USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 832 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: B 64 GLN : amide:sc= -0.472 K(o=-5.7,f=-7.5) USER MOD Set 1.2: B 78 ASN : amide:sc= -5.26 K(o=-5.7,f=-16!) USER MOD Set 2.1: A 64 GLN : amide:sc= -0.452 K(o=-5.6,f=-7.7) USER MOD Set 2.2: A 78 ASN : amide:sc= -5.17 K(o=-5.6,f=-16!) USER MOD Single : A 32 SER OG : rot 28:sc= 0.499 USER MOD Single : A 37 HIS : no HD1:sc= -0.154 X(o=-0.15,f=-0.41) USER MOD Single : A 38 TYR OH : rot 180:sc= -0.0309 USER MOD Single : A 41 GLN : amide:sc= -1.59 X(o=-1.6,f=-1.6) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 MET CE :methyl 152:sc= -3.2 (180deg=-4.97!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.259 USER MOD Single : A 67 GLN : amide:sc= -0.0142 X(o=-0.014,f=-0.45) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 97:sc= 0.113 USER MOD Single : B 32 SER OG : rot 18:sc= 0.487 USER MOD Single : B 37 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.35) USER MOD Single : B 38 TYR OH : rot 180:sc= -0.0249 USER MOD Single : B 41 GLN : amide:sc= -1.56 X(o=-1.6,f=-1.6) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 MET CE :methyl 149:sc= -3.12 (180deg=-4.84!) USER MOD Single : B 62 THR OG1 : rot 150:sc= -0.224 USER MOD Single : B 67 GLN : amide:sc= -0.0161 X(o=-0.016,f=-0.42) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 96:sc= 0.105 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 32 6.690 0.013 1.233 1.00 0.00 N ATOM 28 CA SER A 32 8.062 -0.494 0.938 1.00 0.00 C ATOM 29 C SER A 32 8.571 0.102 -0.376 1.00 0.00 C ATOM 30 O SER A 32 9.764 0.153 -0.617 1.00 0.00 O ATOM 31 CB SER A 32 8.033 -2.017 0.822 1.00 0.00 C ATOM 32 OG SER A 32 7.169 -2.549 1.817 1.00 0.00 O ATOM 0 HA SER A 32 8.728 -0.200 1.749 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.689 -2.311 -0.170 1.00 0.00 H new ATOM 0 HB3 SER A 32 9.038 -2.421 0.943 1.00 0.00 H new ATOM 0 HG SER A 32 6.483 -1.887 2.042 1.00 0.00 H new ATOM 38 N ASP A 33 7.683 0.555 -1.232 1.00 0.00 N ATOM 39 CA ASP A 33 8.124 1.145 -2.526 1.00 0.00 C ATOM 40 C ASP A 33 8.422 2.641 -2.363 1.00 0.00 C ATOM 41 O ASP A 33 8.569 3.351 -3.338 1.00 0.00 O ATOM 42 CB ASP A 33 7.032 0.963 -3.582 1.00 0.00 C ATOM 43 CG ASP A 33 6.589 -0.503 -3.623 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.719 -0.860 -2.846 1.00 0.00 O ATOM 45 OD2 ASP A 33 7.128 -1.241 -4.431 1.00 0.00 O ATOM 0 H ASP A 33 6.674 0.539 -1.085 1.00 0.00 H new ATOM 0 HA ASP A 33 9.032 0.633 -2.843 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.181 1.603 -3.352 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.405 1.267 -4.560 1.00 0.00 H new ATOM 50 N ALA A 34 8.521 3.129 -1.149 1.00 0.00 N ATOM 51 CA ALA A 34 8.825 4.568 -0.936 1.00 0.00 C ATOM 52 C ALA A 34 10.346 4.762 -0.825 1.00 0.00 C ATOM 53 O ALA A 34 10.846 5.866 -0.934 1.00 0.00 O ATOM 54 CB ALA A 34 8.154 5.042 0.355 1.00 0.00 C ATOM 0 H ALA A 34 8.402 2.584 -0.295 1.00 0.00 H new ATOM 0 HA ALA A 34 8.448 5.148 -1.778 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.375 6.097 0.514 1.00 0.00 H new ATOM 0 HB2 ALA A 34 7.075 4.905 0.276 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.533 4.461 1.196 1.00 0.00 H new ATOM 60 N GLU A 35 11.084 3.698 -0.603 1.00 0.00 N ATOM 61 CA GLU A 35 12.567 3.811 -0.478 1.00 0.00 C ATOM 62 C GLU A 35 13.186 4.448 -1.740 1.00 0.00 C ATOM 63 O GLU A 35 14.044 5.300 -1.614 1.00 0.00 O ATOM 64 CB GLU A 35 13.176 2.420 -0.245 1.00 0.00 C ATOM 65 CG GLU A 35 12.462 1.721 0.922 1.00 0.00 C ATOM 66 CD GLU A 35 13.373 1.703 2.153 1.00 0.00 C ATOM 67 OE1 GLU A 35 14.367 0.994 2.119 1.00 0.00 O ATOM 68 OE2 GLU A 35 13.062 2.397 3.107 1.00 0.00 O ATOM 0 H GLU A 35 10.716 2.752 -0.503 1.00 0.00 H new ATOM 0 HA GLU A 35 12.789 4.456 0.372 1.00 0.00 H new ATOM 0 HB2 GLU A 35 13.086 1.819 -1.150 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.240 2.512 -0.028 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.532 2.240 1.154 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.197 0.702 0.640 1.00 0.00 H new ATOM 75 N PRO A 36 12.763 4.038 -2.928 1.00 0.00 N ATOM 76 CA PRO A 36 13.302 4.586 -4.213 1.00 0.00 C ATOM 77 C PRO A 36 12.565 5.871 -4.614 1.00 0.00 C ATOM 78 O PRO A 36 13.168 6.829 -5.054 1.00 0.00 O ATOM 79 CB PRO A 36 13.034 3.469 -5.212 1.00 0.00 C ATOM 80 CG PRO A 36 11.883 2.641 -4.672 1.00 0.00 C ATOM 81 CD PRO A 36 11.705 2.995 -3.195 1.00 0.00 C ATOM 0 HA PRO A 36 14.356 4.858 -4.151 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.784 3.881 -6.190 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.922 2.851 -5.344 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.969 2.850 -5.228 1.00 0.00 H new ATOM 0 HG3 PRO A 36 12.091 1.577 -4.788 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.706 3.383 -2.997 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.839 2.121 -2.558 1.00 0.00 H new ATOM 89 N HIS A 37 11.259 5.889 -4.472 1.00 0.00 N ATOM 90 CA HIS A 37 10.450 7.098 -4.846 1.00 0.00 C ATOM 91 C HIS A 37 10.364 7.250 -6.374 1.00 0.00 C ATOM 92 O HIS A 37 9.785 8.199 -6.869 1.00 0.00 O ATOM 93 CB HIS A 37 11.064 8.368 -4.237 1.00 0.00 C ATOM 94 CG HIS A 37 10.003 9.427 -4.111 1.00 0.00 C ATOM 95 ND1 HIS A 37 8.821 9.209 -3.421 1.00 0.00 N ATOM 96 CD2 HIS A 37 9.932 10.715 -4.579 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.095 10.340 -3.493 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.726 11.290 -4.189 1.00 0.00 N ATOM 0 H HIS A 37 10.712 5.108 -4.109 1.00 0.00 H new ATOM 0 HA HIS A 37 9.444 6.961 -4.449 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.489 8.146 -3.258 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.879 8.728 -4.865 1.00 0.00 H new ATOM 0 HD2 HIS A 37 10.696 11.208 -5.162 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.121 10.464 -3.043 1.00 0.00 H new ATOM 0 HE2 HIS A 37 8.395 12.233 -4.391 1.00 0.00 H new ATOM 106 N TYR A 38 10.915 6.325 -7.126 1.00 0.00 N ATOM 107 CA TYR A 38 10.840 6.416 -8.616 1.00 0.00 C ATOM 108 C TYR A 38 10.187 5.142 -9.157 1.00 0.00 C ATOM 109 O TYR A 38 9.418 5.178 -10.097 1.00 0.00 O ATOM 110 CB TYR A 38 12.243 6.577 -9.215 1.00 0.00 C ATOM 111 CG TYR A 38 13.196 5.574 -8.603 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.262 4.270 -9.108 1.00 0.00 C ATOM 113 CD2 TYR A 38 14.019 5.954 -7.536 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.151 3.346 -8.546 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.908 5.030 -6.973 1.00 0.00 C ATOM 116 CZ TYR A 38 14.973 3.726 -7.478 1.00 0.00 C ATOM 117 OH TYR A 38 15.849 2.814 -6.924 1.00 0.00 O ATOM 0 H TYR A 38 11.414 5.510 -6.769 1.00 0.00 H new ATOM 0 HA TYR A 38 10.246 7.286 -8.895 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.202 6.437 -10.295 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.607 7.589 -9.038 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.627 3.977 -9.931 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.968 6.960 -7.147 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.203 2.340 -8.936 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.543 5.323 -6.150 1.00 0.00 H new ATOM 0 HH TYR A 38 16.345 3.239 -6.194 1.00 0.00 H new ATOM 127 N LEU A 39 10.481 4.015 -8.555 1.00 0.00 N ATOM 128 CA LEU A 39 9.881 2.721 -9.001 1.00 0.00 C ATOM 129 C LEU A 39 8.345 2.845 -9.131 1.00 0.00 C ATOM 130 O LEU A 39 7.796 2.512 -10.167 1.00 0.00 O ATOM 131 CB LEU A 39 10.229 1.637 -7.967 1.00 0.00 C ATOM 132 CG LEU A 39 10.881 0.425 -8.657 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.978 -0.109 -9.778 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.228 0.847 -9.249 1.00 0.00 C ATOM 0 H LEU A 39 11.120 3.937 -7.763 1.00 0.00 H new ATOM 0 HA LEU A 39 10.284 2.455 -9.978 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.907 2.045 -7.218 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.327 1.323 -7.443 1.00 0.00 H new ATOM 0 HG LEU A 39 11.026 -0.364 -7.919 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.456 -0.965 -10.254 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.020 -0.415 -9.359 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.816 0.674 -10.519 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.694 -0.008 -9.739 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.072 1.642 -9.978 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.879 1.208 -8.452 1.00 0.00 H new ATOM 146 N PRO A 40 7.684 3.326 -8.092 1.00 0.00 N ATOM 147 CA PRO A 40 6.194 3.503 -8.095 1.00 0.00 C ATOM 148 C PRO A 40 5.800 4.705 -8.963 1.00 0.00 C ATOM 149 O PRO A 40 4.659 4.841 -9.367 1.00 0.00 O ATOM 150 CB PRO A 40 5.846 3.724 -6.630 1.00 0.00 C ATOM 151 CG PRO A 40 7.096 4.237 -5.949 1.00 0.00 C ATOM 152 CD PRO A 40 8.291 3.775 -6.781 1.00 0.00 C ATOM 0 HA PRO A 40 5.660 2.650 -8.514 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.031 4.442 -6.531 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.510 2.795 -6.169 1.00 0.00 H new ATOM 0 HG2 PRO A 40 7.075 5.324 -5.877 1.00 0.00 H new ATOM 0 HG3 PRO A 40 7.165 3.852 -4.932 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.007 4.583 -6.931 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.826 2.961 -6.291 1.00 0.00 H new ATOM 160 N GLN A 41 6.741 5.561 -9.276 1.00 0.00 N ATOM 161 CA GLN A 41 6.436 6.732 -10.143 1.00 0.00 C ATOM 162 C GLN A 41 6.351 6.242 -11.592 1.00 0.00 C ATOM 163 O GLN A 41 5.603 6.767 -12.399 1.00 0.00 O ATOM 164 CB GLN A 41 7.561 7.768 -10.001 1.00 0.00 C ATOM 165 CG GLN A 41 7.303 8.965 -10.923 1.00 0.00 C ATOM 166 CD GLN A 41 6.022 9.679 -10.490 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.797 9.890 -9.315 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.165 10.063 -11.397 1.00 0.00 N ATOM 0 H GLN A 41 7.710 5.496 -8.965 1.00 0.00 H new ATOM 0 HA GLN A 41 5.492 7.194 -9.853 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.626 8.105 -8.966 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.519 7.310 -10.248 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.146 9.655 -10.885 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.213 8.629 -11.956 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.353 9.886 -12.384 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.307 10.540 -11.119 1.00 0.00 H new ATOM 177 N LEU A 42 7.124 5.240 -11.924 1.00 0.00 N ATOM 178 CA LEU A 42 7.116 4.707 -13.307 1.00 0.00 C ATOM 179 C LEU A 42 5.875 3.841 -13.516 1.00 0.00 C ATOM 180 O LEU A 42 5.219 3.923 -14.538 1.00 0.00 O ATOM 181 CB LEU A 42 8.369 3.845 -13.532 1.00 0.00 C ATOM 182 CG LEU A 42 9.709 4.645 -13.452 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.525 6.133 -13.094 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.617 3.998 -12.402 1.00 0.00 C ATOM 0 H LEU A 42 7.764 4.768 -11.285 1.00 0.00 H new ATOM 0 HA LEU A 42 7.107 5.539 -14.011 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.388 3.048 -12.789 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.299 3.368 -14.510 1.00 0.00 H new ATOM 0 HG LEU A 42 10.150 4.609 -14.448 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.499 6.621 -13.057 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.905 6.615 -13.850 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.041 6.216 -12.121 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.554 4.551 -12.341 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.121 4.016 -11.432 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.823 2.966 -12.685 1.00 0.00 H new ATOM 196 N ARG A 43 5.546 3.004 -12.560 1.00 0.00 N ATOM 197 CA ARG A 43 4.346 2.131 -12.714 1.00 0.00 C ATOM 198 C ARG A 43 3.102 3.009 -12.858 1.00 0.00 C ATOM 199 O ARG A 43 2.262 2.778 -13.711 1.00 0.00 O ATOM 200 CB ARG A 43 4.212 1.202 -11.499 1.00 0.00 C ATOM 201 CG ARG A 43 3.886 1.994 -10.230 1.00 0.00 C ATOM 202 CD ARG A 43 3.876 1.045 -9.028 1.00 0.00 C ATOM 203 NE ARG A 43 3.263 1.738 -7.852 1.00 0.00 N ATOM 204 CZ ARG A 43 1.961 1.930 -7.768 1.00 0.00 C ATOM 205 NH1 ARG A 43 1.143 1.526 -8.713 1.00 0.00 N ATOM 206 NH2 ARG A 43 1.474 2.538 -6.722 1.00 0.00 N ATOM 0 H ARG A 43 6.057 2.890 -11.684 1.00 0.00 H new ATOM 0 HA ARG A 43 4.453 1.514 -13.606 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.428 0.468 -11.684 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.140 0.648 -11.357 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.624 2.782 -10.080 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.916 2.481 -10.331 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.312 0.143 -9.267 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.892 0.731 -8.790 1.00 0.00 H new ATOM 0 HE ARG A 43 3.866 2.069 -7.099 1.00 0.00 H new ATOM 0 HH11 ARG A 43 1.511 1.051 -9.537 1.00 0.00 H new ATOM 0 HH12 ARG A 43 0.140 1.687 -8.623 1.00 0.00 H new ATOM 0 HH21 ARG A 43 2.098 2.858 -5.982 1.00 0.00 H new ATOM 0 HH22 ARG A 43 0.469 2.693 -6.644 1.00 0.00 H new ATOM 220 N LYS A 44 2.983 4.030 -12.042 1.00 0.00 N ATOM 221 CA LYS A 44 1.807 4.917 -12.153 1.00 0.00 C ATOM 222 C LYS A 44 1.870 5.632 -13.509 1.00 0.00 C ATOM 223 O LYS A 44 0.858 5.943 -14.101 1.00 0.00 O ATOM 224 CB LYS A 44 1.795 5.928 -10.994 1.00 0.00 C ATOM 225 CG LYS A 44 2.951 6.928 -11.126 1.00 0.00 C ATOM 226 CD LYS A 44 2.844 7.988 -10.024 1.00 0.00 C ATOM 227 CE LYS A 44 3.015 7.328 -8.653 1.00 0.00 C ATOM 228 NZ LYS A 44 2.942 8.370 -7.589 1.00 0.00 N ATOM 0 H LYS A 44 3.651 4.277 -11.312 1.00 0.00 H new ATOM 0 HA LYS A 44 0.886 4.337 -12.092 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.846 6.463 -10.983 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.873 5.399 -10.044 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.906 6.407 -11.052 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.923 7.404 -12.106 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.607 8.753 -10.167 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.877 8.488 -10.080 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.238 6.579 -8.498 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.972 6.809 -8.