USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 782 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 10 HIS : no HD1:sc= -0.16 X(o=-0.02,f=0.35) USER MOD Set 1.2: A 12 SER OG : rot 48:sc= 0.139 USER MOD Set 2.1: A 9 HIS : no HD1:sc= -0.0521 X(o=-0.11,f=0.029) USER MOD Set 2.2: A 11 SER OG : rot -84:sc= -0.0561 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -118:sc= 0.0439 (180deg=-0.0437) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0454 X(o=-0.045,f=-0.012) USER MOD Single : A 6 HIS : no HD1:sc= -0.387 X(o=-0.39,f=-0.24) USER MOD Single : A 7 HIS : no HD1:sc= -0.118 X(o=-0.12,f=-0.6) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 16 ASN : amide:sc=-0.00525 X(o=-0.0053,f=-0.29) USER MOD Single : A 18 TYR OH : rot 180:sc= -0.0338 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.65) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 120:sc= 0.51 USER MOD Single : A 32 SER OG : rot 46:sc= 0.47 USER MOD Single : A 33 LYS NZ :NH3+ 171:sc= -0.0717 (180deg=-0.267) USER MOD Single : A 34 LYS NZ :NH3+ -149:sc= -2.87! (180deg=-4.89!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -151:sc= 0.323 (180deg=-0.628!) USER MOD Single : A 48 MET CE :methyl 157:sc= -0.263 (180deg=-1.12) USER MOD Single : A 52 SER OG : rot 11:sc= 1.27 USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc=-0.00145 X(o=-0.0015,f=0) USER MOD Single : A 56 SER OG : rot 150:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -70:sc= 1.14 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= -0.0992 USER MOD Single : A 83 LYS NZ :NH3+ 176:sc= 1.24 (180deg=1.09) USER MOD Single : A 89 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0437) USER MOD Single : A 94 LYS NZ :NH3+ -173:sc= 2.14 (180deg=1.82) USER MOD Single : A 98 GLN : amide:sc= 1.12 K(o=1.1,f=-0.48) USER MOD Single : A 99 LYS NZ :NH3+ 176:sc= 1.02 (180deg=0.759) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.035 -6.562 85.086 1.00 0.00 N ATOM 2 CA MET A 1 -1.260 -6.442 85.789 1.00 0.00 C ATOM 3 C MET A 1 -1.970 -5.166 85.368 1.00 0.00 C ATOM 4 O MET A 1 -1.322 -4.176 85.024 1.00 0.00 O ATOM 5 CB MET A 1 -1.062 -6.452 87.307 1.00 0.00 C ATOM 6 CG MET A 1 -0.558 -7.780 87.847 1.00 0.00 C ATOM 7 SD MET A 1 -1.701 -9.137 87.532 1.00 0.00 S ATOM 8 CE MET A 1 -0.845 -10.482 88.341 1.00 0.00 C ATOM 0 H1 MET A 1 0.031 -7.417 84.494 1.00 0.00 H new ATOM 0 H2 MET A 1 0.183 -5.726 84.486 1.00 0.00 H new ATOM 0 H3 MET A 1 0.804 -6.628 85.783 1.00 0.00 H new ATOM 0 HA MET A 1 -1.874 -7.300 85.516 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.355 -5.668 87.578 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.008 -6.209 87.790 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.406 -8.010 87.393 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.392 -7.692 88.921 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.426 -11.398 88.236 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.134 -10.618 87.882 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.721 -10.250 89.399 1.00 0.00 H new ATOM 18 N GLY A 2 -3.297 -5.194 85.395 1.00 0.00 N ATOM 19 CA GLY A 2 -4.078 -4.061 84.933 1.00 0.00 C ATOM 20 C GLY A 2 -4.396 -4.184 83.460 1.00 0.00 C ATOM 21 O GLY A 2 -3.503 -4.418 82.648 1.00 0.00 O ATOM 0 H GLY A 2 -3.848 -5.984 85.730 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -5.004 -3.997 85.504 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -3.527 -3.138 85.114 1.00 0.00 H new ATOM 25 N SER A 3 -5.667 -4.048 83.113 1.00 0.00 N ATOM 26 CA SER A 3 -6.100 -4.206 81.733 1.00 0.00 C ATOM 27 C SER A 3 -5.737 -2.984 80.899 1.00 0.00 C ATOM 28 O SER A 3 -6.368 -1.930 81.006 1.00 0.00 O ATOM 29 CB SER A 3 -7.607 -4.444 81.682 1.00 0.00 C ATOM 30 OG SER A 3 -7.974 -5.551 82.490 1.00 0.00 O ATOM 0 H SER A 3 -6.417 -3.828 83.769 1.00 0.00 H new ATOM 0 HA SER A 3 -5.584 -5.069 81.313 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.132 -3.551 82.022 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.916 -4.622 80.652 1.00 0.00 H new ATOM 0 HG SER A 3 -8.944 -5.683 82.443 1.00 0.00 H new ATOM 36 N SER A 4 -4.716 -3.124 80.072 1.00 0.00 N ATOM 37 CA SER A 4 -4.294 -2.045 79.202 1.00 0.00 C ATOM 38 C SER A 4 -5.059 -2.100 77.880 1.00 0.00 C ATOM 39 O SER A 4 -4.519 -2.482 76.841 1.00 0.00 O ATOM 40 CB SER A 4 -2.783 -2.116 78.968 1.00 0.00 C ATOM 41 OG SER A 4 -2.087 -2.160 80.204 1.00 0.00 O ATOM 0 H SER A 4 -4.164 -3.977 79.986 1.00 0.00 H new ATOM 0 HA SER A 4 -4.519 -1.093 79.682 1.00 0.00 H new ATOM 0 HB2 SER A 4 -2.542 -3.000 78.377 1.00 0.00 H new ATOM 0 HB3 SER A 4 -2.458 -1.250 78.392 1.00 0.00 H new ATOM 0 HG SER A 4 -1.123 -2.207 80.035 1.00 0.00 H new ATOM 47 N HIS A 5 -6.338 -1.752 77.942 1.00 0.00 N ATOM 48 CA HIS A 5 -7.179 -1.704 76.755 1.00 0.00 C ATOM 49 C HIS A 5 -7.480 -0.264 76.392 1.00 0.00 C ATOM 50 O HIS A 5 -7.872 0.529 77.247 1.00 0.00 O ATOM 51 CB HIS A 5 -8.489 -2.469 76.969 1.00 0.00 C ATOM 52 CG HIS A 5 -8.327 -3.953 76.998 1.00 0.00 C ATOM 53 ND1 HIS A 5 -8.974 -4.761 77.904 1.00 0.00 N ATOM 54 CD2 HIS A 5 -7.599 -4.779 76.212 1.00 0.00 C ATOM 55 CE1 HIS A 5 -8.650 -6.020 77.676 1.00 0.00 C ATOM 56 NE2 HIS A 5 -7.817 -6.060 76.654 1.00 0.00 N ATOM 0 H HIS A 5 -6.816 -1.498 78.806 1.00 0.00 H new ATOM 0 HA HIS A 5 -6.636 -2.181 75.939 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -8.938 -2.144 77.907 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -9.186 -2.205 76.174 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -6.964 -4.485 75.389 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -9.007 -6.874 78.233 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -7.403 -6.904 76.258 1.00 0.00 H new ATOM 65 N HIS A 6 -7.282 0.071 75.131 1.00 0.00 N ATOM 66 CA HIS A 6 -7.511 1.426 74.657 1.00 0.00 C ATOM 67 C HIS A 6 -7.905 1.419 73.182 1.00 0.00 C ATOM 68 O HIS A 6 -7.077 1.183 72.303 1.00 0.00 O ATOM 69 CB HIS A 6 -6.262 2.304 74.886 1.00 0.00 C ATOM 70 CG HIS A 6 -5.008 1.812 74.210 1.00 0.00 C ATOM 71 ND1 HIS A 6 -4.330 2.536 73.252 1.00 0.00 N ATOM 72 CD2 HIS A 6 -4.309 0.662 74.363 1.00 0.00 C ATOM 73 CE1 HIS A 6 -3.277 1.852 72.846 1.00 0.00 C ATOM 74 NE2 HIS A 6 -3.241 0.711 73.505 1.00 0.00 N ATOM 0 H HIS A 6 -6.962 -0.578 74.413 1.00 0.00 H new ATOM 0 HA HIS A 6 -8.335 1.854 75.229 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -6.475 3.313 74.533 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -6.076 2.374 75.958 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -4.549 -0.146 75.038 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -2.565 2.173 72.100 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -2.534 -0.016 73.395 1.00 0.00 H new ATOM 83 N HIS A 7 -9.181 1.644 72.915 1.00 0.00 N ATOM 84 CA HIS A 7 -9.645 1.755 71.543 1.00 0.00 C ATOM 85 C HIS A 7 -9.233 3.107 70.978 1.00 0.00 C ATOM 86 O HIS A 7 -9.728 4.153 71.397 1.00 0.00 O ATOM 87 CB HIS A 7 -11.164 1.526 71.431 1.00 0.00 C ATOM 88 CG HIS A 7 -12.010 2.373 72.335 1.00 0.00 C ATOM 89 ND1 HIS A 7 -12.335 2.003 73.622 1.00 0.00 N ATOM 90 CD2 HIS A 7 -12.612 3.569 72.126 1.00 0.00 C ATOM 91 CE1 HIS A 7 -13.100 2.933 74.164 1.00 0.00 C ATOM 92 NE2 HIS A 7 -13.284 3.892 73.278 1.00 0.00 N ATOM 0 H HIS A 7 -9.907 1.752 73.623 1.00 0.00 H new ATOM 0 HA HIS A 7 -9.176 0.970 70.950 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -11.467 1.710 70.400 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -11.373 0.477 71.643 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -12.571 4.158 71.222 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -13.506 2.912 75.164 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -13.836 4.737 73.425 1.00 0.00 H new ATOM 101 N HIS A 8 -8.291 3.075 70.053 1.00 0.00 N ATOM 102 CA HIS A 8 -7.714 4.291 69.508 1.00 0.00 C ATOM 103 C HIS A 8 -7.975 4.364 68.010 1.00 0.00 C ATOM 104 O HIS A 8 -7.494 3.530 67.240 1.00 0.00 O ATOM 105 CB HIS A 8 -6.212 4.338 69.804 1.00 0.00 C ATOM 106 CG HIS A 8 -5.546 5.629 69.429 1.00 0.00 C ATOM 107 ND1 HIS A 8 -4.452 5.689 68.598 1.00 0.00 N ATOM 108 CD2 HIS A 8 -5.802 6.908 69.801 1.00 0.00 C ATOM 109 CE1 HIS A 8 -4.061 6.942 68.476 1.00 0.00 C ATOM 110 NE2 HIS A 8 -4.863 7.702 69.196 1.00 0.00 N ATOM 0 H HIS A 8 -7.907 2.215 69.661 1.00 0.00 H new ATOM 0 HA HIS A 8 -8.183 5.154 69.981 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -6.058 4.160 70.868 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -5.723 3.523 69.270 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -6.597 7.239 70.452 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -3.225 7.288 67.886 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -4.795 8.716 69.288 1.00 0.00 H new ATOM 119 N HIS A 9 -8.745 5.358 67.610 1.00 0.00 N ATOM 120 CA HIS A 9 -9.126 5.522 66.218 1.00 0.00 C ATOM 121 C HIS A 9 -8.926 6.974 65.792 1.00 0.00 C ATOM 122 O HIS A 9 -9.831 7.803 65.920 1.00 0.00 O ATOM 123 CB HIS A 9 -10.586 5.088 66.023 1.00 0.00 C ATOM 124 CG HIS A 9 -11.034 5.034 64.595 1.00 0.00 C ATOM 125 ND1 HIS A 9 -12.246 5.531 64.176 1.00 0.00 N ATOM 126 CD2 HIS A 9 -10.444 4.510 63.496 1.00 0.00 C ATOM 127 CE1 HIS A 9 -12.385 5.315 62.883 1.00 0.00 C ATOM 128 NE2 HIS A 9 -11.305 4.698 62.448 1.00 0.00 N ATOM 0 H HIS A 9 -9.122 6.070 68.235 1.00 0.00 H new ATOM 0 HA HIS A 9 -8.494 4.892 65.592 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -10.722 4.103 66.470 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -11.232 5.777 66.567 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -9.476 4.033 63.453 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -13.238 5.596 62.283 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -11.137 4.407 61.485 1.00 0.00 H new ATOM 137 N HIS A 10 -7.722 7.283 65.327 1.00 0.00 N ATOM 138 CA HIS A 10 -7.387 8.633 64.892 1.00 0.00 C ATOM 139 C HIS A 10 -7.660 8.776 63.397 1.00 0.00 C ATOM 140 O HIS A 10 -6.846 8.379 62.566 1.00 0.00 O ATOM 141 CB HIS A 10 -5.913 8.934 65.202 1.00 0.00 C ATOM 142 CG HIS A 10 -5.525 10.379 65.086 1.00 0.00 C ATOM 143 ND1 HIS A 10 -4.917 11.070 66.110 1.00 0.00 N ATOM 144 CD2 HIS A 10 -5.626 11.255 64.057 1.00 0.00 C ATOM 145 CE1 HIS A 10 -4.659 12.302 65.719 1.00 0.00 C ATOM 146 NE2 HIS A 10 -5.079 12.443 64.476 1.00 0.00 N ATOM 0 H HIS A 10 -6.958 6.613 65.241 1.00 0.00 H new ATOM 0 HA HIS A 10 -8.007 9.349 65.431 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -5.693 8.594 66.214 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -5.288 8.350 64.526 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -6.057 11.056 63.087 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -4.184 13.067 66.315 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -5.009 13.294 63.918 1.00 0.00 H new ATOM 155 N SER A 11 -8.815 9.330 63.068 1.00 0.00 N ATOM 156 CA SER A 11 -9.220 9.495 61.683 1.00 0.00 C ATOM 157 C SER A 11 -9.005 10.928 61.225 1.00 0.00 C ATOM 158 O SER A 11 -9.682 11.849 61.690 1.00 0.00 O ATOM 159 CB SER A 11 -10.688 9.106 61.512 1.00 0.00 C ATOM 160 OG SER A 11 -10.897 7.749 61.859 1.00 0.00 O ATOM 0 H SER A 11 -9.493 9.675 63.747 1.00 0.00 H new ATOM 0 HA SER A 11 -8.604 8.840 61.067 1.00 0.00 H new ATOM 0 HB2 SER A 11 -11.312 9.745 62.136 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.994 9.272 60.479 1.00 0.00 H new ATOM 0 HG SER A 11 -10.690 7.179 61.089 1.00 0.00 H new ATOM 166 N SER A 12 -8.042 11.111 60.337 1.00 0.00 N ATOM 167 CA SER A 12 -7.780 12.412 59.757 1.00 0.00 C ATOM 168 C SER A 12 -7.252 12.283 58.330 1.00 0.00 C ATOM 169 O SER A 12 -6.062 12.044 58.113 1.00 0.00 O ATOM 170 CB SER A 12 -6.796 13.193 60.635 1.00 0.00 C ATOM 171 OG SER A 12 -5.665 12.404 60.980 1.00 0.00 O ATOM 0 H SER A 12 -7.427 10.369 60.002 1.00 0.00 H new ATOM 0 HA SER A 12 -8.719 12.963 59.712 1.00 0.00 H new ATOM 0 HB2 SER A 12 -6.469 14.089 