2 LYS A 102 7.980 7.876 -10.492 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.296 8.295 -10.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.615 7.129 -12.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.082 8.713 -12.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.714 8.307 -12.865 1.00 0.00 H new ATOM 1607 N HIS A 103 5.696 10.429 -5.337 1.00 0.00 N ATOM 1608 CA HIS A 103 5.783 11.193 -4.098 1.00 0.00 C ATOM 1609 C HIS A 103 6.579 10.433 -3.042 1.00 0.00 C ATOM 1610 O HIS A 103 7.222 11.035 -2.182 1.00 0.00 O ATOM 1611 CB HIS A 103 4.384 11.508 -3.568 1.00 0.00 C ATOM 1612 CG HIS A 103 4.273 12.862 -2.940 1.00 0.00 C ATOM 1613 ND1 HIS A 103 5.070 13.274 -1.892 1.00 0.00 N ATOM 1614 CD2 HIS A 103 3.451 13.903 -3.216 1.00 0.00 C ATOM 1615 CE1 HIS A 103 4.743 14.509 -1.551 1.00 0.00 C ATOM 1616 NE2 HIS A 103 3.764 14.913 -2.340 1.00 0.00 N ATOM 0 H HIS A 103 4.744 10.208 -5.630 1.00 0.00 H new ATOM 0 HA HIS A 103 6.301 12.127 -4.315 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.669 11.437 -4.388 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.104 10.752 -2.834 1.00 0.00 H new ATOM 0 HD1 HIS A 103 5.798 12.713 -1.449 1.00 0.00 H new ATOM 0 HD2 HIS A 103 2.691 13.933 -3.983 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.199 15.089 -0.762 1.00 0.00 H new ATOM 1625 N PHE A 104 6.534 9.106 -3.112 1.00 0.00 N ATOM 1626 CA PHE A 104 7.252 8.266 -2.160 1.00 0.00 C ATOM 1627 C PHE A 104 8.660 7.938 -2.659 1.00 0.00 C ATOM 1628 O PHE A 104 9.343 7.086 -2.092 1.00 0.00 O ATOM 1629 CB PHE A 104 6.477 6.971 -1.907 1.00 0.00 C ATOM 1630 CG PHE A 104 5.179 7.180 -1.180 1.00 0.00 C ATOM 1631 CD1 PHE A 104 5.112 8.024 -0.083 1.00 0.00 C ATOM 1632 CD2 PHE A 104 4.027 6.530 -1.592 1.00 0.00 C ATOM 1633 CE1 PHE A 104 3.919 8.217 0.588 1.00 0.00 C ATOM 1634 CE2 PHE A 104 2.832 6.718 -0.925 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.777 7.563 0.166 1.00 0.00 C ATOM 0 H PHE A 104 6.008 8.590 -3.817 1.00 0.00 H new ATOM 0 HA PHE A 104 7.342 8.822 -1.227 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.275 6.486 -2.862 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.102 6.290 -1.329 1.00 0.00 H new ATOM 0 HD1 PHE A 104 6.002 8.537 0.251 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.064 5.868 -2.445 1.00 0.00 H new ATOM 0 HE1 PHE A 104 3.879 8.878 1.441 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.941 6.205 -1.256 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.844 7.712 0.688 1.00 0.00 H new ATOM 1645 N ASN A 105 9.091 8.619 -3.720 1.00 0.00 N ATOM 1646 CA ASN A 105 10.418 8.398 -4.286 1.00 0.00 C ATOM 1647 C ASN A 105 10.654 6.917 -4.578 1.00 0.00 C ATOM 1648 O ASN A 105 11.773 6.421 -4.450 1.00 0.00 O ATOM 1649 CB ASN A 105 11.493 8.917 -3.331 1.00 0.00 C ATOM 1650 CG ASN A 105 12.744 9.368 -4.059 1.00 0.00 C ATOM 1651 OD1 ASN A 105 13.777 8.700 -4.014 1.00 0.00 O ATOM 1652 ND2 ASN A 105 12.658 10.508 -4.735 1.00 0.00 N ATOM 0 H ASN A 105 8.540 9.328 -4.204 1.00 0.00 H new ATOM 0 HA ASN A 105 10.477 8.946 -5.226 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.091 9.750 -2.754 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.753 8.133 -2.620 1.00 0.00 H new ATOM 0 HD21 ASN A 105 13.468 10.862 -5.244 1.00 0.00 H new ATOM 0 HD22 ASN A 105 11.782 11.030 -4.745 1.00 0.00 H new ATOM 1659 N VAL A 106 9.593 6.220 -4.972 1.00 0.00 N ATOM 1660 CA VAL A 106 9.688 4.797 -5.281 1.00 0.00 C ATOM 1661 C VAL A 106 10.696 4.544 -6.397 1.00 0.00 C ATOM 1662 O VAL A 106 10.450 4.879 -7.556 1.00 0.00 O ATOM 1663 CB VAL A 106 8.324 4.214 -5.699 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.409 2.700 -5.835 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.243 4.607 -4.702 1.00 0.00 C ATOM 0 H VAL A 106 8.660 6.616 -5.085 1.00 0.00 H new ATOM 0 HA VAL A 106 10.021 4.301 -4.370 1.00 0.00 H new ATOM 0 HB VAL A 106 8.056 4.630 -6.670 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.437 2.306 -6.131 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.150 2.444 -6.592 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.701 2.265 -4.879 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.288 4.185 -5.016 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.502 4.224 -3.715 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.164 5.693 -4.661 1.00 0.00 H new ATOM 1675 N GLU A 107 11.830 3.949 -6.042 1.00 0.00 N ATOM 1676 CA GLU A 107 12.873 3.649 -7.017 1.00 0.00 C ATOM 1677 C GLU A 107 12.331 2.760 -8.131 1.00 0.00 C ATOM 1678 O GLU A 107 12.441 3.088 -9.312 1.00 0.00 O ATOM 1679 CB GLU A 107 14.059 2.966 -6.334 1.00 0.00 C ATOM 1680 CG GLU A 107 15.018 3.938 -5.667 1.00 0.00 C ATOM 1681 CD GLU A 107 16.302 3.270 -5.213 1.00 0.00 C ATOM 