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.058 7.923 -6.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 3.699 9.069 -7.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.018 8.846 -7.632 1.00 0.00 H new ATOM 242 N ASP A 45 3.063 5.873 -14.005 1.00 0.00 N ATOM 243 CA ASP A 45 3.199 6.541 -15.321 1.00 0.00 C ATOM 244 C ASP A 45 2.641 5.619 -16.404 1.00 0.00 C ATOM 245 O ASP A 45 1.877 6.045 -17.244 1.00 0.00 O ATOM 246 CB ASP A 45 4.671 6.836 -15.606 1.00 0.00 C ATOM 247 CG ASP A 45 5.127 8.042 -14.781 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.310 8.917 -14.543 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.287 8.072 -14.403 1.00 0.00 O ATOM 0 H ASP A 45 3.942 5.632 -13.548 1.00 0.00 H new ATOM 0 HA ASP A 45 2.647 7.481 -15.313 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.280 5.965 -15.362 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.812 7.036 -16.668 1.00 0.00 H new ATOM 254 N ILE A 46 3.008 4.353 -16.391 1.00 0.00 N ATOM 255 CA ILE A 46 2.482 3.412 -17.430 1.00 0.00 C ATOM 256 C ILE A 46 0.947 3.381 -17.355 1.00 0.00 C ATOM 257 O ILE A 46 0.275 3.179 -18.349 1.00 0.00 O ATOM 258 CB ILE A 46 3.092 2.003 -17.237 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.786 1.157 -18.480 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.544 1.297 -15.984 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.519 -0.185 -18.391 1.00 0.00 C ATOM 0 H ILE A 46 3.644 3.938 -15.710 1.00 0.00 H new ATOM 0 HA ILE A 46 2.772 3.758 -18.422 1.00 0.00 H new ATOM 0 HB ILE A 46 4.168 2.116 -17.100 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.712 0.990 -18.561 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.095 1.691 -19.379 1.00 0.00 H new ATOM 0 HG21 ILE A 46 3.002 0.312 -15.892 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.778 1.890 -15.100 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.463 1.188 -16.071 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.297 -0.780 -19.277 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.593 -0.010 -18.331 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.189 -0.721 -17.501 1.00 0.00 H new ATOM 273 N LEU A 47 0.393 3.609 -16.186 1.00 0.00 N ATOM 274 CA LEU A 47 -1.087 3.626 -16.048 1.00 0.00 C ATOM 275 C LEU A 47 -1.625 4.825 -16.826 1.00 0.00 C ATOM 276 O LEU A 47 -2.525 4.703 -17.638 1.00 0.00 O ATOM 277 CB LEU A 47 -1.467 3.763 -14.571 1.00 0.00 C ATOM 278 CG LEU A 47 -1.379 2.399 -13.885 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.482 2.582 -12.370 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.526 1.514 -14.371 1.00 0.00 C ATOM 0 H LEU A 47 0.909 3.784 -15.324 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.511 2.700 -16.437 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.801 4.472 -14.079 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.478 4.161 -14.481 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.426 1.929 -14.129 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.419 1.610 -11.881 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.666 3.216 -12.024 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.435 3.051 -12.124 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.466 0.541 -13.884 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.478 1.985 -14.126 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.453 1.384 -15.451 1.00 0.00 H new ATOM 292 N GLU A 48 -1.054 5.982 -16.599 1.00 0.00 N ATOM 293 CA GLU A 48 -1.500 7.196 -17.334 1.00 0.00 C ATOM 294 C GLU A 48 -1.141 7.015 -18.796 1.00 0.00 C ATOM 295 O GLU A 48 -1.873 7.410 -19.683 1.00 0.00 O ATOM 296 CB GLU A 48 -0.780 8.445 -16.818 1.00 0.00 C ATOM 297 CG GLU A 48 -0.821 8.498 -15.295 1.00 0.00 C ATOM 298 CD GLU A 48 -2.272 8.587 -14.813 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.879 9.626 -15.015 1.00 0.00 O ATOM 300 OE2 GLU A 48 -2.750 7.615 -14.252 1.00 0.00 O ATOM 0 H GLU A 48 -0.296 6.134 -15.933 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.573 7.324 -17.192 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.255 8.442 -17.159 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.249 9.338 -17.231 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.345 7.610 -14.879 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.257 9.359 -14.938 1.00 0.00 H new ATOM 307 N VAL A 49 -0.006 6.410 -19.048 1.00 0.00 N ATOM 308 CA VAL A 49 0.425 6.186 -20.452 1.00 0.00 C ATOM 309 C VAL A 49 -0.653 5.362 -21.166 1.00 0.00 C ATOM 310 O VAL A 49 -1.212 5.791 -22.151 1.00 0.00 O ATOM 311 CB VAL A 49 1.774 5.450 -20.472 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.203 5.168 -21.921 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.839 6.319 -19.784 1.00 0.00 C ATOM 0 H VAL A 49 0.638 6.063 -18.337 1.00 0.00 H new ATOM 0 HA VAL A 49 0.552 7.139 -20.965 1.00 0.00 H new ATOM 0 HB VAL A 49 1.670 4.503 -19.942 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.160 4.646 -21.922 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.451 4.548 -22.409 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.302 6.110 -22.461 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.797 5.799 -19.797 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.933 7.267 -20.314 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.543 6.508 -18.752 1.00 0.00 H new ATOM 323 N ILE A 50 -0.982 4.199 -20.649 1.00 0.00 N ATOM 324 CA ILE A 50 -2.062 3.375 -21.284 1.00 0.00 C ATOM 325 C ILE A 50 -3.341 4.218 -21.383 1.00 0.00 C ATOM 326 O ILE A 50 -4.183 3.983 -22.229 1.00 0.00 O ATOM 327 CB ILE A 50 -2.322 2.118 -20.446 1.00 0.00 C ATOM 328 CG1 ILE A 50 -1.018 1.331 -20.292 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.362 1.240 -21.146 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.991 0.649 -18.923 1.00 0.00 C ATOM 0 H ILE A 50 -0.552 3.788 -19.820 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.750 3.068 -22.282 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.694 2.409 -19.464 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.935 0.586 -21.083 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.163 2.000 -20.394 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.545 0.347 -20.549 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.292 1.798 -21.260 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.991 0.949 -22.129 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.062 0.089 -18.814 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.054 1.404 -18.139 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.838 -0.032 -18.839 1.00 0.00 H new ATOM 342 N CYS A 51 -3.476 5.212 -20.536 1.00 0.00 N ATOM 343 CA CYS A 51 -4.673 6.088 -20.588 1.00 0.00 C ATOM 344 C CYS A 51 -4.547 7.044 -21.781 1.00 0.00 C ATOM 345 O CYS A 51 -5.476 7.232 -22.538 1.00 0.00 O ATOM 346 CB CYS A 51 -4.769 6.899 -19.291 1.00 0.00 C ATOM 347 SG CYS A 51 -6.466 7.489 -19.073 1.00 0.00 S ATOM 0 H CYS A 51 -2.800 5.449 -19.810 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.569 5.478 -20.700 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.475 6.283 -18.441 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.081 7.743 -19.326 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.549 8.175 -17.972 1.00 0.00 H new ATOM 353 N LYS A 52 -3.396 7.644 -21.956 1.00 0.00 N ATOM 354 CA LYS A 52 -3.199 8.593 -23.100 1.00 0.00 C ATOM 355 C LYS A 52 -3.506 7.892 -24.425 1.00 0.00 C ATOM 356 O LYS A 52 -3.954 8.508 -25.375 1.00 0.00 O ATOM 357 CB LYS A 52 -1.745 9.076 -23.141 1.00 0.00 C ATOM 358 CG LYS A 52 -1.359 9.736 -21.817 1.00 0.00 C ATOM 359 CD LYS A 52 0.162 9.653 -21.644 1.00 0.00 C ATOM 360 CE LYS A 52 0.803 10.951 -22.136 1.00 0.00 C ATOM 361 NZ LYS A 52 0.843 11.940 -21.022 1.00 0.00 N ATOM 0 H LYS A 52 -2.581 7.519 -21.356 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.871 9.439 -22.959 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.082 8.234 -23.341 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.615 9.785 -23.959 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.683 10.777 -21.806 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.860 9.237 -20.987 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.411 9.487 -20.596 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.557 8.805 -22.204 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.812 10.756 -22.499 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.235 11.354 -22.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.279 12.823 -21.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.125 12.134 -20.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.403 11.554 -20.235 1.00 0.00 H new ATOM 375 N TYR A 53 -3.248 6.615 -24.496 1.00 0.00 N ATOM 376 CA TYR A 53 -3.492 5.859 -25.748 1.00 0.00 C ATOM 377 C TYR A 53 -4.779 5.024 -25.622 1.00 0.00 C ATOM 378 O TYR A 53 -5.314 4.557 -26.610 1.00 0.00 O ATOM 379 CB TYR A 53 -2.312 4.912 -25.992 1.00 0.00 C ATOM 380 CG TYR A 53 -1.013 5.678 -26.168 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.475 6.416 -25.105 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.329 5.624 -27.388 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.733 7.100 -25.259 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.885 6.306 -27.541 1.00 0.00 C ATOM 385 CZ TYR A 53 1.415 7.045 -26.474 1.00 0.00 C ATOM 386 OH TYR A 53 2.611 7.716 -26.626 1.00 0.00 O ATOM 0 H TYR A 53 -2.873 6.060 -23.727 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.598 6.561 -26.575 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.218 4.222 -25.154 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.504 4.310 -26.880 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.998 6.456 -24.161 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.737 5.057 -28.211 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.139 7.671 -24.437 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.413 6.262 -28.482 1.00 0.00 H new ATOM 0 HH TYR A 53 2.954 7.572 -27.533 1.00 0.00 H new ATOM 396 N VAL A 54 -5.271 4.815 -24.419 1.00 0.00 N ATOM 397 CA VAL A 54 -6.512 3.989 -24.237 1.00 0.00 C ATOM 398 C VAL A 54 -7.250 4.490 -22.972 1.00 0.00 C ATOM 399 O VAL A 54 -7.336 5.680 -22.752 1.00 0.00 O ATOM 400 CB VAL A 54 -6.144 2.489 -24.106 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.346 1.638 -24.523 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.955 2.128 -25.008 1.00 0.00 C ATOM 0 H VAL A 54 -4.867 5.181 -23.557 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.164 4.093 -25.104 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.871 2.295 -23.069 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.093 0.582 -24.433 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.194 1.864 -23.876 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.609 1.861 -25.557 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.720 1.070 -24.894 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.211 2.333 -26.047 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.088 2.724 -24.723 1.00 0.00 H new ATOM 412 N GLN A 55 -7.788 3.616 -22.139 1.00 0.00 N ATOM 413 CA GLN A 55 -8.497 4.092 -20.915 1.00 0.00 C ATOM 414 C GLN A 55 -8.774 2.907 -19.987 1.00 0.00 C ATOM 415 O GLN A 55 -9.603 2.062 -20.267 1.00 0.00 O ATOM 416 CB GLN A 55 -9.816 4.762 -21.313 1.00 0.00 C ATOM 417 CG GLN A 55 -9.750 6.261 -21.007 1.00 0.00 C ATOM 418 CD GLN A 55 -11.074 6.922 -21.396 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.777 7.440 -20.552 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.445 6.926 -22.647 1.00 0.00 N ATOM 0 H GLN A 55 -7.762 2.604 -22.260 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.871 4.816 -20.392 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -10.008 4.606 -22.375 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.644 4.307 -20.770 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.551 6.418 -19.947 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.928 6.719 -21.557 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -10.854 6.491 -23.356 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.326 7.364 -22.916 1.00 0.00 H new ATOM 429 N ILE A 56 -8.080 2.851 -18.885 1.00 0.00 N ATOM 430 CA ILE A 56 -8.276 1.735 -17.910 1.00 0.00 C ATOM 431 C ILE A 56 -8.206 2.296 -16.492 1.00 0.00 C ATOM 432 O ILE A 56 -7.792 3.421 -16.282 1.00 0.00 O ATOM 433 CB