USER MOD reduce.3.24.130724 H: found=0, std=0, add=851, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 852 hydrogens (5 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 NoAdj-H: A 10 CSP H2 : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD NoAdj-H: A 10 CSP H : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD Set 1.1: A 59 GLN : amide:sc= 0.881 K(o=0.93,f=-5.8!) USER MOD Set 1.2: A 84 TYR OH : rot 130:sc= 0.047 USER MOD Set 2.1: A 26 GLN : amide:sc= 0.00212 K(o=0.012,f=0.56) USER MOD Set 2.2: A 30 TYR OH : rot 139:sc= 0.01 USER MOD Set 3.1: A 5 HIS : no HD1:sc= 0.204 X(o=0.42,f=0) USER MOD Set 3.2: A 7 TYR OH : rot 61:sc= 0.217 USER MOD Single : A 1 MET CE :methyl -171:sc= 0 (180deg=-0.0772) USER MOD Single : A 1 MET N :NH3+ 150:sc= 0.0804 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -178:sc= 0.00681 (180deg=0.00393) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot -170:sc= 0.0458 USER MOD Single : A 17 SER OG : rot -97:sc= 0.421 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0731) USER MOD Single : A 23 MET CE :methyl -169:sc= -0.0037 (180deg=-0.0668) USER MOD Single : A 29 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0885) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0841) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 88:sc= 0.0305 USER MOD Single : A 63 MET CE :methyl -120:sc= 0 (180deg=-1.72!) USER MOD Single : A 68 GLN : amide:sc=-0.00253 X(o=-0.0025,f=-0.0025) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 74 LYS NZ :NH3+ -172:sc= 0.434 (180deg=0.403) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ -167:sc=-0.00431 (180deg=-0.179) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.791 K(o=-0.79,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.939 16.738 10.625 1.00 0.00 N ATOM 2 CA MET A 1 -7.943 15.955 11.370 1.00 0.00 C ATOM 3 C MET A 1 -6.931 15.467 10.331 1.00 0.00 C ATOM 4 O MET A 1 -7.387 14.986 9.295 1.00 0.00 O ATOM 5 CB MET A 1 -8.638 14.764 12.035 1.00 0.00 C ATOM 6 CG MET A 1 -7.833 14.155 13.184 1.00 0.00 C ATOM 7 SD MET A 1 -6.350 13.223 12.653 1.00 0.00 S ATOM 8 CE MET A 1 -5.107 14.002 13.661 1.00 0.00 C ATOM 0 H1 MET A 1 -9.861 16.670 11.102 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.641 17.734 10.588 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.021 16.365 9.658 1.00 0.00 H new ATOM 0 HA MET A 1 -7.455 16.540 12.150 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.610 15.084 12.411 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.824 13.996 11.284 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.524 14.953 13.859 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.481 13.489 13.754 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.120 13.664 13.347 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.173 15.084 13.548 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.267 13.736 14.706 1.00 0.00 H new ATOM 20 N GLU A 2 -5.647 15.708 10.575 1.00 0.00 N ATOM 21 CA GLU A 2 -4.553 15.363 9.655 1.00 0.00 C ATOM 22 C GLU A 2 -4.469 13.846 9.470 1.00 0.00 C ATOM 23 O GLU A 2 -4.306 13.114 10.445 1.00 0.00 O ATOM 24 CB GLU A 2 -3.256 15.894 10.266 1.00 0.00 C ATOM 25 CG GLU A 2 -2.006 15.704 9.403 1.00 0.00 C ATOM 26 CD GLU A 2 -2.057 16.464 8.077 1.00 0.00 C ATOM 27 OE1 GLU A 2 -1.824 17.692 8.125 1.00 0.00 O ATOM 28 OE2 GLU A 2 -2.232 15.788 7.040 1.00 0.00 O ATOM 0 H GLU A 2 -5.325 16.157 11.432 1.00 0.00 H new ATOM 0 HA GLU A 2 -4.726 15.807 8.674 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -3.378 16.957 10.472 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -3.095 15.400 11.224 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -1.132 16.031 9.967 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -1.874 14.642 9.199 1.00 0.00 H new ATOM 35 N LYS A 3 -4.862 13.398 8.281 1.00 0.00 N ATOM 36 CA LYS A 3 -4.807 11.962 7.970 1.00 0.00 C ATOM 37 C LYS A 3 -4.123 11.765 6.615 1.00 0.00 C ATOM 38 O LYS A 3 -4.360 12.516 5.670 1.00 0.00 O ATOM 39 CB LYS A 3 -6.189 11.311 7.883 1.00 0.00 C ATOM 40 CG LYS A 3 -6.876 11.144 9.240 1.00 0.00 C ATOM 41 CD LYS A 3 -7.497 9.748 9.325 1.00 0.00 C ATOM 42 CE LYS A 3 -8.321 9.524 10.595 1.00 0.00 C ATOM 43 NZ LYS A 3 -9.666 10.094 10.435 1.00 0.00 N ATOM 0 H LYS A 3 -5.215 13.988 7.528 1.00 0.00 H new ATOM 0 HA LYS A 3 -4.257 11.491 8.784 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -6.825 11.914 7.235 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.091 10.333 7.412 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -6.155 11.283 10.045 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -7.646 11.905 9.367 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -8.134 9.589 8.455 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.703 9.002 9.280 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -8.393 8.457 10.807 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.822 9.985 11.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -10.216 9.936 11.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -9.591 11.115 10.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -10.145 9.635 9.634 1.00 0.00 H new ATOM 57 N LYS A 4 -3.260 10.753 6.612 1.00 0.00 N ATOM 58 CA LYS A 4 -2.529 10.345 5.404 1.00 0.00 C ATOM 59 C LYS A 4 -3.142 9.094 4.773 1.00 0.00 C ATOM 60 O LYS A 4 -3.720 8.247 5.452 1.00 0.00 O ATOM 61 CB LYS A 4 -1.046 10.127 5.714 1.00 0.00 C ATOM 62 CG LYS A 4 -0.172 11.374 5.565 1.00 0.00 C ATOM 63 CD LYS A 4 -0.452 12.459 6.607 1.00 0.00 C ATOM 64 CE LYS A 4 0.460 13.678 6.455 1.00 0.00 C ATOM 65 NZ LYS A 4 0.106 14.480 5.275 1.00 0.00 N ATOM 0 H LYS A 4 -3.045 10.193 7.437 1.00 0.00 H new ATOM 0 HA LYS A 4 -2.613 11.154 4.679 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -0.953 9.754 6.734 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -0.661 9.349 5.054 1.00 0.00 H new ATOM 0 HG2 LYS A 4 0.876 11.081 5.633 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.322 11.793 4.570 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -1.491 12.776 6.524 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -0.326 12.039 7.605 1.00 0.00 H new ATOM 0 HE2 LYS A 4 0.391 14.297 7.349 1.00 0.00 H new ATOM 0 HE3 LYS A 4 1.496 13.349 6.