1682 OE1 GLU A 107 16.305 2.031 -5.061 1.00 0.00 O ATOM 1683 OE2 GLU A 107 17.304 3.987 -5.009 1.00 0.00 O ATOM 0 H GLU A 107 12.050 3.665 -5.087 1.00 0.00 H new ATOM 0 HA GLU A 107 13.209 4.589 -7.455 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.684 2.267 -5.586 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.605 2.379 -7.073 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.257 4.742 -6.363 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.527 4.395 -4.808 1.00 0.00 H new ATOM 1690 N SER A 108 11.739 1.634 -7.744 1.00 0.00 N ATOM 1691 CA SER A 108 11.173 0.698 -8.709 1.00 0.00 C ATOM 1692 C SER A 108 10.277 -0.323 -8.014 1.00 0.00 C ATOM 1693 O SER A 108 10.491 -0.664 -6.851 1.00 0.00 O ATOM 1694 CB SER A 108 12.284 -0.023 -9.473 1.00 0.00 C ATOM 1695 OG SER A 108 13.015 0.879 -10.284 1.00 0.00 O ATOM 0 H SER A 108 11.639 1.348 -6.770 1.00 0.00 H new ATOM 0 HA SER A 108 10.570 1.269 -9.415 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.957 -0.510 -8.768 1.00 0.00 H new ATOM 0 HB3 SER A 108 11.852 -0.807 -10.095 1.00 0.00 H new ATOM 0 HG SER A 108 12.555 1.744 -10.308 1.00 0.00 H new ATOM 1701 N ILE A 109 9.274 -0.804 -8.738 1.00 0.00 N ATOM 1702 CA ILE A 109 8.342 -1.785 -8.195 1.00 0.00 C ATOM 1703 C ILE A 109 8.913 -3.202 -8.282 1.00 0.00 C ATOM 1704 O ILE A 109 9.803 -3.472 -9.088 1.00 0.00 O ATOM 1705 CB ILE A 109 6.974 -1.731 -8.917 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.134 -1.626 -10.443 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.169 -0.552 -8.399 1.00 0.00 C ATOM 1708 CD1 ILE A 109 8.183 -2.548 -11.028 1.00 0.00 C ATOM 0 H ILE A 109 9.085 -0.531 -9.702 1.00 0.00 H new ATOM 0 HA ILE A 109 8.192 -1.529 -7.146 1.00 0.00 H new ATOM 0 HB ILE A 109 6.448 -2.662 -8.705 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.175 -1.843 -10.912 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.388 -0.598 -10.699 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.206 -0.516 -8.909 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.008 -0.665 -7.327 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.714 0.372 -8.589 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.229 -2.408 -12.108 1.00 0.00 H new ATOM 0 HD12 ILE A 109 9.154 -2.318 -10.591 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.922 -3.583 -10.807 1.00 0.00 H new ATOM 1720 N PRO A 110 8.412 -4.130 -7.444 1.00 0.00 N ATOM 1721 CA PRO A 110 7.356 -3.860 -6.465 1.00 0.00 C ATOM 1722 C PRO A 110 7.893 -3.166 -5.218 1.00 0.00 C ATOM 1723 O PRO A 110 9.096 -3.178 -4.958 1.00 0.00 O ATOM 1724 CB PRO A 110 6.819 -5.258 -6.107 1.00 0.00 C ATOM 1725 CG PRO A 110 7.574 -6.227 -6.966 1.00 0.00 C ATOM 1726 CD PRO A 110 8.834 -5.529 -7.387 1.00 0.00 C ATOM 0 HA PRO A 110 6.595 -3.191 -6.866 1.00 0.00 H new ATOM 0 HB2 PRO A 110 6.971 -5.475 -5.050 1.00 0.00 H new ATOM 0 HB3 PRO A 110 5.747 -5.324 -6.295 1.00 0.00 H new ATOM 0 HG2 PRO A 110 7.801 -7.139 -6.414 1.00 0.00 H new ATOM 0 HG3 PRO A 110 6.983 -6.518 -7.834 1.00 0.00 H new ATOM 0 HD2 PRO A 110 9.642 -5.681 -6.671 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.193 -5.885 -8.353 1.00 0.00 H new ATOM 1734 N THR A 111 6.993 -2.566 -4.445 1.00 0.00 N ATOM 1735 CA THR A 111 7.381 -1.873 -3.223 1.00 0.00 C ATOM 1736 C THR A 111 6.248 -1.887 -2.199 1.00 0.00 C ATOM 1737 O THR A 111 5.171 -2.425 -2.453 1.00 0.00 O ATOM 1738 CB THR A 111 7.801 -0.432 -3.534 1.00 0.00 C ATOM 1739 OG1 THR A 111 8.576 0.103 -2.475 1.00 0.00 O ATOM 1740 CG2 THR A 111 6.634 0.505 -3.765 1.00 0.00 C ATOM 0 H THR A 111 5.993 -2.546 -4.643 1.00 0.00 H new ATOM 0 HA THR A 111 8.232 -2.401 -2.793 1.00 0.00 H new ATOM 0 HB THR A 111 8.377 -0.497 -4.457 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.836 1.023 -2.692 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.008 1.506 -3.979 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.044 0.150 -4.610 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.009 0.535 -2.872 1.00 0.00 H new ATOM 1748 N LEU A 112 6.501 -1.276 -1.046 1.00 0.00 N ATOM 1749 CA LEU A 112 5.498 -1.199 0.023 1.00 0.00 C ATOM 1750 C LEU A 112 5.659 0.108 0.798 1.00 0.00 C ATOM 1751 O LEU A 112 6.733 0.392 1.325 1.00 0.00 O ATOM 1752 CB LEU A 112 5.606 -2.407 0.982 1.00 0.00 C ATOM 1753 CG LEU A 112 4.278 -2.957 1.514 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.396 -1.853 2.051 1.00 0.00 C ATOM 1755 CD2 LEU A 112 3.527 -3.708 0.439 1.00 0.00 C ATOM 0 H LEU A 112 7.389 -0.826 -0.823 1.00 0.00 H new ATOM 0 HA LEU A 112 4.510 -1.224 -0.436 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.130 -3.211 0.465 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.224 -2.118 1.832 1.00 0.00 H new ATOM 0 HG LEU A 112 4.525 -3.641 