ILE A 56 -7.183 0.673 -18.087 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.830 1.345 -18.367 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.548 -0.247 -19.251 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.723 0.609 -17.610 1.00 0.00 C ATOM 0 H ILE A 56 -7.377 3.538 -18.613 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.248 1.274 -18.086 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.105 0.089 -17.170 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.622 1.334 -19.437 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.861 2.390 -18.059 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.771 -1.001 -19.376 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.499 -0.737 -19.043 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.635 0.340 -20.165 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.765 1.088 -17.811 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.929 0.643 -16.540 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.686 -0.429 -17.939 1.00 0.00 H new ATOM 448 N ASP A 57 -8.601 1.520 -15.520 1.00 0.00 N ATOM 449 CA ASP A 57 -8.552 1.998 -14.109 1.00 0.00 C ATOM 450 C ASP A 57 -7.350 1.354 -13.406 1.00 0.00 C ATOM 451 O ASP A 57 -6.810 0.383 -13.899 1.00 0.00 O ATOM 452 CB ASP A 57 -9.841 1.596 -13.388 1.00 0.00 C ATOM 453 CG ASP A 57 -10.906 2.672 -13.604 1.00 0.00 C ATOM 454 OD1 ASP A 57 -11.375 2.798 -14.723 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.234 3.353 -12.646 1.00 0.00 O ATOM 0 H ASP A 57 -8.957 0.572 -15.643 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.453 3.083 -14.090 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.197 0.637 -13.765 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.649 1.468 -12.323 1.00 0.00 H new ATOM 460 N PRO A 58 -6.958 1.894 -12.269 1.00 0.00 N ATOM 461 CA PRO A 58 -5.805 1.360 -11.480 1.00 0.00 C ATOM 462 C PRO A 58 -6.209 0.059 -10.796 1.00 0.00 C ATOM 463 O PRO A 58 -5.399 -0.828 -10.599 1.00 0.00 O ATOM 464 CB PRO A 58 -5.502 2.462 -10.476 1.00 0.00 C ATOM 465 CG PRO A 58 -6.773 3.270 -10.314 1.00 0.00 C ATOM 466 CD PRO A 58 -7.591 3.087 -11.594 1.00 0.00 C ATOM 0 HA PRO A 58 -4.931 1.122 -12.087 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.189 2.039 -9.521 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.686 3.092 -10.829 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.337 2.930 -9.445 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.542 4.323 -10.152 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.643 2.908 -11.372 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.545 3.974 -12.226 1.00 0.00 H new ATOM 474 N GLU A 59 -7.470 -0.077 -10.470 1.00 0.00 N ATOM 475 CA GLU A 59 -7.946 -1.340 -9.843 1.00 0.00 C ATOM 476 C GLU A 59 -7.841 -2.482 -10.869 1.00 0.00 C ATOM 477 O GLU A 59 -7.917 -3.644 -10.518 1.00 0.00 O ATOM 478 CB GLU A 59 -9.403 -1.176 -9.406 1.00 0.00 C ATOM 479 CG GLU A 59 -9.497 -0.084 -8.338 1.00 0.00 C ATOM 480 CD GLU A 59 -9.291 -0.704 -6.955 1.00 0.00 C ATOM 481 OE1 GLU A 59 -8.501 -1.626 -6.852 1.00 0.00 O ATOM 482 OE2 GLU A 59 -9.928 -0.244 -6.021 1.00 0.00 O ATOM 0 H GLU A 59 -8.188 0.634 -10.612 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.333 -1.572 -8.972 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -10.024 -0.915 -10.263 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.784 -2.118 -9.012 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.744 0.683 -8.520 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.470 0.405 -8.388 1.00 0.00 H new ATOM 489 N MET A 60 -7.662 -2.159 -12.135 1.00 0.00 N ATOM 490 CA MET A 60 -7.545 -3.215 -13.178 1.00 0.00 C ATOM 491 C MET A 60 -6.075 -3.614 -13.335 1.00 0.00 C ATOM 492 O MET A 60 -5.764 -4.709 -13.762 1.00 0.00 O ATOM 493 CB MET A 60 -8.071 -2.663 -14.507 1.00 0.00 C ATOM 494 CG MET A 60 -9.607 -2.713 -14.522 1.00 0.00 C ATOM 495 SD MET A 60 -10.174 -4.067 -15.585 1.00 0.00 S ATOM 496 CE MET A 60 -10.017 -3.194 -17.161 1.00 0.00 C ATOM 0 H MET A 60 -7.593 -1.203 -12.483 1.00 0.00 H new ATOM 0 HA MET A 60 -8.127 -4.090 -12.887 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.730 -1.637 -14.645 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.671 -3.246 -15.337 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.984 -2.853 -13.509 1.00 0.00 H new ATOM 0 HG3 MET A 60 -10.006 -1.765 -14.883 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.827 -3.913 -17.958 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.940 -2.654 -17.372 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.189 -2.488 -17.105 1.00 0.00 H new ATOM 506 N VAL A 61 -5.168 -2.726 -13.001 1.00 0.00 N ATOM 507 CA VAL A 61 -3.717 -3.041 -13.133 1.00 0.00 C ATOM 508 C VAL A 61 -3.168 -3.523 -11.786 1.00 0.00 C ATOM 509 O VAL A 61 -3.372 -2.894 -10.764 1.00 0.00 O ATOM 510 CB VAL A 61 -2.972 -1.776 -13.572 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.496 -2.097 -13.816 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.600 -1.243 -14.865 1.00 0.00 C ATOM 0 H VAL A 61 -5.375 -1.794 -12.642 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.577 -3.827 -13.875 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.047 -1.023 -12.788 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.974 -1.193 -14.128 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -1.049 -2.476 -12.897 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.412 -2.852 -14.598 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.073 -0.343 -15.181 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.525 -2.000 -15.645 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.649 -1.006 -14.689 1.00 0.00 H new ATOM 522 N THR A 62 -2.474 -4.635 -11.779 1.00 0.00 N ATOM 523 CA THR A 62 -1.908 -5.165 -10.509 1.00 0.00 C ATOM 524 C THR A 62 -0.423 -4.808 -10.419 1.00 0.00 C ATOM 525 O THR A 62 0.217 -4.528 -11.416 1.00 0.00 O ATOM 526 CB THR A 62 -2.065 -6.687 -10.467 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.330 -7.047 -11.005 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.969 -7.171 -9.020 1.00 0.00 C ATOM 0 H THR A 62 -2.277 -5.198 -12.606 1.00 0.00 H new ATOM 0 HA THR A 62 -2.442 -4.722 -9.669 1.00 0.00 H new ATOM 0 HB THR A 62 -1.274 -7.150 -11.057 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.431 -8.021 -10.980 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.081 -8.255 -8.991 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.998 -6.895 -8.608 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.759 -6.709 -8.428 1.00 0.00 H new ATOM 536 N VAL A 63 0.127 -4.818 -9.231 1.00 0.00 N ATOM 537 CA VAL A 63 1.570 -4.484 -9.064 1.00 0.00 C ATOM 538 C VAL A 63 2.169 -5.378 -7.980 1.00 0.00 C ATOM 539 O VAL A 63 1.825 -5.267 -6.817 1.00 0.00 O ATOM 540 CB VAL A 63 1.706 -3.023 -8.645 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.186 -2.631 -8.612 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.972 -2.138 -9.650 1.00 0.00 C ATOM 0 H VAL A 63 -0.366 -5.044 -8.367 1.00 0.00 H new ATOM 0 HA VAL A 63 2.095 -4.644 -10.005 1.00 0.00 H new ATOM 0 HB VAL A 63 1.274 -2.890 -7.653 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.279 -1.587 -8.312 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.714 -3.262 -7.897 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.620 -2.764 -9.603 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.068 -1.094 -9.353 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.406 -2.275 -10.640 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.082 -2.413 -9.675 1.00 0.00 H new ATOM 552 N GLN A 64 3.059 -6.262 -8.349 1.00 0.00 N ATOM 553 CA GLN A 64 3.679 -7.164 -7.339 1.00 0.00 C ATOM 554 C GLN A 64 5.205 -7.066 -7.426 1.00 0.00 C ATOM 555 O GLN A 64 5.789 -7.240 -8.479 1.00 0.00 O ATOM 556 CB GLN A 64 3.230 -8.610 -7.595 1.00 0.00 C ATOM 557 CG GLN A 64 3.494 -8.993 -9.060 1.00 0.00 C ATOM 558 CD GLN A 64 2.173 -9.045 -9.831 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.272 -8.273 -9.569 1.00 0.00 O ATOM 560 NE2 GLN A 64 2.018 -9.930 -10.778 1.00 0.00 N ATOM 0 H GLN A 64 3.382 -6.397 -9.307 1.00 0.00 H new ATOM 0 HA GLN A 64 3.361 -6.863 -6.341 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.766 -9.288 -6.931 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.169 -8.715 -7.369 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.165 -8.267 -9.519 1.00 0.00 H new ATOM 0 HG3 GLN A 64 3.991 -9.962 -9.108 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.774 -10.578 -10.999 1.00 0.00 H new ATOM 0 HE22 GLN A 64 1.141 -9.973 -11.297 1.00 0.00 H new ATOM 569 N LEU A 65 5.854 -6.781 -6.324 1.00 0.00 N ATOM 570 CA LEU A 65 7.335 -6.663 -6.338 1.00 0.00 C ATOM 571 C LEU A 65 7.967 -7.941 -5.790 1.00 0.00 C ATOM 572 O LEU A 65 7.662 -8.381 -4.697 1.00 0.00 O ATOM 573 CB LEU A 65 7.758 -5.472 -5.479 1.00 0.00 C ATOM 574 CG LEU A 65 7.134 -5.581 -4.078 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.230 -5.463 -3.015 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.115 -4.455 -3.881 1.00 0.00 C ATOM 0 H LEU A 65 5.416 -6.626 -5.416 1.00 0.00 H new ATOM 0 HA LEU A 65 7.673 -6.512 -7.363 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.845 -5.439 -5.400 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.445 -4.542 -5.954 1.00 0.00 H new ATOM 0 HG LEU A 65 6.636 -6.546 -3.981 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.785 -5.541 -2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.956 -6.265 -3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.730 -4.500 -3.114 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.673 -4.534 -2.888 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.614 -3.491 -3.981 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.331 -4.538 -4.634 1.00 0.00 H new ATOM 588 N GLU A 66 8.854 -8.532 -6.545 1.00 0.00 N ATOM 589 CA GLU A 66 9.528 -9.777 -6.086 1.00 0.00 C ATOM 590 C GLU A 66 11.020 -9.495 -5.914 1.00 0.00 C ATOM 591 O GLU A 66 11.492 -8.418 -6.225 1.00 0.00 O ATOM 592 CB GLU A 66 9.326 -10.886 -7.130 1.00 0.00 C ATOM 593 CG GLU A 66 7.883 -11.402 -7.097 1.00 0.00 C ATOM 594 CD GLU A 66 7.535 -11.924 -5.698 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.027 -12.981 -5.342 1.00 0.00 O ATOM 596 OE2 GLU A 66 6.781 -11.256 -5.009 1.00 0.00 O ATOM 0 H GLU A 66 9.141 -8.202 -7.466 1.00 0.00 H new ATOM 0 HA GLU A 66 9.103 -10.102 -5.136 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.559 -10.504 -8.124 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.016 -11.707 -6.935 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.197 -10.602 -7.375 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.758 -12.198 -7.831 1.00 0.00 H new ATOM 603 N GLN A 67 11.765 -10.447 -5.415 1.00 0.00 N ATOM 604 CA GLN A 67 13.228 -10.228 -5.219 1.00 0.00 C ATOM 605 C GLN A 67 14.008 -11.410 -5.794 1.00 0.00 C ATOM 606 O GLN A 67 13.436 -12.398 -6.214 1.00 0.00 O ATOM 607 CB GLN A 67 13.530 -10.093 -3.725 1.00 0.00 C ATOM 608 CG GLN A 67 13.064 -8.721 -3.233 1.00 0.00 C ATOM 609 CD GLN A 67 12.561 -8.839 -1.793 1.00 0.00 C ATOM 610 OE1 GLN A 67 13.073 -9.626 -1.021 1.00 0.00 O ATOM 611 NE2 GLN A 67 11.573 -8.086 -1.397 1.00 0.00 N ATOM 0 H GLN A 67 11.423 -11.366 -5.135 1.00 0.00 H new ATOM 0 HA GLN A 67 13.527 -9.315 -5.734 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.025 -10.882 -3.168 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.599 -10.212 -3.547 1.00 0.00 H new ATOM 0 HG2 GLN A 67 13.885 -8.006 -3.285 1.00 0.00 H new ATOM 0 HG3 GLN A 67 12.270 -8.342 -3.877 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.144 -7.426 -2.045 1.00 0.00 H new ATOM 0 HE22 GLN A 67 11.230 -8.157 -0.439 1.00 0.00 H new ATOM 620 N LYS A 68 15.312 -11.308 -5.822 1.00 0.00 N ATOM 621 CA LYS A 68 16.144 -12.420 -6.379 1.00 0.00 C ATOM 622 C LYS A 68 17.291 -12.720 -5.411 1.00 0.00 C ATOM 623 O LYS A 68 17.618 -11.917 -4.557 1.00 0.00 O ATOM 624 CB LYS A 68 16.730 -12.025 -7.748 1.00 0.00 C ATOM 625 CG LYS A 68 15.766 -11.089 -8.507 1.00 0.00 C ATOM 626 CD LYS A 68 15.850 -11.313 -10.029 1.00 0.00 C ATOM 627 CE LYS A 68 17.306 -11.311 -10.521 1.00 0.00 C ATOM 628 NZ LYS A 68 17.632 -12.642 -11.109 1.00 0.00 N ATOM 0 H LYS A 68 15.838 -10.503 -5.483 1.00 0.00 H new ATOM 0 HA LYS A 68 15.515 -13.301 -6.506 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.691 -11.529 -7.608 1.00 0.00 H new ATOM 0 HB3 LYS A 68 16.917 -12.920 -8.341 1.00 0.00 H new ATOM 0 HG2 LYS A 68 14.745 -11.263 -8.168 1.00 0.00 H new ATOM 0 HG3 LYS A 68 16.007 -10.051 -8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.380 -12.263 -10.284 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.290 -10.532 -10.544 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.449 -10.528 -11.265 1.00 0.00 H new ATOM 0 HE3 LYS A 68 17.981 -11.092 -9.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.617 -12.642 -11.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.511 -13.380 -10.