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.767 15.278 5.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.163 13.887 4.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -0.863 14.843 5.380 1.00 0.00 H new ATOM 79 N HIS A 5 -3.035 9.048 3.447 1.00 0.00 N ATOM 80 CA HIS A 5 -3.617 8.004 2.589 1.00 0.00 C ATOM 81 C HIS A 5 -2.561 7.027 2.068 1.00 0.00 C ATOM 82 O HIS A 5 -1.633 7.367 1.337 1.00 0.00 O ATOM 83 CB HIS A 5 -4.377 8.638 1.422 1.00 0.00 C ATOM 84 CG HIS A 5 -5.630 9.392 1.872 1.00 0.00 C ATOM 85 ND1 HIS A 5 -6.841 8.870 2.038 1.00 0.00 N ATOM 86 CD2 HIS A 5 -5.713 10.769 2.045 1.00 0.00 C ATOM 87 CE1 HIS A 5 -7.625 9.913 2.297 1.00 0.00 C ATOM 88 NE2 HIS A 5 -6.979 11.076 2.313 1.00 0.00 N ATOM 0 H HIS A 5 -2.526 9.756 2.918 1.00 0.00 H new ATOM 0 HA HIS A 5 -4.312 7.431 3.203 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -3.716 9.324 0.893 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -4.661 7.860 0.714 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -4.892 11.468 1.974 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -8.686 9.824 2.477 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -7.369 12.001 2.492 1.00 0.00 H new ATOM 96 N ILE A 6 -2.739 5.787 2.516 1.00 0.00 N ATOM 97 CA ILE A 6 -1.902 4.629 2.164 1.00 0.00 C ATOM 98 C ILE A 6 -2.814 3.645 1.429 1.00 0.00 C ATOM 99 O ILE A 6 -3.621 2.931 2.021 1.00 0.00 O ATOM 100 CB ILE A 6 -1.285 4.014 3.421 1.00 0.00 C ATOM 101 CG1 ILE A 6 -0.471 5.044 4.207 1.00 0.00 C ATOM 102 CG2 ILE A 6 -0.425 2.805 3.043 1.00 0.00 C ATOM 103 CD1 ILE A 6 -0.100 4.614 5.627 1.00 0.00 C ATOM 0 H ILE A 6 -3.495 5.546 3.157 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.065 4.913 1.526 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.093 3.679 4.071 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.444 5.261 3.656 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -1.039 5.973 4.260 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.011 2.373 3.944 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.045 2.059 2.546 1.00 0.00 H new ATOM 0 HG23 ILE A 6 0.372 3.122 2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 6 0.475 5.405 6.108 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -1.008 4.427 6.199 1.00 0.00 H new ATOM 0 HD13 ILE A 6 0.498 3.704 5.587 1.00 0.00 H new ATOM 115 N TYR A 7 -2.664 3.640 0.107 1.00 0.00 N ATOM 116 CA TYR A 7 -3.465 2.771 -0.766 1.00 0.00 C ATOM 117 C TYR A 7 -2.639 1.629 -1.364 1.00 0.00 C ATOM 118 O TYR A 7 -1.562 1.819 -1.925 1.00 0.00 O ATOM 119 CB TYR A 7 -4.169 3.557 -1.873 1.00 0.00 C ATOM 120 CG TYR A 7 -5.159 4.640 -1.438 1.00 0.00 C ATOM 121 CD1 TYR A 7 -5.842 4.612 -0.227 1.00 0.00 C ATOM 122 CD2 TYR A 7 -5.410 5.626 -2.384 1.00 0.00 C ATOM 123 CE1 TYR A 7 -6.785 5.595 0.051 1.00 0.00 C ATOM 124 CE2 TYR A 7 -6.344 6.620 -2.112 1.00 0.00 C ATOM 125 CZ TYR A 7 -7.021 6.582 -0.900 1.00 0.00 C ATOM 126 OH TYR A 7 -7.996 7.508 -0.689 1.00 0.00 O ATOM 0 H TYR A 7 -1.994 4.228 -0.389 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.231 2.330 -0.128 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.405 4.026 -2.493 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.701 2.847 -2.506 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -5.641 3.832 0.493 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.882 5.621 -3.326 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.324 5.592 0.987 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -6.539 7.405 -2.828 1.00 0.00 H new ATOM 0 HH TYR A 7 -7.792 8.019 0.122 1.00 0.00 H new ATOM 136 N LEU A 8 -3.186 0.434 -1.162 1.00 0.00 N ATOM 137 CA LEU A 8 -2.586 -0.845 -1.570 1.00 0.00 C ATOM 138 C LEU A 8 -3.288 -1.406 -2.807 1.00 0.00 C ATOM 139 O LEU A 8 -4.509 -1.338 -2.940 1.00 0.00 O ATOM 140 CB LEU A 8 -2.643 -1.885 -0.449 1.00 0.00 C ATOM 141 CG LEU A 8 -1.614 -1.662 0.661 1.00 0.00 C ATOM 142 CD1 LEU A 8 -2.095 -0.587 1.636 1.00 0.00 C ATOM 143 CD2 LEU A 8 -1.370 -2.968 1.420 1.00 0.00 C ATOM 0 H LEU A 8 -4.086 0.319 -0.696 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.541 -0.641 -1.802 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.641 -1.878 -0.011 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.490 -2.875 -0.878 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.683 -1.329 0.202 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.349 -0.444 2.417 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.243 0.350 1.100 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.037 -0.900 2.087 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.636 -2.799 2.208 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.305 -3.312 1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.995 -3.725 0.731 1.00 0.00 H new ATOM 155 N PHE A 9 -2.448 -1.871 -3.726 1.00 0.00 N ATOM 156 CA PHE A 9 -2.873 -2.397 -5.032 1.00 0.00 C ATOM 157 C PHE A 9 -2.263 -3.762 -5.360 1.00 0.00 C ATOM 158 O PHE A 9 -1.087 -4.035 -5.123 1.00 0.00 O ATOM 159 CB PHE A 9 -2.543 -1.392 -6.137 1.00 0.00 C ATOM 160 CG PHE A 9 -3.349 -0.097 -6.025 1.00 0.00 C ATOM 161 CD1 PHE A 9 -2.835 0.972 -5.300 1.00 0.00 C ATOM 162 CD2 PHE A 9 -4.554 0.028 -6.706 1.00 0.00 C ATOM 163 CE1 PHE A 9 -3.504 2.191 -5.292 1.00 0.00 C ATOM 164 CE2 PHE A 9 -5.234 1.241 -6.688 1.00 0.00 C ATOM 