60.108 1.00 0.00 H new ATOM 0 HB3 SER A 12 -7.301 13.524 61.543 1.00 0.00 H new ATOM 0 HG SER A 12 -5.314 11.967 60.176 1.00 0.00 H new ATOM 177 N GLY A 13 -8.155 12.398 57.362 1.00 0.00 N ATOM 178 CA GLY A 13 -7.745 12.415 55.970 1.00 0.00 C ATOM 179 C GLY A 13 -7.022 13.703 55.649 1.00 0.00 C ATOM 180 O GLY A 13 -5.996 13.704 54.963 1.00 0.00 O ATOM 0 H GLY A 13 -9.160 12.479 57.516 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.094 11.565 55.766 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.618 12.310 55.326 1.00 0.00 H new ATOM 184 N ARG A 14 -7.579 14.799 56.164 1.00 0.00 N ATOM 185 CA ARG A 14 -6.958 16.117 56.115 1.00 0.00 C ATOM 186 C ARG A 14 -6.950 16.676 54.697 1.00 0.00 C ATOM 187 O ARG A 14 -7.820 17.463 54.329 1.00 0.00 O ATOM 188 CB ARG A 14 -5.538 16.065 56.685 1.00 0.00 C ATOM 189 CG ARG A 14 -4.980 17.422 57.074 1.00 0.00 C ATOM 190 CD ARG A 14 -3.559 17.301 57.595 1.00 0.00 C ATOM 191 NE ARG A 14 -3.130 18.501 58.305 1.00 0.00 N ATOM 192 CZ ARG A 14 -1.867 18.774 58.613 1.00 0.00 C ATOM 193 NH1 ARG A 14 -0.883 17.994 58.179 1.00 0.00 N ATOM 194 NH2 ARG A 14 -1.582 19.840 59.345 1.00 0.00 N ATOM 0 H ARG A 14 -8.485 14.793 56.632 1.00 0.00 H new ATOM 0 HA ARG A 14 -7.554 16.789 56.732 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -5.532 15.416 57.561 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -4.878 15.610 55.947 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -4.998 18.087 56.211 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -5.613 17.873 57.838 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.490 16.442 58.262 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -2.883 17.112 56.761 1.00 0.00 H new ATOM 0 HE ARG A 14 -3.845 19.173 58.583 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -1.095 17.178 57.605 1.00 0.00 H new ATOM 0 HH12 ARG A 14 0.084 18.211 58.420 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -2.332 20.450 59.671 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -0.613 20.051 59.583 1.00 0.00 H new ATOM 208 N GLU A 15 -5.981 16.252 53.900 1.00 0.00 N ATOM 209 CA GLU A 15 -5.829 16.757 52.548 1.00 0.00 C ATOM 210 C GLU A 15 -5.544 15.612 51.584 1.00 0.00 C ATOM 211 O GLU A 15 -4.390 15.307 51.278 1.00 0.00 O ATOM 212 CB GLU A 15 -4.707 17.797 52.489 1.00 0.00 C ATOM 213 CG GLU A 15 -4.940 18.991 53.399 1.00 0.00 C ATOM 214 CD GLU A 15 -3.804 19.989 53.364 1.00 0.00 C ATOM 215 OE1 GLU A 15 -3.919 20.999 52.637 1.00 0.00 O ATOM 216 OE2 GLU A 15 -2.792 19.773 54.067 1.00 0.00 O ATOM 0 H GLU A 15 -5.286 15.556 54.170 1.00 0.00 H new ATOM 0 HA GLU A 15 -6.761 17.237 52.250 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.766 17.320 52.762 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.601 18.148 51.462 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.864 19.490 53.106 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -5.077 18.640 54.422 1.00 0.00 H new ATOM 224 N ASN A 16 -6.606 14.953 51.148 1.00 0.00 N ATOM 225 CA ASN A 16 -6.496 13.843 50.208 1.00 0.00 C ATOM 226 C ASN A 16 -7.556 13.975 49.125 1.00 0.00 C ATOM 227 O ASN A 16 -7.868 13.015 48.416 1.00 0.00 O ATOM 228 CB ASN A 16 -6.654 12.503 50.940 1.00 0.00 C ATOM 229 CG ASN A 16 -8.024 12.335 51.582 1.00 0.00 C ATOM 230 OD1 ASN A 16 -8.250 12.777 52.705 1.00 0.00 O ATOM 231 ND2 ASN A 16 -8.945 11.684 50.884 1.00 0.00 N ATOM 0 H ASN A 16 -7.562 15.168 51.431 1.00 0.00 H new ATOM 0 HA ASN A 16 -5.509 13.871 49.746 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -6.486 11.688 50.236 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -5.886 12.422 51.709 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -9.874 11.538 51.278 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -8.724 11.330 49.953 1.00 0.00 H new ATOM 238 N LEU A 17 -8.086 15.180 48.983 1.00 0.00 N ATOM 239 CA LEU A 17 -9.181 15.432 48.058 1.00 0.00 C ATOM 240 C LEU A 17 -8.659 15.665 46.645 1.00 0.00 C ATOM 241 O LEU A 17 -8.458 16.809 46.226 1.00 0.00 O ATOM 242 CB LEU A 17 -10.031 16.628 48.516 1.00 0.00 C ATOM 243 CG LEU A 17 -10.797 16.441 49.834 1.00 0.00 C ATOM 244 CD1 LEU A 17 -9.870 16.564 51.037 1.00 0.00 C ATOM 245 CD2 LEU A 17 -11.934 17.444 49.933 1.00 0.00 C ATOM 0 H LEU A 17 -7.774 16.003 49.499 1.00 0.00 H new ATOM 0 HA LEU A 17 -9.815 14.545 48.050 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -9.378 17.495 48.617 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -10.750 16.860 47.730 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.216 15.435 49.838 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -10.443 16.427 51.954 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -9.093 15.802 50.977 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -9.409 17.552 51.042 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -12.467 17.298 50.873 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -11.531 18.456 49.898 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -12.621 17.298 49.100 1.00 0.00 H new ATOM 257 N TYR A 18 -8.437 14.558 45.934 1.00 0.00 N ATOM 258 CA TYR A 18 -7.921 14.565 44.562 1.00 0.00 C ATOM 259 C TYR A 18 -6.451 14.978 44.512 1.00 0.00 C ATOM 260 O TYR A 18 -6.028 15.942 45.156 1.00 0.00 O ATOM 261 CB TYR A 18 -8.758 15.469 43.642 1.00 0.00 C ATOM 262 CG TYR A 18 -8.254 15.505 42.215 1.00 0.00 C ATOM 263 CD1 TYR A 18 -8.565 14.486 41.322 1.00 0.00 C ATOM 264 CD2 TYR A 18 -7.449 16.545 41.767 1.00 0.00 C ATOM 265 CE1 TYR A 18 -8.091 14.507 40.023 1.00 0.00 C ATOM 266 CE2 TYR A 18 -6.970 16.571 40.471 1.00 0.00 C ATOM 267 CZ TYR A 18 -7.291 15.550 39.604 1.00 0.00 C ATOM 268 OH TYR A 18 -6.809 15.572 38.313 1.00 0.00 O ATOM 0 H TYR A 18 -8.612 13.621 46.297 1.00 0.00 H new ATOM 0 HA TYR A 18 -8.000 13.541 44.196 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -9.791 15.122 43.646 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -8.760 16.482 44.044 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -9.187 13.665 41.648 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -7.193 17.347 42.443 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -8.346 13.711 39.340 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -6.347 17.388 40.139 1.00 0.00 H new ATOM 0 HH TYR A 18 -6.263 16.375 38.181 1.00 0.00 H new ATOM 278 N PHE A 19 -5.677 14.226 43.745 1.00 0.00 N ATOM 279 CA PHE A 19 -4.273 14.535 43.523 1.00 0.00 C ATOM 280 C PHE A 19 -3.767 13.778 42.301 1.00 0.00 C ATOM 281 O PHE A 19 -2.926 14.269 41.548 1.00 0.00 O ATOM 282 CB PHE A 19 -3.437 14.175 44.757 1.00 0.00 C ATOM 283 CG PHE A 19 -2.009 14.634 44.672 1.00 0.00 C ATOM 284 CD1 PHE A 19 -1.675 15.950 44.952 1.00 0.00 C ATOM 285 CD2 PHE A 19 -1.004 13.754 44.304 1.00 0.00 C ATOM 286 CE1 PHE A 19 -0.362 16.379 44.872 1.00 0.00 C ATOM 287 CE2 PHE A 19 0.310 14.176 44.223 1.00 0.00 C ATOM 288 CZ PHE A 19 0.632 15.492 44.503 1.00 0.00 C ATOM 0 H PHE A 19 -6.002 13.389 43.261 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.173 15.606 43.347 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.900 14.616 45.640 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.455 13.094 44.894 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.448 16.648 45.236 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.250 12.727 44.078 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.114 17.406 45.098 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.085 13.479 43.941 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.657 15.825 44.434 1.00 0.00 H new ATOM 298 N GLN A 20 -4.299 12.582 42.097 1.00 0.00 N ATOM 299 CA GLN A 20 -3.907 11.755 40.972 1.00 0.00 C ATOM 300 C GLN A 20 -4.893 11.912 39.824 1.00 0.00 C ATOM 301 O GLN A 20 -6.075 11.593 39.958 1.00 0.00 O ATOM 302 CB GLN A 20 -3.819 10.292 41.401 1.00 0.00 C ATOM 303 CG GLN A 20 -2.668 10.009 42.351 1.00 0.00 C ATOM 304 CD GLN A 20 -2.723 8.607 42.923 1.00 0.00 C ATOM 305 OE1 GLN A 20 -2.199 7.659 42.338 1.00 0.00 O ATOM 306 NE2 GLN A 20 -3.337 8.468 44.087 1.00 0.00 N ATOM 0 H GLN A 20 -5.007 12.163 42.701 1.00 0.00 H new ATOM 0 HA GLN A 20 -2.925 12.080 40.627 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.755 10.005 41.881 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -3.710 9.667 40.514 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -1.724 10.147 41.825 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -2.687 10.732 43.166 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -3.759 9.278 44.541 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -3.388 7.551 44.530 1.00 0.00 H new ATOM 315 N GLY A 21 -4.405 12.423 38.707 1.00 0.00 N ATOM 316 CA GLY A 21 -5.251 12.623 37.546 1.00 0.00 C ATOM 317 C GLY A 21 -4.492 13.245 36.395 1.00 0.00 C ATOM 318 O GLY A 21 -3.909 12.531 35.577 1.00 0.00 O ATOM 0 H GLY A 21 -3.433 12.705 38.581 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.667 11.666 37.231 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -6.091 13.263 37.815 1.00 0.00 H new ATOM 322 N HIS A 22 -4.499 14.576 36.341 1.00 0.00 N ATOM 323 CA HIS A 22 -3.771 15.327 35.314 1.00 0.00 C ATOM 324 C HIS A 22 -4.323 15.014 33.914 1.00 0.00 C ATOM 325 O HIS A 22 -3.570 14.881 32.950 1.00 0.00 O ATOM 326 CB HIS A 22 -2.265 15.020 35.406 1.00 0.00 C ATOM 327 CG HIS A 22 -1.398 15.865 34.515 1.00 0.00 C ATOM 328 ND1 HIS A 22 -0.759 15.368 33.399 1.00 0.00 N ATOM 329 CD2 HIS A 22 -1.066 17.176 34.583 1.00 0.00 C ATOM 330 CE1 HIS A 22 -0.070 16.335 32.821 1.00 0.00 C ATOM 331 NE2 HIS A 22 -0.238 17.441 33.521 1.00 0.00 N ATOM 0 H HIS A 22 -5.006 15.163 37.003 1.00 0.00 H new ATOM 0 HA HIS A 22 -3.914 16.393 35.489 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -1.943 15.155 36.438 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -2.106 13.971 35.157 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -1.392 17.881 35.333 1.00 0.00 H new ATOM 0 HE1 HIS A 22 0.529 16.237 31.928 1.00 0.00 H new ATOM 0 HE2 HIS A 22 0.180 18.347 33.307 1.00 0.00 H new ATOM 340 N MET A 23 -5.653 14.913 33.821 1.00 0.00 N ATOM 341 CA MET A 23 -6.349 14.696 32.545 1.00 0.00 C ATOM 342 C MET A 23 -6.024 13.329 31.938 1.00 0.00 C ATOM 343 O MET A 23 -5.280 12.535 32.518 1.00 0.00 O ATOM 344 CB MET A 23 -6.028 15.813 31.538 1.00 0.00 C ATOM 345 CG MET A 23 -6.793 17.113 31.771 1.00 0.00 C ATOM 346 SD MET A 23 -6.391 17.920 33.334 1.00 0.00 S ATOM 347 CE MET A 23 -7.405 19.394 33.217 1.00 0.00 C ATOM 0 H MET A 23 -6.277 14.979 34.625 1.00 0.00 H new ATOM 0 HA MET A 23 -7.417 14.719 32.764 1.00 0.00 H new ATOM 0 HB2 MET A 23 -4.959 16.023 31.576 1.00 0.00 H new ATOM 0 HB3 MET A 23 -6.246 15.453 30.533 1.00 0.00 H new ATOM 0 HG2 MET A 23 -6.581 17.801 30.952 1.00 0.00 H new ATOM 0 HG3 MET A 23 -7.863 16.905 31.744 1.00 0.00 H new ATOM 0 HE1 MET A 23 -7.268 20.002 34.112 1.00 0.00 H new ATOM 0 HE2 MET A 23 -7.111 19.969 32.339 1.00 0.00 H new ATOM 0 HE3 MET A 23 -8.453 19.108 33.129 1.00 0.00 H new ATOM 357 N ALA A 24 -6.599 13.058 30.767 1.00 0.00 N ATOM 358 CA ALA A 24 -6.435 11.769 30.107 1.00 0.00 C ATOM 359 C ALA A 24 -6.915 11.832 28.658 1.00 0.00 C ATOM 360 O ALA A 24 -7.300 12.903 28.177 1.00 0.00 O ATOM 361 CB ALA A 24 -7.189 10.686 30.866 1.00 0.00 C ATOM 0 H ALA A 24 -7.184 13.719 30.256 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.373 11.522 30.104 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -7.057 9.729 30.361 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.801 10.617 31.882 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -8.249 10.936 30.899 1.00 0.00 H new ATOM 367 N ALA A 25 -6.884 10.672 27.984 1.00 0.00 N ATOM 368 CA ALA A 25 -7.351 10.519 26.602 1.00 0.00 C ATOM 369 C ALA A 25 -6.397 11.157 25.595 1.00 0.00 C ATOM 370 O ALA A 25 -6.276 12.380 25.513 1.00 0.00 O ATOM 371 CB ALA A 25 -8.763 11.064 26.436 1.00 0.00 