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.996 -12.833 -11.909 1.00 0.00 H new ATOM 642 N ASP A 69 17.899 -13.873 -5.535 1.00 0.00 N ATOM 643 CA ASP A 69 19.022 -14.237 -4.624 1.00 0.00 C ATOM 644 C ASP A 69 20.322 -13.568 -5.093 1.00 0.00 C ATOM 645 O ASP A 69 21.304 -14.230 -5.377 1.00 0.00 O ATOM 646 CB ASP A 69 19.197 -15.762 -4.605 1.00 0.00 C ATOM 647 CG ASP A 69 19.313 -16.295 -6.037 1.00 0.00 C ATOM 648 OD1 ASP A 69 19.841 -15.583 -6.875 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.870 -17.407 -6.270 1.00 0.00 O ATOM 0 H ASP A 69 17.663 -14.580 -6.232 1.00 0.00 H new ATOM 0 HA ASP A 69 18.791 -13.888 -3.618 1.00 0.00 H new ATOM 0 HB2 ASP A 69 20.089 -16.027 -4.036 1.00 0.00 H new ATOM 0 HB3 ASP A 69 18.349 -16.227 -4.103 1.00 0.00 H new ATOM 654 N GLY A 70 20.336 -12.259 -5.174 1.00 0.00 N ATOM 655 CA GLY A 70 21.572 -11.547 -5.620 1.00 0.00 C ATOM 656 C GLY A 70 21.382 -10.032 -5.494 1.00 0.00 C ATOM 657 O GLY A 70 21.905 -9.269 -6.283 1.00 0.00 O ATOM 0 H GLY A 70 19.545 -11.655 -4.951 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.422 -11.866 -5.017 1.00 0.00 H new ATOM 0 HA3 GLY A 70 21.798 -11.808 -6.654 1.00 0.00 H new ATOM 661 N ASP A 71 20.632 -9.596 -4.512 1.00 0.00 N ATOM 662 CA ASP A 71 20.390 -8.133 -4.321 1.00 0.00 C ATOM 663 C ASP A 71 19.704 -7.572 -5.566 1.00 0.00 C ATOM 664 O ASP A 71 20.038 -6.507 -6.051 1.00 0.00 O ATOM 665 CB ASP A 71 21.718 -7.406 -4.083 1.00 0.00 C ATOM 666 CG ASP A 71 22.168 -7.627 -2.638 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.351 -7.451 -1.750 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.323 -7.969 -2.443 1.00 0.00 O ATOM 0 H ASP A 71 20.173 -10.198 -3.828 1.00 0.00 H new ATOM 0 HA ASP A 71 19.750 -7.982 -3.452 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.477 -7.777 -4.772 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.602 -6.340 -4.280 1.00 0.00 H new ATOM 673 N ILE A 72 18.752 -8.298 -6.087 1.00 0.00 N ATOM 674 CA ILE A 72 18.032 -7.842 -7.310 1.00 0.00 C ATOM 675 C ILE A 72 16.524 -7.877 -7.044 1.00 0.00 C ATOM 676 O ILE A 72 16.033 -8.728 -6.325 1.00 0.00 O ATOM 677 CB ILE A 72 18.384 -8.763 -8.481 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.907 -9.010 -8.500 1.00 0.00 C ATOM 679 CG2 ILE A 72 17.931 -8.097 -9.787 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.330 -9.765 -9.771 1.00 0.00 C ATOM 0 H ILE A 72 18.440 -9.195 -5.714 1.00 0.00 H new ATOM 0 HA ILE A 72 18.329 -6.824 -7.561 1.00 0.00 H new ATOM 0 HB ILE A 72 17.878 -9.722 -8.373 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.434 -8.057 -8.447 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.196 -9.583 -7.619 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.176 -8.744 -10.629 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.854 -7.933 -9.757 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.441 -7.141 -9.903 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.408 -9.925 -9.757 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.821 -10.728 -9.809 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.062 -9.178 -10.649 1.00 0.00 H new ATOM 692 N SER A 73 15.790 -6.949 -7.606 1.00 0.00 N ATOM 693 CA SER A 73 14.316 -6.910 -7.377 1.00 0.00 C ATOM 694 C SER A 73 13.582 -7.283 -8.665 1.00 0.00 C ATOM 695 O SER A 73 14.176 -7.394 -9.721 1.00 0.00 O ATOM 696 CB SER A 73 13.902 -5.502 -6.947 1.00 0.00 C ATOM 697 OG SER A 73 14.229 -5.316 -5.577 1.00 0.00 O ATOM 0 H SER A 73 16.151 -6.215 -8.215 1.00 0.00 H new ATOM 0 HA SER A 73 14.056 -7.623 -6.594 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.411 -4.758 -7.559 1.00 0.00 H new ATOM 0 HB3 SER A 73 12.832 -5.362 -7.100 1.00 0.00 H new ATOM 0 HG SER A 73 13.967 -4.414 -5.298 1.00 0.00 H new ATOM 703 N ILE A 74 12.295 -7.487 -8.575 1.00 0.00 N ATOM 704 CA ILE A 74 11.498 -7.868 -9.773 1.00 0.00 C ATOM 705 C ILE A 74 10.082 -7.288 -9.645 1.00 0.00 C ATOM 706 O ILE A 74 9.185 -7.937 -9.141 1.00 0.00 O ATOM 707 CB ILE A 74 11.427 -9.398 -9.842 1.00 0.00 C ATOM 708 CG1 ILE A 74 12.854 -9.968 -9.947 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.577 -9.832 -11.047 1.00 0.00 C ATOM 710 CD1 ILE A 74 12.818 -11.495 -10.135 1.00 0.00 C ATOM 0 H ILE A 74 11.758 -7.404 -7.712 1.00 0.00 H new ATOM 0 HA ILE A 74 11.963 -7.477 -10.678 1.00 0.00 H new ATOM 0 HB ILE A 74 10.957 -9.785 -8.938 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.375 -9.506 -10.786 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.417 -9.721 -9.047 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.532 -10.920 -11.088 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.569 -9.431 -10.944 1.00 0.00 H new ATOM 0 HG23 ILE A 74 11.026 -9.453 -11.965 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.836 -11.877 -10.207 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.317 -11.955 -9.283 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.275 -11.736 -11.049 1.00 0.00 H new ATOM 722 N LEU A 75 9.878 -6.076 -10.096 1.00 0.00 N ATOM 723 CA LEU A 75 8.526 -5.457 -9.999 1.00 0.00 C ATOM 724 C LEU A 75 7.669 -5.886 -11.191 1.00 0.00 C ATOM 725 O LEU A 75 7.864 -5.436 -12.304 1.00 0.00 O ATOM 726 CB LEU A 75 8.659 -3.933 -9.978 1.00 0.00 C ATOM 727 CG LEU A 75 7.298 -3.307 -9.660 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.499 -2.031 -8.839 1.00 0.00 C ATOM 729 CD2 LEU A 75 6.578 -2.966 -10.968 1.00 0.00 C ATOM 0 H LEU A 75 10.592 -5.489 -10.528 1.00 0.00 H new ATOM 0 HA LEU A 75 8.045 -5.790 -9.079 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.394 -3.631 -9.231 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.020 -3.575 -10.942 1.00 0.00 H new ATOM 0 HG LEU A 75 6.698 -4.014 -9.087 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.529 -1.587 -8.614 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.012 -2.274 -7.908 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.099 -1.322 -9.409 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.609 -2.520 -10.744 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.179 -2.259 -11.541 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.433 -3.875 -11.551 1.00 0.00 H new ATOM 741 N GLU A 76 6.715 -6.752 -10.957 1.00 0.00 N ATOM 742 CA GLU A 76 5.826 -7.223 -12.062 1.00 0.00 C ATOM 743 C GLU A 76 4.467 -6.534 -11.929 1.00 0.00 C ATOM 744 O GLU A 76 3.846 -6.581 -10.887 1.00 0.00 O ATOM 745 CB GLU A 76 5.628 -8.744 -11.966 1.00 0.00 C ATOM 746 CG GLU A 76 6.971 -9.445 -11.736 1.00 0.00 C ATOM 747 CD GLU A 76 6.719 -10.880 -11.268 1.00 0.00 C ATOM 748 OE1 GLU A 76 5.840 -11.517 -11.824 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.409 -11.316 -10.362 1.00 0.00 O ATOM 0 H GLU A 76 6.513 -7.155 -10.042 1.00 0.00 H new ATOM 0 HA GLU A 76 6.282 -6.981 -13.022 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.945 -8.977 -11.150 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.169 -9.116 -12.882 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.555 -9.448 -12.656 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.554 -8.904 -10.990 1.00 0.00 H new ATOM 756 N LEU A 77 3.995 -5.897 -12.971 1.00 0.00 N ATOM 757 CA LEU A 77 2.669 -5.216 -12.885 1.00 0.00 C ATOM 758 C LEU A 77 1.716 -5.823 -13.917 1.00 0.00 C ATOM 759 O LEU A 77 2.032 -5.938 -15.086 1.00 0.00 O ATOM 760 CB LEU A 77 2.825 -3.709 -13.128 1.00 0.00 C ATOM 761 CG LEU A 77 3.600 -3.456 -14.421 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.099 -2.165 -15.069 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.092 -3.318 -14.103 1.00 0.00 C ATOM 0 H LEU A 77 4.468 -5.820 -13.872 1.00 0.00 H new ATOM 0 HA LEU A 77 2.257 -5.361 -11.886 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.843 -3.240 -13.187 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.347 -3.251 -12.288 1.00 0.00 H new ATOM 0 HG LEU A 77 3.449 -4.291 -15.105 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.651 -1.983 -15.991 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.037 -2.259 -15.294 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.252 -1.331 -14.384 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.645 -3.138 -15.025 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.243 -2.482 -13.420 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.451 -4.236 -13.638 1.00 0.00 H new ATOM 775 N ASN A 78 0.551 -6.217 -13.483 1.00 0.00 N ATOM 776 CA ASN A 78 -0.438 -6.820 -14.411 1.00 0.00 C ATOM 777 C ASN A 78 -1.299 -5.713 -14.993 1.00 0.00 C ATOM 778 O ASN A 78 -1.650 -4.775 -14.308 1.00 0.00 O ATOM 779 CB ASN A 78 -1.326 -7.776 -13.630 1.00 0.00 C ATOM 780 CG ASN A 78 -0.451 -8.786 -12.888 1.00 0.00 C ATOM 781 OD1 ASN A 78 0.311 -8.422 -12.016 1.00 0.00 O ATOM 782 ND2 ASN A 78 -0.530 -10.047 -13.201 1.00 0.00 N ATOM 0 H ASN A 78 0.242 -6.145 -12.514 1.00 0.00 H new ATOM 0 HA ASN A 78 0.075 -7.356 -15.210 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.942 -7.222 -12.922 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.006 -8.294 -14.307 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.049 -10.731 -12.713 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -1.171 -10.351 -13.934 1.00 0.00 H new ATOM 789 N VAL A 79 -1.641 -5.808 -16.248 1.00 0.00 N ATOM 790 CA VAL A 79 -2.483 -4.749 -16.870 1.00 0.00 C ATOM 791 C VAL A 79 -3.742 -5.379 -17.466 1.00 0.00 C ATOM 792 O VAL A 79 -3.756 -5.804 -18.606 1.00 0.00 O ATOM 793 CB VAL A 79 -1.689 -4.038 -17.966 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.455 -2.793 -18.408 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.318 -3.626 -17.418 1.00 0.00 C ATOM 0 H VAL A 79 -1.374 -6.572 -16.869 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.771 -4.023 -16.110 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.552 -4.708 -18.815 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.895 -2.280 -19.190 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.432 -3.085 -18.793 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.585 -2.125 -17.557 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.249 -3.119 -18.199 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.452 -2.952 -16.572 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.226 -4.513 -17.093 1.00 0.00 H new ATOM 805 N THR A 80 -4.798 -5.439 -16.697 1.00 0.00 N ATOM 806 CA THR A 80 -6.067 -6.038 -17.201 1.00 0.00 C ATOM 807 C THR A 80 -6.824 -5.003 -18.036 1.00 0.00 C ATOM 808 O THR A 80 -7.455 -4.109 -17.506 1.00 0.00 O ATOM 809 CB THR A 80 -6.934 -6.469 -16.015 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.186 -7.338 -15.175 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.181 -7.196 -16.522 1.00 0.00 C ATOM 0 H THR A 80 -4.835 -5.097 -15.737 1.00 0.00 H new ATOM 0 HA THR A 80 -5.838 -6.906 -17.819 1.00 0.00 H new ATOM 0 HB THR A 80 -7.238 -5.587 -15.451 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.804 -6.826 -14.432 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.795 -7.501 -15.674 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.755 -6.528 -17.164 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.883 -8.078 -17.089 1.00 0.00 H new ATOM 819 N LEU A 81 -6.765 -5.122 -19.338 1.00 0.00 N ATOM 820 CA LEU A 81 -7.477 -4.156 -20.216 1.00 0.00 C ATOM 821 C LEU A 81 -8.899 -4.682 -20.492 1.00 0.00 C ATOM 822 O LEU A 81 -9.071 -5.865 -20.702 1.00 0.00 O ATOM 823 CB LEU A 81 -6.716 -4.036 -21.535 1.00 0.00 C ATOM 824 CG LEU A 81 -5.312 -3.491 -21.270 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.332 -4.095 -22.278 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.319 -1.968 -21.418 1.00 0.00 C ATOM 0 H LEU A 81 -6.250 -5.852 -19.830 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.535 -3.181 -19.733 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.653 -5.010 -22.020 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.251 -3.375 -22.216 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.005 -3.757 -20.259 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.331 -3.707 -22.090 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.326 -5.180 -22.174 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.640 -3.829 -23.289 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.318 -1.579 -21.229 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.627 -1.702 -22.429 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.017 -1.536 -20.701 1.00 0.00 H new ATOM 838 N PRO A 82 -9.885 -3.803 -20.486 1.00 0.00 N ATOM 839 CA PRO A 82 -11.314 -4.176 -20.738 1.00 0.00 C ATOM 840 C PRO A 82 -11.602 -4.232 -22.241 1.00 0.00 C ATOM 841 O PRO A 82 -10.742 -3.957 -23.057 1.00 0.00 O ATOM 842 CB PRO A 82 -12.095 -3.052 -20.074 1.00 0.00 C ATOM 843 CG PRO A 82 -11.182 -1.839 -20.018 1.00 0.00 C ATOM 844 CD PRO A 82 -9.748 -2.322 -20.236 1.00 0.00 C ATOM 0 HA PRO A 82 -11.575 -5.160 -20.348 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.999 -2.826 -20.639 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.410 -3.343 -19.072 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.462 -1.115 -20.783 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.273 -1.336 -19.055 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.283 -1.817 -21.083 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.125 -2.122 -19.365 1.00 0.00 H new ATOM 976 N SER B 32 1.533 -10.386 -32.167 1.00 0.00 N ATOM 977 CA SER B 32 0.108 -10.318 -31.728 1.00 0.00 C ATOM 978 C SER B 32 -0.170 -8.971 -31.054 1.00 0.00 C ATOM 979 O SER B 