165 CZ PHE A 9 -4.701 2.316 -5.987 1.00 0.00 C ATOM 0 H PHE A 9 -1.438 -1.896 -3.589 1.00 0.00 H new ATOM 0 HA PHE A 9 -3.952 -2.544 -4.974 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -1.479 -1.156 -6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -2.735 -1.850 -7.107 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -1.917 0.856 -4.743 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -4.961 -0.814 -7.247 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -3.097 3.033 -4.751 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -6.170 1.347 -7.216 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.224 3.261 -5.982 1.00 0.00 H new HETATM 175 N CSP A 10 -3.190 -4.631 -5.749 1.00 0.00 N HETATM 176 CA CSP A 10 -2.955 -5.975 -6.296 1.00 0.00 C HETATM 177 CB CSP A 10 -2.919 -7.054 -5.211 1.00 0.00 C HETATM 178 SG CSP A 10 -4.503 -7.466 -4.393 1.00 0.00 S HETATM 179 C CSP A 10 -4.046 -6.250 -7.334 1.00 0.00 C HETATM 180 O CSP A 10 -4.973 -5.453 -7.465 1.00 0.00 O HETATM 181 P CSP A 10 -4.465 -9.604 -4.469 1.00 0.00 P HETATM 182 O1P CSP A 10 -3.909 -10.019 -5.777 1.00 0.00 O HETATM 183 O2P CSP A 10 -5.794 -10.030 -3.977 1.00 0.00 O HETATM 184 O3P CSP A 10 -3.383 -10.106 -3.389 1.00 0.00 O HETATM 0 HB3 CSP A 10 -2.520 -7.966 -5.654 1.00 0.00 H new HETATM 0 HB2 CSP A 10 -2.214 -6.738 -4.443 1.00 0.00 H new HETATM 0 HA CSP A 10 -1.971 -6.009 -6.763 1.00 0.00 H new ATOM 190 N SER A 11 -3.969 -7.388 -8.018 1.00 0.00 N ATOM 191 CA SER A 11 -4.867 -7.713 -9.136 1.00 0.00 C ATOM 192 C SER A 11 -6.355 -7.646 -8.786 1.00 0.00 C ATOM 193 O SER A 11 -7.164 -7.103 -9.536 1.00 0.00 O ATOM 194 CB SER A 11 -4.558 -9.116 -9.663 1.00 0.00 C ATOM 195 OG SER A 11 -3.163 -9.270 -9.937 1.00 0.00 O ATOM 0 H SER A 11 -3.283 -8.116 -7.817 1.00 0.00 H new ATOM 0 HA SER A 11 -4.680 -6.949 -9.891 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.872 -9.860 -8.930 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.132 -9.301 -10.571 1.00 0.00 H new ATOM 0 HG SER A 11 -2.993 -10.176 -10.271 1.00 0.00 H new ATOM 201 N ALA A 12 -6.726 -8.232 -7.652 1.00 0.00 N ATOM 202 CA ALA A 12 -8.135 -8.266 -7.233 1.00 0.00 C ATOM 203 C ALA A 12 -8.504 -7.343 -6.070 1.00 0.00 C ATOM 204 O ALA A 12 -9.631 -6.853 -6.022 1.00 0.00 O ATOM 205 CB ALA A 12 -8.524 -9.715 -6.928 1.00 0.00 C ATOM 0 H ALA A 12 -6.081 -8.688 -7.007 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.710 -7.869 -8.070 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.568 -9.754 -6.616 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -8.390 -10.324 -7.822 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.892 -10.101 -6.128 1.00 0.00 H new ATOM 211 N GLY A 13 -7.563 -7.116 -5.158 1.00 0.00 N ATOM 212 CA GLY A 13 -7.787 -6.290 -3.963 1.00 0.00 C ATOM 213 C GLY A 13 -8.112 -7.049 -2.675 1.00 0.00 C ATOM 214 O GLY A 13 -8.198 -6.425 -1.618 1.00 0.00 O ATOM 0 H GLY A 13 -6.619 -7.498 -5.222 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.896 -5.686 -3.791 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.605 -5.600 -4.171 1.00 0.00 H new ATOM 218 N MET A 14 -8.176 -8.376 -2.722 1.00 0.00 N ATOM 219 CA MET A 14 -8.712 -9.156 -1.598 1.00 0.00 C ATOM 220 C MET A 14 -7.724 -9.858 -0.663 1.00 0.00 C ATOM 221 O MET A 14 -7.999 -9.915 0.534 1.00 0.00 O ATOM 222 CB MET A 14 -9.807 -10.123 -2.055 1.00 0.00 C ATOM 223 CG MET A 14 -9.355 -11.181 -3.063 1.00 0.00 C ATOM 224 SD MET A 14 -10.633 -12.470 -3.301 1.00 0.00 S ATOM 225 CE MET A 14 -9.707 -13.650 -4.260 1.00 0.00 C ATOM 0 H MET A 14 -7.867 -8.936 -3.517 1.00 0.00 H new ATOM 0 HA MET A 14 -9.125 -8.372 -0.964 1.00 0.00 H new ATOM 0 HB2 MET A 14 -10.214 -10.628 -1.179 1.00 0.00 H new ATOM 0 HB3 MET A 14 -10.620 -9.546 -2.496 1.00 0.00 H new ATOM 0 HG2 MET A 14 -9.135 -10.704 -4.018 1.00 0.00 H new ATOM 0 HG3 MET A 14 -8.430 -11.643 -2.717 1.00 0.00 H new ATOM 0 HE1 MET A 14 -10.340 -14.506 -4.494 1.00 0.00 H new ATOM 0 HE2 MET A 14 -9.371 -13.183 -5.186 1.00 0.00 H new ATOM 0 HE3 MET A 14 -8.842 -13.985 -3.688 1.00 0.00 H new ATOM 235 N SER A 15 -6.612 -10.398 -1.152 1.00 0.00 N ATOM 236 CA SER A 15 -5.608 -11.062 -0.306 1.00 0.00 C ATOM 237 C SER A 15 -4.836 -10.100 0.598 1.00 0.00 C ATOM 238 O SER A 15 -4.513 -10.428 1.739 1.00 0.00 O ATOM 239 CB SER A 15 -4.605 -11.867 -1.133 1.00 0.00 C ATOM 240 OG SER A 15 -5.295 -12.831 -1.933 1.00 0.00 O ATOM 0 H SER A 15 -6.375 -10.391 -2.144 1.00 0.00 H new ATOM 0 HA SER A 15 -6.187 -11.732 0.329 1.00 0.00 H new ATOM 0 HB2 SER A 15 -4.027 -11.198 -1.771 1.00 0.00 H new ATOM 0 HB3 SER A 15 -3.897 -12.369 -0.474 1.00 0.00 H new ATOM 0 HG SER A 15 -4.647 -13.342 -2.461 1.00 0.00 H new ATOM 246 N THR A 16 -4.637 -8.875 0.120 1.00 0.00 N ATOM 247 CA THR A 16 -4.059 -7.745 0.861 1.00 0.00 C ATOM 248 C THR A 16 -4.876 -7.298 2.074 1.00 0.00 C ATOM 249 O THR A 16 -4.326 -6.693 2.993 1.00 0.00 O ATOM 250 CB THR A 16 -3.960 -6.531 -0.064 1.00 0.00 C ATOM 251 OG1 THR A 16 -5.192 -6.462 -0.787 1.00 0.00 O ATOM 252 CG2 THR A 16 -2.744 -6.595 -0.991 1.00 0.00 C ATOM 0 H THR A 16 -4.884 -8.626 -0.838 1.00 0.00 H new ATOM 0 HA THR A 16 -3.091 -8.101 1.215 1.00 0.00 H new ATOM 0 HB THR A 16 -3.808 -5.623 0.520 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.115 -5.797 -1.502 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.723 -5.709 -1.625 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.833 -6.636 -0.394 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.809 -7.486 -1.615 1.00 0.00 H new ATOM 260 N SER A 17 -6.152 -7.672 2.116 1.00 0.00 N ATOM 261 CA SER A 17 -7.104 -7.241 3.151 1.00 0.00 C ATOM 262 C SER A 17 -6.631 -7.510 4.581 1.00 0.00 C ATOM 263 O SER A 17 -6.795 -6.665 5.460 1.00 0.00 O ATOM 264 CB SER A 17 -8.460 -7.922 2.961 1.00 0.00 C ATOM 