2.326 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.463 -2.279 2.420 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.908 -1.342 2.866 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.180 -1.140 1.255 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.589 -4.086 0.847 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.316 -3.037 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.133 -4.543 0.088 1.00 0.00 H new ATOM 1767 N ILE A 113 4.596 0.906 0.859 1.00 0.00 N ATOM 1768 CA ILE A 113 4.645 2.183 1.568 1.00 0.00 C ATOM 1769 C ILE A 113 3.576 2.262 2.653 1.00 0.00 C ATOM 1770 O ILE A 113 2.519 1.644 2.540 1.00 0.00 O ATOM 1771 CB ILE A 113 4.461 3.369 0.599 1.00 0.00 C ATOM 1772 CG1 ILE A 113 5.434 3.255 -0.577 1.00 0.00 C ATOM 1773 CG2 ILE A 113 4.655 4.689 1.331 1.00 0.00 C ATOM 1774 CD1 ILE A 113 6.884 3.444 -0.184 1.00 0.00 C ATOM 0 H ILE A 113 3.696 0.694 0.429 1.00 0.00 H new ATOM 0 HA ILE A 113 5.630 2.244 2.032 1.00 0.00 H new ATOM 0 HB ILE A 113 3.445 3.341 0.206 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.317 2.276 -1.041 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.170 3.998 -1.329 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.522 5.515 0.633 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.923 4.771 2.134 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.660 4.728 1.751 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.516 3.350 -1.067 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.016 4.434 0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.165 2.685 0.546 1.00 0.00 H new ATOM 1786 N GLY A 114 3.856 3.033 3.702 1.00 0.00 N ATOM 1787 CA GLY A 114 2.906 3.185 4.789 1.00 0.00 C ATOM 1788 C GLY A 114 2.808 4.619 5.273 1.00 0.00 C ATOM 1789 O GLY A 114 3.827 5.275 5.495 1.00 0.00 O ATOM 0 H GLY A 114 4.725 3.555 3.817 1.00 0.00 H new ATOM 0 HA2 GLY A 114 1.923 2.847 4.459 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.202 2.543 5.619 1.00 0.00 H new ATOM 1793 N VAL A 115 1.583 5.108 5.443 1.00 0.00 N ATOM 1794 CA VAL A 115 1.361 6.464 5.907 1.00 0.00 C ATOM 1795 C VAL A 115 0.320 6.493 7.017 1.00 0.00 C ATOM 1796 O VAL A 115 -0.434 5.539 7.205 1.00 0.00 O ATOM 1797 CB VAL A 115 0.910 7.394 4.760 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.896 7.332 3.603 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.496 7.039 4.292 1.00 0.00 C ATOM 0 H VAL A 115 0.729 4.579 5.264 1.00 0.00 H new ATOM 0 HA VAL A 115 2.314 6.827 6.293 1.00 0.00 H new ATOM 0 HB VAL A 115 0.890 8.416 5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.562 7.994 2.804 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.881 7.647 3.947 1.00 0.00 H new ATOM 0 HG13 VAL A 115 1.953 6.310 3.228 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.790 7.708 3.484 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.511 6.010 3.934 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.194 7.145 5.123 1.00 0.00 H new ATOM 1809 N ASP A 116 0.288 7.596 7.743 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.657 7.767 8.840 1.00 0.00 C ATOM 1811 C ASP A 116 -1.821 8.658 8.419 1.00 0.00 C ATOM 1812 O ASP A 116 -1.638 9.842 8.136 1.00 0.00 O ATOM 1813 CB ASP A 116 0.044 8.367 10.059 1.00 0.00 C ATOM 1814 CG ASP A 116 0.662 7.308 10.950 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.229 6.140 10.872 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.580 7.647 11.726 1.00 0.00 O ATOM 0 H ASP A 116 0.908 8.392 7.594 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.049 6.785 9.104 1.00 0.00 H new ATOM 0 HB2 ASP A 116 0.820 9.056 9.726 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -0.673 8.950 10.636 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.017 8.082 8.383 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.211 8.823 7.998 1.00 0.00 C ATOM 1823 C ALA A 117 -4.660 9.761 9.115 1.00 0.00 C ATOM 1824 O ALA A 117 -5.170 10.850 8.857 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.332 7.862 7.634 1.00 0.00 C ATOM 0 H ALA A 117 -3.185 7.103 8.616 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.967 9.429 7.126 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.218 8.428 7.348 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.017 7.235 6.800 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.565 7.233 8.493 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.471 9.324 10.356 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.859 10.119 11.517 1.00 0.00 C ATOM 1833 C ASP A 118 -4.192 11.491 11.496 1.00 0.00 C ATOM 1834 O ASP A 118 -4.866 12.518 11.421 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.494 9.381 12.808 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.620 9.402 13.822 