32 -1.305 -8.538 -30.972 1.00 0.00 O ATOM 980 CB SER B 32 -0.179 -11.445 -30.738 1.00 0.00 C ATOM 981 OG SER B 32 0.482 -12.627 -31.167 1.00 0.00 O ATOM 0 HA SER B 32 -0.536 -10.424 -32.601 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.163 -11.165 -29.742 1.00 0.00 H new ATOM 0 HB3 SER B 32 -1.253 -11.620 -30.669 1.00 0.00 H new ATOM 0 HG SER B 32 1.178 -12.395 -31.817 1.00 0.00 H new ATOM 987 N ASP B 33 0.851 -8.303 -30.568 1.00 0.00 N ATOM 988 CA ASP B 33 0.637 -6.990 -29.900 1.00 0.00 C ATOM 989 C ASP B 33 0.652 -5.852 -30.932 1.00 0.00 C ATOM 990 O ASP B 33 0.726 -4.695 -30.573 1.00 0.00 O ATOM 991 CB ASP B 33 1.736 -6.743 -28.865 1.00 0.00 C ATOM 992 CG ASP B 33 1.860 -7.957 -27.942 1.00 0.00 C ATOM 993 OD1 ASP B 33 2.578 -8.877 -28.298 1.00 0.00 O ATOM 994 OD2 ASP B 33 1.234 -7.945 -26.894 1.00 0.00 O ATOM 0 H ASP B 33 1.821 -8.615 -30.608 1.00 0.00 H new ATOM 0 HA ASP B 33 -0.334 -7.012 -29.406 1.00 0.00 H new ATOM 0 HB2 ASP B 33 2.686 -6.557 -29.367 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.505 -5.852 -28.281 1.00 0.00 H new ATOM 999 N ALA B 34 0.574 -6.165 -32.205 1.00 0.00 N ATOM 1000 CA ALA B 34 0.567 -5.101 -33.243 1.00 0.00 C ATOM 1001 C ALA B 34 -0.881 -4.692 -33.553 1.00 0.00 C ATOM 1002 O ALA B 34 -1.126 -3.660 -34.147 1.00 0.00 O ATOM 1003 CB ALA B 34 1.232 -5.630 -34.515 1.00 0.00 C ATOM 0 H ALA B 34 0.515 -7.118 -32.564 1.00 0.00 H new ATOM 0 HA ALA B 34 1.116 -4.233 -32.877 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.228 -4.852 -35.278 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.260 -5.918 -34.295 1.00 0.00 H new ATOM 0 HB3 ALA B 34 0.682 -6.498 -34.879 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.842 -5.497 -33.158 1.00 0.00 N ATOM 1010 CA GLU B 35 -3.272 -5.168 -33.429 1.00 0.00 C ATOM 1011 C GLU B 35 -3.652 -3.797 -32.828 1.00 0.00 C ATOM 1012 O GLU B 35 -4.316 -3.025 -33.491 1.00 0.00 O ATOM 1013 CB GLU B 35 -4.177 -6.262 -32.843 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.711 -7.645 -33.323 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.689 -8.189 -34.368 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -5.804 -8.512 -33.996 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -4.305 -8.273 -35.523 1.00 0.00 O ATOM 0 H GLU B 35 -1.691 -6.372 -32.657 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.412 -5.117 -34.509 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -4.154 -6.219 -31.754 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -5.210 -6.092 -33.147 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.711 -7.574 -33.750 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.649 -8.331 -32.478 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.243 -3.511 -31.601 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.564 -2.213 -30.923 1.00 0.00 C ATOM 1026 C PRO B 36 -2.545 -1.131 -31.302 1.00 0.00 C ATOM 1027 O PRO B 36 -2.898 0.005 -31.553 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.470 -2.556 -29.443 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.561 -3.764 -29.313 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.415 -4.393 -30.699 1.00 0.00 C ATOM 0 HA PRO B 36 -4.538 -1.813 -31.206 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -3.071 -1.713 -28.878 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.458 -2.773 -29.036 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.587 -3.468 -28.924 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.981 -4.483 -28.610 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.372 -4.418 -31.016 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.776 -5.421 -30.709 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.278 -1.476 -31.338 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.208 -0.484 -31.690 1.00 0.00 C ATOM 1040 C HIS B 37 0.015 0.515 -30.540 1.00 0.00 C ATOM 1041 O HIS B 37 0.816 1.423 -30.657 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.578 0.281 -32.968 1.00 0.00 C ATOM 1043 CG HIS B 37 0.671 0.808 -33.618 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.729 -0.017 -33.964 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.046 2.075 -33.992 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.682 0.755 -34.519 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.316 2.039 -34.561 1.00 0.00 N ATOM 0 H HIS B 37 -0.935 -2.415 -31.136 1.00 0.00 H new ATOM 0 HA HIS B 37 0.715 -1.039 -31.860 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.109 -0.376 -33.657 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.251 1.104 -32.729 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.447 2.964 -33.864 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.627 0.382 -34.885 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.852 2.824 -34.931 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.664 0.350 -29.428 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.468 1.281 -28.276 1.00 0.00 C ATOM 1057 C TYR B 38 -0.065 0.464 -27.045 1.00 0.00 C ATOM 1058 O TYR B 38 0.759 0.881 -26.255 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.760 2.054 -27.985 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.944 1.114 -27.957 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.250 0.407 -26.788 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.740 0.958 -29.097 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.351 -0.459 -26.761 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.842 0.094 -29.070 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.147 -0.614 -27.902 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.233 -1.465 -27.875 1.00 0.00 O ATOM 0 H TYR B 38 -1.346 -0.392 -29.271 1.00 0.00 H new ATOM 0 HA TYR B 38 0.314 1.999 -28.521 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.675 2.570 -27.028 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.913 2.818 -28.747 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.637 0.529 -25.907 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.505 1.504 -29.998 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.585 -1.007 -25.860 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.456 -0.026 -29.950 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.678 -1.455 -28.748 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.631 -0.708 -26.889 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.291 -1.584 -25.728 1.00 0.00 C ATOM 1078 C LEU B 39 1.243 -1.736 -25.588 1.00 0.00 C ATOM 1079 O LEU B 39 1.780 -1.505 -24.519 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.932 -2.964 -25.949 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.776 -3.368 -24.727 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.930 -3.318 -23.445 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.958 -2.405 -24.592 1.00 0.00 C ATOM 0 H LEU B 39 -1.324 -1.099 -27.527 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.673 -1.133 -24.812 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.559 -2.942 -26.840 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -0.155 -3.708 -26.124 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.136 -4.387 -24.869 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.544 -3.607 -22.592 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.090 -4.006 -23.537 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.555 -2.305 -23.296 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.560 -2.686 -23.728 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.586 -1.389 -24.460 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.571 -2.453 -25.492 1.00 0.00 H new ATOM 1095 N PRO B 40 1.917 -2.110 -26.663 1.00 0.00 N ATOM 1096 CA PRO B 40 3.406 -2.286 -26.660 1.00 0.00 C ATOM 1097 C PRO B 40 4.106 -0.921 -26.638 1.00 0.00 C ATOM 1098 O PRO B 40 5.275 -0.820 -26.312 1.00 0.00 O ATOM 1099 CB PRO B 40 3.690 -3.048 -27.947 1.00 0.00 C ATOM 1100 CG PRO B 40 2.533 -2.782 -28.885 1.00 0.00 C ATOM 1101 CD PRO B 40 1.328 -2.401 -28.025 1.00 0.00 C ATOM 0 HA PRO B 40 3.775 -2.819 -25.784 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.629 -2.718 -28.391 1.00 0.00 H new ATOM 0 HB3 PRO B 40 3.788 -4.115 -27.749 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.779 -1.979 -29.580 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.313 -3.666 -29.484 1.00 0.00 H new ATOM 0 HD2 PRO B 40 0.811 -1.531 -28.429 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.600 -3.211 -27.979 1.00 0.00 H new ATOM 1109 N GLN B 41 3.392 0.131 -26.955 1.00 0.00 N ATOM 1110 CA GLN B 41 3.999 1.490 -26.922 1.00 0.00 C ATOM 1111 C GLN B 41 4.078 1.941 -25.460 1.00 0.00 C ATOM 1112 O GLN B 41 4.975 2.665 -25.065 1.00 0.00 O ATOM 1113 CB GLN B 41 3.111 2.454 -27.723 1.00 0.00 C ATOM 1114 CG GLN B 41 3.680 3.876 -27.664 1.00 0.00 C ATOM 1115 CD GLN B 41 5.051 3.908 -28.343 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.232 3.336 -29.400 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.030 4.559 -27.777 1.00 0.00 N ATOM 0 H GLN B 41 2.412 0.103 -27.236 1.00 0.00 H new ATOM 0 HA GLN B 41 4.997 1.480 -27.361 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.047 2.124 -28.760 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.098 2.444 -27.322 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.001 4.571 -28.159 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.769 4.201 -26.627 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.878 5.039 -26.890 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.948 4.588 -28.222 1.00 0.00 H new ATOM 1126 N LEU B 42 3.135 1.517 -24.657 1.00 0.00 N ATOM 1127 CA LEU B 42 3.126 1.910 -23.229 1.00 0.00 C ATOM 1128 C LEU B 42 4.169 1.094 -22.465 1.00 0.00 C ATOM 1129 O LEU B 42 4.895 1.619 -21.643 1.00 0.00 O ATOM 1130 CB LEU B 42 1.739 1.635 -22.628 1.00 0.00 C ATOM 1131 CG LEU B 42 0.596 2.498 -23.256 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.066 3.410 -24.406 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.500 1.567 -23.788 1.00 0.00 C ATOM 0 H LEU B 42 2.366 0.909 -24.940 1.00 0.00 H new ATOM 0 HA LEU B 42 3.359 2.972 -23.149 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.499 0.580 -22.760 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.775 1.822 -21.555 1.00 0.00 H new ATOM 0 HG LEU B 42 0.228 3.149 -22.463 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.218 3.977 -24.790 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.826 4.099 -24.037 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.487 2.800 -25.205 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.301 2.162 -24.228 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.080 0.907 -24.547 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.900 0.970 -22.968 1.00 0.00 H new ATOM 1145 N ARG B 43 4.245 -0.191 -22.721 1.00 0.00 N ATOM 1146 CA ARG B 43 5.240 -1.036 -22.000 1.00 0.00 C ATOM 1147 C ARG B 43 6.649 -0.529 -22.312 1.00 0.00 C ATOM 1148 O ARG B 43 7.478 -0.388 -21.430 1.00 0.00 O ATOM 1149 CB ARG B 43 5.087 -2.505 -22.425 1.00 0.00 C ATOM 1150 CG ARG B 43 5.485 -2.701 -23.891 1.00 0.00 C ATOM 1151 CD ARG B 43 5.211 -4.149 -24.302 1.00 0.00 C ATOM 1152 NE ARG B 43 5.872 -4.428 -25.614 1.00 0.00 N ATOM 1153 CZ ARG B 43 7.177 -4.603 -25.703 1.00 0.00 C ATOM 1154 NH1 ARG B 43 7.954 -4.537 -24.647 1.00 0.00 N ATOM 1155 NH2 ARG B 43 7.707 -4.846 -26.871 1.00 0.00 N ATOM 0 H ARG B 43 3.662 -0.686 -23.396 1.00 0.00 H new ATOM 0 HA ARG B 43 5.068 -0.972 -20.926 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.707 -3.137 -21.789 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.054 -2.823 -22.280 1.00 0.00 H new ATOM 0 HG2 ARG B 43 4.922 -2.018 -24.527 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.541 -2.466 -24.027 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.587 -4.832 -23.540 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.137 -4.319 -24.380 1.00 0.00 H new ATOM 0 HE ARG B 43 5.302 -4.484 -26.458 1.00 0.00 H new ATOM 0 HH11 ARG B 43 7.552 -4.346 -23.729 1.00 0.00 H new ATOM 0 HH12 ARG B 43 8.960 -4.676 -24.744 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.114 -4.898 -27.699 1.00 0.00 H new ATOM 0 HH22 ARG B 43 8.714 -4.983 -26.955 1.00 0.00 H new ATOM 1169 N LYS B 44 6.923 -0.238 -23.561 1.00 0.00 N ATOM 1170 CA LYS B 44 8.266 0.273 -23.911 1.00 0.00 C ATOM 1171 C LYS B 44 8.451 1.639 -23.242 1.00 0.00 C ATOM 1172 O LYS B 44 9.545 2.017 -22.876 1.00 0.00 O ATOM 1173 CB LYS B 44 8.411 0.380 -25.439 1.00 0.00 C ATOM 1174 CG LYS B 44 7.506 1.483 -26.000 1.00 0.00 C ATOM 1175 CD LYS B 44 7.757 1.641 -27.503 1.00 0.00 C ATOM 1176 CE LYS B 44 7.355 0.356 -28.234 1.00 0.00 C ATOM 1177 NZ LYS B 44 7.573 0.530 -29.698 1.00 0.00 N ATOM 0 H LYS B 44 6.273 -0.335 -24.342 1.00 0.00 H new ATOM 0 HA LYS B 44 9.036 -0.411 -23.555 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.449 0.591 -25.696 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.156 -0.574 -25.900 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.460 1.235 -25.820 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.703 2.425 -25.487 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.185 2.484 -27.890 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.809 1.859 -27.684 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.943 -0.484 -27.865 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.308 0.124 -28.