265 OG SER A 17 -8.371 -9.302 3.327 1.00 0.00 O ATOM 0 H SER A 17 -6.567 -8.294 1.422 1.00 0.00 H new ATOM 0 HA SER A 17 -7.186 -6.161 3.025 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.215 -7.424 3.570 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.779 -7.833 1.922 1.00 0.00 H new ATOM 0 HG SER A 17 -8.231 -9.845 2.523 1.00 0.00 H new ATOM 271 N LEU A 18 -6.041 -8.682 4.800 1.00 0.00 N ATOM 272 CA LEU A 18 -5.544 -9.092 6.121 1.00 0.00 C ATOM 273 C LEU A 18 -4.357 -8.239 6.573 1.00 0.00 C ATOM 274 O LEU A 18 -4.339 -7.775 7.712 1.00 0.00 O ATOM 275 CB LEU A 18 -5.236 -10.590 6.156 1.00 0.00 C ATOM 276 CG LEU A 18 -4.644 -11.034 7.495 1.00 0.00 C ATOM 277 CD1 LEU A 18 -5.644 -10.930 8.648 1.00 0.00 C ATOM 278 CD2 LEU A 18 -4.123 -12.470 7.397 1.00 0.00 C ATOM 0 H LEU A 18 -5.891 -9.378 4.070 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.340 -8.914 6.844 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.151 -11.151 5.963 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.538 -10.833 5.355 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.821 -10.353 7.713 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.169 -11.258 9.572 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.970 -9.895 8.755 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.507 -11.562 8.439 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.705 -12.772 8.357 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.943 -13.137 7.133 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.349 -12.525 6.631 1.00 0.00 H new ATOM 290 N LEU A 19 -3.432 -7.967 5.656 1.00 0.00 N ATOM 291 CA LEU A 19 -2.329 -7.031 5.913 1.00 0.00 C ATOM 292 C LEU A 19 -2.851 -5.637 6.267 1.00 0.00 C ATOM 293 O LEU A 19 -2.570 -5.155 7.364 1.00 0.00 O ATOM 294 CB LEU A 19 -1.389 -6.986 4.706 1.00 0.00 C ATOM 295 CG LEU A 19 -0.166 -6.105 4.968 1.00 0.00 C ATOM 296 CD1 LEU A 19 0.791 -6.728 5.987 1.00 0.00 C ATOM 297 CD2 LEU A 19 0.566 -5.837 3.652 1.00 0.00 C ATOM 0 H LEU A 19 -3.420 -8.381 4.724 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.766 -7.388 6.775 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.063 -7.997 4.462 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -1.930 -6.608 3.839 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.520 -5.166 5.393 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.643 -6.065 6.139 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.271 -6.873 6.934 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.142 -7.691 5.615 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.437 -5.209 3.841 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.888 -6.783 3.216 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.105 -5.328 2.960 1.00 0.00 H new ATOM 309 N VAL A 20 -3.824 -5.158 5.497 1.00 0.00 N ATOM 310 CA VAL A 20 -4.518 -3.883 5.733 1.00 0.00 C ATOM 311 C VAL A 20 -5.145 -3.883 7.129 1.00 0.00 C ATOM 312 O VAL A 20 -4.935 -2.955 7.908 1.00 0.00 O ATOM 313 CB VAL A 20 -5.582 -3.670 4.654 1.00 0.00 C ATOM 314 CG1 VAL A 20 -6.502 -2.472 4.905 1.00 0.00 C ATOM 315 CG2 VAL A 20 -4.928 -3.446 3.289 1.00 0.00 C ATOM 0 H VAL A 20 -4.164 -5.652 4.672 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.803 -3.062 5.680 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.183 -4.579 4.681 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.226 -2.393 4.094 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.029 -2.609 5.849 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -5.907 -1.560 4.951 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.701 -3.297 2.535 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.288 -2.565 3.332 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.328 -4.317 3.026 1.00 0.00 H new ATOM 325 N SER A 21 -5.891 -4.942 7.433 1.00 0.00 N ATOM 326 CA SER A 21 -6.564 -5.137 8.725 1.00 0.00 C ATOM 327 C SER A 21 -5.604 -5.045 9.913 1.00 0.00 C ATOM 328 O SER A 21 -5.821 -4.264 10.838 1.00 0.00 O ATOM 329 CB SER A 21 -7.268 -6.495 8.722 1.00 0.00 C ATOM 330 OG SER A 21 -7.920 -6.721 9.974 1.00 0.00 O ATOM 0 H SER A 21 -6.051 -5.707 6.778 1.00 0.00 H new ATOM 0 HA SER A 21 -7.288 -4.332 8.846 1.00 0.00 H new ATOM 0 HB2 SER A 21 -7.998 -6.532 7.913 1.00 0.00 H new ATOM 0 HB3 SER A 21 -6.543 -7.287 8.534 1.00 0.00 H new ATOM 0 HG SER A 21 -8.367 -7.593 9.957 1.00 0.00 H new ATOM 336 N LYS A 22 -4.463 -5.717 9.789 1.00 0.00 N ATOM 337 CA LYS A 22 -3.394 -5.687 10.796 1.00 0.00 C ATOM 338 C LYS A 22 -2.720 -4.317 10.905 1.00 0.00 C ATOM 339 O LYS A 22 -2.547 -3.820 12.017 1.00 0.00 O ATOM 340 CB LYS A 22 -2.318 -6.741 10.523 1.00 0.00 C ATOM 341 CG LYS A 22 -2.838 -8.172 10.664 1.00 0.00 C ATOM 342 CD LYS A 22 -1.653 -9.138 10.715 1.00 0.00 C ATOM 343 CE LYS A 22 -2.073 -10.607 10.788 1.00 0.00 C ATOM 344 NZ LYS A 22 -2.789 -10.867 12.046 1.00 0.00 N ATOM 0 H LYS A 22 -4.248 -6.304 8.983 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.889 -5.909 11.741 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -1.926 -6.600 9.516 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.487 -6.592 11.213 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.438 -8.266 11.569 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.488 -8.419 9.825 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.033 -8.988 9.831 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.036 -8.900 11.582 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.712 -10.853 9.940 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.194 -11.248 10.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.965 -11.888 12.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -2.213 -10.539 12.