C ATOM 0 H ALA A 25 -6.530 9.806 28.390 1.00 0.00 H new ATOM 0 HA ALA A 25 -7.370 9.450 26.391 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.083 10.937 25.402 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -9.442 10.522 27.095 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -8.777 12.123 26.693 1.00 0.00 H new ATOM 377 N ARG A 26 -5.721 10.314 24.827 1.00 0.00 N ATOM 378 CA ARG A 26 -4.818 10.783 23.786 1.00 0.00 C ATOM 379 C ARG A 26 -4.939 9.946 22.516 1.00 0.00 C ATOM 380 O ARG A 26 -4.963 8.713 22.563 1.00 0.00 O ATOM 381 CB ARG A 26 -3.364 10.758 24.261 1.00 0.00 C ATOM 382 CG ARG A 26 -2.949 11.980 25.063 1.00 0.00 C ATOM 383 CD ARG A 26 -1.437 12.067 25.157 1.00 0.00 C ATOM 384 NE ARG A 26 -0.815 12.000 23.831 1.00 0.00 N ATOM 385 CZ ARG A 26 0.442 11.613 23.613 1.00 0.00 C ATOM 386 NH1 ARG A 26 1.243 11.342 24.636 1.00 0.00 N ATOM 387 NH2 ARG A 26 0.898 11.513 22.369 1.00 0.00 N ATOM 0 H ARG A 26 -5.781 9.299 24.906 1.00 0.00 H new ATOM 0 HA ARG A 26 -5.108 11.810 23.562 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -3.208 9.868 24.870 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -2.711 10.669 23.393 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -3.342 12.881 24.593 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -3.379 11.929 26.063 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -1.154 12.999 25.647 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -1.062 11.254 25.778 1.00 0.00 H new ATOM 0 HE ARG A 26 -1.380 12.266 23.024 1.00 0.00 H new ATOM 0 HH11 ARG A 26 0.897 11.430 25.592 1.00 0.00 H new ATOM 0 HH12 ARG A 26 2.204 11.046 24.467 1.00 0.00 H new ATOM 0 HH21 ARG A 26 0.287 11.732 21.583 1.00 0.00 H new ATOM 0 HH22 ARG A 26 1.859 11.217 22.201 1.00 0.00 H new ATOM 401 N ILE A 27 -5.026 10.630 21.384 1.00 0.00 N ATOM 402 CA ILE A 27 -4.967 9.996 20.090 1.00 0.00 C ATOM 403 C ILE A 27 -4.141 10.861 19.137 1.00 0.00 C ATOM 404 O ILE A 27 -4.542 11.966 18.769 1.00 0.00 O ATOM 405 CB ILE A 27 -6.378 9.736 19.515 1.00 0.00 C ATOM 406 CG1 ILE A 27 -6.252 9.266 18.075 1.00 0.00 C ATOM 407 CG2 ILE A 27 -7.260 10.973 19.619 1.00 0.00 C ATOM 408 CD1 ILE A 27 -7.491 8.595 17.531 1.00 0.00 C ATOM 0 H ILE A 27 -5.140 11.643 21.345 1.00 0.00 H new ATOM 0 HA ILE A 27 -4.487 9.024 20.204 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.862 8.957 20.104 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -6.010 10.122 17.445 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.415 8.571 18.003 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -8.244 10.754 19.205 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -7.362 11.260 20.666 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -6.806 11.792 19.061 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.317 8.290 16.499 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.724 7.717 18.134 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -8.328 9.292 17.567 1.00 0.00 H new ATOM 420 N THR A 28 -2.966 10.372 18.783 1.00 0.00 N ATOM 421 CA THR A 28 -2.032 11.135 17.970 1.00 0.00 C ATOM 422 C THR A 28 -1.926 10.538 16.567 1.00 0.00 C ATOM 423 O THR A 28 -2.439 9.447 16.312 1.00 0.00 O ATOM 424 CB THR A 28 -0.642 11.149 18.638 1.00 0.00 C ATOM 425 OG1 THR A 28 -0.797 11.049 20.062 1.00 0.00 O ATOM 426 CG2 THR A 28 0.110 12.433 18.307 1.00 0.00 C ATOM 0 H THR A 28 -2.633 9.445 19.047 1.00 0.00 H new ATOM 0 HA THR A 28 -2.402 12.157 17.886 1.00 0.00 H new ATOM 0 HB THR A 28 -0.070 10.302 18.259 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.342 10.243 20.385 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.087 12.417 18.790 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.240 12.510 17.228 1.00 0.00 H new ATOM 0 HG23 THR A 28 -0.459 13.291 18.666 1.00 0.00 H new ATOM 434 N GLY A 29 -1.279 11.258 15.660 1.00 0.00 N ATOM 435 CA GLY A 29 -1.069 10.749 14.323 1.00 0.00 C ATOM 436 C GLY A 29 -1.855 11.516 13.285 1.00 0.00 C ATOM 437 O GLY A 29 -2.667 12.380 13.620 1.00 0.00 O ATOM 0 H GLY A 29 -0.896 12.188 15.829 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -0.007 10.799 14.081 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.355 9.698 14.288 1.00 0.00 H new ATOM 441 N GLU A 30 -1.607 11.207 12.025 1.00 0.00 N ATOM 442 CA GLU A 30 -2.327 11.827 10.926 1.00 0.00 C ATOM 443 C GLU A 30 -3.160 10.781 10.205 1.00 0.00 C ATOM 444 O GLU A 30 -2.801 9.601 10.184 1.00 0.00 O ATOM 445 CB GLU A 30 -1.356 12.494 9.949 1.00 0.00 C ATOM 446 CG GLU A 30 -0.727 13.766 10.490 1.00 0.00 C ATOM 447 CD GLU A 30 0.209 14.418 9.495 1.00 0.00 C ATOM 448 OE1 GLU A 30 -0.258 14.815 8.406 1.00 0.00 O ATOM 449 OE2 GLU A 30 1.413 14.543 9.798 1.00 0.00 O ATOM 0 H GLU A 30 -0.906 10.525 11.735 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.986 12.596 11.330 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -0.566 11.787 9.696 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.885 12.725 9.025 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.514 14.471 10.759 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.178 13.536 11.403 1.00 0.00 H new ATOM 457 N PRO A 31 -4.301 11.183 9.639 1.00 0.00 N ATOM 458 CA PRO A 31 -5.156 10.289 8.862 1.00 0.00 C ATOM 459 C PRO A 31 -4.506 9.882 7.540 1.00 0.00 C ATOM 460 O PRO A 31 -4.810 10.449 6.486 1.00 0.00 O ATOM 461 CB PRO A 31 -6.426 11.114 8.606 1.00 0.00 C ATOM 462 CG PRO A 31 -6.329 12.293 9.520 1.00 0.00 C ATOM 463 CD PRO A 31 -4.864 12.535 9.729 1.00 0.00 C ATOM 0 HA PRO A 31 -5.350 9.356 9.390 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -6.486 11.429 7.564 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -7.322 10.529 8.814 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -6.810 13.167 9.081 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -6.831 12.095 10.467 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -4.450 13.198 8.969 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -4.663 12.994 10.697 1.00 0.00 H new ATOM 471 N SER A 32 -3.590 8.922 7.609 1.00 0.00 N ATOM 472 CA SER A 32 -2.920 8.415 6.425 1.00 0.00 C ATOM 473 C SER A 32 -3.884 7.567 5.605 1.00 0.00 C ATOM 474 O SER A 32 -4.224 6.441 5.980 1.00 0.00 O ATOM 475 CB SER A 32 -1.684 7.602 6.823 1.00 0.00 C ATOM 476 OG SER A 32 -2.028 6.568 7.729 1.00 0.00 O ATOM 0 H SER A 32 -3.296 8.479 8.480 1.00 0.00 H new ATOM 0 HA SER A 32 -2.593 9.256 5.813 1.00 0.00 H new ATOM 0 HB2 SER A 32 -1.224 7.173 5.933 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.943 8.259 7.279 1.00 0.00 H new ATOM 0 HG SER A 32 -2.830 6.105 7.408 1.00 0.00 H new ATOM 482 N LYS A 33 -4.340 8.126 4.502 1.00 0.00 N ATOM 483 CA LYS A 33 -5.334 7.478 3.669 1.00 0.00 C ATOM 484 C LYS A 33 -4.673 6.494 2.715 1.00 0.00 C ATOM 485 O LYS A 33 -3.537 6.707 2.281 1.00 0.00 O ATOM 486 CB LYS A 33 -6.130 8.543 2.917 1.00 0.00 C ATOM 487 CG LYS A 33 -6.726 9.577 3.858 1.00 0.00 C ATOM 488 CD LYS A 33 -7.355 10.741 3.115 1.00 0.00 C ATOM 489 CE LYS A 33 -7.772 11.838 4.083 1.00 0.00 C ATOM 490 NZ LYS A 33 -6.606 12.384 4.830 1.00 0.00 N ATOM 0 H LYS A 33 -4.034 9.037 4.159 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.021 6.907 4.294 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.480 9.040 2.196 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.929 8.066 2.350 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.479 9.101 4.486 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.947 9.952 4.522 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.647 11.140 2.389 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -8.224 10.394 2.555 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -8.261 12.642 3.533 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -8.503 11.443 4.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.900 13.227 5.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.248 11.664 5.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -5.855 12.644 4.159 1.00 0.00 H new ATOM 504 N LYS A 34 -5.391 5.414 2.411 1.00 0.00 N ATOM 505 CA LYS A 34 -4.876 4.330 1.579 1.00 0.00 C ATOM 506 C LYS A 34 -3.751 3.589 2.300 1.00 0.00 C ATOM 507 O LYS A 34 -2.569 3.895 2.121 1.00 0.00 O ATOM 508 CB LYS A 34 -4.392 4.860 0.225 1.00 0.00 C ATOM 509 CG LYS A 34 -3.822 3.788 -0.689 1.00 0.00 C ATOM 510 CD LYS A 34 -3.043 4.391 -1.853 1.00 0.00 C ATOM 511 CE LYS A 34 -1.685 4.942 -1.424 1.00 0.00 C ATOM 512 NZ LYS A 34 -1.798 6.162 -0.576 1.00 0.00 N ATOM 0 H LYS A 34 -6.347 5.267 2.735 1.00 0.00 H new ATOM 0 HA LYS A 34 -5.690 3.628 1.395 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -5.224 5.350 -0.281 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -3.630 5.621 0.395 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -3.168 3.132 -0.115 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.633 3.171 -1.075 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -2.897 3.631 -2.621 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -3.630 5.191 -2.304 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -1.143 4.172 -0.875 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.096 5.175 -2.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -0.973 6.775 -0.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -2.666 6.678 -0.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -1.833 5.886 0.426 1.00 0.00 H new ATOM 526 N ALA A 35 -4.128 2.639 3.142 1.00 0.00 N ATOM 527 CA ALA A 35 -3.156 1.805 3.837 1.00 0.00 C ATOM 528 C ALA A 35 -3.080 0.433 3.178 1.00 0.00 C ATOM 529 O ALA A 35 -4.011 0.028 2.477 1.00 0.00 O ATOM 530 CB ALA A 35 -3.520 1.668 5.309 1.00 0.00 C ATOM 0 H ALA A 35 -5.101 2.425 3.362 1.00 0.00 H new ATOM 0 HA ALA A 35 -2.178 2.282 3.771 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -2.782 1.042 5.810 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -3.534 2.654 5.774 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -4.505 1.210 5.399 1.00 0.00 H new ATOM 536 N VAL A 36 -1.979 -0.276 3.391 1.00 0.00 N ATOM 537 CA VAL A 36 -1.791 -1.584 2.782 1.00 0.00 C ATOM 538 C VAL A 36 -2.044 -2.690 3.798 1.00 0.00 C ATOM 539 O VAL A 36 -1.329 -2.813 4.792 1.00 0.00 O ATOM 540 CB VAL A 36 -0.373 -1.750 2.205 1.00 0.00 C ATOM 541 CG1 VAL A 36 -0.267 -3.032 1.394 1.00 0.00 C ATOM 542 CG2 VAL A 36 0.015 -0.544 1.363 1.00 0.00 C ATOM 0 H VAL A 36 -1.205 0.033 3.979 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.509 -1.659 1.966 1.00 0.00 H new ATOM 0 HB VAL A 36 0.325 -1.817 3.039 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.743 -3.128 0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.488 -3.886 2.034 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.980 -3.001 0.570 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.021 -0.685 0.967 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.688 -0.435 0.537 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -0.009 0.354 1.981 1.00 0.00 H new ATOM 552 N SER A 37 -3.064 -3.481 3.542 1.00 0.00 N ATOM 553 CA SER A 37 -3.426 -4.579 4.425 1.00 0.00 C ATOM 554 C SER A 37 -2.769 -5.879 3.962 1.00 0.00 C ATOM 555 O SER A 37 -2.562 -6.089 2.765 1.00 0.00 O ATOM 556 CB SER A 37 -4.948 -4.736 4.466 1.00 0.00 C ATOM 557 OG SER A 37 -5.576 -3.504 4.789 1.00 0.00 O ATOM 0 H SER A 37 -3.664 -3.386 2.723 1.00 0.00 H new ATOM 0 HA SER A 37 -3.067 -4.353 5.429 1.00 0.00 H new ATOM 0 HB2 SER A 37 -5.307 -5.090 3.500 1.00 0.00 H new ATOM 0 HB3 SER A 37 -5.220 -5.492 5.203 1.00 0.00 H new ATOM 0 HG SER A 37 -6.548 -3.627 4.808 1.00 0.00 H new ATOM 563 N ASP A 38 -2.470 -6.759 4.914 1.00 0.00 N ATOM 564 CA ASP A 38 -1.788 -8.019 4.621 1.00 0.00 C ATOM 565 C ASP A 38 -2.751 -9.031 4.003 1.00 0.00 C ATOM 566 O ASP A 38 -2.378 -10.171 3.730 1.00 0.00 O ATOM 567 CB ASP A 38 -1.172 -8.597 5.903 1.00 0.00 C ATOM 568 CG ASP A 38 -2.218 -9.022 6.919 1.00 