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -6.793 9.271 13.412 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -5.330 9.549 15.028 1.00 0.00 O ATOM 0 H ASP A 118 -4.051 8.423 10.584 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.938 10.265 11.478 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.239 8.348 12.573 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.606 9.837 13.246 1.00 0.00 H new ATOM 1843 N SER A 119 -2.864 11.501 11.569 1.00 0.00 N ATOM 1844 CA SER A 119 -2.109 12.749 11.564 1.00 0.00 C ATOM 1845 C SER A 119 -1.781 13.187 10.140 1.00 0.00 C ATOM 1846 O SER A 119 -1.913 14.362 9.797 1.00 0.00 O ATOM 1847 CB SER A 119 -0.819 12.590 12.370 1.00 0.00 C ATOM 1848 OG SER A 119 0.156 11.871 11.636 1.00 0.00 O ATOM 0 H SER A 119 -2.290 10.660 11.632 1.00 0.00 H new ATOM 0 HA SER A 119 -2.728 13.519 12.025 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.428 13.573 12.634 1.00 0.00 H new ATOM 0 HB3 SER A 119 -1.032 12.070 13.304 1.00 0.00 H new ATOM 0 HG SER A 119 0.971 11.785 12.173 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.350 12.237 9.316 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.007 12.548 7.941 1.00 0.00 C ATOM 1856 C GLY A 120 0.471 12.368 7.658 1.00 0.00 C ATOM 1857 O GLY A 120 1.193 11.769 8.455 1.00 0.00 O ATOM 0 H GLY A 120 -1.232 11.258 9.576 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.583 11.908 7.272 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.293 13.577 7.722 1.00 0.00 H new ATOM 1861 N ASP A 121 0.922 12.887 6.521 1.00 0.00 N ATOM 1862 CA ASP A 121 2.325 12.779 6.135 1.00 0.00 C ATOM 1863 C ASP A 121 2.752 11.318 6.041 1.00 0.00 C ATOM 1864 O ASP A 121 2.071 10.428 6.550 1.00 0.00 O ATOM 1865 CB ASP A 121 3.210 13.517 7.142 1.00 0.00 C ATOM 1866 CG ASP A 121 3.340 14.994 6.824 1.00 0.00 C ATOM 1867 OD1 ASP A 121 4.046 15.331 5.851 1.00 0.00 O ATOM 1868 OD2 ASP A 121 2.735 15.812 7.547 1.00 0.00 O ATOM 0 H ASP A 121 0.337 13.386 5.851 1.00 0.00 H new ATOM 0 HA ASP A 121 2.443 13.237 5.153 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.794 13.399 8.142 1.00 0.00 H new ATOM 0 HB3 ASP A 121 4.200 13.062 7.153 1.00 0.00 H new ATOM 1873 N VAL A 122 3.884 11.077 5.388 1.00 0.00 N ATOM 1874 CA VAL A 122 4.399 9.724 5.228 1.00 0.00 C ATOM 1875 C VAL A 122 4.950 9.187 6.543 1.00 0.00 C ATOM 1876 O VAL A 122 5.464 9.942 7.368 1.00 0.00 O ATOM 1877 CB VAL A 122 5.507 9.666 4.160 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.818 8.224 3.793 1.00 0.00 C ATOM 1879 CG2 VAL A 122 5.108 10.462 2.926 1.00 0.00 C ATOM 0 H VAL A 122 4.461 11.802 4.961 1.00 0.00 H new ATOM 0 HA VAL A 122 3.562 9.104 4.906 1.00 0.00 H new ATOM 0 HB VAL A 122 6.408 10.116 4.576 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.603 8.202 3.037 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.153 7.687 4.680 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.921 7.747 3.398 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.905 10.408 2.184 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.192 10.047 2.506 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.941 11.503 3.203 1.00 0.00 H new ATOM 1889 N VAL A 123 4.833 7.877 6.734 1.00 0.00 N ATOM 1890 CA VAL A 123 5.312 7.236 7.950 1.00 0.00 C ATOM 1891 C VAL A 123 6.465 6.275 7.670 1.00 0.00 C ATOM 1892 O VAL A 123 7.410 6.185 8.452 1.00 0.00 O ATOM 1893 CB VAL A 123 4.180 6.472 8.664 1.00 0.00 C ATOM 1894 CG1 VAL A 123 4.652 5.951 10.011 1.00 0.00 C ATOM 1895 CG2 VAL A 123 2.957 7.361 8.826 1.00 0.00 C ATOM 0 H VAL A 123 4.410 7.239 6.060 1.00 0.00 H new ATOM 0 HA VAL A 123 5.672 8.035 8.598 1.00 0.00 H new ATOM 0 HB VAL A 123 3.900 5.616 8.049 1.00 0.00 H new ATOM 0 HG11 VAL A 123 3.838 5.415 10.499 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.495 5.276 9.865 1.00 0.00 H new ATOM 0 HG13 VAL A 123 4.962 6.788 10.637 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.168 6.805 9.332 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.220 8.238 9.418 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.605 7.678 7.844 1.00 0.00 H new ATOM 1905 N THR A 124 6.382 5.555 6.557 1.00 0.00 N ATOM 1906 CA THR A 124 7.419 4.600 6.184 1.00 0.00 C ATOM 1907 C THR A 124 7.407 4.363 4.677 1.00 0.00 C ATOM 1908 O THR A 124 6.359 4.441 4.035 1.00 0.00 O ATOM 1909 CB THR A 124 7.224 3.279 6.941 1.00 0.00 C ATOM 1910 OG1 THR A 124 7.624 2.173 6.148 1.00 0.00 O ATOM 1911 CG2 THR A 124 5.793 3.038 7.376 1.00 0.00 C ATOM 0 H THR A 124 5.607 5.615 5.897 1.00 0.00 H new ATOM 0 HA THR A 124 8.389 5.014 6.458 1.00 0.00 H new ATOM 0 HB THR A 124 7.847 3.370 7.831 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.522 1.885 6.417 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.729 