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -3.696 -10.358 12.041 1.00 0.00 H new ATOM 358 N MET A 23 -2.449 -3.698 9.760 1.00 0.00 N ATOM 359 CA MET A 23 -1.887 -2.342 9.680 1.00 0.00 C ATOM 360 C MET A 23 -2.810 -1.333 10.365 1.00 0.00 C ATOM 361 O MET A 23 -2.360 -0.624 11.264 1.00 0.00 O ATOM 362 CB MET A 23 -1.660 -1.874 8.241 1.00 0.00 C ATOM 363 CG MET A 23 -0.524 -2.569 7.489 1.00 0.00 C ATOM 364 SD MET A 23 -0.442 -2.150 5.709 1.00 0.00 S ATOM 365 CE MET A 23 0.217 -0.497 5.718 1.00 0.00 C ATOM 0 H MET A 23 -2.613 -4.124 8.848 1.00 0.00 H new ATOM 0 HA MET A 23 -0.922 -2.392 10.185 1.00 0.00 H new ATOM 0 HB2 MET A 23 -2.584 -2.019 7.681 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.460 -0.803 8.254 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.424 -2.304 7.958 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.640 -3.648 7.593 1.00 0.00 H new ATOM 0 HE1 MET A 23 0.130 -0.065 4.721 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.341 0.113 6.428 1.00 0.00 H new ATOM 0 HE3 MET A 23 1.267 -0.525 6.011 1.00 0.00 H new ATOM 375 N ARG A 24 -4.109 -1.461 10.111 1.00 0.00 N ATOM 376 CA ARG A 24 -5.161 -0.652 10.742 1.00 0.00 C ATOM 377 C ARG A 24 -5.207 -0.866 12.257 1.00 0.00 C ATOM 378 O ARG A 24 -5.070 0.095 13.012 1.00 0.00 O ATOM 379 CB ARG A 24 -6.552 -0.957 10.185 1.00 0.00 C ATOM 380 CG ARG A 24 -6.860 -0.334 8.822 1.00 0.00 C ATOM 381 CD ARG A 24 -8.349 -0.513 8.520 1.00 0.00 C ATOM 382 NE ARG A 24 -8.775 0.034 7.223 1.00 0.00 N ATOM 383 CZ ARG A 24 -9.478 -0.624 6.290 1.00 0.00 C ATOM 384 NH1 ARG A 24 -9.773 -1.923 6.422 1.00 0.00 N ATOM 385 NH2 ARG A 24 -10.027 0.048 5.269 1.00 0.00 N ATOM 0 H ARG A 24 -4.473 -2.144 9.447 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.901 0.382 10.514 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.665 -2.038 10.106 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.297 -0.610 10.902 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.601 0.725 8.824 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.258 -0.808 8.046 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.588 -1.576 8.549 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.928 -0.035 9.310 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.513 0.998 7.015 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.461 -2.435 7.247 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.309 -2.400 5.698 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.910 1.059 5.202 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.562 -0.452 4.559 1.00 0.00 H new ATOM 399 N ALA A 25 -5.203 -2.122 12.696 1.00 0.00 N ATOM 400 CA ALA A 25 -5.265 -2.464 14.125 1.00 0.00 C ATOM 401 C ALA A 25 -4.080 -1.934 14.935 1.00 0.00 C ATOM 402 O ALA A 25 -4.225 -1.542 16.091 1.00 0.00 O ATOM 403 CB ALA A 25 -5.355 -3.987 14.241 1.00 0.00 C ATOM 0 H ALA A 25 -5.157 -2.933 12.079 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.145 -1.981 14.550 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.402 -4.270 15.293 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.251 -4.338 13.730 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.475 -4.439 13.783 1.00 0.00 H new ATOM 409 N GLN A 26 -2.905 -1.938 14.311 1.00 0.00 N ATOM 410 CA GLN A 26 -1.682 -1.383 14.911 1.00 0.00 C ATOM 411 C GLN A 26 -1.641 0.143 14.808 1.00 0.00 C ATOM 412 O GLN A 26 -1.217 0.792 15.763 1.00 0.00 O ATOM 413 CB GLN A 26 -0.428 -1.994 14.283 1.00 0.00 C ATOM 414 CG GLN A 26 -0.308 -3.513 14.416 1.00 0.00 C ATOM 415 CD GLN A 26 -0.203 -4.046 15.847 1.00 0.00 C ATOM 416 OE1 GLN A 26 0.367 -3.445 16.757 1.00 0.00 O ATOM 417 NE2 GLN A 26 -0.587 -5.299 16.076 1.00 0.00 N ATOM 0 H GLN A 26 -2.768 -2.324 13.377 1.00 0.00 H new ATOM 0 HA GLN A 26 -1.700 -1.646 15.969 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.408 -1.735 13.224 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.449 -1.535 14.740 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -1.175 -3.971 13.940 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.571 -3.840 13.860 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -1.062 -5.828 15.345 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -0.406 -5.730 16.982 1.00 0.00 H new ATOM 426 N ALA A 27 -2.215 0.704 13.748 1.00 0.00 N ATOM 427 CA ALA A 27 -2.400 2.154 13.588 1.00 0.00 C ATOM 428 C ALA A 27 -3.340 2.720 14.655 1.00 0.00 C ATOM 429 O ALA A 27 -3.057 3.789 15.192 1.00 0.00 O ATOM 430 CB ALA A 27 -2.966 2.459 12.200 1.00 0.00 C ATOM 0 H ALA A 27 -2.572 0.162 12.961 1.00 0.00 H new ATOM 0 HA ALA A 27 -1.425 2.628 13.703 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.100 3.535 12.090 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.274 2.100 11.438 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.928 1.960 12.081 1.00 0.00 H new ATOM 436 N GLU A 28 -4.346 1.939 15.041 1.00 0.00 N ATOM 437 CA GLU A 28 -5.269 2.273 16.135 1.00 0.00 C ATOM 438 C GLU A 28 -4.560 2.204 17.489 1.00 0.00 C ATOM 439 O GLU A 28 -4.536 3.172 18.248 1.00 0.00 O ATOM 440 CB GLU A 28 -6.441 1.289 16.125 1.00 0.00 C ATOM 441 CG GLU A 28 -7.417 1.476 14.962 1.00 0.00 C ATOM 442 CD GLU A 28 -8.205 2.787 14.990 1.00 0.00 C ATOM 443 OE1 GLU A 28 -8.986 2.968 15.950 1.00 0.00 O ATOM 444 OE2 GLU A 28 -8.122 3.511 13.974 1.00 0.00 O ATOM 0 H GLU A 28 -4.550 1.042 14.600 1.00 0.00 H new ATOM 0 HA GLU A 28 -5.631 3.290 15.986 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.046 0.274 16.091 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.989 1.387 17.062 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.860 1.423 14.027 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.122 0.645 14.961 1.00 0.00 H new ATOM 451 N LYS A 29 -3.815 1.121 17.687 1.00 0.00 N ATOM 452 CA LYS A 29 -3.050 0.862 18.916 1.00 0.00 C ATOM 453 C LYS A 29 -1.990 1.928 19.201 1.00 