0.00 C ATOM 569 OD1 ASP A 38 -2.271 -10.225 7.262 1.00 0.00 O ATOM 570 OD2 ASP A 38 -2.992 -8.156 7.383 1.00 0.00 O ATOM 0 H ASP A 38 -2.690 -6.622 5.901 1.00 0.00 H new ATOM 0 HA ASP A 38 -0.995 -7.817 3.901 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.551 -9.455 5.647 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -0.516 -7.852 6.353 1.00 0.00 H new ATOM 576 N ARG A 39 -3.984 -8.601 3.763 1.00 0.00 N ATOM 577 CA ARG A 39 -5.011 -9.473 3.208 1.00 0.00 C ATOM 578 C ARG A 39 -4.800 -9.679 1.711 1.00 0.00 C ATOM 579 O ARG A 39 -5.461 -10.510 1.092 1.00 0.00 O ATOM 580 CB ARG A 39 -6.398 -8.876 3.449 1.00 0.00 C ATOM 581 CG ARG A 39 -6.629 -8.443 4.885 1.00 0.00 C ATOM 582 CD ARG A 39 -8.053 -7.967 5.098 1.00 0.00 C ATOM 583 NE ARG A 39 -9.011 -9.071 5.039 1.00 0.00 N ATOM 584 CZ ARG A 39 -9.741 -9.471 6.080 1.00 0.00 C ATOM 585 NH1 ARG A 39 -9.600 -8.867 7.253 1.00 0.00 N ATOM 586 NH2 ARG A 39 -10.602 -10.475 5.956 1.00 0.00 N ATOM 0 H ARG A 39 -4.298 -7.648 3.946 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.939 -10.439 3.709 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -6.534 -8.017 2.792 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -7.154 -9.611 3.173 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.418 -9.276 5.556 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -5.934 -7.643 5.142 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.129 -7.471 6.066 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.306 -7.226 4.340 1.00 0.00 H new ATOM 0 HE ARG A 39 -9.127 -9.562 4.152 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -8.935 -8.100 7.355 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -10.156 -9.170 8.053 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -10.709 -10.947 5.058 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -11.156 -10.774 6.759 1.00 0.00 H new ATOM 600 N LEU A 40 -3.883 -8.911 1.137 1.00 0.00 N ATOM 601 CA LEU A 40 -3.600 -8.994 -0.288 1.00 0.00 C ATOM 602 C LEU A 40 -2.530 -10.043 -0.576 1.00 0.00 C ATOM 603 O LEU A 40 -2.309 -10.426 -1.724 1.00 0.00 O ATOM 604 CB LEU A 40 -3.158 -7.630 -0.820 1.00 0.00 C ATOM 605 CG LEU A 40 -4.206 -6.516 -0.715 1.00 0.00 C ATOM 606 CD1 LEU A 40 -3.655 -5.212 -1.276 1.00 0.00 C ATOM 607 CD2 LEU A 40 -5.490 -6.912 -1.436 1.00 0.00 C ATOM 0 H LEU A 40 -3.322 -8.222 1.639 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.516 -9.295 -0.797 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.265 -7.319 -0.278 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.873 -7.741 -1.866 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.442 -6.365 0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.412 -4.432 -1.194 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.769 -4.919 -0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.389 -5.350 -2.324 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.220 -6.107 -1.349 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.275 -7.094 -2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.895 -7.819 -0.987 1.00 0.00 H new ATOM 619 N ILE A 41 -1.876 -10.516 0.473 1.00 0.00 N ATOM 620 CA ILE A 41 -0.840 -11.524 0.325 1.00 0.00 C ATOM 621 C ILE A 41 -1.462 -12.908 0.264 1.00 0.00 C ATOM 622 O ILE A 41 -2.162 -13.328 1.185 1.00 0.00 O ATOM 623 CB ILE A 41 0.179 -11.468 1.482 1.00 0.00 C ATOM 624 CG1 ILE A 41 0.807 -10.074 1.574 1.00 0.00 C ATOM 625 CG2 ILE A 41 1.263 -12.524 1.300 1.00 0.00 C ATOM 626 CD1 ILE A 41 1.557 -9.655 0.325 1.00 0.00 C ATOM 0 H ILE A 41 -2.044 -10.218 1.434 1.00 0.00 H new ATOM 0 HA ILE A 41 -0.311 -11.316 -0.605 1.00 0.00 H new ATOM 0 HB ILE A 41 -0.350 -11.676 2.412 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.022 -9.345 1.776 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.491 -10.050 2.422 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.970 -12.466 2.127 1.00 0.00 H new ATOM 0 HG22 ILE A 41 0.807 -13.514 1.281 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.788 -12.348 0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.973 -8.657 0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.365 -10.361 0.132 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.873 -9.645 -0.524 1.00 0.00 H new ATOM 638 N GLY A 42 -1.206 -13.609 -0.824 1.00 0.00 N ATOM 639 CA GLY A 42 -1.802 -14.910 -1.021 1.00 0.00 C ATOM 640 C GLY A 42 -3.087 -14.836 -1.819 1.00 0.00 C ATOM 641 O GLY A 42 -3.877 -15.778 -1.831 1.00 0.00 O ATOM 0 H GLY A 42 -0.593 -13.300 -1.578 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.093 -15.558 -1.536 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.004 -15.366 -0.052 1.00 0.00 H new ATOM 645 N ARG A 43 -3.300 -13.708 -2.479 1.00 0.00 N ATOM 646 CA ARG A 43 -4.488 -13.516 -3.298 1.00 0.00 C ATOM 647 C ARG A 43 -4.208 -13.894 -4.744 1.00 0.00 C ATOM 648 O ARG A 43 -3.052 -13.942 -5.179 1.00 0.00 O ATOM 649 CB ARG A 43 -4.963 -12.062 -3.243 1.00 0.00 C ATOM 650 CG ARG A 43 -5.381 -11.585 -1.860 1.00 0.00 C ATOM 651 CD ARG A 43 -6.699 -12.194 -1.399 1.00 0.00 C ATOM 652 NE ARG A 43 -6.557 -13.575 -0.937 1.00 0.00 N ATOM 653 CZ ARG A 43 -6.698 -13.943 0.338 1.00 0.00 C ATOM 654 NH1 ARG A 43 -6.863 -13.020 1.279 1.00 0.00 N ATOM 655 NH2 ARG A 43 -6.661 -15.226 0.675 1.00 0.00 N ATOM 0 H ARG A 43 -2.665 -12.910 -2.464 1.00 0.00 H new ATOM 0 HA ARG A 43 -5.270 -14.162 -2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -4.163 -11.418 -3.609 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -5.805 -11.943 -3.924 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.600 -11.836 -1.143 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -5.471 -10.499 -1.867 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.112 -11.587 -0.593 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -7.415 -12.163 -2.220 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.339 -14.295 -1.626 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.882 -12.032 1.026 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -6.971 -13.299 2.254 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -6.524 -15.938 -0.042 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -6.769 -15.500 1.651 1.00 0.00 H new ATOM 669 N LYS A 44 -5.271 -14.159 -5.481 1.00 0.00 N ATOM 670 CA LYS A 44 -5.169 -14.467 -6.892 1.00 0.00 C ATOM 671 C LYS A 44 -5.183 -13.171 -7.697 1.00 0.00 C ATOM 672 O LYS A 44 -5.889 -12.222 -7.358 1.00 0.00 O ATOM 673 CB LYS A 44 -6.339 -15.370 -7.292 1.00 0.00 C ATOM 674 CG LYS A 44 -6.123 -16.213 -8.546 1.00 0.00 C ATOM 675 CD LYS A 44 -6.206 -15.408 -9.835 1.00 0.00 C ATOM 676 CE LYS A 44 -7.556 -14.728 -10.001 1.00 0.00 C ATOM 677 NZ LYS A 44 -7.655 -14.013 -11.300 1.00 0.00 N ATOM 0 H LYS A 44 -6.224 -14.166 -5.119 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.235 -14.990 -7.098 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.559 -16.039 -6.460 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.221 -14.747 -7.442 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.146 -16.694 -8.488 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.868 -17.008 -8.574 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.418 -14.655 -9.842 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.026 -16.066 -10.685 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.349 -15.473 -9.934 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.711 -14.023 -9.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.301 -13.204 -11.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -6.714 -13.672 -11.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.019 -14.662 -12.027 1.00 0.00 H new ATOM 691 N GLY A 45 -4.409 -13.154 -8.760 1.00 0.00 N ATOM 692 CA GLY A 45 -4.361 -12.014 -9.642 1.00 0.00 C ATOM 693 C GLY A 45 -4.266 -12.449 -11.085 1.00 0.00 C ATOM 694 O GLY A 45 -4.087 -13.631 -11.370 1.00 0.00 O ATOM 0 H GLY A 45 -3.800 -13.925 -9.034 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.252 -11.403 -9.501 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.504 -11.390 -9.389 1.00 0.00 H new ATOM 698 N VAL A 46 -4.381 -11.503 -11.992 1.00 0.00 N ATOM 699 CA VAL A 46 -4.368 -11.802 -13.415 1.00 0.00 C ATOM 700 C VAL A 46 -3.297 -10.981 -14.123 1.00 0.00 C ATOM 701 O VAL A 46 -3.065 -9.821 -13.779 1.00 0.00 O ATOM 702 CB VAL A 46 -5.755 -11.525 -14.048 1.00 0.00 C ATOM 703 CG1 VAL A 46 -6.129 -10.054 -13.937 1.00 0.00 C ATOM 704 CG2 VAL A 46 -5.803 -11.983 -15.499 1.00 0.00 C ATOM 0 H VAL A 46 -4.485 -10.513 -11.771 1.00 0.00 H new ATOM 0 HA VAL A 46 -4.137 -12.860 -13.536 1.00 0.00 H new ATOM 0 HB VAL A 46 -6.489 -12.104 -13.487 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.107 -9.892 -14.390 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.164 -9.766 -12.886 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.385 -9.449 -14.455 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.789 -11.775 -15.914 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.047 -11.449 -16.074 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.607 -13.054 -15.549 1.00 0.00 H new ATOM 714 N VAL A 47 -2.650 -11.583 -15.106 1.00 0.00 N ATOM 715 CA VAL A 47 -1.590 -10.908 -15.839 1.00 0.00 C ATOM 716 C VAL A 47 -2.165 -10.111 -17.004 1.00 0.00 C ATOM 717 O VAL A 47 -2.645 -10.679 -17.988 1.00 0.00 O ATOM 718 CB VAL A 47 -0.541 -11.910 -16.370 1.00 0.00 C ATOM 719 CG1 VAL A 47 0.585 -11.189 -17.091 1.00 0.00 C ATOM 720 CG2 VAL A 47 0.014 -12.760 -15.239 1.00 0.00 C ATOM 0 H VAL A 47 -2.839 -12.536 -15.416 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.098 -10.229 -15.143 1.00 0.00 H new ATOM 0 HB VAL A 47 -1.038 -12.566 -17.084 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.310 -11.918 -17.455 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.178 -10.630 -17.934 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.076 -10.501 -16.403 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.751 -13.458 -15.636 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.487 -12.116 -14.498 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.797 -13.317 -14.770 1.00 0.00 H new ATOM 730 N MET A 48 -2.122 -8.792 -16.881 1.00 0.00 N ATOM 731 CA MET A 48 -2.622 -7.911 -17.923 1.00 0.00 C ATOM 732 C MET A 48 -1.480 -7.480 -18.831 1.00 0.00 C ATOM 733 O MET A 48 -1.653 -7.328 -20.037 1.00 0.00 O ATOM 734 CB MET A 48 -3.302 -6.682 -17.316 1.00 0.00 C ATOM 735 CG MET A 48 -4.452 -7.023 -16.390 1.00 0.00 C ATOM 736 SD MET A 48 -5.393 -5.576 -15.866 1.00 0.00 S ATOM 737 CE MET A 48 -5.991 -4.986 -17.448 1.00 0.00 C ATOM 0 H MET A 48 -1.744 -8.308 -16.066 1.00 0.00 H new ATOM 0 HA MET A 48 -3.361 -8.457 -18.510 1.00 0.00 H new ATOM 0 HB2 MET A 48 -2.562 -6.102 -16.765 1.00 0.00 H new ATOM 0 HB3 MET A 48 -3.670 -6.046 -18.121 1.00 0.00 H new ATOM 0 HG2 MET A 48 -5.121 -7.721 -16.893 1.00 0.00 H new ATOM 0 HG3 MET A 48 -4.062 -7.534 -15.509 1.00 0.00 H new ATOM 0 HE1 MET A 48 -6.884 -4.380 -17.296 1.00 0.00 H new ATOM 0 HE2 MET A 48 -5.220 -4.382 -17.926 1.00 0.00 H new ATOM 0 HE3 MET A 48 -6.234 -5.836 -18.085 1.00 0.00 H new ATOM 747 N GLU A 49 -0.315 -7.286 -18.232 1.00 0.00 N ATOM 748 CA GLU A 49 0.883 -6.906 -18.972 1.00 0.00 C ATOM 749 C GLU A 49 1.950 -7.976 -18.767 1.00 0.00 C ATOM 750 O GLU A 49 2.153 -8.429 -17.641 1.00 0.00 O ATOM 751 CB GLU A 49 1.378 -5.536 -18.487 1.00 0.00 C ATOM 752 CG GLU A 49 2.636 -5.024 -19.177 1.00 0.00 C ATOM 753 CD GLU A 49 2.400 -4.638 -20.621 1.00 0.00 C ATOM 754 OE1 GLU A 49 2.845 -5.382 -21.513 1.00 0.00 O ATOM 755 OE2 GLU A 49 1.779 -3.579 -20.865 1.00 0.00 O ATOM 0 H GLU A 49 -0.171 -7.386 -17.227 1.00 0.00 H new ATOM 0 HA GLU A 49 0.660 -6.828 -20.036 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.581 -4.807 -18.631 1.00 0.00 H new ATOM 0 HB3 GLU A 49 1.568 -5.594 -17.415 