2.087 7.905 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.473 3.843 8.037 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.146 3.010 6.499 1.00 0.00 H new ATOM 1919 N THR A 125 8.579 4.088 4.113 1.00 0.00 N ATOM 1920 CA THR A 125 8.698 3.860 2.676 1.00 0.00 C ATOM 1921 C THR A 125 9.333 2.504 2.356 1.00 0.00 C ATOM 1922 O THR A 125 8.781 1.725 1.581 1.00 0.00 O ATOM 1923 CB THR A 125 9.506 4.986 2.036 1.00 0.00 C ATOM 1924 OG1 THR A 125 10.830 5.006 2.541 1.00 0.00 O ATOM 1925 CG2 THR A 125 8.900 6.353 2.273 1.00 0.00 C ATOM 0 H THR A 125 9.457 4.018 4.627 1.00 0.00 H new ATOM 0 HA THR A 125 7.691 3.850 2.260 1.00 0.00 H new ATOM 0 HB THR A 125 9.501 4.780 0.966 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.331 5.734 2.117 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.518 7.113 1.795 1.00 0.00 H new ATOM 0 HG22 THR A 125 7.895 6.384 1.851 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.850 6.548 3.344 1.00 0.00 H new ATOM 1933 N ARG A 126 10.491 2.222 2.947 1.00 0.00 N ATOM 1934 CA ARG A 126 11.183 0.958 2.709 1.00 0.00 C ATOM 1935 C ARG A 126 10.541 -0.183 3.498 1.00 0.00 C ATOM 1936 O ARG A 126 11.234 -0.983 4.124 1.00 0.00 O ATOM 1937 CB ARG A 126 12.663 1.088 3.084 1.00 0.00 C ATOM 1938 CG ARG A 126 12.914 1.123 4.585 1.00 0.00 C ATOM 1939 CD ARG A 126 13.892 2.222 4.967 1.00 0.00 C ATOM 1940 NE ARG A 126 15.261 1.899 4.569 1.00 0.00 N ATOM 1941 CZ ARG A 126 16.056 1.079 5.252 1.00 0.00 C ATOM 1942 NH1 ARG A 126 15.624 0.495 6.363 1.00 0.00 N ATOM 1943 NH2 ARG A 126 17.287 0.840 4.821 1.00 0.00 N ATOM 0 H ARG A 126 10.969 2.850 3.593 1.00 0.00 H new ATOM 0 HA ARG A 126 11.100 0.724 1.648 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.213 0.252 2.652 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.063 1.998 2.636 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.970 1.278 5.108 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.305 0.159 4.911 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.589 3.157 4.496 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.856 2.381 6.045 1.00 0.00 H new ATOM 0 HE ARG A 126 15.628 2.327 3.719 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.677 0.674 6.698 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.239 -0.132 6.882 1.00 0.00 H new ATOM 0 HH21 ARG A 126 17.624 1.284 3.967 1.00 0.00 H new ATOM 0 HH22 ARG A 126 17.897 0.212 5.344 1.00 0.00 H new ATOM 1957 N ALA A 127 9.213 -0.252 3.465 1.00 0.00 N ATOM 1958 CA ALA A 127 8.488 -1.296 4.180 1.00 0.00 C ATOM 1959 C ALA A 127 8.736 -2.664 3.561 1.00 0.00 C ATOM 1960 O ALA A 127 8.588 -3.689 4.227 1.00 0.00 O ATOM 1961 CB ALA A 127 6.998 -0.986 4.208 1.00 0.00 C ATOM 0 H ALA A 127 8.620 0.400 2.953 1.00 0.00 H new ATOM 0 HA ALA A 127 8.860 -1.320 5.204 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.472 -1.775 4.745 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.834 -0.033 4.711 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.619 -0.927 3.188 1.00 0.00 H new ATOM 1967 N ARG A 128 9.119 -2.681 2.290 1.00 0.00 N ATOM 1968 CA ARG A 128 9.391 -3.933 1.599 1.00 0.00 C ATOM 1969 C ARG A 128 10.427 -4.750 2.363 1.00 0.00 C ATOM 1970 O ARG A 128 10.318 -5.969 2.462 1.00 0.00 O ATOM 1971 CB ARG A 128 9.882 -3.663 0.176 1.00 0.00 C ATOM 1972 CG ARG A 128 11.116 -2.777 0.114 1.00 0.00 C ATOM 1973 CD ARG A 128 12.384 -3.599 -0.057 1.00 0.00 C ATOM 1974 NE ARG A 128 12.415 -4.300 -1.338 1.00 0.00 N ATOM 1975 CZ ARG A 128 13.204 -5.342 -1.595 1.00 0.00 C ATOM 1976 NH1 ARG A 128 14.026 -5.805 -0.663 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.168 -5.921 -2.787 1.00 0.00 N ATOM 0 H ARG A 128 9.248 -1.845 1.720 1.00 0.00 H new ATOM 0 HA ARG A 128 8.464 -4.504 1.547 1.00 0.00 H new ATOM 0 HB2 ARG A 128 10.103 -4.614 -0.309 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.079 -3.194 -0.393 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.021 -2.076 -0.715 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.186 -2.184 1.026 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.253 -2.945 0.019 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.458 -4.323 0.754 1.00 0.00 H new ATOM 0 HE ARG A 128 11.796 -3.972 -2.080 1.00 0.00 H new ATOM 0 HH11 ARG A 128 14.056 -5.363 0.256 1.00 0.00 H new ATOM 0 HH12 ARG A 128 14.628 -6.603 -0.865 1.00 0.00 H new ATOM 0 HH21 ARG A 128 12.537 -5.569 -3.506 1.00 0.00 H new ATOM 0 HH22 ARG A 128 13.772 -6.719 -2.985 1.00 0.00 H new ATOM 1991 N ALA A 129 11.432 -4.064 2.900 1.00 0.00 N ATOM 1992 CA ALA A 129 12.494 -4.714 3.660 1.00 0.00 C ATOM 1993 C ALA A 129 12.109 -4.912 5.125 1.00 0.00 C ATOM 1994 O ALA A 129 12.118 -6.030 5.640 1.00 0.00 O ATOM 1995 CB ALA A 129 13.771 -3.891 3.568 