0.00 C ATOM 454 O LYS A 29 -1.670 2.182 20.360 1.00 0.00 O ATOM 455 CB LYS A 29 -2.392 -0.515 18.799 1.00 0.00 C ATOM 456 CG LYS A 29 -1.795 -0.953 20.137 1.00 0.00 C ATOM 457 CD LYS A 29 -1.001 -2.256 20.027 1.00 0.00 C ATOM 458 CE LYS A 29 -0.388 -2.670 21.366 1.00 0.00 C ATOM 459 NZ LYS A 29 -1.440 -3.075 22.308 1.00 0.00 N ATOM 0 H LYS A 29 -3.720 0.382 16.990 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.746 0.893 19.754 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.129 -1.247 18.469 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.610 -0.485 18.040 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -1.143 -0.165 20.515 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.597 -1.080 20.864 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -1.656 -3.050 19.667 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.209 -2.136 19.288 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.310 -3.493 21.214 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.183 -1.841 21.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.006 -3.511 23.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.988 -2.240 22.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -2.072 -3.762 21.849 1.00 0.00 H new ATOM 473 N TYR A 30 -1.317 2.356 18.136 1.00 0.00 N ATOM 474 CA TYR A 30 -0.239 3.353 18.195 1.00 0.00 C ATOM 475 C TYR A 30 -0.656 4.741 17.704 1.00 0.00 C ATOM 476 O TYR A 30 0.188 5.521 17.266 1.00 0.00 O ATOM 477 CB TYR A 30 0.952 2.834 17.385 1.00 0.00 C ATOM 478 CG TYR A 30 1.525 1.493 17.848 1.00 0.00 C ATOM 479 CD1 TYR A 30 1.787 1.232 19.188 1.00 0.00 C ATOM 480 CD2 TYR A 30 1.665 0.506 16.879 1.00 0.00 C ATOM 481 CE1 TYR A 30 2.172 -0.047 19.573 1.00 0.00 C ATOM 482 CE2 TYR A 30 2.060 -0.773 17.255 1.00 0.00 C ATOM 483 CZ TYR A 30 2.285 -1.035 18.601 1.00 0.00 C ATOM 484 OH TYR A 30 2.458 -2.324 18.999 1.00 0.00 O ATOM 0 H TYR A 30 -1.504 2.018 17.192 1.00 0.00 H new ATOM 0 HA TYR A 30 0.030 3.483 19.243 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.647 2.739 16.343 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.746 3.580 17.419 1.00 0.00 H new ATOM 0 HD1 TYR A 30 1.692 2.017 19.924 1.00 0.00 H new ATOM 0 HD2 TYR A 30 1.468 0.731 15.841 1.00 0.00 H new ATOM 0 HE1 TYR A 30 2.380 -0.270 20.609 1.00 0.00 H new ATOM 0 HE2 TYR A 30 2.190 -1.549 16.515 1.00 0.00 H new ATOM 0 HH TYR A 30 1.914 -2.915 18.438 1.00 0.00 H new ATOM 494 N GLU A 31 -1.956 5.010 17.782 1.00 0.00 N ATOM 495 CA GLU A 31 -2.636 6.261 17.412 1.00 0.00 C ATOM 496 C GLU A 31 -2.019 7.049 16.256 1.00 0.00 C ATOM 497 O GLU A 31 -1.893 8.273 16.247 1.00 0.00 O ATOM 498 CB GLU A 31 -2.901 7.102 18.662 1.00 0.00 C ATOM 499 CG GLU A 31 -1.649 7.490 19.450 1.00 0.00 C ATOM 500 CD GLU A 31 -1.970 8.273 20.726 1.00 0.00 C ATOM 501 OE1 GLU A 31 -2.147 9.506 20.622 1.00 0.00 O ATOM 502 OE2 GLU A 31 -1.964 7.637 21.803 1.00 0.00 O ATOM 0 H GLU A 31 -2.615 4.313 18.130 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.592 5.964 16.980 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -3.424 8.012 18.367 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.571 6.548 19.320 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.096 6.588 19.712 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.997 8.090 18.815 1.00 0.00 H new ATOM 509 N VAL A 32 -1.922 6.331 15.139 1.00 0.00 N ATOM 510 CA VAL A 32 -1.403 6.820 13.855 1.00 0.00 C ATOM 511 C VAL A 32 -2.602 7.164 12.968 1.00 0.00 C ATOM 512 O VAL A 32 -3.233 6.260 12.422 1.00 0.00 O ATOM 513 CB VAL A 32 -0.518 5.781 13.164 1.00 0.00 C ATOM 514 CG1 VAL A 32 0.157 6.371 11.925 1.00 0.00 C ATOM 515 CG2 VAL A 32 0.575 5.207 14.068 1.00 0.00 C ATOM 0 H VAL A 32 -2.213 5.354 15.098 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.781 7.698 14.030 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.195 4.972 12.891 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.780 5.611 11.453 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.604 6.705 11.220 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.777 7.218 12.217 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.162 4.477 13.510 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.226 6.012 14.409 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.117 4.722 14.930 1.00 0.00 H new ATOM 525 N PRO A 33 -2.865 8.445 12.726 1.00 0.00 N ATOM 526 CA PRO A 33 -4.019 8.867 11.918 1.00 0.00 C ATOM 527 C PRO A 33 -3.796 8.709 10.413 1.00 0.00 C ATOM 528 O PRO A 33 -3.423 9.622 9.678 1.00 0.00 O ATOM 529 CB PRO A 33 -4.270 10.316 12.343 1.00 0.00 C ATOM 530 CG PRO A 33 -2.882 10.828 12.731 1.00 0.00 C ATOM 531 CD PRO A 33 -2.198 9.602 13.340 1.00 0.00 C ATOM 0 HA PRO A 33 -4.889 8.235 12.096 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -4.700 10.902 11.531 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -4.966 10.373 13.180 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.337 11.201 11.864 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -2.944 11.648 13.446 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.129 9.600 13.126 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.306 9.589 14.425 1.00 0.00 H new ATOM 539 N VAL A 34 -4.114 7.499 9.961 1.00 0.00 N ATOM 540 CA VAL A 34 -3.990 7.070 8.560 1.00 0.00 C ATOM 541 C VAL A 34 -5.170 6.220 8.088 1.00 0.00 C ATOM 542 O VAL A 34 -5.831 5.523 8.856 1.00 0.00 O ATOM 543 CB VAL A 34 -2.681 6.328 8.280 1.00 0.00 C ATOM 544 CG1 VAL A 34 -1.493 7.292 8.324 1.00 0.00 C ATOM 545 CG2 VAL A 34 -2.416 5.154 9.225 1.00 0.00 C ATOM 0 H VAL A 34 -4.475 6.766 10.571 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.989 7.998 7.989 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.794 5.909 7.280 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.572 