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.300 -0.342 -30.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 6.994 1.322 -30.044 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.577 0.732 -29.878 1.00 0.00 H new ATOM 1191 N ASP B 45 7.373 2.373 -23.066 1.00 0.00 N ATOM 1192 CA ASP B 45 7.474 3.697 -22.408 1.00 0.00 C ATOM 1193 C ASP B 45 7.898 3.495 -20.954 1.00 0.00 C ATOM 1194 O ASP B 45 8.792 4.158 -20.474 1.00 0.00 O ATOM 1195 CB ASP B 45 6.121 4.406 -22.454 1.00 0.00 C ATOM 1196 CG ASP B 45 5.875 4.961 -23.859 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.840 5.331 -24.508 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.725 5.007 -24.262 1.00 0.00 O ATOM 0 H ASP B 45 6.432 2.103 -23.354 1.00 0.00 H new ATOM 0 HA ASP B 45 8.211 4.309 -22.928 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.326 3.711 -22.183 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.099 5.215 -21.724 1.00 0.00 H new ATOM 1203 N ILE B 46 7.271 2.575 -20.247 1.00 0.00 N ATOM 1204 CA ILE B 46 7.657 2.338 -18.820 1.00 0.00 C ATOM 1205 C ILE B 46 9.141 1.945 -18.754 1.00 0.00 C ATOM 1206 O ILE B 46 9.823 2.228 -17.787 1.00 0.00 O ATOM 1207 CB ILE B 46 6.749 1.254 -18.189 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.956 1.258 -16.670 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.047 -0.149 -18.748 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.951 0.313 -16.004 1.00 0.00 C ATOM 0 H ILE B 46 6.516 1.985 -20.597 1.00 0.00 H new ATOM 0 HA ILE B 46 7.518 3.253 -18.244 1.00 0.00 H new ATOM 0 HB ILE B 46 5.714 1.490 -18.438 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.973 0.947 -16.432 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.832 2.268 -16.280 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.386 -0.876 -18.276 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.882 -0.154 -19.825 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.084 -0.411 -18.538 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.104 0.321 -14.925 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.937 0.643 -16.229 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.096 -0.698 -16.384 1.00 0.00 H new ATOM 1222 N LEU B 47 9.648 1.319 -19.792 1.00 0.00 N ATOM 1223 CA LEU B 47 11.085 0.937 -19.810 1.00 0.00 C ATOM 1224 C LEU B 47 11.919 2.216 -19.849 1.00 0.00 C ATOM 1225 O LEU B 47 12.827 2.408 -19.060 1.00 0.00 O ATOM 1226 CB LEU B 47 11.382 0.097 -21.054 1.00 0.00 C ATOM 1227 CG LEU B 47 10.958 -1.352 -20.813 1.00 0.00 C ATOM 1228 CD1 LEU B 47 10.992 -2.122 -22.135 1.00 0.00 C ATOM 1229 CD2 LEU B 47 11.923 -2.002 -19.821 1.00 0.00 C ATOM 0 H LEU B 47 9.122 1.059 -20.626 1.00 0.00 H new ATOM 0 HA LEU B 47 11.328 0.352 -18.923 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.850 0.503 -21.914 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.446 0.140 -21.288 1.00 0.00 H new ATOM 0 HG LEU B 47 9.946 -1.373 -20.408 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.690 -3.155 -21.962 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.307 -1.657 -22.844 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.003 -2.103 -22.541 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.624 -3.036 -19.646 1.00 0.00 H new ATOM 0 HD22 LEU B 47 12.933 -1.981 -20.229 1.00 0.00 H new ATOM 0 HD23 LEU B 47 11.900 -1.454 -18.879 1.00 0.00 H new ATOM 1241 N GLU B 48 11.590 3.108 -20.752 1.00 0.00 N ATOM 1242 CA GLU B 48 12.334 4.395 -20.841 1.00 0.00 C ATOM 1243 C GLU B 48 12.048 5.187 -19.580 1.00 0.00 C ATOM 1244 O GLU B 48 12.907 5.862 -19.045 1.00 0.00 O ATOM 1245 CB GLU B 48 11.861 5.220 -22.040 1.00 0.00 C ATOM 1246 CG GLU B 48 11.806 4.357 -23.297 1.00 0.00 C ATOM 1247 CD GLU B 48 13.205 3.837 -23.636 1.00 0.00 C ATOM 1248 OE1 GLU B 48 14.031 4.638 -24.041 1.00 0.00 O ATOM 1249 OE2 GLU B 48 13.426 2.647 -23.484 1.00 0.00 O ATOM 0 H GLU B 48 10.837 2.996 -21.430 1.00 0.00 H new ATOM 0 HA GLU B 48 13.397 4.185 -20.956 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.875 5.637 -21.835 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.536 6.061 -22.199 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.125 3.520 -23.144 1.00 0.00 H new ATOM 0 HG3 GLU B 48 11.413 4.939 -24.131 1.00 0.00 H new ATOM 1256 N VAL B 49 10.831 5.104 -19.100 1.00 0.00 N ATOM 1257 CA VAL B 49 10.460 5.844 -17.868 1.00 0.00 C ATOM 1258 C VAL B 49 11.387 5.392 -16.733 1.00 0.00 C ATOM 1259 O VAL B 49 12.092 6.186 -16.151 1.00 0.00 O ATOM 1260 CB VAL B 49 8.991 5.568 -17.513 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.615 6.288 -16.209 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.090 6.068 -18.652 1.00 0.00 C ATOM 0 H VAL B 49 10.080 4.552 -19.515 1.00 0.00 H new ATOM 0 HA VAL B 49 10.572 6.917 -18.024 1.00 0.00 H new ATOM 0 HB VAL B 49 8.853 4.495 -17.377 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.572 6.084 -15.969 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.251 5.930 -15.399 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.756 7.362 -16.333 1.00 0.00 H new ATOM 0 HG21 VAL B 49 7.047 5.873 -18.403 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.237 7.139 -18.788 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.346 5.546 -19.574 1.00 0.00 H new ATOM 1272 N ILE B 50 11.426 4.110 -16.444 1.00 0.00 N ATOM 1273 CA ILE B 50 12.348 3.610 -15.372 1.00 0.00 C ATOM 1274 C ILE B 50 13.781 4.056 -15.698 1.00 0.00 C ATOM 1275 O ILE B 50 14.610 4.190 -14.819 1.00 0.00 O ATOM 1276 CB ILE B 50 12.276 2.081 -15.291 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.827 1.652 -15.044 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.153 1.586 -14.139 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.561 0.322 -15.750 1.00 0.00 C ATOM 0 H ILE B 50 10.863 3.393 -16.901 1.00 0.00 H new ATOM 0 HA ILE B 50 12.049 4.022 -14.408 1.00 0.00 H new ATOM 0 HB ILE B 50 12.631 1.652 -16.228 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.644 1.551 -13.974 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.143 2.415 -15.414 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.101 0.499 -14.083 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.185 1.891 -14.310 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.799 2.015 -13.202 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.530 0.017 -15.574 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.727 0.439 -16.821 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.236 -0.439 -15.359 1.00 0.00 H new ATOM 1291 N CYS B 51 14.063 4.307 -16.956 1.00 0.00 N ATOM 1292 CA CYS B 51 15.420 4.768 -17.344 1.00 0.00 C ATOM 1293 C CYS B 51 15.582 6.240 -16.952 1.00 0.00 C ATOM 1294 O CYS B 51 16.581 6.635 -16.388 1.00 0.00 O ATOM 1295 CB CYS B 51 15.595 4.619 -18.859 1.00 0.00 C ATOM 1296 SG CYS B 51 17.360 4.592 -19.262 1.00 0.00 S ATOM 0 H CYS B 51 13.404 4.210 -17.728 1.00 0.00 H new ATOM 0 HA CYS B 51 16.173 4.168 -16.833 1.00 0.00 H new ATOM 0 HB2 CYS B 51 15.118 3.701 -19.202 1.00 0.00 H new ATOM 0 HB3 CYS B 51 15.106 5.445 -19.375 1.00 0.00 H new ATOM 0 HG CYS B 51 17.510 4.464 -20.547 1.00 0.00 H new ATOM 1302 N LYS B 52 14.600 7.056 -17.244 1.00 0.00 N ATOM 1303 CA LYS B 52 14.688 8.512 -16.892 1.00 0.00 C ATOM 1304 C LYS B 52 14.932 8.678 -15.390 1.00 0.00 C ATOM 1305 O LYS B 52 15.565 9.621 -14.955 1.00 0.00 O ATOM 1306 CB LYS B 52 13.377 9.221 -17.245 1.00 0.00 C ATOM 1307 CG LYS B 52 13.048 9.041 -18.726 1.00 0.00 C ATOM 1308 CD LYS B 52 11.536 9.197 -18.923 1.00 0.00 C ATOM 1309 CE LYS B 52 11.220 10.636 -19.334 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.314 10.763 -20.816 1.00 0.00 N ATOM 0 H LYS B 52 13.738 6.778 -17.712 1.00 0.00 H new ATOM 0 HA LYS B 52 15.513 8.948 -17.456 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.566 8.821 -16.636 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.458 10.283 -17.012 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.584 9.779 -19.323 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.373 8.058 -19.067 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.185 8.504 -19.688 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.011 8.947 -18.001 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.220 10.910 -18.998 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.917 11.324 -18.855 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.099 11.742 -21.095 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.276 10.518 -21.125 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.632 10.118 -21.264 1.00 0.00 H new ATOM 1324 N TYR B 53 14.415 7.775 -14.601 1.00 0.00 N ATOM 1325 CA TYR B 53 14.580 7.869 -13.131 1.00 0.00 C ATOM 1326 C TYR B 53 15.649 6.871 -12.653 1.00 0.00 C ATOM 1327 O TYR B 53 16.141 6.973 -11.544 1.00 0.00 O ATOM 1328 CB TYR B 53 13.245 7.522 -12.461 1.00 0.00 C ATOM 1329 CG TYR B 53 12.154 8.500 -12.859 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.712 8.566 -14.187 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.561 9.319 -11.891 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.689 9.447 -14.549 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.533 10.199 -12.253 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.098 10.262 -13.584 1.00 0.00 C ATOM 1335 OH TYR B 53 9.086 11.129 -13.940 1.00 0.00 O ATOM 0 H TYR B 53 13.880 6.968 -14.921 1.00 0.00 H new ATOM 0 HA TYR B 53 14.889 8.880 -12.868 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.948 6.511 -12.740 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.367 7.531 -11.378 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.164 7.932 -14.935 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.896 9.272 -10.865 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.356 9.497 -15.575 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.075 10.830 -11.506 1.00 0.00 H new ATOM 0 HH TYR B 53 8.784 11.622 -13.149 1.00 0.00 H new ATOM 1345 N VAL B 54 16.000 5.897 -13.465 1.00 0.00 N ATOM 1346 CA VAL B 54 17.022 4.881 -13.040 1.00 0.00 C ATOM 1347 C VAL B 54 17.759 4.372 -14.302 1.00 0.00 C ATOM 1348 O VAL B 54 18.080 5.156 -15.172 1.00 0.00 O ATOM 1349 CB VAL B 54 16.337 3.710 -12.290 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.357 3.036 -11.370 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.164 4.209 -11.435 1.00 0.00 C ATOM 0 H VAL B 54 15.623 5.762 -14.403 1.00 0.00 H new ATOM 0 HA VAL B 54 17.740 5.335 -12.357 1.00 0.00 H new ATOM 0 HB VAL B 54 15.958 3.006 -13.031 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.880 2.212 -10.840 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.187 2.654 -11.965 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.732 3.762 -10.649 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.703 3.365 -10.921 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.529 4.926 -10.700 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.425 4.690 -12.076 1.00 0.00 H new ATOM 1361 N GLN B 55 18.041 3.087 -14.423 1.00 0.00 N ATOM 1362 CA GLN B 55 18.747 2.590 -15.640 1.00 0.00 C ATOM 1363 C GLN B 55 18.701 1.061 -15.673 1.00 0.00 C ATOM 1364 O GLN B 55 19.349 0.389 -14.893 1.00 0.00 O ATOM 1365 CB GLN B 55 20.203 3.067 -15.620 1.00 0.00 C ATOM 1366 CG GLN B 55 20.434 4.073 -16.751 1.00 0.00 C ATOM 1367 CD GLN B 55 21.892 4.537 -16.734 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.629 4.298 -17.670 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.341 5.196 -15.702 1.00 0.00 N ATOM 0 H GLN B 55 17.811 2.373 -13.732 1.00 0.00 H new ATOM 0 HA GLN B 55 18.254 2.981 -16.530 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.431 3.528 -14.659 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.876 2.217 -15.734 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.198 3.616 -17.712 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.768 4.928 -16.633 1.00 0.00 H new ATOM 0 HE21 GLN B 55 21.722 5.397 -14.916 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.311 5.511 -15.681 1.00 0.00 H new ATOM 1378 N ILE B 56 17.935 0.517 -16.578 1.00 0.00 N ATOM 1379 CA ILE B 56 17.822 -0.969 -16.694 1.00 0.00 C ATOM 1380 C ILE B 56 17.774 -1.349 -18.173 1.00 0.00 C ATOM 1381 O ILE B 56 17.593 -0.506 -19.032 1.00 0.00 O ATOM 1382 CB ILE B 56 16.544 -1.463 -16.005 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.387 -0.487 -16.269 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.786 -1.576 -14.501 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.099 -1.273 -16.524 1.00 0.00 C ATOM 0 H ILE B 56 17.376 1.042 -17.250 1.00 0.00 H new ATOM 0 HA ILE B 56 18.684 -1.431 -16.212 1.00 0.00 H new ATOM 0 HB ILE B 56 16.280 -2.441 -16.407 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.256 0.177 -15.415 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.617 0.142 -17.129 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.877 -1.927 -14.012 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.595 -2.283 -14.315 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.059 -0.599 -14.102 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.280 -0.579 -16.711 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.233 -1.919 -17.392 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.866 -1.882 -15.651 1.00 0.00 H new ATOM 1397 N ASP B 57 17.926 -2.611 -18.473 1.00 0.00 N ATOM 1398 CA ASP B 57 17.881 -3.055 -19.896 1.00 0.00 C ATOM 1399 C ASP B 57 16.524 -3.716 -20.167 1.00 0.00 C ATOM 1400 O ASP B 57 15.827 -4.070 -19.238 1.00 0.00 O ATOM 1401 CB ASP B 57 19.002 -4.065 -20.150 1.00 0.00 C ATOM 1402 CG ASP B 57 20.283 -3.323 -20.534 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.845 -2.666 -19.672 1.00 0.00 O ATOM 1404 OD2 ASP B 57 20.680 -3.423 -21.683 1.00 0.00 O ATOM 0 H ASP B 57 18.080 -3.355 -17.792 1.00 0.00 H new ATOM 0 HA ASP B 57 18.013 -2.198 -20.556 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.172 -4.667 -19.257 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.714 -4.751 -20.947 1.00 0.00 H new ATOM 1409 N PRO B 58 16.177 -3.879 -21.428 1.00 0.00 N ATOM 1410 CA PRO B 58 14.884 -4.514 -21.833 1.00 0.00 C ATOM 1411 C PRO B 58 14.956 -6.019 -21.591 1.00 0.00 C ATOM 1412 O PRO B 58 13.964 -6.655 -21.286 1.00 0.00 O ATOM 1413 CB PRO B 58 14.753 -4.179 -23.311 1.00 0.00 C ATOM 1414 CG PRO B 58 16.153 -3.913 -23.827 1.00 0.00 C ATOM 1415 CD PRO B 58 17.000 -3.476 -22.630 1.00 0.00 C ATOM 0 HA PRO B 58 14.023 -4.158 -21.267 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.291 -5.003 -23.854 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.116 -3.306 -23.454 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.570 -4.809 -24.287 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.140 -3.138 -24.593 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.973 -3.968 -22.630 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.185 -2.402 -22.644 1.00 0.00 H new ATOM 1423 N GLU B 59 16.132 -6.583 -21.686 1.00 0.00 N ATOM 1424 CA GLU B 59 16.285 -8.039 -21.418 1.00 0.00 C ATOM 1425 C GLU B 59 16.013 -8.306 -19.927 1.00 0.00 C ATOM 1426 O GLU B 59 15.815 -9.436 -19.521 1.00 0.00 O ATOM 1427 CB GLU B 59 17.710 -8.477 -21.764 1.00 0.00 C ATOM 1428 CG GLU B 59 17.959 -8.270 -23.260 1.00 0.00 C ATOM 1429 CD GLU B 59 17.530 -9.523 -24.027 1.00 0.00 C ATOM 1430 OE1 GLU B 59 16.556 -10.137 -23.622 1.00 0.00 O ATOM 1431 OE2 GLU B 59 18.184 -9.848 -25.004 1.00 0.00 O ATOM 0 H GLU B 59 16.992 -6.096 -21.938 1.00 0.00 H new ATOM 0 HA GLU B 59 15.578 -8.601 -22.028 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.430 -7.902 -21.182 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.853 -9.525 -21.502 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.401 -7.404 -23.616 1.00 0.00 H new ATOM 0 HG3 GLU B 59 19.014 -8.065 -23.439 1.00 0.00 H new ATOM 1438 N MET B 60 15.995 -7.273 -19.108 1.00 0.00 N ATOM 1439 CA MET B 60 15.731 -7.460 -17.655 1.00 0.00 C ATOM 1440 C MET B 60 14.223 -7.367 -17.397 1.00 0.00 C ATOM 1441 O MET B 60 13.717 -7.908 -16.432 1.00 0.00 O ATOM 1442 CB MET B 60 16.453 -6.360 -16.870 1.00 0.00 C ATOM 1443 CG MET B 60 17.940 -6.715 -16.721 1.00 0.00 C ATOM 1444 SD MET B 60 18.280 -7.269 -15.030 1.00 0.00 S ATOM 1445 CE MET B 60 18.422 -5.628 -14.282 1.00 0.00 C ATOM 0 H MET B 60 16.154 -6.307 -19.394 1.00 0.00 H new ATOM 0 HA MET B 60 16.093 -8.437 -17.336 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.348 -5.405 -17.385 1.00 0.00 H new ATOM 0 HB3 MET B 60 15.997 -6.244 -15.887 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.208 -7.499 -17.430 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.555 -5.847 -16.958 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.090 -5.671 -13.245 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.461 -5.301 -14.317 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.801 -4.922 -14.833 1.00 0.00 H new ATOM 1455 N VAL B 61 13.505 -6.679 -18.252 1.00 0.00 N ATOM 1456 CA VAL B 61 12.032 -6.539 -18.062 1.00 0.00 C ATOM 1457 C VAL B 61 11.300 -7.590 -18.903 1.00 0.00 C ATOM 1458 O VAL B 61 11.561 -7.743 -20.082 1.00 0.00 O ATOM 1459 CB VAL B 61 11.606 -5.136 -18.502 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.115 -4.930 -18.221 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.419 -4.092 -17.728 1.00 0.00 C ATOM 0 H VAL B 61 13.880 -6.208 -19.075 1.00 0.00 H new ATOM 0 HA VAL B 61 11.780 -6.688 -17.012 1.00 0.00 H new ATOM 0 HB VAL B 61 11.787 -5.025 -19.571 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.820 -3.929 -18.537 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.535 -5.670 -18.772 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.927 -5.044 -17.153 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.117 -3.092 -18.040 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.238 -4.209 -16.659 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.480 -4.232 -17.934 1.00 0.00 H new ATOM 1471 N THR B 62 10.387 -8.316 -18.303 1.00 0.00 N ATOM 1472 CA THR B 62 9.635 -9.356 -19.057 1.00 0.00 C ATOM 1473 C THR B 62 8.257 -8.814 -19.442 1.00 0.00 C ATOM 1474 O THR B 62 7.762 -7.876 -18.849 1.00 0.00 O ATOM 1475 CB THR B 62 9.462 -10.603 -18.185 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.656 -10.836 -17.452 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.166 -11.811 -19.075 1.00 0.00 C ATOM 0 H THR B 62 10.133 -8.229 -17.319 1.00 0.00 H new ATOM 0 HA THR B 62 10.191 -9.617 -19.958 1.00 0.00 H new ATOM 0 HB THR B 62 8.634 -10.451 -17.493 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.438 -11.270 -16.601 1.00 0.00 H new ATOM 0 HG21 THR B 62 9.043 -12.699 -18.454 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.250 -11.632 -19.638 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.994 -11.964 -19.767 1.00 0.00 H new ATOM 1485 N VAL B 63 7.636 -9.405 -20.432 1.00 0.00 N ATOM 1486 CA VAL B 63 6.288 -8.937 -20.864 1.00 0.00 C ATOM 1487 C VAL B 63 5.440 -10.145 -21.256 1.00 0.00 C ATOM 1488 O VAL B 63 5.716 -10.813 -22.235 1.00 0.00 O ATOM 1489 CB VAL B 63 6.435 -8.011 -22.071 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.074 -7.412 -22.431 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.409 -6.886 -21.729 1.00 0.00 C ATOM 0 H VAL B 63 8.008 -10.194 -20.960 1.00 0.00 H new ATOM 0 HA VAL B 63 5.808 -8.398 -20.047 1.00 0.00 H new ATOM 0 HB VAL B 63 6.814 -8.581 -22.920 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.183 -6.752 -23.292 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.376 -8.214 -22.674 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.692 -6.843 -21.584 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.516 -6.224 -22.588 1.00 0.00 H new ATOM 0 HG22 VAL B 63 7.027 -6.320 -20.880 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.380 -7.310 -21.475 1.00 0.00 H new ATOM 1501 N GLN B 64 4.410 -10.429 -20.501 1.00 0.00 N ATOM 1502 CA GLN B 64 3.544 -11.597 -20.830 1.00 0.00 C ATOM 1503 C GLN B 64 2.083 -11.146 -20.924 1.00 0.00 C ATOM 1504 O GLN B 64 1.551 -10.538 -20.014 1.00 0.00 O ATOM 1505 CB GLN B 64 3.694 -12.669 -19.743 1.00 0.00 C ATOM 1506 CG GLN B 64 3.457 -12.053 -18.355 1.00 0.00 C ATOM 1507 CD GLN B 64 4.788 -11.920 -17.610 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.812 -11.661 -18.212 1.00 0.00 O ATOM 1509 NE2 GLN B 64 4.817 -12.088 -16.316 1.00 0.00 N ATOM 0 H GLN B 64 4.133 -9.903 -19.672 1.00 0.00 H new ATOM 0 HA GLN B 64 3.848 -12.016 -21.789 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.982 -13.476 -19.917 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.691 -13.107 -19.789 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.988 -11.074 -18.457 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.771 -12.677 -17.783 1.00 0.00 H new ATOM 0 HE21 GLN B 64 3.958 -12.305 -15.811 1.00 0.00 H new ATOM 0 HE22 GLN B 64 5.699 -12.002 -15.810 1.00 0.00 H new ATOM 1518 N LEU B 65 1.434 -11.431 -22.025 1.00 0.00 N ATOM 1519 CA LEU B 65 0.017 -11.017 -22.187 1.00 0.00 C ATOM 1520 C LEU B 65 -0.910 -12.202 -21.922 1.00 0.00 C ATOM 1521 O LEU B 65 -0.783 -13.253 -22.522 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.203 -10.502 -23.608 1.00 0.00 C ATOM 1523 CG LEU B 65 0.284 -11.542 -24.630 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -0.833 -11.841 -25.633 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.503 -10.994 -25.380 1.00 0.00 C ATOM 0 H LEU B 65 1.831 -11.935 -22.818 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.207 -10.225 -21.472 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.261 -10.292 -23.767 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.333 -9.563 -23.750 1.00 0.00 H new ATOM 0 HG LEU B 65 0.558 -12.458 -24.106 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.485 -12.578 -26.356 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -1.702 -12.233 -25.104 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.109 -10.924 -26.154 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.847 -11.733 -26.104 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.228 -10.077 -25.900 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.302 -10.783 -24.670 1.00 0.00 H new ATOM 1537 N GLU B 66 -1.849 -12.030 -21.029 1.00 0.00 N ATOM 1538 CA GLU B 66 -2.804 -13.127 -20.714 1.00 0.00 C ATOM 1539 C GLU B 66 -4.210 -12.691 -21.121 1.00 0.00 C ATOM 1540 O GLU B 66 -4.420 -11.568 -21.536 1.00 0.00 O ATOM 1541 CB GLU B 66 -2.766 -13.428 -19.208 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.471 -14.156 -18.833 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.339 -15.459 -19.630 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.069 -16.390 -19.331 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.510 -15.501 -20.525 1.00 0.00 O ATOM 0 H GLU B 66 -1.994 -11.169 -20.502 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.527 -14.028 -21.261 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -2.842 -12.498 -18.644 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.625 -14.039 -18.933 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.614 -13.512 -19.032 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.465 -14.374 -17.765 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.169 -13.573 -21.019 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.563 -13.210 -21.407 1.00 0.00 C ATOM 1554 C GLN B 67 -7.532 -13.631 -20.305 1.00 0.00 C ATOM 1555 O GLN B 67 -7.154 -14.277 -19.345 1.00 0.00 O ATOM 1556 CB GLN B 67 -6.931 -13.918 -22.713 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.221 -13.235 -23.883 1.00 0.00 C ATOM 1558 CD GLN B 67 -5.856 -14.279 -24.939 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -6.576 -15.238 -25.136 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -4.760 -14.133 -25.632 1.00 0.00 N ATOM 0 H GLN B 67 -5.047 -14.529 -20.684 1.00 0.00 H new ATOM 0 HA GLN B 67 -6.628 -12.131 -21.548 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.644 -14.968 -22.663 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.010 -13.890 -22.863 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -6.867 -12.472 -24.319 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.322 -12.729 -23.531 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.156 -13.328 -25.467 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -4.508 -14.824 -26.339 1.00 0.00 H new ATOM 1569 N LYS B 68 -8.780 -13.259 -20.433 1.00 0.00 N ATOM 1570 CA LYS B 68 -9.787 -13.624 -19.390 1.00 0.00 C ATOM 1571 C LYS B 68 -11.037 -14.184 -20.073 1.00 0.00 C ATOM 1572 O LYS B 68 -11.245 -13.988 -21.257 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.179 -12.387 -18.558 1.00 0.00 C ATOM 1574 CG LYS B 68 -8.989 -11.414 -18.428 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.012 -10.679 -17.075 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.397 -10.078 -16.781 1.00 0.00 C ATOM 1577 NZ LYS B 68 -10.954 -10.704 -15.549 1.00 0.00 N ATOM 0 H LYS B 68 -9.146 -12.717 -21.216 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.351 -14.371 -18.727 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -11.020 -11.879 -19.029 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -10.509 -12.699 -17.567 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -8.054 -11.965 -18.529 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -9.021 -10.687 -19.240 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.739 -11.372 -16.279 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -8.264 -9.886 -17.078 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.318 -8.999 -16.650 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.067 -10.249 -17.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.891 -10.300 -15.347 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.043 -11.730 -15.