1.00 0.00 C ATOM 0 H ALA A 129 11.533 -3.052 2.822 1.00 0.00 H new ATOM 0 HA ALA A 129 12.656 -5.700 3.225 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.561 -4.381 4.137 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.075 -3.806 2.525 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.593 -2.896 3.976 1.00 0.00 H new ATOM 2001 N THR A 130 11.798 -3.805 5.791 1.00 0.00 N ATOM 2002 CA THR A 130 11.440 -3.801 7.190 1.00 0.00 C ATOM 2003 C THR A 130 10.336 -4.791 7.516 1.00 0.00 C ATOM 2004 O THR A 130 10.452 -5.560 8.465 1.00 0.00 O ATOM 2005 CB THR A 130 11.049 -2.387 7.587 1.00 0.00 C ATOM 2006 OG1 THR A 130 10.071 -1.871 6.708 1.00 0.00 O ATOM 2007 CG2 THR A 130 12.223 -1.430 7.584 1.00 0.00 C ATOM 0 H THR A 130 11.790 -2.879 5.363 1.00 0.00 H new ATOM 0 HA THR A 130 12.305 -4.125 7.769 1.00 0.00 H new ATOM 0 HB THR A 130 10.659 -2.464 8.602 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.194 -1.895 7.144 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.883 -0.436 7.875 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.977 -1.777 8.290 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.655 -1.387 6.584 1.00 0.00 H new ATOM 2015 N LEU A 131 9.269 -4.783 6.737 1.00 0.00 N ATOM 2016 CA LEU A 131 8.166 -5.699 6.980 1.00 0.00 C ATOM 2017 C LEU A 131 8.663 -7.141 7.079 1.00 0.00 C ATOM 2018 O LEU A 131 8.115 -7.943 7.836 1.00 0.00 O ATOM 2019 CB LEU A 131 7.123 -5.579 5.867 1.00 0.00 C ATOM 2020 CG LEU A 131 5.961 -6.573 5.957 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.638 -5.879 5.671 1.00 0.00 C ATOM 2022 CD2 LEU A 131 6.179 -7.733 4.996 1.00 0.00 C ATOM 0 H LEU A 131 9.142 -4.160 5.939 1.00 0.00 H new ATOM 0 HA LEU A 131 7.706 -5.430 7.931 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.717 -4.567 5.878 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.622 -5.712 4.907 1.00 0.00 H new ATOM 0 HG LEU A 131 5.924 -6.969 6.972 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.825 -6.602 5.740 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.479 -5.084 6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.660 -5.453 4.668 1.00 0.00 H new ATOM 0 HD21 LEU A 131 5.345 -8.430 5.072 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.243 -7.354 3.976 1.00 0.00 H new ATOM 0 HD23 LEU A 131 7.106 -8.247 5.251 1.00 0.00 H new ATOM 2034 N VAL A 132 9.703 -7.465 6.314 1.00 0.00 N ATOM 2035 CA VAL A 132 10.270 -8.803 6.321 1.00 0.00 C ATOM 2036 C VAL A 132 11.367 -8.945 7.369 1.00 0.00 C ATOM 2037 O VAL A 132 11.519 -9.997 7.991 1.00 0.00 O ATOM 2038 CB VAL A 132 10.866 -9.179 4.948 1.00 0.00 C ATOM 2039 CG1 VAL A 132 10.384 -10.552 4.505 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.555 -8.132 3.894 1.00 0.00 C ATOM 0 H VAL A 132 10.168 -6.814 5.681 1.00 0.00 H new ATOM 0 HA VAL A 132 9.446 -9.475 6.559 1.00 0.00 H new ATOM 0 HB VAL A 132 11.949 -9.216 5.063 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.818 -10.794 3.535 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.691 -11.299 5.237 1.00 0.00 H new ATOM 0 HG13 VAL A 132 9.297 -10.548 4.426 1.00 0.00 H new ATOM 0 HG21 VAL A 132 10.992 -8.433 2.942 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.475 -8.036 3.784 1.00 0.00 H new ATOM 0 HG23 VAL A 132 10.975 -7.173 4.198 1.00 0.00 H new ATOM 2050 N LYS A 133 12.165 -7.893 7.511 1.00 0.00 N ATOM 2051 CA LYS A 133 13.294 -7.904 8.427 1.00 0.00 C ATOM 2052 C LYS A 133 12.981 -7.230 9.765 1.00 0.00 C ATOM 2053 O LYS A 133 13.889 -6.866 10.512 1.00 0.00 O ATOM 2054 CB LYS A 133 14.486 -7.234 7.743 1.00 0.00 C ATOM 2055 CG LYS A 133 14.712 -7.725 6.319 1.00 0.00 C ATOM 2056 CD LYS A 133 15.875 -7.004 5.659 1.00 0.00 C ATOM 2057 CE LYS A 133 15.603 -5.514 5.529 1.00 0.00 C ATOM 2058 NZ LYS A 133 16.091 -4.755 6.714 1.00 0.00 N ATOM 0 H LYS A 133 12.048 -7.018 6.999 1.00 0.00 H new ATOM 0 HA LYS A 133 13.530 -8.941 8.665 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.330 -6.155 7.728 1.00 0.00 H new ATOM 0 HB3 LYS A 133 15.385 -7.418 8.331 1.00 0.00 H new ATOM 0 HG2 LYS A 133 14.906 -8.797 6.329 1.00 0.00 H new ATOM 0 HG3 LYS A 133 13.807 -7.571 5.732 1.00 0.00 H new ATOM 0 HD2 LYS A 133 16.781 -7.160 6.244 1.00 0.00 H new ATOM 0 HD3 LYS A 133 16.056 -7.430 4.672 1.00 0.00 H new ATOM 0 HE2 LYS A 133 16.087 -5.134 4.630 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.532 -5.350 5.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 15.310 -4.198 7.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 16.446 -5.420 7.