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.017 -4.160 -18.633 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.407 -5.793 -19.133 1.00 0.00 H new ATOM 763 N ALA A 50 2.608 -8.377 -19.851 1.00 0.00 N ATOM 764 CA ALA A 50 3.565 -9.486 -19.822 1.00 0.00 C ATOM 765 C ALA A 50 4.649 -9.276 -18.771 1.00 0.00 C ATOM 766 O ALA A 50 5.346 -8.258 -18.765 1.00 0.00 O ATOM 767 CB ALA A 50 4.191 -9.683 -21.189 1.00 0.00 C ATOM 0 H ALA A 50 2.496 -7.948 -20.770 1.00 0.00 H new ATOM 0 HA ALA A 50 3.012 -10.385 -19.550 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.899 -10.511 -21.149 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.412 -9.907 -21.917 1.00 0.00 H new ATOM 0 HB3 ALA A 50 4.713 -8.773 -21.485 1.00 0.00 H new ATOM 773 N ILE A 51 4.791 -10.251 -17.886 1.00 0.00 N ATOM 774 CA ILE A 51 5.770 -10.174 -16.811 1.00 0.00 C ATOM 775 C ILE A 51 6.996 -11.004 -17.159 1.00 0.00 C ATOM 776 O ILE A 51 6.878 -12.186 -17.481 1.00 0.00 O ATOM 777 CB ILE A 51 5.185 -10.670 -15.470 1.00 0.00 C ATOM 778 CG1 ILE A 51 3.908 -9.896 -15.125 1.00 0.00 C ATOM 779 CG2 ILE A 51 6.217 -10.522 -14.355 1.00 0.00 C ATOM 780 CD1 ILE A 51 3.169 -10.442 -13.922 1.00 0.00 C ATOM 0 H ILE A 51 4.238 -11.108 -17.891 1.00 0.00 H new ATOM 0 HA ILE A 51 6.049 -9.126 -16.698 1.00 0.00 H new ATOM 0 HB ILE A 51 4.932 -11.725 -15.570 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.165 -8.853 -14.939 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.241 -9.911 -15.987 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.791 -10.875 -13.416 1.00 0.00 H new ATOM 0 HG22 ILE A 51 7.101 -11.112 -14.597 1.00 0.00 H new ATOM 0 HG23 ILE A 51 6.497 -9.473 -14.255 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.277 -9.843 -13.740 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.879 -11.476 -14.111 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.818 -10.401 -13.047 1.00 0.00 H new ATOM 792 N SER A 52 8.166 -10.389 -17.103 1.00 0.00 N ATOM 793 CA SER A 52 9.401 -11.090 -17.395 1.00 0.00 C ATOM 794 C SER A 52 10.407 -10.876 -16.273 1.00 0.00 C ATOM 795 O SER A 52 10.266 -9.941 -15.482 1.00 0.00 O ATOM 796 CB SER A 52 9.980 -10.609 -18.729 1.00 0.00 C ATOM 797 OG SER A 52 9.982 -9.194 -18.806 1.00 0.00 O ATOM 0 H SER A 52 8.284 -9.406 -16.858 1.00 0.00 H new ATOM 0 HA SER A 52 9.188 -12.156 -17.472 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.997 -10.984 -18.843 1.00 0.00 H new ATOM 0 HB3 SER A 52 9.395 -11.020 -19.552 1.00 0.00 H new ATOM 0 HG SER A 52 9.780 -8.818 -17.924 1.00 0.00 H new ATOM 803 N PRO A 53 11.422 -11.748 -16.183 1.00 0.00 N ATOM 804 CA PRO A 53 12.504 -11.607 -15.205 1.00 0.00 C ATOM 805 C PRO A 53 13.207 -10.256 -15.323 1.00 0.00 C ATOM 806 O PRO A 53 13.675 -9.699 -14.330 1.00 0.00 O ATOM 807 CB PRO A 53 13.468 -12.744 -15.563 1.00 0.00 C ATOM 808 CG PRO A 53 12.641 -13.741 -16.297 1.00 0.00 C ATOM 809 CD PRO A 53 11.576 -12.957 -17.012 1.00 0.00 C ATOM 0 HA PRO A 53 12.137 -11.656 -14.180 1.00 0.00 H new ATOM 0 HB2 PRO A 53 14.290 -12.383 -16.181 1.00 0.00 H new ATOM 0 HB3 PRO A 53 13.910 -13.182 -14.668 1.00 0.00 H new ATOM 0 HG2 PRO A 53 13.249 -14.306 -17.004 1.00 0.00 H new ATOM 0 HG3 PRO A 53 12.198 -14.462 -15.609 1.00 0.00 H new ATOM 0 HD2 PRO A 53 11.876 -12.710 -18.030 1.00 0.00 H new ATOM 0 HD3 PRO A 53 10.644 -13.517 -17.081 1.00 0.00 H new ATOM 817 N GLN A 54 13.267 -9.732 -16.546 1.00 0.00 N ATOM 818 CA GLN A 54 13.913 -8.449 -16.804 1.00 0.00 C ATOM 819 C GLN A 54 12.958 -7.289 -16.547 1.00 0.00 C ATOM 820 O GLN A 54 13.226 -6.420 -15.717 1.00 0.00 O ATOM 821 CB GLN A 54 14.409 -8.375 -18.249 1.00 0.00 C ATOM 822 CG GLN A 54 15.444 -9.427 -18.606 1.00 0.00 C ATOM 823 CD GLN A 54 15.991 -9.239 -20.004 1.00 0.00 C ATOM 824 OE1 GLN A 54 15.462 -9.784 -20.974 1.00 0.00 O ATOM 825 NE2 GLN A 54 17.055 -8.461 -20.117 1.00 0.00 N ATOM 0 H GLN A 54 12.875 -10.179 -17.375 1.00 0.00 H new ATOM 0 HA GLN A 54 14.760 -8.370 -16.122 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.556 -8.478 -18.920 1.00 0.00 H new ATOM 0 HB3 GLN A 54 14.835 -7.387 -18.425 1.00 0.00 H new ATOM 0 HG2 GLN A 54 16.264 -9.386 -17.888 1.00 0.00 H new ATOM 0 HG3 GLN A 54 14.997 -10.417 -18.523 1.00 0.00 H new ATOM 0 HE21 GLN A 54 17.461 -8.029 -19.287 1.00 0.00 H new ATOM 0 HE22 GLN A 54 17.469 -8.293 -21.034 1.00 0.00 H new ATOM 834 N ASN A 55 11.840 -7.281 -17.260 1.00 0.00 N ATOM 835 CA ASN A 55 10.920 -6.155 -17.214 1.00 0.00 C ATOM 836 C ASN A 55 9.619 -6.555 -16.532 1.00 0.00 C ATOM 837 O ASN A 55 9.017 -7.579 -16.871 1.00 0.00 O ATOM 838 CB ASN A 55 10.663 -5.631 -18.634 1.00 0.00 C ATOM 839 CG ASN A 55 9.706 -4.454 -18.671 1.00 0.00 C ATOM 840 OD1 ASN A 55 10.103 -3.304 -18.469 1.00 0.00 O ATOM 841 ND2 ASN A 55 8.449 -4.730 -18.971 1.00 0.00 N ATOM 0 H ASN A 55 11.549 -8.040 -17.876 1.00 0.00 H new ATOM 0 HA ASN A 55 11.369 -5.353 -16.628 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.611 -5.335 -19.082 1.00 0.00 H new ATOM 0 HB3 ASN A 55 10.260 -6.438 -19.245 1.00 0.00 H new ATOM 0 HD21 ASN A 55 7.765 -3.977 -19.043 1.00 0.00 H new ATOM 0 HD22 ASN A 55 8.163 -5.696 -19.130 1.00 0.00 H new ATOM 848 N SER A 56 9.207 -5.748 -15.567 1.00 0.00 N ATOM 849 CA SER A 56 8.021 -6.029 -14.772 1.00 0.00 C ATOM 850 C SER A 56 6.749 -5.936 -15.613 1.00 0.00 C ATOM 851 O SER A 56 6.722 -5.281 -16.659 1.00 0.00 O ATOM 852 CB SER A 56 7.929 -5.044 -13.608 1.00 0.00 C ATOM 853 OG SER A 56 9.153 -4.963 -12.899 1.00 0.00 O ATOM 0 H SER A 56 9.683 -4.882 -15.313 1.00 0.00 H new ATOM 0 HA SER A 56 8.109 -7.047 -14.393 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.660 -4.057 -13.985 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.134 -5.354 -12.930 1.00 0.00 H new ATOM 0 HG SER A 56 9.251 -4.066 -12.517 1.00 0.00 H new ATOM 859 N GLY A 57 5.701 -6.583 -15.141 1.00 0.00 N ATOM 860 CA GLY A 57 4.426 -6.529 -15.818 1.00 0.00 C ATOM 861 C GLY A 57 3.363 -5.924 -14.928 1.00 0.00 C ATOM 862 O GLY A 57 3.684 -5.318 -13.903 1.00 0.00 O ATOM 0 H GLY A 57 5.710 -7.150 -14.293 1.00 0.00 H new ATOM 0 HA2 GLY A 57 4.520 -5.940 -16.730 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.126 -7.534 -16.117 1.00 0.00 H new ATOM 866 N LEU A 58 2.103 -6.111 -15.294 1.00 0.00 N ATOM 867 CA LEU A 58 0.995 -5.515 -14.556 1.00 0.00 C ATOM 868 C LEU A 58 -0.032 -6.563 -14.164 1.00 0.00 C ATOM 869 O LEU A 58 -0.497 -7.341 -15.002 1.00 0.00 O ATOM 870 CB LEU A 58 0.312 -4.426 -15.386 1.00 0.00 C ATOM 871 CG LEU A 58 1.154 -3.182 -15.657 1.00 0.00 C ATOM 872 CD1 LEU A 58 0.369 -2.184 -16.491 1.00 0.00 C ATOM 873 CD2 LEU A 58 1.611 -2.542 -14.354 1.00 0.00 C ATOM 0 H LEU A 58 1.821 -6.671 -16.098 1.00 0.00 H new ATOM 0 HA LEU A 58 1.411 -5.072 -13.651 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.012 -4.856 -16.342 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.600 -4.121 -14.873 1.00 0.00 H new ATOM 0 HG LEU A 58 2.040 -3.485 -16.216 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.982 -1.302 -16.676 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.094 -2.641 -17.442 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.534 -1.892 -15.954 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.209 -1.658 -14.573 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.740 -2.254 -13.765 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.211 -3.255 -13.789 1.00 0.00 H new ATOM 885 N VAL A 59 -0.374 -6.576 -12.887 1.00 0.00 N ATOM 886 CA VAL A 59 -1.423 -7.438 -12.377 1.00 0.00 C ATOM 887 C VAL A 59 -2.530 -6.568 -11.813 1.00 0.00 C ATOM 888 O VAL A 59 -2.284 -5.436 -11.403 1.00 0.00 O ATOM 889 CB VAL A 59 -0.915 -8.372 -11.259 1.00 0.00 C ATOM 890 CG1 VAL A 59 -1.949 -9.424 -10.894 1.00 0.00 C ATOM 891 CG2 VAL A 59 0.401 -9.025 -11.651 1.00 0.00 C ATOM 0 H VAL A 59 0.067 -5.991 -12.178 1.00 0.00 H new ATOM 0 HA VAL A 59 -1.779 -8.059 -13.199 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.743 -7.757 -10.375 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -1.555 -10.063 -10.104 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -2.859 -8.935 -10.546 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -2.176 -10.030 -11.771 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.737 -9.678 -10.846 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.260 -9.611 -12.559 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.151 -8.254 -11.830 1.00 0.00 H new ATOM 901 N LYS A 60 -3.729 -7.098 -11.773 1.00 0.00 N ATOM 902 CA LYS A 60 -4.870 -6.348 -11.274 1.00 0.00 C ATOM 903 C LYS A 60 -5.496 -7.069 -10.096 1.00 0.00 C ATOM 904 O LYS A 60 -6.012 -8.178 -10.235 1.00 0.00 O ATOM 905 CB LYS A 60 -5.908 -6.146 -12.379 1.00 0.00 C ATOM 906 CG LYS A 60 -7.131 -5.357 -11.933 1.00 0.00 C ATOM 907 CD LYS A 60 -8.145 -5.204 -13.054 1.00 0.00 C ATOM 908 CE LYS A 60 -8.610 -6.556 -13.573 1.00 0.00 C ATOM 909 NZ LYS A 60 -9.639 -6.419 -14.634 1.00 0.00 N ATOM 0 H LYS A 60 -3.946 -8.047 -12.079 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.521 -5.369 -10.945 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -5.439 -5.629 -13.216 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -6.229 -7.121 -12.746 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.599 -5.860 -11.086 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -6.821 -4.371 -11.587 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -9.003 -4.636 -12.695 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -7.703 -4.632 -13.870 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -7.756 -7.107 -13.965 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -9.015 -7.141 -12.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -9.929 -7.363 -14.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -10.465 -5.915 -14.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -9.245 -5.883 -15.433 1.00 0.00 H new ATOM 923 N VAL A 61 -5.436 -6.440 -8.935 1.00 0.00 N ATOM 924 CA VAL A 61 -6.049 -6.992 -7.746 1.00 0.00 C ATOM 925 C VAL A 61 -7.405 -6.334 -7.542 1.00 0.00 C ATOM 926 O VAL A 61 -7.576 -5.480 -6.670 1.00 0.00 O ATOM 927 CB VAL A 61 -5.168 -6.803 -6.490 1.00 0.00 C ATOM 928 CG1 VAL A 61 -5.746 -7.566 -5.304 1.00 0.00 C ATOM 929 CG2 VAL A 61 -3.742 -7.252 -6.771 1.00 0.00 C ATOM 0 H VAL A 61 -4.967 -5.545 -8.793 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.166 -8.066 -7.889 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.154 -5.743 -6.237 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.110 -7.419 -4.431 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.749 -7.198 -5.088 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -5.793 -8.628 -5.543 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.134 -7.113 -5.877 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.741 -8.306 -7.050 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.328 -6.660 -7.587 1.00 0.00 H new ATOM 939 N ASP A 62 -8.339 -6.694 -8.425 1.00 0.00 N ATOM 940 CA ASP A 62 -9.715 -6.185 -8.406 1.00 0.00 C ATOM 941 C ASP A 62 -9.786 -4.686 -8.684 1.00 0.00 C ATOM 942 O ASP A 62 -10.140 -4.262 -9.785 1.00 0.00 O ATOM 943 CB ASP A 62 -10.417 -6.507 -7.080 1.00 0.00 C ATOM 944 CG ASP A 62 -10.669 -7.991 -6.902 1.00 0.00 C ATOM 945 OD1 ASP A 62 -10.365 -8.524 -5.813 1.00 0.00 O ATOM 946 OD2 ASP A 62 -11.173 -8.632 -7.850 1.00 0.00 O ATOM 0 H ASP A 62 -8.161 -7.354 -9.182 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.238 -6.698 -9.213 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.808 -6.143 -6.252 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -11.366 -5.973 -7.036 1.00 0.00 H new ATOM 952 N GLY A 63 -9.442 -3.891 -7.691 1.00 0.00 N ATOM 953 CA GLY A 63 -9.588 -2.455 -7.799 1.00 0.00 C ATOM 954 C GLY A 63 -8.337 -1.761 -8.307 1.00 0.00 C ATOM 955 O GLY A 63 -8.426 -0.748 -9.001 1.00 0.00 O ATOM 0 H GLY A 63 -9.060 -4.215 -6.802 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.417 -2.230 -8.470 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.849 -2.049 -6.822 1.00 0.00 H new ATOM 959 N GLU A 64 -7.170 -2.305 -7.977 1.00 0.00 N ATOM 960 CA GLU A 64 -5.913 -1.637 -8.275 1.00 0.00 C ATOM 961 C GLU A 64 -5.045 -2.446 -9.234 1.00 0.00 C ATOM 962 O GLU A 64 -4.985 -3.675 -9.150 1.00 0.00 O ATOM 963 CB GLU A 64 -5.148 -1.403 -6.979 1.00 0.00 C ATOM 964 CG GLU A 64 -5.889 -0.534 -5.980 1.00 0.00 C ATOM 965 CD GLU A 64 -6.078 0.889 -6.458 1.00 0.00 C ATOM 966 OE1 GLU A 64 -7.238 1.303 -6.659 1.00 0.00 O ATOM 967 OE2 GLU A 64 -5.067 1.603 -6.633 1.00 0.00 O ATOM 0 H GLU A 64 -7.071 -3.204 -7.505 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.148 -0.689 -8.759 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -4.930 -2.366 -6.518 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -4.190 -0.937 -7.212 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -6.865 -0.975 -5.777 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -5.341 -0.525 -5.038 1.00 0.00 H new ATOM 975 N THR A 65 -4.377 -1.744 -10.136 1.00 0.00 N ATOM 976 CA THR A 65 -3.410 -2.361 -11.026 1.00 0.00 C ATOM 977 C THR A 65 -1.999 -2.123 -10.484 1.00 0.00 C ATOM 978 O THR A 65 -1.591 -0.979 -10.276 1.00 0.00 O ATOM 979 CB THR A 65 -3.522 -1.789 -12.453 1.00 0.00 C ATOM 980 OG1 THR A 65 -4.896 -1.770 -12.870 1.00 0.00 O ATOM 981 CG2 THR A 65 -2.710 -2.620 -13.435 1.00 0.00 C ATOM 0 H THR A 65 -4.489 -0.739 -10.270 1.00 0.00 H new ATOM 0 HA THR A 65 -3.616 -3.430 -11.073 1.00 0.00 H new ATOM 0 HB THR A 65 -3.128 -0.773 -12.442 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.958 -1.404 -13.777 1.00 0.00 H new ATOM 0 HG21 THR A 65 -2.805 -2.197 -14.435 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.662 -2.615 -13.136 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.081 -3.645 -13.438 1.00 0.00 H new ATOM 989 N TRP A 66 -1.272 -3.200 -10.245 1.00 0.00 N ATOM 990 CA TRP A 66 0.043 -3.116 -9.620 1.00 0.00 C ATOM 991 C TRP A 66 1.129 -3.627 -10.557 1.00 0.00 C ATOM 992 O TRP A 66 0.861 -4.413 -11.467 1.00 0.00 O ATOM 993 CB TRP A 66 0.078 -3.938 -8.328 1.00 0.00 C ATOM 994 CG TRP A 66 -0.868 -3.461 -7.267 1.00 0.00 C ATOM 995 CD1 TRP A 66 -2.167 -3.845 -7.094 1.00 0.00 C ATOM 996 CD2 TRP A 66 -0.584 -2.520 -6.225 1.00 0.00 C ATOM 997 NE1 TRP A 66 -2.705 -3.203 -6.007 1.00 0.00 N ATOM 998 CE2 TRP A 66 -1.754 -2.387 -5.455 1.00 0.00 C ATOM 999 CE3 TRP A 66 0.549 -1.783 -5.861 1.00 0.00 C ATOM 1000 CZ2 TRP A 66 -1.829 -1.541 -4.350 1.00 0.00 C ATOM 1001 CZ3 TRP A 66 0.474 -0.943 -4.765 1.00 0.00 C ATOM 1002 CH2 TRP A 66 -0.705 -0.834 -4.017 1.00 0.00 C ATOM 0 H TRP A 66 -1.569 -4.149 -10.474 1.00 0.00 H new ATOM 0 HA TRP A 66 0.230 -2.066 -9.394 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -0.154 -4.976 -8.565 1.00 0.00 H new ATOM 0 HB3 TRP A 66 1.092 -3.922 -7.928 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -2.693 -4.550 -7.720 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -3.659 -3.316 -5.665 1.00 0.00 H new ATOM 0 HE3 TRP A 66 1.465 -1.869 -6.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 -2.740 -1.447 -3.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 1.339 -0.362 -4.481 1.00 0.00 H new ATOM 0 HH2 TRP A 66 -0.728 -0.178 -3.159 1.00 0.00 H new ATOM 1013 N ARG A 67 2.354 -3.173 -10.327 1.00 0.00 N ATOM 1014 CA ARG A 67 3.502 -3.686 -11.054 1.00 0.00 C ATOM 1015 C ARG A 67 3.973 -4.965 -10.392 1.00 0.00 C ATOM 1016 O ARG A 67 3.975 -5.069 -9.165 1.00 0.00 O ATOM 1017 CB ARG A 67 4.653 -2.677 -11.085 1.00 0.00 C ATOM 1018 CG ARG A 67 4.440 -1.488 -12.010 1.00 0.00 C ATOM 1019 CD ARG A 67 3.313 -0.588 -11.537 1.00 0.00 C ATOM 1020 NE ARG A 67 3.327 0.710 -12.209 1.00 0.00 N ATOM 1021 CZ ARG A 67 2.351 1.615 -12.121 1.00 0.00 C ATOM 1022 NH1 ARG A 67 1.269 1.374 -11.391 1.00 0.00 N ATOM 1023 NH2 ARG A 67 2.452 2.769 -12.771 1.00 0.00 N ATOM 0 H ARG A 67 2.576 -2.450 -9.642 1.00 0.00 H new ATOM 0 HA ARG A 67 3.196 -3.875 -12.083 1.00 0.00 H new ATOM 0 HB2 ARG A 67 4.819 -2.306 -10.073 1.00 0.00 H new ATOM 0 HB3 ARG A 67 5.563 -3.195 -11.388 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.362 -0.910 -12.074 1.00 0.00 H new ATOM 0 HG3 ARG A 67 4.219 -1.847 -13.015 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.357 -1.079 -11.718 1.00 0.00 H new ATOM 0 HD3 ARG A 67 3.396 -0.439 -10.460 1.00 0.00 H new ATOM 0 HE ARG A 67 4.138 0.939 -12.784 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.178 0.490 -10.891 1.00 0.00 H new ATOM 0 HH12 ARG A 67 0.529 2.073 -11.330 1.00 0.00 H new ATOM 0 HH21 ARG A 67 3.277 2.964 -13.339 1.00 0.00 H new ATOM 0 HH22 ARG A 67 1.705 3.460 -12.703 1.00 0.00 H new ATOM 1037 N ALA A 68 4.371 -5.930 -11.188 1.00 0.00 N ATOM 1038 CA ALA A 68 4.759 -7.225 -10.655 1.00 0.00 C ATOM 1039 C ALA A 68 6.058 -7.724 -11.264 1.00 0.00 C ATOM 1040 O ALA A 68 6.305 -7.562 -12.463 1.00 0.00 O ATOM 1041 CB ALA A 68 3.651 -8.236 -10.886 1.00 0.00 C ATOM 0 H ALA A 68 4.436 -5.849 -12.203 1.00 0.00 H new ATOM 0 HA ALA A 68 4.924 -7.105 -9.584 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.951 -9.203 -10.483 1.00 0.00 H new ATOM 0 HB2 ALA A 68 2.742 -7.901 -10.386 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.462 -8.331 -11.955 1.00 0.00 H new ATOM 1047 N THR A 69 6.878 -8.328 -10.420 1.00 0.00 N ATOM 1048 CA THR A 69 8.122 -8.948 -10.843 1.00 0.00 C ATOM 1049 C THR A 69 8.051 -10.451 -10.624 1.00 0.00 C ATOM 1050 O THR A 69 7.443 -10.910 -9.653 1.00 0.00 O ATOM 1051 CB THR A 69 9.322 -8.378 -10.062 1.00 0.00 C ATOM 1052 OG1 THR A 69 8.992 -8.275 -8.669 1.00 0.00 O ATOM 1053 CG2 THR A 69 9.731 -7.016 -10.597 1.00 0.00 C ATOM 0 H THR A 69 6.699 -8.402 -9.419 1.00 0.00 H new ATOM 0 HA THR A 69 8.262 -8.732 -11.902 1.00 0.00 H new ATOM 0 HB THR A 69 10.164 -9.059 -10.189 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.759 -7.914 -8.177 1.00 0.00 H new ATOM 0 HG21 THR A 69 10.580 -6.641 -10.026 1.00 0.00 H new ATOM 0 HG22 THR A 69 10.012 -7.107 -11.646 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.895 -6.322 -10.503 1.00 0.00 H new ATOM 1061 N SER A 70 8.660 -11.208 -11.521 1.00 0.00 N ATOM 1062 CA SER A 70 8.663 -12.657 -11.419 1.00 0.00 C ATOM 1063 C SER A 70 9.984 -13.227 -11.923 1.00 0.00 C ATOM 1064 O SER A 70 10.703 -12.574 -12.679 1.00 0.00 O ATOM 1065 CB SER A 70 7.502 -13.236 -12.227 1.00 0.00 C ATOM 1066 OG SER A 70 6.262 -12.720 -11.777 1.00 0.00 O ATOM 0 H SER A 70 9.160 -10.841 -12.331 1.00 0.00 H new ATOM 0 HA SER A 70 8.545 -12.933 -10.371 1.00 0.00 H new ATOM 0 HB2 SER A 70 7.636 -13.000 -13.283 1.00 0.00 H new ATOM 0 HB3 SER A 70 7.501 -14.323 -12.141 1.00 0.00 H new ATOM 0 HG SER A 70 6.056 -13.089 -10.893 1.00 0.00 H new ATOM 1072 N GLY A 71 10.298 -14.440 -11.494 1.00 0.00 N ATOM 1073 CA GLY A 71 11.496 -15.108 -11.961 1.00 0.00 C ATOM 1074 C GLY A 71 11.195 -16.016 -13.129 1.00 0.00 C ATOM 1075 O GLY A 71 12.044 -16.792 -13.574 1.00 0.00 O ATOM 0 H GLY A 71 9.742 -14.976 -10.828 1.00 0.00 H new ATOM 0 HA2 GLY A 71 12.238 -14.366 -12.256 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.932 -15.689 -11.148 1.00 0.00 H new ATOM 1079 N THR A 72 9.969 -15.928 -13.610 1.00 0.00 N ATOM 1080 CA THR A 72 9.524 -16.705 -14.749 1.00 0.00 C ATOM 1081 C THR A 72 8.890 -15.773 -15.776 1.00 0.00 C ATOM 1082 O THR A 72 8.624 -14.606 -15.478 1.00 0.00 O ATOM 1083 CB THR A 72 8.486 -17.764 -14.324 1.00 0.00 C ATOM 1084 OG1 THR A 72 8.755 -18.210 -12.989 1.00 0.00 O ATOM 1085 CG2 THR A 72 8.502 -18.964 -15.259 1.00 0.00 C ATOM 0 H THR A 72 9.253 -15.314 -13.220 1.00 0.00 H new ATOM 0 HA THR A 72 10.387 -17.214 -15.178 1.00 0.00 H new ATOM 0 HB THR A 72 7.502 -17.297 -14.371 1.00 0.00 H new ATOM 0 HG1 THR A 72 8.090 -18.881 -12.728 1.00 0.00 H new ATOM 0 HG21 THR A 72 7.759 -19.691 -14.931 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.268 -18.639 -16.273 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.490 -19.424 -15.244 1.00 0.00 H new ATOM 1093 N VAL A 73 8.644 -16.279 -16.974 1.00 0.00 N ATOM 1094 CA VAL A 73 7.989 -15.492 -18.010 1.00 0.00 C ATOM 1095 C VAL A 73 6.487 -15.736 -17.971 1.00 0.00 C ATOM 1096 O VAL A 73 6.019 -16.829 -18.294 1.00 0.00 O ATOM 1097 CB VAL A 73 8.527 -15.820 -19.418 1.00 0.00 C ATOM 1098 CG1 VAL A 73 7.842 -14.963 -20.474 1.00 0.00 C ATOM 1099 CG2 VAL A 73 10.036 -15.630 -19.473 1.00 0.00 C ATOM 0 H VAL A 73 8.887 -17.229 -17.254 1.00 0.00 H new ATOM 0 HA VAL A 73 8.205 -14.443 -17.808 1.00 0.00 H new ATOM 0 HB VAL A 73 8.303 -16.865 -19.631 1.00 0.00 H new ATOM 0 HG11 VAL A 73 8.238 -15.213 -21.458 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.769 -15.152 -20.456 1.00 0.00 H new ATOM 0 HG13 VAL A 73 8.028 -13.910 -20.264 1.00 0.00 H new ATOM 0 HG21 VAL A 73 10.396 -15.866 -20.474 1.00 0.00 H new ATOM 0 HG22 VAL A 73 10.281 -14.595 -19.234 1.00 0.00 H new ATOM 0 HG23 VAL A 73 10.513 -16.292 -18.750 1.00 0.00 H new ATOM 1109 N LEU A 74 5.739 -14.725 -17.558 1.00 0.00 N ATOM 1110 CA LEU A 74 4.299 -14.855 -17.405 1.00 0.00 C ATOM 1111 C LEU A 74 3.571 -14.224 -18.580 1.00 0.00 C ATOM 1112 O LEU A 74 3.774 -13.051 -18.900 1.00 0.00 O ATOM 1113 CB LEU A 74 3.842 -14.216 -16.097 1.00 0.00 C ATOM 1114 CG LEU A 74 4.528 -14.761 -14.841 1.00 0.00 C ATOM 1115 CD1 LEU A 74 4.014 -14.051 -13.603 1.00 0.00 C ATOM 1116 CD2 LEU A 74 4.315 -16.263 -14.719 1.00 0.00 C ATOM 0 H LEU A 74 6.107 -13.803 -17.322 1.00 0.00 H new ATOM 0 HA LEU A 74 4.055 -15.917 -17.381 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.018 -13.142 -16.153 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.766 -14.358 -15.996 1.00 0.00 H new ATOM 0 HG LEU A 74 5.598 -14.573 -14.929 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.513 -14.452 -12.720 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.220 -12.984 -13.684 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.939 -14.207 -13.514 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.811 -16.629 -13.820 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.248 -16.475 -14.657 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.734 -16.762 -15.593 1.00 0.00 H new ATOM 1128 N ASP A 75 2.715 -15.012 -19.208 1.00 0.00 N ATOM 1129 CA ASP A 75 2.006 -14.587 -20.404 1.00 0.00 C ATOM 1130 C ASP A 75 0.766 -13.786 -20.042 1.00 0.00 C ATOM 1131 O ASP A 75 0.268 -13.861 -18.917 1.00 0.00 O ATOM 1132 CB ASP A 75 1.595 -15.804 -21.238 1.00 0.00 C ATOM 1133 CG ASP A 75 2.762 -16.712 -21.575 1.00 0.00 C ATOM 1134 OD1 ASP A 75 3.454 -16.454 -22.582 1.00 0.00 O ATOM 1135 OD2 ASP A 75 2.985 -17.698 -20.836 1.00 0.00 O ATOM 0 H ASP A 75 2.492 -15.960 -18.905 1.00 0.00 H new ATOM 0 HA ASP A 75 2.678 -13.956 -20.986 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.843 -16.375 -20.692 1.00 0.00 H new ATOM 0 HB3 ASP A 75 1.128 -15.463 -22.162 1.00 0.00 H new ATOM 1141 N VAL A 76 0.261 -13.028 -21.003 1.00 0.00 N ATOM 1142 CA VAL A 76 -0.940 -12.238 -20.796 1.00 0.00 C ATOM 1143 C VAL A 76 -2.157 -13.153 -20.712 1.00 0.00 C ATOM 1144 O VAL A 76 -2.335 -14.043 -21.546 1.00 0.00 O ATOM 1145 CB VAL A 76 -1.141 -11.209 -21.928 1.00 0.00 C ATOM 1146 CG1 VAL A 76 -2.353 -10.327 -21.661 1.00 0.00 C ATOM 1147 CG2 VAL A 76 0.106 -10.355 -22.102 1.00 0.00 C ATOM 0 H VAL A 76 0.666 -12.944 -21.935 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.824 -11.694 -19.859 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.320 -11.760 -22.852 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.469 -9.612 -22.475 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.247 -10.947 -21.593 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.212 -9.789 -20.723 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -0.055 -9.635 -22.905 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.315 -9.823 -21.174 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.953 -10.994 -22.352 1.00 0.00 H new ATOM 1157 N GLY A 77 -2.986 -12.938 -19.698 1.00 0.00 N ATOM 1158 CA GLY A 77 -4.158 -13.768 -19.506 1.00 0.00 C ATOM 1159 C GLY A 77 -3.913 -14.888 -18.517 1.00 0.00 C ATOM 1160 O GLY A 77 -4.796 -15.714 -18.265 1.00 0.00 O ATOM 0 H GLY A 77 -2.866 -12.201 -19.003 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -4.984 -13.150 -19.155 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -4.461 -14.192 -20.463 1.00 0.00 H new ATOM 1164 N GLU A 78 -2.705 -14.930 -17.973 1.00 0.00 N ATOM 1165 CA GLU A 78 -2.359 -15.907 -16.963 1.00 0.00 C ATOM 1166 C GLU A 78 -2.890 -15.514 -15.597 1.00 0.00 C ATOM 1167 O GLU A 78 -3.255 -14.360 -15.355 1.00 0.00 O ATOM 1168 CB GLU A 78 -0.851 -16.063 -16.887 1.00 0.00 C ATOM 1169 CG GLU A 78 -0.312 -17.171 -17.762 1.00 0.00 C ATOM 1170 CD GLU A 78 -0.559 -18.553 -17.184 1.00 0.00 C ATOM 1171 OE1 GLU A 78 -1.208 -18.658 -16.119 1.00 0.00 O ATOM 1172 OE2 GLU A 78 -0.092 -19.547 -17.782 1.00 0.00 O ATOM 0 H GLU A 78 -1.948 -14.293 -18.219 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.819 -16.853 -17.250 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.382 -15.123 -17.176 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.566 -16.257 -15.853 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.774 -17.107 -18.747 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.759 -17.028 -17.903 1.00 0.00 H new ATOM 1180 N GLU A 79 -2.892 -16.487 -14.707 1.00 0.00 N ATOM 1181 CA GLU A 79 -3.358 -16.302 -13.344 1.00 0.00 C ATOM 1182 C GLU A 79 -2.192 -16.481 -12.391 1.00 0.00 C ATOM 1183 O GLU A 79 -1.517 -17.513 -12.412 1.00 0.00 O ATOM 1184 CB GLU A 79 -4.448 -17.318 -13.026 1.00 0.00 C ATOM 1185 CG GLU A 79 -5.672 -17.204 -13.916 1.00 0.00 C ATOM 1186 CD GLU A 79 -6.628 -16.125 -13.446 1.00 0.00 C ATOM 1187 OE1 GLU A 79 -6.421 -14.942 -13.772 1.00 0.00 O ATOM 1188 OE2 GLU A 79 -7.593 -16.457 -12.729 1.00 0.00 O ATOM 0 H GLU A 79 -2.569 -17.433 -14.909 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.770 -15.299 -13.233 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.034 -18.322 -13.120 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.754 -17.196 -11.987 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.357 -16.987 -14.937 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.192 -18.162 -13.939 1.00 0.00 H new ATOM 1196 N VAL A 80 -1.949 -15.485 -11.565 1.00 0.00 N ATOM 1197 CA VAL A 80 -0.796 -15.515 -10.675 1.00 0.00 C ATOM 1198 C VAL A 80 -1.195 -15.305 -9.223 1.00 0.00 C ATOM 1199 O VAL A 80 -2.236 -14.723 -8.930 1.00 0.00 O ATOM 1200 CB VAL A 80 0.251 -14.456 -11.074 1.00 0.00 C ATOM 1201 CG1 VAL A 80 0.853 -14.793 -12.426 1.00 0.00 C ATOM 1202 CG2 VAL A 80 -0.367 -13.066 -11.090 1.00 0.00 C ATOM 0 H VAL A 80 -2.527 -14.648 -11.487 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.356 -16.507 -10.775 1.00 0.00 H new ATOM 0 HB VAL A 80 1.048 -14.462 -10.331 1.00 0.00 H new ATOM 0 HG11 VAL A 80 1.590 -14.037 -12.695 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.336 -15.769 -12.376 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.066 -14.816 -13.179 1.00 0.00 H new ATOM 0 HG21 VAL A 80 0.390 -12.335 -11.374 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.185 -13.040 -11.810 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.749 -12.826 -10.098 1.00 0.00 H new ATOM 1212 N SER A 81 -0.376 -15.819 -8.323 1.00 0.00 N ATOM 1213 CA SER A 81 -0.570 -15.613 -6.898 1.00 0.00 C ATOM 1214 C SER A 81 0.407 -14.566 -6.389 1.00 0.00 C ATOM 1215 O SER A 81 1.605 -14.636 -6.676 1.00 0.00 O ATOM 1216 CB SER A 81 -0.366 -16.925 -6.133 1.00 0.00 C ATOM 1217 OG SER A 81 -1.285 -17.914 -6.557 1.00 0.00 O ATOM 0 H SER A 81 0.438 -16.388 -8.557 1.00 0.00 H new ATOM 0 HA SER A 81 -1.590 -15.266 -6.733 1.00 0.00 H new ATOM 0 HB2 SER A 81 0.652 -17.283 -6.285 1.00 0.00 H new ATOM 0 HB3 SER A 81 -0.486 -16.748 -5.064 1.00 0.00 H new ATOM 0 HG SER A 81 -1.131 -18.741 -6.054 1.00 0.00 H new ATOM 1223 N VAL A 82 -0.105 -13.589 -5.657 1.00 0.00 N ATOM 1224 CA VAL A 82 0.747 -12.587 -5.040 1.00 0.00 C ATOM 1225 C VAL A 82 1.401 -13.186 -3.806 1.00 0.00 C ATOM 1226 O VAL A 82 0.752 -13.374 -2.779 1.00 0.00 O ATOM 1227 CB VAL A 82 -0.037 -11.316 -4.650 1.00 0.00 C ATOM 1228 CG1 VAL A 82 0.898 -10.249 -4.096 1.00 0.00 C ATOM 1229 CG2 VAL A 82 -0.816 -10.780 -5.842 1.00 0.00 C ATOM 0 H VAL A 82 -1.102 -13.469 -5.477 1.00 0.00 H new ATOM 0 HA VAL A 82 1.502 -12.291 -5.768 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.747 -11.583 -3.867 1.00 0.00 H new ATOM 0 HG11 VAL A 82 0.322 -9.363 -3.829 1.00 0.00 H new ATOM 0 HG12 VAL A 82 1.405 -10.633 -3.211 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.638 -9.986 -4.852 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.362 -9.884 -5.547 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -0.124 -10.534 -6.648 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.520 -11.537 -6.186 1.00 0.00 H new ATOM 1239 N LYS A 83 2.680 -13.501 -3.928 1.00 0.00 N ATOM 1240 CA LYS A 83 3.393 -14.242 -2.899 1.00 0.00 C ATOM 1241 C LYS A 83 4.029 -13.302 -1.881 1.00 0.00 C ATOM 1242 O LYS A 83 4.143 -13.638 -0.701 1.00 0.00 O ATOM 1243 CB LYS A 83 4.459 -15.106 -3.553 1.00 0.00 C ATOM 1244 CG LYS A 83 4.805 -16.350 -2.763 1.00 0.00 C ATOM 1245 CD LYS A 83 5.744 -17.222 -3.558 1.00 0.00 C ATOM 1246 CE LYS A 83 6.026 -18.546 -2.873 1.00 0.00 C ATOM 1247 NZ LYS A 83 6.902 -19.407 -3.705 1.00 0.00 N ATOM 0 H LYS A 83 3.250 -13.253 -4.736 1.00 0.00 H new ATOM 0 HA LYS A 83 2.681 -14.873 -2.367 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.117 -15.400 -4.545 1.00 0.00 H new ATOM 0 HB3 LYS A 83 5.362 -14.511 -3.691 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.268 -16.072 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.897 -16.903 -2.524 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.315 -17.410 -4.542 1.00 0.00 H new ATOM 0 HD3 LYS A 83 6.683 -16.691 -3.716 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.500 -18.365 -1.908 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.087 -19.063 -2.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.132 -20.276 -3.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.410 -19.654 -4.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.779 -18.896 -3.930 1.00 0.00 H new ATOM 1261 N ALA A 84 4.451 -12.132 -2.347 1.00 0.00 N ATOM 1262 CA ALA A 84 5.083 -11.144 -1.481 1.00 0.00 C ATOM 1263 C ALA A 84 5.137 -9.785 -2.166 1.00 0.00 C ATOM 1264 O ALA A 84 4.690 -9.634 -3.304 1.00 0.00 O ATOM 1265 CB ALA A 84 6.488 -11.594 -1.096 1.00 0.00 C ATOM 0 H ALA A 84 4.367 -11.844 -3.322 1.00 0.00 H new ATOM 0 HA ALA A 84 4.484 -11.052 -0.575 1.00 0.00 H new ATOM 0 HB1 ALA A 84 6.946 -10.845 -0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 84 6.433 -12.545 -0.567 1.00 0.00 H new ATOM 0 HB3 ALA A 84 7.091 -11.714 -1.996 1.00 0.00 H new ATOM 1271 N ILE A 85 5.679 -8.798 -1.465 1.00 0.00 N ATOM 1272 CA ILE A 85 5.870 -7.464 -2.017 1.00 0.00 C ATOM 1273 C ILE A 85 7.334 -7.060 -1.879 1.00 0.00 C ATOM 1274 O ILE A 85 7.949 -7.289 -0.836 1.00 0.00 O ATOM 1275 CB ILE A 85 4.978 -6.423 -1.298 1.00 0.00 C ATOM 1276 CG1 ILE A 85 3.510 -6.860 -1.337 1.00 0.00 C ATOM 1277 CG2 ILE A 85 5.144 -5.042 -1.927 1.00 0.00 C ATOM 1278 CD1 ILE A 85 2.563 -5.906 -0.638 1.00 0.00 C ATOM 0 H ILE A 85 5.997 -8.899 -0.501 1.00 0.00 H new ATOM 0 HA ILE A 85 5.585 -7.488 -3.069 1.00 0.00 H new ATOM 0 HB ILE A 85 5.293 -6.362 -0.256 1.00 0.00 H new ATOM 0 HG12 ILE A 85 3.201 -6.965 -2.377 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.422 -7.844 -0.877 1.00 0.00 H new ATOM 0 HG21 ILE A 85 4.508 -4.326 -1.406 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.185 -4.728 -1.847 1.00 0.00 H new ATOM 0 HG23 ILE A 85 4.858 -5.084 -2.978 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.544 -6.287 -0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.844 -5.818 0.412 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.619 -4.926 -1.112 1.00 0.00 H new ATOM 1290 N GLU A 86 7.895 -6.480 -2.926 1.00 0.00 N ATOM 1291 CA GLU A 86 9.287 -6.069 -2.915 1.00 0.00 C ATOM 1292 C GLU A 86 9.408 -4.655 -3.470 1.00 0.00 C ATOM 1293 O GLU A 86 9.173 -4.415 -4.658 1.00 0.00 O ATOM 1294 CB GLU A 86 10.131 -7.061 -3.717 1.00 0.00 C ATOM 1295 CG GLU A 86 11.626 -6.831 -3.610 1.00 0.00 C ATOM 1296 CD GLU A 86 12.425 -7.992 -4.163 1.00 0.00 C ATOM 1297 OE1 GLU A 86 12.626 -8.058 -5.391 1.00 0.00 O ATOM 1298 OE2 GLU A 86 12.862 -8.851 -3.364 1.00 0.00 O ATOM 0 H GLU A 86 7.404 -6.283 -3.798 1.00 0.00 H new ATOM 0 HA GLU A 86 9.662 -6.065 -1.891 1.00 0.00 H new ATOM 0 HB2 GLU A 86 9.905 -8.072 -3.377 1.00 0.00 H new ATOM 0 HB3 GLU A 86 9.840 -7.004 -4.766 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.891 -5.921 -4.148 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.894 -6.673 -2.565 1.00 0.00 H new ATOM 1306 N GLY A 87 9.734 -3.713 -2.595 1.00 0.00 N ATOM 1307 CA GLY A 87 9.757 -2.320 -2.985 1.00 0.00 C ATOM 1308 C GLY A 87 8.355 -1.772 -3.089 1.00 0.00 C ATOM 1309 O GLY A 87 7.642 -1.688 -2.087 1.00 0.00 O ATOM 0 H GLY A 87 9.983 -3.890 -1.622 1.00 0.00 H new ATOM 0 HA2 GLY A 87 10.325 -1.742 -2.256 1.00 0.00 H new ATOM 0 HA3 GLY A 87 10.266 -2.214 -3.943 1.00 0.00 H new ATOM 1313 N VAL A 88 7.959 -1.408 -4.299 1.00 0.00 N ATOM 1314 CA VAL A 88 6.591 -0.980 -4.568 1.00 0.00 C ATOM 1315 C VAL A 88 5.968 -1.927 -5.598 1.00 0.00 C ATOM 1316 O VAL A 88 4.862 -1.709 -6.098 1.00 0.00 O ATOM 1317 CB VAL A 88 6.540 0.483 -5.082 1.00 0.00 C ATOM 1318 CG1 VAL A 88 5.112 1.010 -5.102 1.00 0.00 C ATOM 1319 CG2 VAL A 88 7.425 1.388 -4.236 1.00 0.00 C ATOM 0 H VAL A 88 8.569 -1.400 -5.117 1.00 0.00 H new ATOM 0 HA VAL A 88 6.025 -1.015 -3.637 1.00 0.00 H new ATOM 0 HB VAL A 88 6.919 0.486 -6.104 1.00 0.00 H new ATOM 0 HG11 VAL A 88 5.108 2.037 -5.467 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.504 0.389 -5.760 1.00 0.00 H new ATOM 0 HG13 VAL A 88 4.700 0.982 -4.093 1.00 0.00 H new ATOM 0 HG21 VAL A 88 7.372 2.408 -4.617 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.082 1.368 -3.202 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.456 1.036 -4.283 1.00 0.00 H new ATOM 1329 N LYS A 89 6.689 -3.000 -5.898 1.00 0.00 N ATOM 1330 CA LYS A 89 6.232 -3.983 -6.868 1.00 0.00 C ATOM 1331 C LYS A 89 5.869 -5.285 -6.172 1.00 0.00 C ATOM 1332 O LYS A 89 6.387 -5.593 -5.099 1.00 0.00 O ATOM 1333 CB LYS A 89 7.309 -4.241 -7.924 1.00 0.00 C ATOM 1334 CG LYS A 89 7.617 -3.035 -8.796 1.00 0.00 C ATOM 1335 CD LYS A 89 8.675 -3.366 -9.839 1.00 0.00 C ATOM 1336 CE LYS A 89 10.013 -3.700 -9.196 1.00 0.00 C ATOM 1337 NZ LYS A 89 10.658 -2.507 -8.593 1.00 0.00 N ATOM 0 H LYS A 89 7.596 -3.211 -5.481 1.00 0.00 H new ATOM 0 HA LYS A 89 5.346 -3.586 -7.362 1.00 0.00 H new ATOM 0 HB2 LYS A 89 8.224 -4.560 -7.425 1.00 0.00 H new ATOM 0 HB3 LYS A 89 6.989 -5.066 -8.561 1.00 0.00 H new ATOM 0 HG2 LYS A 89 6.706 -2.699 -9.292 1.00 0.00 H new ATOM 0 HG3 LYS A 89 7.963 -2.211 -8.172 1.00 0.00 H new ATOM 0 HD2 LYS A 89 8.340 -4.210 -10.442 1.00 0.00 H new ATOM 0 HD3 LYS A 89 8.797 -2.520 -10.515 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.866 -4.459 -8.427 1.00 0.00 H new ATOM 0 HE3 LYS A 89 10.677 -4.130 -9.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 11.616 -2.755 -8.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 10.716 -1.748 -9.