6.744 8.122 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.626 8.068 7.570 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.433 7.751 9.311 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.470 4.681 8.961 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.366 5.517 10.251 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.223 4.426 9.137 1.00 0.00 H new ATOM 555 N ILE A 35 -5.441 6.377 6.795 1.00 0.00 N ATOM 556 CA ILE A 35 -6.452 5.611 6.052 1.00 0.00 C ATOM 557 C ILE A 35 -5.708 4.624 5.150 1.00 0.00 C ATOM 558 O ILE A 35 -4.851 4.995 4.349 1.00 0.00 O ATOM 559 CB ILE A 35 -7.388 6.533 5.270 1.00 0.00 C ATOM 560 CG1 ILE A 35 -8.181 7.415 6.237 1.00 0.00 C ATOM 561 CG2 ILE A 35 -8.348 5.719 4.399 1.00 0.00 C ATOM 562 CD1 ILE A 35 -8.947 8.571 5.593 1.00 0.00 C ATOM 0 H ILE A 35 -4.953 7.058 6.214 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.098 5.060 6.736 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.784 7.166 4.619 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.890 6.787 6.776 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.492 7.825 6.976 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -9.005 6.395 3.852 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.777 5.117 3.693 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -8.947 5.064 5.032 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.474 9.133 6.364 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.247 9.230 5.079 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -9.667 8.176 4.876 1.00 0.00 H new ATOM 574 N ILE A 36 -5.947 3.355 5.466 1.00 0.00 N ATOM 575 CA ILE A 36 -5.310 2.226 4.771 1.00 0.00 C ATOM 576 C ILE A 36 -6.406 1.373 4.129 1.00 0.00 C ATOM 577 O ILE A 36 -7.206 0.756 4.830 1.00 0.00 O ATOM 578 CB ILE A 36 -4.469 1.392 5.739 1.00 0.00 C ATOM 579 CG1 ILE A 36 -3.563 2.279 6.597 1.00 0.00 C ATOM 580 CG2 ILE A 36 -3.638 0.373 4.958 1.00 0.00 C ATOM 581 CD1 ILE A 36 -3.154 1.622 7.916 1.00 0.00 C ATOM 0 H ILE A 36 -6.586 3.074 6.209 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.637 2.602 4.001 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.144 0.863 6.412 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.667 2.529 6.029 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.078 3.216 6.809 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.041 -0.218 5.652 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.302 -0.286 4.398 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.978 0.896 4.266 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.513 2.302 8.478 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.045 1.397 8.502 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.612 0.699 7.710 1.00 0.00 H new ATOM 593 N GLU A 37 -6.388 1.350 2.799 1.00 0.00 N ATOM 594 CA GLU A 37 -7.380 0.662 1.959 1.00 0.00 C ATOM 595 C GLU A 37 -6.729 -0.042 0.766 1.00 0.00 C ATOM 596 O GLU A 37 -5.707 0.391 0.235 1.00 0.00 O ATOM 597 CB GLU A 37 -8.417 1.646 1.413 1.00 0.00 C ATOM 598 CG GLU A 37 -9.329 2.232 2.492 1.00 0.00 C ATOM 599 CD GLU A 37 -10.381 3.173 1.903 1.00 0.00 C ATOM 600 OE1 GLU A 37 -11.160 2.707 1.043 1.00 0.00 O ATOM 601 OE2 GLU A 37 -10.432 4.320 2.397 1.00 0.00 O ATOM 0 H GLU A 37 -5.665 1.821 2.255 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.859 -0.077 2.601 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -7.901 2.460 0.903 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.029 1.140 0.667 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.825 1.422 3.026 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -8.726 2.773 3.222 1.00 0.00 H new ATOM 608 N ALA A 38 -7.360 -1.155 0.401 1.00 0.00 N ATOM 609 CA ALA A 38 -6.919 -1.999 -0.720 1.00 0.00 C ATOM 610 C ALA A 38 -7.892 -1.950 -1.900 1.00 0.00 C ATOM 611 O ALA A 38 -9.108 -1.906 -1.720 1.00 0.00 O ATOM 612 CB ALA A 38 -6.739 -3.442 -0.242 1.00 0.00 C ATOM 0 H ALA A 38 -8.195 -1.503 0.872 1.00 0.00 H new ATOM 0 HA ALA A 38 -5.966 -1.606 -1.073 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -6.412 -4.063 -1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -5.989 -3.473 0.549 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -7.687 -3.819 0.142 1.00 0.00 H new ATOM 618 N PHE A 39 -7.294 -1.870 -3.085 1.00 0.00 N ATOM 619 CA PHE A 39 -7.979 -1.706 -4.375 1.00 0.00 C ATOM 620 C PHE A 39 -7.351 -2.559 -5.480 1.00 0.00 C ATOM 621 O PHE A 39 -6.169 -2.885 -5.386 1.00 0.00 O ATOM 622 CB PHE A 39 -7.898 -0.239 -4.803 1.00 0.00 C ATOM 623 CG PHE A 39 -8.581 0.749 -3.856 1.00 0.00 C ATOM 624 CD1 PHE A 39 -9.951 0.951 -3.974 1.00 0.00 C ATOM 625 CD2 PHE A 39 -7.821 1.509 -2.974 1.00 0.00 C ATOM 626 CE1 PHE A 39 -10.570 1.939 -3.217 1.00 0.00 C ATOM 627 CE2 PHE A 39 -8.437 2.504 -2.223 1.00 0.00 C ATOM 628 CZ PHE A 39 -9.808 2.699 -2.336 1.00 0.00 C ATOM 0 H PHE A 39 -6.280 -1.919 -3.183 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.011 -2.028 -4.237 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -6.848 0.039 -4.898 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -8.345 -0.139 -5.792 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -10.532 0.343 -4.651 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -6.761 1.328 -2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -11.631 2.115 -3.312 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -7.853 3.121 -1.556 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.289 3.452 -1.730 1.00 0.00 H new ATOM 638 N PRO A 40 -8.107 -2.931 -6.509 1.00 0.00 N ATOM 639 CA PRO A 40 -7.531 -3.523 -7.725 1.00 0.00 C ATOM 640 C PRO A 40 -6.746 -2.503 -8.553 1.00 0.00 C ATOM 641 O PRO A 40 -7.048 -1.310 -8.570 1.00 0.00 O ATOM 642 CB PRO A 40 -8.694 -4.114 -8.525 1.00 0.00 C ATOM 643 CG