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 16.859 -4.116 6.425 1.00 0.00 H new ATOM 2072 N ASP A 134 11.696 -7.091 10.071 1.00 0.00 N ATOM 2073 CA ASP A 134 11.266 -6.489 11.335 1.00 0.00 C ATOM 2074 C ASP A 134 10.269 -7.402 12.041 1.00 0.00 C ATOM 2075 O ASP A 134 9.074 -7.111 12.095 1.00 0.00 O ATOM 2076 CB ASP A 134 10.637 -5.112 11.108 1.00 0.00 C ATOM 2077 CG ASP A 134 11.607 -4.120 10.496 1.00 0.00 C ATOM 2078 OD1 ASP A 134 12.611 -4.559 9.897 1.00 0.00 O ATOM 2079 OD2 ASP A 134 11.363 -2.901 10.617 1.00 0.00 O ATOM 0 H ASP A 134 10.931 -7.386 9.464 1.00 0.00 H new ATOM 0 HA ASP A 134 12.148 -6.363 11.963 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.770 -5.216 10.456 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.275 -4.721 12.059 1.00 0.00 H new ATOM 2084 N PRO A 135 10.752 -8.531 12.587 1.00 0.00 N ATOM 2085 CA PRO A 135 9.905 -9.497 13.284 1.00 0.00 C ATOM 2086 C PRO A 135 9.610 -9.102 14.729 1.00 0.00 C ATOM 2087 O PRO A 135 9.113 -9.915 15.508 1.00 0.00 O ATOM 2088 CB PRO A 135 10.743 -10.771 13.242 1.00 0.00 C ATOM 2089 CG PRO A 135 12.154 -10.290 13.270 1.00 0.00 C ATOM 2090 CD PRO A 135 12.164 -8.960 12.557 1.00 0.00 C ATOM 0 HA PRO A 135 8.923 -9.586 12.820 1.00 0.00 H new ATOM 0 HB2 PRO A 135 10.527 -11.417 14.093 1.00 0.00 H new ATOM 0 HB3 PRO A 135 10.539 -11.351 12.342 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.508 -10.184 14.295 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.817 -11.001 12.776 1.00 0.00 H new ATOM 0 HD2 PRO A 135 12.811 -8.241 13.061 1.00 0.00 H new ATOM 0 HD3 PRO A 135 12.530 -9.057 11.535 1.00 0.00 H new ATOM 2098 N GLU A 136 9.912 -7.857 15.090 1.00 0.00 N ATOM 2099 CA GLU A 136 9.670 -7.380 16.433 1.00 0.00 C ATOM 2100 C GLU A 136 8.425 -6.502 16.464 1.00 0.00 C ATOM 2101 O GLU A 136 7.783 -6.354 17.504 1.00 0.00 O ATOM 2102 CB GLU A 136 10.894 -6.609 16.926 1.00 0.00 C ATOM 2103 CG GLU A 136 11.076 -5.250 16.265 1.00 0.00 C ATOM 2104 CD GLU A 136 12.455 -5.077 15.656 1.00 0.00 C ATOM 2105 OE1 GLU A 136 13.441 -5.036 16.422 1.00 0.00 O ATOM 2106 OE2 GLU A 136 12.548 -4.984 14.415 1.00 0.00 O ATOM 0 H GLU A 136 10.325 -7.166 14.464 1.00 0.00 H new ATOM 0 HA GLU A 136 9.499 -8.229 17.095 1.00 0.00 H new ATOM 0 HB2 GLU A 136 10.813 -6.470 18.004 1.00 0.00 H new ATOM 0 HB3 GLU A 136 11.786 -7.210 16.748 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.322 -5.124 15.488 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.908 -4.466 17.003 1.00 0.00 H new ATOM 2113 N GLY A 137 8.091 -5.914 15.313 1.00 0.00 N ATOM 2114 CA GLY A 137 6.925 -5.053 15.236 1.00 0.00 C ATOM 2115 C GLY A 137 6.936 -4.000 16.321 1.00 0.00 C ATOM 2116 O GLY A 137 5.888 -3.512 16.743 1.00 0.00 O ATOM 0 H GLY A 137 8.606 -6.020 14.439 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.893 -4.569 14.260 1.00 0.00 H new ATOM 0 HA3 GLY A 137 6.021 -5.656 15.323 1.00 0.00 H new ATOM 2120 N GLU A 138 8.135 -3.660 16.776 1.00 0.00 N ATOM 2121 CA GLU A 138 8.301 -2.661 17.829 1.00 0.00 C ATOM 2122 C GLU A 138 8.305 -1.256 17.253 1.00 0.00 C ATOM 2123 O GLU A 138 7.960 -0.290 17.933 1.00 0.00 O ATOM 2124 CB GLU A 138 9.600 -2.904 18.598 1.00 0.00 C ATOM 2125 CG GLU A 138 9.703 -4.301 19.175 1.00 0.00 C ATOM 2126 CD GLU A 138 11.009 -4.537 19.908 1.00 0.00 C ATOM 2127 OE1 GLU A 138 12.030 -3.939 19.509 1.00 0.00 O ATOM 2128 OE2 GLU A 138 11.011 -5.321 20.881 1.00 0.00 O ATOM 0 H GLU A 138 9.008 -4.060 16.434 1.00 0.00 H new ATOM 0 HA GLU A 138 7.457 -2.755 18.512 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.446 -2.730 17.933 1.00 0.00 H new ATOM 0 HB3 GLU A 138 9.676 -2.178 19.407 1.00 0.00 H new ATOM 0 HG2 GLU A 138 8.872 -4.469 19.859 1.00 0.00 H new ATOM 0 HG3 GLU A 138 9.606 -5.030 18.370 1.00 0.00 H new ATOM 2135 N GLN A 139 8.701 -1.149 15.994 1.00 0.00 N ATOM 2136 CA GLN A 139 8.756 0.142 15.320 1.00 0.00 C ATOM 2137 C GLN A 139 7.994 0.091 14.008 1.00 0.00 C ATOM 2138 O GLN A 139 8.378 0.748 13.052 1.00 0.00 O ATOM 2139 CB GLN A 139 10.203 0.543 15.016 1.00 0.00 C ATOM 2140 CG GLN A 139 11.251 -0.089 15.916 1.00 0.00 C ATOM 2141 CD GLN A 139 12.362 0.875 16.281 1.00 0.00 C ATOM 2142 OE1 GLN A 139 12.159 2.090 16.318 1.00 0.00 O ATOM 2143 NE2 GLN A 139 13.545 0.339 16.553 1.00 0.00 N ATOM 0 H GLN A 139 8.989 -1.939 15.417 1.00 0.00 H new ATOM 0 HA GLN A 139 8.305 0.875 15.989 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.427 0.279 13.983 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.287 1.627 15.093 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.773 -0.449 16.827 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.678 -0.958 15.416 1.00 0.00 H new ATOM 0 HE21 GLN A 139 13.669 -0.673 16.510 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.331 0.939 16.805 1.00 0.00 H new ATOM 2152 N PHE A 140 6.933 -0.709 13.960 1.00 0.00 N ATOM 2153 CA PHE A 140 6.148 -0.871 12.736 1.00 0.00 C ATOM 2154 C PHE A 140 6.025 0.398 11.901 1.00 