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 10.095 -2.181 -7.782 1.00 0.00 H new ATOM 1351 N LEU A 90 4.971 -6.038 -6.782 1.00 0.00 N ATOM 1352 CA LEU A 90 4.539 -7.305 -6.223 1.00 0.00 C ATOM 1353 C LEU A 90 5.427 -8.437 -6.706 1.00 0.00 C ATOM 1354 O LEU A 90 5.954 -8.407 -7.822 1.00 0.00 O ATOM 1355 CB LEU A 90 3.086 -7.608 -6.607 1.00 0.00 C ATOM 1356 CG LEU A 90 2.063 -6.535 -6.234 1.00 0.00 C ATOM 1357 CD1 LEU A 90 0.664 -6.985 -6.637 1.00 0.00 C ATOM 1358 CD2 LEU A 90 2.117 -6.238 -4.743 1.00 0.00 C ATOM 0 H LEU A 90 4.526 -5.793 -7.667 1.00 0.00 H new ATOM 0 HA LEU A 90 4.613 -7.225 -5.138 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.040 -7.768 -7.684 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.792 -8.544 -6.133 1.00 0.00 H new ATOM 0 HG LEU A 90 2.307 -5.619 -6.773 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.058 -6.214 -6.367 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.631 -7.152 -7.714 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.416 -7.911 -6.119 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.381 -5.472 -4.498 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.895 -7.146 -4.183 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.113 -5.883 -4.479 1.00 0.00 H new ATOM 1370 N VAL A 91 5.593 -9.430 -5.855 1.00 0.00 N ATOM 1371 CA VAL A 91 6.294 -10.645 -6.220 1.00 0.00 C ATOM 1372 C VAL A 91 5.267 -11.743 -6.459 1.00 0.00 C ATOM 1373 O VAL A 91 4.724 -12.318 -5.511 1.00 0.00 O ATOM 1374 CB VAL A 91 7.294 -11.092 -5.129 1.00 0.00 C ATOM 1375 CG1 VAL A 91 8.046 -12.346 -5.560 1.00 0.00 C ATOM 1376 CG2 VAL A 91 8.267 -9.968 -4.807 1.00 0.00 C ATOM 0 H VAL A 91 5.248 -9.418 -4.895 1.00 0.00 H new ATOM 0 HA VAL A 91 6.871 -10.451 -7.124 1.00 0.00 H new ATOM 0 HB VAL A 91 6.730 -11.330 -4.227 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.743 -12.640 -4.775 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.336 -13.154 -5.736 1.00 0.00 H new ATOM 0 HG13 VAL A 91 8.598 -12.142 -6.478 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.964 -10.299 -4.037 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.821 -9.698 -5.706 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.714 -9.100 -4.447 1.00 0.00 H new ATOM 1386 N VAL A 92 4.971 -11.999 -7.718 1.00 0.00 N ATOM 1387 CA VAL A 92 3.925 -12.942 -8.072 1.00 0.00 C ATOM 1388 C VAL A 92 4.497 -14.118 -8.841 1.00 0.00 C ATOM 1389 O VAL A 92 5.575 -14.022 -9.432 1.00 0.00 O ATOM 1390 CB VAL A 92 2.813 -12.277 -8.919 1.00 0.00 C ATOM 1391 CG1 VAL A 92 2.180 -11.114 -8.171 1.00 0.00 C ATOM 1392 CG2 VAL A 92 3.358 -11.813 -10.263 1.00 0.00 C ATOM 0 H VAL A 92 5.440 -11.568 -8.515 1.00 0.00 H new ATOM 0 HA VAL A 92 3.488 -13.293 -7.137 1.00 0.00 H new ATOM 0 HB VAL A 92 2.041 -13.025 -9.102 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.402 -10.665 -8.788 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.742 -11.475 -7.241 1.00 0.00 H new ATOM 0 HG13 VAL A 92 2.942 -10.367 -7.947 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.558 -11.349 -10.840 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.156 -11.088 -10.101 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.751 -12.669 -10.811 1.00 0.00 H new ATOM 1402 N GLU A 93 3.780 -15.225 -8.818 1.00 0.00 N ATOM 1403 CA GLU A 93 4.141 -16.370 -9.631 1.00 0.00 C ATOM 1404 C GLU A 93 2.893 -17.106 -10.097 1.00 0.00 C ATOM 1405 O GLU A 93 1.829 -17.010 -9.481 1.00 0.00 O ATOM 1406 CB GLU A 93 5.121 -17.308 -8.906 1.00 0.00 C ATOM 1407 CG GLU A 93 4.815 -17.557 -7.436 1.00 0.00 C ATOM 1408 CD GLU A 93 5.945 -18.294 -6.736 1.00 0.00 C ATOM 1409 OE1 GLU A 93 5.712 -19.399 -6.201 1.00 0.00 O ATOM 1410 OE2 GLU A 93 7.080 -17.770 -6.716 1.00 0.00 O ATOM 0 H GLU A 93 2.946 -15.356 -8.246 1.00 0.00 H new ATOM 0 HA GLU A 93 4.665 -16.001 -10.512 1.00 0.00 H new ATOM 0 HB2 GLU A 93 5.133 -18.266 -9.425 1.00 0.00 H new ATOM 0 HB3 GLU A 93 6.125 -16.890 -8.986 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.639 -16.605 -6.936 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.896 -18.137 -7.350 1.00 0.00 H new ATOM 1418 N LYS A 94 3.040 -17.818 -11.202 1.00 0.00 N ATOM 1419 CA LYS A 94 1.919 -18.443 -11.896 1.00 0.00 C ATOM 1420 C LYS A 94 1.280 -19.558 -11.071 1.00 0.00 C ATOM 1421 O LYS A 94 1.962 -20.299 -10.364 1.00 0.00 O ATOM 1422 CB LYS A 94 2.414 -18.998 -13.238 1.00 0.00 C ATOM 1423 CG LYS A 94 1.382 -19.800 -14.018 1.00 0.00 C ATOM 1424 CD LYS A 94 2.003 -20.453 -15.246 1.00 0.00 C ATOM 1425 CE LYS A 94 1.284 -21.743 -15.632 1.00 0.00 C ATOM 1426 NZ LYS A 94 -0.156 -21.530 -15.921 1.00 0.00 N ATOM 0 H LYS A 94 3.943 -17.981 -11.647 1.00 0.00 H new ATOM 0 HA LYS A 94 1.152 -17.686 -12.057 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.750 -18.166 -13.857 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.282 -19.631 -13.055 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.951 -20.567 -13.374 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.566 -19.146 -14.325 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.971 -19.755 -16.083 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.054 -20.668 -15.050 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.767 -22.175 -16.509 1.00 0.00 H new ATOM 0 HE3 LYS A 94 1.385 -22.467 -14.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -0.622 -22.449 -16.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -0.601 -21.035 -15.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -0.256 -20.956 -16.783 1.00 0.00 H new ATOM 1440 N LEU A 95 -0.040 -19.653 -11.168 1.00 0.00 N ATOM 1441 CA LEU A 95 -0.778 -20.785 -10.621 1.00 0.00 C ATOM 1442 C LEU A 95 -0.492 -22.034 -11.443 1.00 0.00 C ATOM 1443 O LEU A 95 0.263 -21.979 -12.411 1.00 0.00 O ATOM 1444 CB LEU A 95 -2.285 -20.513 -10.655 1.00 0.00 C ATOM 1445 CG LEU A 95 -2.886 -19.842 -9.417 1.00 0.00 C ATOM 1446 CD1 LEU A 95 -2.460 -18.391 -9.328 1.00 0.00 C ATOM 1447 CD2 LEU A 95 -4.404 -19.954 -9.434 1.00 0.00 C ATOM 0 H LEU A 95 -0.626 -18.954 -11.624 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.459 -20.932 -9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.499 -19.886 -11.521 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.799 -21.461 -10.813 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.511 -20.359 -8.534 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.900 -17.936 -8.440 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.373 -18.334 -9.264 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -2.800 -17.857 -10.215 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.814 -19.472 -8.547 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.795 -19.465 -10.326 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.691 -21.005 -9.441 1.00 0.00 H new ATOM 1459 N GLU A 96 -1.099 -23.154 -11.065 1.00 0.00 N ATOM 1460 CA GLU A 96 -0.993 -24.381 -11.846 1.00 0.00 C ATOM 1461 C GLU A 96 0.448 -24.911 -11.795 1.00 0.00 C ATOM 1462 O GLU A 96 0.966 -25.466 -12.765 1.00 0.00 O ATOM 1463 CB GLU A 96 -1.449 -24.099 -13.288 1.00 0.00 C ATOM 1464 CG GLU A 96 -1.562 -25.318 -14.179 1.00 0.00 C ATOM 1465 CD GLU A 96 -1.932 -24.943 -15.597 1.00 0.00 C ATOM 1466 OE1 GLU A 96 -1.171 -24.178 -16.237 1.00 0.00 O ATOM 1467 OE2 GLU A 96 -2.978 -25.415 -16.084 1.00 0.00 O ATOM 0 H GLU A 96 -1.669 -23.237 -10.223 1.00 0.00 H new ATOM 0 HA GLU A 96 -1.639 -25.153 -11.427 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -2.419 -23.602 -13.255 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.748 -23.400 -13.743 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.614 -25.857 -14.181 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.313 -25.996 -13.774 1.00 0.00 H new ATOM 1475 N GLU A 97 1.090 -24.730 -10.642 1.00 0.00 N ATOM 1476 CA GLU A 97 2.431 -25.258 -10.417 1.00 0.00 C ATOM 1477 C GLU A 97 2.377 -26.778 -10.517 1.00 0.00 C ATOM 1478 O GLU A 97 1.338 -27.375 -10.222 1.00 0.00 O ATOM 1479 CB GLU A 97 2.951 -24.818 -9.042 1.00 0.00 C ATOM 1480 CG GLU A 97 4.418 -24.395 -9.025 1.00 0.00 C ATOM 1481 CD GLU A 97 5.383 -25.545 -9.240 1.00 0.00 C ATOM 1482 OE1 GLU A 97 5.870 -26.116 -8.241 1.00 0.00 O ATOM 1483 OE2 GLU A 97 5.665 -25.882 -10.408 1.00 0.00 O ATOM 0 H GLU A 97 0.701 -24.220 -9.849 1.00 0.00 H new ATOM 0 HA GLU A 97 3.117 -24.870 -11.170 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.342 -23.987 -8.687 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.814 -25.638 -8.337 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.581 -23.645 -9.800 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.639 -23.919 -8.070 1.00 0.00 H new ATOM 1491 N GLN A 98 3.483 -27.393 -10.927 1.00 0.00 N ATOM 1492 CA GLN A 98 3.509 -28.823 -11.221 1.00 0.00 C ATOM 1493 C GLN A 98 2.593 -29.091 -12.416 1.00 0.00 C ATOM 1494 O GLN A 98 1.820 -30.049 -12.434 1.00 0.00 O ATOM 1495 CB GLN A 98 3.071 -29.641 -9.999 1.00 0.00 C ATOM 1496 CG GLN A 98 3.376 -31.127 -10.103 1.00 0.00 C ATOM 1497 CD GLN A 98 2.693 -31.927 -9.018 1.00 0.00 C ATOM 1498 OE1 GLN A 98 2.445 -31.424 -7.920 1.00 0.00 O ATOM 1499 NE2 GLN A 98 2.391 -33.179 -9.309 1.00 0.00 N ATOM 0 H GLN A 98 4.377 -26.921 -11.064 1.00 0.00 H new ATOM 0 HA GLN A 98 4.526 -29.129 -11.465 1.00 0.00 H new ATOM 0 HB2 GLN A 98 3.564 -29.241 -9.113 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.999 -29.511 -9.854 1.00 0.00 H new ATOM 0 HG2 GLN A 98 3.057 -31.494 -11.078 1.00 0.00 H new ATOM 0 HG3 GLN A 98 4.453 -31.280 -10.042 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.614 -33.556 -10.230 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.935 -33.769 -8.613 1.00 0.00 H new ATOM 1508 N LYS A 99 2.698 -28.212 -13.411 1.00 0.00 N ATOM 1509 CA LYS A 99 1.866 -28.269 -14.609 1.00 0.00 C ATOM 1510 C LYS A 99 1.995 -29.623 -15.305 1.00 0.00 C ATOM 1511 O LYS A 99 3.012 -29.919 -15.939 1.00 0.00 O ATOM 1512 CB LYS A 99 2.255 -27.138 -15.565 1.00 0.00 C ATOM 1513 CG LYS A 99 1.360 -27.021 -16.792 1.00 0.00 C ATOM 1514 CD LYS A 99 1.739 -25.811 -17.633 1.00 0.00 C ATOM 1515 CE LYS A 99 0.828 -25.651 -18.840 1.00 0.00 C ATOM 1516 NZ LYS A 99 -0.598 -25.533 -18.450 1.00 0.00 N ATOM 0 H LYS A 99 3.364 -27.439 -13.408 1.00 0.00 H new ATOM 0 HA LYS A 99 0.825 -28.145 -14.312 1.00 0.00 H new ATOM 0 HB2 LYS A 99 2.232 -26.194 -15.021 1.00 0.00 H new ATOM 0 HB3 LYS A 99 3.283 -27.292 -15.893 1.00 0.00 H new ATOM 0 HG2 LYS A 99 1.442 -27.926 -17.394 1.00 0.00 H new ATOM 0 HG3 LYS A 99 0.319 -26.939 -16.480 1.00 0.00 H new ATOM 0 HD2 LYS A 99 1.689 -24.912 -17.019 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.771 -25.911 -17.968 1.00 0.00 H new ATOM 0 HE2 LYS A 99 1.124 -24.766 -19.402 1.00 0.00 H new ATOM 0 HE3 LYS A 99 0.952 -26.507 -19.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -1.176 -25.358 -19.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.908 -26.416 -17.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -0.711 -24.742 -17.784 1.00 0.00 H new ATOM 1530 N GLY A 100 0.954 -30.430 -15.178 1.00 0.00 N ATOM 1531 CA GLY A 100 0.985 -31.786 -15.687 1.00 0.00 C ATOM 1532 C GLY A 100 0.783 -32.787 -14.572 1.00 0.00 C ATOM 1533 O GLY A 100 -0.264 -32.798 -13.925 1.00 0.00 O ATOM 0 H GLY A 100 0.078 -30.167 -14.726 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.208 -31.913 -16.440 1.00 0.00 H new ATOM 0 HA3 GLY A 100 1.940 -31.972 -16.179 1.00 0.00 H new ATOM 1537 N SER A 101 1.784 -33.618 -14.339 1.00 0.00 N ATOM 1538 CA SER A 101 1.761 -34.557 -13.230 1.00 0.00 C ATOM 1539 C SER A 101 3.166 -34.711 -12.661 1.00 0.00 C ATOM 1540 O SER A 101 3.980 -35.445 -13.261 1.00 0.00 O ATOM 1541 CB SER A 101 1.207 -35.913 -13.681 1.00 0.00 C ATOM 1542 OG SER A 101 -0.139 -35.802 -14.114 1.00 0.00 O ATOM 1543 OXT SER A 101 3.463 -34.077 -11.630 1.00 0.00 O ATOM 0 H SER A 101 2.629 -33.662 -14.908 1.00 0.00 H new ATOM 0 HA SER A 101 1.104 -34.170 -12.451 1.00 0.00 H new ATOM 0 HB2 SER A 101 1.820 -36.308 -14.491 1.00 0.00 H new ATOM 0 HB3 SER A 101 1.269 -36.625 -12.858 1.00 0.00 H new ATOM 0 HG SER A 101 -0.465 -36.682 -14.397 1.00 0.00 H new TER 1549 SER A 101