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.317 -10.519 -14.748 1.00 0.00 H new ATOM 1591 N ASP B 69 -11.865 -14.882 -19.339 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.100 -15.464 -19.939 1.00 0.00 C ATOM 1593 C ASP B 69 -14.192 -14.389 -20.044 1.00 0.00 C ATOM 1594 O ASP B 69 -15.271 -14.532 -19.496 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.595 -16.629 -19.070 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.722 -16.180 -17.611 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -14.028 -15.020 -17.391 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.510 -17.006 -16.739 1.00 0.00 O ATOM 0 H ASP B 69 -11.737 -15.074 -18.345 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.872 -15.832 -20.939 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -14.560 -16.981 -19.436 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -12.901 -17.467 -19.142 1.00 0.00 H new ATOM 1603 N GLY B 70 -13.923 -13.317 -20.748 1.00 0.00 N ATOM 1604 CA GLY B 70 -14.947 -12.236 -20.893 1.00 0.00 C ATOM 1605 C GLY B 70 -14.449 -11.167 -21.871 1.00 0.00 C ATOM 1606 O GLY B 70 -14.741 -9.997 -21.720 1.00 0.00 O ATOM 0 H GLY B 70 -13.040 -13.144 -21.228 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -15.885 -12.659 -21.251 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.151 -11.785 -19.922 1.00 0.00 H new ATOM 1610 N ASP B 71 -13.694 -11.564 -22.867 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.161 -10.584 -23.863 1.00 0.00 C ATOM 1612 C ASP B 71 -12.287 -9.559 -23.141 1.00 0.00 C ATOM 1613 O ASP B 71 -12.352 -8.372 -23.398 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.319 -9.874 -24.575 1.00 0.00 C ATOM 1615 CG ASP B 71 -14.906 -10.800 -25.642 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.132 -11.357 -26.404 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.117 -10.937 -25.680 1.00 0.00 O ATOM 0 H ASP B 71 -13.423 -12.533 -23.033 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.565 -11.112 -24.607 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.089 -9.598 -23.854 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -13.966 -8.950 -25.034 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.476 -10.023 -22.228 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.591 -9.102 -21.459 1.00 0.00 C ATOM 1624 C ILE B 72 -9.146 -9.608 -21.548 1.00 0.00 C ATOM 1625 O ILE B 72 -8.900 -10.798 -21.592 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.048 -9.059 -19.998 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.585 -8.917 -19.944 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.375 -7.867 -19.305 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.068 -8.670 -18.506 1.00 0.00 C ATOM 0 H ILE B 72 -11.389 -11.009 -21.981 1.00 0.00 H new ATOM 0 HA ILE B 72 -10.646 -8.096 -21.875 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.766 -9.979 -19.486 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -12.900 -8.092 -20.583 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.051 -9.821 -20.337 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.692 -7.825 -18.263 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.292 -7.984 -19.350 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.662 -6.944 -19.809 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.154 -8.574 -18.498 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.773 -9.508 -17.874 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.620 -7.753 -18.124 1.00 0.00 H new ATOM 1641 N SER B 73 -8.194 -8.710 -21.588 1.00 0.00 N ATOM 1642 CA SER B 73 -6.762 -9.126 -21.691 1.00 0.00 C ATOM 1643 C SER B 73 -6.039 -8.813 -20.383 1.00 0.00 C ATOM 1644 O SER B 73 -6.570 -8.152 -19.509 1.00 0.00 O ATOM 1645 CB SER B 73 -6.094 -8.364 -22.836 1.00 0.00 C ATOM 1646 OG SER B 73 -6.470 -8.953 -24.073 1.00 0.00 O ATOM 0 H SER B 73 -8.348 -7.702 -21.554 1.00 0.00 H new ATOM 0 HA SER B 73 -6.710 -10.198 -21.884 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.392 -7.316 -22.813 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.010 -8.390 -22.722 1.00 0.00 H new ATOM 0 HG SER B 73 -6.045 -8.466 -24.810 1.00 0.00 H new ATOM 1652 N ILE B 74 -4.835 -9.297 -20.245 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.056 -9.058 -18.999 1.00 0.00 C ATOM 1654 C ILE B 74 -2.562 -8.981 -19.344 1.00 0.00 C ATOM 1655 O ILE B 74 -1.861 -9.974 -19.307 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.307 -10.229 -18.041 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.811 -10.310 -17.721 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.486 -10.040 -16.755 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.087 -11.399 -16.671 1.00 0.00 C ATOM 0 H ILE B 74 -4.353 -9.854 -20.951 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.362 -8.122 -18.531 1.00 0.00 H new ATOM 0 HB ILE B 74 -3.995 -11.162 -18.510 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.162 -9.346 -17.353 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.370 -10.526 -18.631 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.670 -10.876 -16.080 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.425 -10.000 -17.003 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.780 -9.110 -16.269 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.156 -11.439 -16.460 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -5.756 -12.365 -17.053 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.545 -11.166 -15.754 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.075 -7.813 -19.678 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.634 -7.672 -20.026 1.00 0.00 C ATOM 1673 C LEU B 75 0.195 -7.489 -18.753 1.00 0.00 C ATOM 1674 O LEU B 75 0.178 -6.443 -18.133 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.440 -6.466 -20.948 1.00 0.00 C ATOM 1676 CG LEU B 75 0.996 -6.453 -21.476 1.00 0.00 C ATOM 1677 CD1 LEU B 75 1.013 -5.896 -22.901 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.862 -5.571 -20.572 1.00 0.00 C ATOM 0 H LEU B 75 -2.617 -6.950 -19.724 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.302 -8.574 -20.540 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.144 -6.513 -21.779 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.648 -5.543 -20.406 1.00 0.00 H new ATOM 0 HG LEU B 75 1.391 -7.469 -21.480 1.00 0.00 H new ATOM 0 HD11 LEU B 75 2.036 -5.887 -23.276 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.396 -6.524 -23.544 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.619 -4.880 -22.899 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.886 -5.560 -20.947 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.467 -4.555 -20.568 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.851 -5.969 -19.557 1.00 0.00 H new ATOM 1690 N GLU B 76 0.925 -8.505 -18.366 1.00 0.00 N ATOM 1691 CA GLU B 76 1.769 -8.414 -17.136 1.00 0.00 C ATOM 1692 C GLU B 76 3.231 -8.240 -17.553 1.00 0.00 C ATOM 1693 O GLU B 76 3.753 -9.021 -18.322 1.00 0.00 O ATOM 1694 CB GLU B 76 1.632 -9.699 -16.307 1.00 0.00 C ATOM 1695 CG GLU B 76 0.159 -10.098 -16.174 1.00 0.00 C ATOM 1696 CD GLU B 76 0.068 -11.546 -15.691 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.828 -11.904 -14.807 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.762 -12.273 -16.214 1.00 0.00 O ATOM 0 H GLU B 76 0.972 -9.400 -18.853 1.00 0.00 H new ATOM 0 HA GLU B 76 1.443 -7.565 -16.535 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.192 -10.506 -16.780 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.065 -9.548 -15.318 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.347 -9.436 -15.471 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.347 -9.990 -17.134 1.00 0.00 H new ATOM 1705 N LEU B 77 3.899 -7.231 -17.054 1.00 0.00 N ATOM 1706 CA LEU B 77 5.329 -7.031 -17.430 1.00 0.00 C ATOM 1707 C LEU B 77 6.201 -7.100 -16.176 1.00 0.00 C ATOM 1708 O LEU B 77 5.949 -6.438 -15.187 1.00 0.00 O ATOM 1709 CB LEU B 77 5.513 -5.678 -18.131 1.00 0.00 C ATOM 1710 CG LEU B 77 4.901 -4.557 -17.290 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.709 -3.274 -17.491 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.454 -4.320 -17.733 1.00 0.00 C ATOM 0 H LEU B 77 3.518 -6.541 -16.406 1.00 0.00 H new ATOM 0 HA LEU B 77 5.630 -7.819 -18.120 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.574 -5.485 -18.290 1.00 0.00 H new ATOM 0 HB3 LEU B 77 5.042 -5.703 -19.114 1.00 0.00 H new ATOM 0 HG LEU B 77 4.919 -4.840 -16.237 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.275 -2.473 -16.893 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.740 -3.441 -17.180 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.688 -2.992 -18.544 1.00 0.00 H new ATOM 0 HD21 LEU B 77 3.016 -3.521 -17.134 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.438 -4.036 -18.785 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.877 -5.234 -17.595 1.00 0.00 H new ATOM 1724 N ASN B 78 7.223 -7.909 -16.212 1.00 0.00 N ATOM 1725 CA ASN B 78 8.123 -8.046 -15.040 1.00 0.00 C ATOM 1726 C ASN B 78 9.239 -7.022 -15.161 1.00 0.00 C ATOM 1727 O ASN B 78 9.731 -6.766 -16.240 1.00 0.00 O ATOM 1728 CB ASN B 78 8.733 -9.440 -15.048 1.00 0.00 C ATOM 1729 CG ASN B 78 7.613 -10.479 -15.113 1.00 0.00 C ATOM 1730 OD1 ASN B 78 6.887 -10.545 -16.084 1.00 0.00 O ATOM 1731 ND2 ASN B 78 7.445 -11.297 -14.115 1.00 0.00 N ATOM 0 H ASN B 78 7.473 -8.487 -17.015 1.00 0.00 H new ATOM 0 HA ASN B 78 7.565 -7.888 -14.117 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.400 -9.553 -15.903 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.335 -9.592 -14.152 1.00 0.00 H new ATOM 0 HD21 ASN B 78 6.702 -11.995 -14.147 1.00 0.00 H new ATOM 0 HD22 ASN B 78 8.056 -11.240 -13.300 1.00 0.00 H new ATOM 1738 N VAL B 79 9.638 -6.432 -14.070 1.00 0.00 N ATOM 1739 CA VAL B 79 10.729 -5.417 -14.131 1.00 0.00 C ATOM 1740 C VAL B 79 11.863 -5.827 -13.193 1.00 0.00 C ATOM 1741 O VAL B 79 11.866 -5.492 -12.022 1.00 0.00 O ATOM 1742 CB VAL B 79 10.181 -4.051 -13.721 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.222 -2.981 -14.042 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.894 -3.759 -14.500 1.00 0.00 C ATOM 0 H VAL B 79 9.258 -6.607 -13.140 1.00 0.00 H new ATOM 0 HA VAL B 79 11.113 -5.356 -15.149 1.00 0.00 H new ATOM 0 HB VAL B 79 9.964 -4.048 -12.653 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.839 -2.002 -13.753 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.139 -3.189 -13.491 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.432 -2.987 -15.112 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.504 -2.784 -14.206 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.108 -3.757 -15.569 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.153 -4.527 -14.280 1.00 0.00 H new ATOM 1754 N THR B 80 12.827 -6.549 -13.704 1.00 0.00 N ATOM 1755 CA THR B 80 13.972 -6.991 -12.856 1.00 0.00 C ATOM 1756 C THR B 80 14.987 -5.851 -12.737 1.00 0.00 C ATOM 1757 O THR B 80 15.755 -5.597 -13.647 1.00 0.00 O ATOM 1758 CB THR B 80 14.643 -8.207 -13.500 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.671 -9.220 -13.719 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.740 -8.741 -12.576 1.00 0.00 C ATOM 0 H THR B 80 12.869 -6.852 -14.677 1.00 0.00 H new ATOM 0 HA THR B 80 13.609 -7.259 -11.864 1.00 0.00 H new ATOM 0 HB THR B 80 15.087 -7.914 -14.452 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.343 -9.165 -14.641 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.215 -9.606 -13.038 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.486 -7.964 -12.409 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.302 -9.034 -11.622 1.00 0.00 H new ATOM 1768 N LEU B 81 14.995 -5.167 -11.621 1.00 0.00 N ATOM 1769 CA LEU B 81 15.955 -4.047 -11.431 1.00 0.00 C ATOM 1770 C LEU B 81 17.249 -4.597 -10.802 1.00 0.00 C ATOM 1771 O LEU B 81 17.181 -5.435 -9.925 1.00 0.00 O ATOM 1772 CB LEU B 81 15.331 -3.019 -10.492 1.00 0.00 C ATOM 1773 CG LEU B 81 14.059 -2.451 -11.124 1.00 0.00 C ATOM 1774 CD1 LEU B 81 13.046 -2.122 -10.026 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.400 -1.175 -11.898 1.00 0.00 C ATOM 0 H LEU B 81 14.373 -5.340 -10.831 1.00 0.00 H new ATOM 0 HA LEU B 81 16.184 -3.580 -12.389 1.00 0.00 H new ATOM 0 HB2 LEU B 81 15.097 -3.482 -9.533 1.00 0.00 H new ATOM 0 HB3 LEU B 81 16.040 -2.216 -10.293 1.00 0.00 H new ATOM 0 HG LEU B 81 13.632 -3.188 -11.804 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.140 -1.717 -10.476 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.802 -3.029 -9.472 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.473 -1.385 -9.346 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.494 -0.770 -12.349 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.827 -0.439 -11.216 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.122 -1.406 -12.681 1.00 0.00 H new ATOM 1787 N PRO B 82 18.397 -4.123 -11.253 1.00 0.00 N ATOM 1788 CA PRO B 82 19.728 -4.569 -10.731 1.00 0.00 C ATOM 1789 C PRO B 82 20.102 -3.791 -9.466 1.00 0.00 C ATOM 1790 O PRO B 82 19.379 -2.916 -9.028 1.00 0.00 O ATOM 1791 CB PRO B 82 20.682 -4.247 -11.872 1.00 0.00 C ATOM 1792 CG PRO B 82 20.045 -3.138 -12.692 1.00 0.00 C ATOM 1793 CD PRO B 82 18.559 -3.085 -12.333 1.00 0.00 C ATOM 0 HA PRO B 82 19.746 -5.622 -10.449 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.651 -3.931 -11.486 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.856 -5.129 -12.488 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.524 -2.182 -12.479 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.174 -3.329 -13.757 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.271 -2.095 -11.979 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.933 -3.309 -13.197 1.00 0.00 H new