0.00 C ATOM 2155 O PHE A 140 6.189 0.331 10.683 1.00 0.00 O ATOM 2156 CB PHE A 140 4.789 -1.503 13.018 1.00 0.00 C ATOM 2157 CG PHE A 140 3.988 -0.823 14.091 1.00 0.00 C ATOM 2158 CD1 PHE A 140 4.274 -1.033 15.431 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.942 0.025 13.758 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.536 -0.409 16.419 1.00 0.00 C ATOM 2161 CE2 PHE A 140 2.201 0.652 14.742 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.499 0.435 16.073 1.00 0.00 C ATOM 0 H PHE A 140 6.596 -1.256 14.752 1.00 0.00 H new ATOM 0 HA PHE A 140 6.718 -1.563 12.116 1.00 0.00 H new ATOM 0 HB2 PHE A 140 4.207 -1.505 12.096 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.940 -2.544 13.302 1.00 0.00 H new ATOM 0 HD1 PHE A 140 5.084 -1.693 15.706 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.704 0.197 12.719 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.770 -0.581 17.459 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.390 1.311 14.470 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.921 0.925 16.843 1.00 0.00 H new ATOM 2172 N PRO A 141 5.782 1.582 12.489 1.00 0.00 N ATOM 2173 CA PRO A 141 5.714 2.802 11.688 1.00 0.00 C ATOM 2174 C PRO A 141 7.068 3.117 11.043 1.00 0.00 C ATOM 2175 O PRO A 141 7.226 4.151 10.396 1.00 0.00 O ATOM 2176 CB PRO A 141 5.334 3.884 12.697 1.00 0.00 C ATOM 2177 CG PRO A 141 5.761 3.343 14.019 1.00 0.00 C ATOM 2178 CD PRO A 141 5.594 1.851 13.930 1.00 0.00 C ATOM 0 HA PRO A 141 5.003 2.720 10.866 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.836 4.825 12.475 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.262 4.082 12.679 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.797 3.608 14.233 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.154 3.756 14.824 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.330 1.325 14.538 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.610 1.534 14.275 1.00 0.00 H new ATOM 2186 N TRP A 142 8.040 2.203 11.240 1.00 0.00 N ATOM 2187 CA TRP A 142 9.406 2.329 10.710 1.00 0.00 C ATOM 2188 C TRP A 142 9.653 3.683 10.057 1.00 0.00 C ATOM 2189 O TRP A 142 9.807 3.787 8.841 1.00 0.00 O ATOM 2190 CB TRP A 142 9.702 1.196 9.721 1.00 0.00 C ATOM 2191 CG TRP A 142 9.062 -0.107 10.103 1.00 0.00 C ATOM 2192 CD1 TRP A 142 9.212 -0.795 11.280 1.00 0.00 C ATOM 2193 CD2 TRP A 142 8.167 -0.883 9.299 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.432 -1.927 11.264 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.793 -2.009 10.055 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.638 -0.727 8.015 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.915 -2.973 9.568 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.768 -1.686 7.532 1.00 0.00 C ATOM 2199 CH2 TRP A 142 6.415 -2.797 8.309 1.00 0.00 C ATOM 0 H TRP A 142 7.893 1.349 11.778 1.00 0.00 H new ATOM 0 HA TRP A 142 10.087 2.253 11.557 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.353 1.487 8.730 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.781 1.056 9.651 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.849 -0.492 12.098 1.00 0.00 H new ATOM 0 HE1 TRP A 142 8.343 -2.597 12.028 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.904 0.128 7.411 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 6.639 -3.830 10.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 6.354 -1.577 6.540 1.00 0.00 H new ATOM 0 HH2 TRP A 142 5.733 -3.530 7.904 1.00 0.00 H new ATOM 2210 N LYS A 143 9.685 4.717 10.891 1.00 0.00 N ATOM 2211 CA LYS A 143 9.910 6.087 10.429 1.00 0.00 C ATOM 2212 C LYS A 143 11.034 6.150 9.397 1.00 0.00 C ATOM 2213 O LYS A 143 11.791 5.194 9.229 1.00 0.00 O ATOM 2214 CB LYS A 143 10.243 6.995 11.613 1.00 0.00 C ATOM 2215 CG LYS A 143 11.519 6.605 12.340 1.00 0.00 C ATOM 2216 CD LYS A 143 12.100 7.777 13.115 1.00 0.00 C ATOM 2217 CE LYS A 143 11.362 7.999 14.425 1.00 0.00 C ATOM 2218 NZ LYS A 143 11.888 9.177 15.167 1.00 0.00 N ATOM 0 H LYS A 143 9.557 4.633 11.899 1.00 0.00 H new ATOM 0 HA LYS A 143 8.992 6.432 9.953 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.337 8.021 11.258 1.00 0.00 H new ATOM 0 HB3 LYS A 143 9.413 6.976 12.319 1.00 0.00 H new ATOM 0 HG2 LYS A 143 11.312 5.782 13.024 1.00 0.00 H new ATOM 0 HG3 LYS A 143 12.253 6.244 11.620 1.00 0.00 H new ATOM 0 HD2 LYS A 143 13.155 7.594 13.317 1.00 0.00 H new ATOM 0 HD3 LYS A 143 12.044 8.680 12.507 1.00 0.00 H new ATOM 0 HE2 LYS A 143 10.300 8.142 14.224 1.00 0.00 H new ATOM 0 HE3 LYS A 143 11.452 7.109 15.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 11.358 9.294 16.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 12.895 9.031 15.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 11.779 10.031 14.584 1.00 0.00 H new