PRO A 40 -9.940 -3.437 -7.950 1.00 0.00 C ATOM 644 CD PRO A 40 -9.569 -3.079 -6.509 1.00 0.00 C ATOM 0 HA PRO A 40 -6.809 -4.295 -7.458 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.587 -3.909 -9.590 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.743 -5.197 -8.412 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -10.205 -2.548 -8.522 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -10.801 -4.104 -7.981 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -10.057 -2.157 -6.195 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -9.885 -3.859 -5.816 1.00 0.00 H new ATOM 652 N GLU A 41 -5.779 -3.045 -9.286 1.00 0.00 N ATOM 653 CA GLU A 41 -4.778 -2.314 -10.077 1.00 0.00 C ATOM 654 C GLU A 41 -5.356 -1.374 -11.137 1.00 0.00 C ATOM 655 O GLU A 41 -4.784 -0.324 -11.425 1.00 0.00 O ATOM 656 CB GLU A 41 -3.799 -3.317 -10.691 1.00 0.00 C ATOM 657 CG GLU A 41 -4.233 -4.083 -11.943 1.00 0.00 C ATOM 658 CD GLU A 41 -5.395 -5.071 -11.824 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.546 -4.613 -11.661 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.107 -6.261 -12.074 1.00 0.00 O ATOM 0 H GLU A 41 -5.661 -4.056 -9.352 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.259 -1.647 -9.388 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.881 -2.781 -10.931 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.549 -4.049 -9.924 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.497 -3.350 -12.706 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.367 -4.632 -12.314 1.00 0.00 H new ATOM 667 N THR A 42 -6.559 -1.681 -11.612 1.00 0.00 N ATOM 668 CA THR A 42 -7.337 -0.887 -12.574 1.00 0.00 C ATOM 669 C THR A 42 -7.582 0.555 -12.123 1.00 0.00 C ATOM 670 O THR A 42 -7.460 1.492 -12.911 1.00 0.00 O ATOM 671 CB THR A 42 -8.699 -1.535 -12.832 1.00 0.00 C ATOM 672 OG1 THR A 42 -9.374 -1.731 -11.586 1.00 0.00 O ATOM 673 CG2 THR A 42 -8.579 -2.851 -13.605 1.00 0.00 C ATOM 0 H THR A 42 -7.047 -2.530 -11.327 1.00 0.00 H new ATOM 0 HA THR A 42 -6.732 -0.862 -13.480 1.00 0.00 H new ATOM 0 HB THR A 42 -9.282 -0.862 -13.460 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.248 -2.144 -11.749 1.00 0.00 H new ATOM 0 HG21 THR A 42 -9.572 -3.272 -13.763 1.00 0.00 H new ATOM 0 HG22 THR A 42 -8.106 -2.665 -14.569 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.974 -3.555 -13.034 1.00 0.00 H new ATOM 681 N LEU A 43 -7.714 0.719 -10.811 1.00 0.00 N ATOM 682 CA LEU A 43 -7.985 2.017 -10.176 1.00 0.00 C ATOM 683 C LEU A 43 -6.736 2.732 -9.655 1.00 0.00 C ATOM 684 O LEU A 43 -6.818 3.773 -9.005 1.00 0.00 O ATOM 685 CB LEU A 43 -8.991 1.820 -9.041 1.00 0.00 C ATOM 686 CG LEU A 43 -10.359 1.345 -9.536 1.00 0.00 C ATOM 687 CD1 LEU A 43 -11.228 0.952 -8.340 1.00 0.00 C ATOM 688 CD2 LEU A 43 -11.085 2.416 -10.353 1.00 0.00 C ATOM 0 H LEU A 43 -7.636 -0.050 -10.146 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.393 2.666 -10.951 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.594 1.093 -8.332 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.111 2.759 -8.501 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.190 0.487 -10.187 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.202 0.614 -8.693 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.743 0.147 -7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.359 1.814 -7.686 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -12.050 2.031 -10.681 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.238 3.302 -9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.484 2.679 -11.224 1.00 0.00 H new ATOM 700 N ALA A 44 -5.581 2.261 -10.118 1.00 0.00 N ATOM 701 CA ALA A 44 -4.268 2.828 -9.775 1.00 0.00 C ATOM 702 C ALA A 44 -4.118 4.294 -10.186 1.00 0.00 C ATOM 703 O ALA A 44 -3.656 5.099 -9.379 1.00 0.00 O ATOM 704 CB ALA A 44 -3.142 2.002 -10.400 1.00 0.00 C ATOM 0 H ALA A 44 -5.524 1.464 -10.751 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.198 2.789 -8.688 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.179 2.439 -10.134 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.192 0.979 -10.028 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.252 1.999 -11.484 1.00 0.00 H new ATOM 710 N GLY A 45 -4.619 4.635 -11.369 1.00 0.00 N ATOM 711 CA GLY A 45 -4.674 6.027 -11.840 1.00 0.00 C ATOM 712 C GLY A 45 -5.617 6.852 -10.962 1.00 0.00 C ATOM 713 O GLY A 45 -5.168 7.519 -10.031 1.00 0.00 O ATOM 0 H GLY A 45 -5.000 3.960 -12.032 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.675 6.463 -11.821 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.014 6.054 -12.875 1.00 0.00 H new ATOM 717 N GLU A 46 -6.876 6.428 -11.012 1.00 0.00 N ATOM 718 CA GLU A 46 -8.020 7.172 -10.464 1.00 0.00 C ATOM 719 C GLU A 46 -7.896 7.484 -8.971 1.00 0.00 C ATOM 720 O GLU A 46 -8.072 8.617 -8.526 1.00 0.00 O ATOM 721 CB GLU A 46 -9.267 6.328 -10.734 1.00 0.00 C ATOM 722 CG GLU A 46 -10.569 7.079 -10.451 1.00 0.00 C ATOM 723 CD GLU A 46 -11.784 6.149 -10.498 1.00 0.00 C ATOM 724 OE1 GLU A 46 -12.245 5.862 -11.624 1.00 0.00 O ATOM 725 OE2 GLU A 46 -12.237 5.771 -9.396 1.00 0.00 O ATOM 0 H GLU A 46 -7.141 5.542 -11.441 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.070 8.146 -10.951 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.260 6.002 -11.774 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.231 5.429 -10.118 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.510 7.551 -9.470 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.694 7.878 -11.182 1.00 0.00 H new ATOM 732 N LYS A 47 -7.569 6.450 -8.201 1.00 0.00 N ATOM 733 CA LYS A 47 -7.445 6.551 -6.739 1.00 0.00 C ATOM 734 C LYS A 47 -6.042 6.915 -6.249 1.00 0.00 C ATOM 735 O LYS A 47 -5.920 7.727 -5.334 1.00 0.00 O ATOM 736 CB LYS A 47 -7.917 5.277 -6.035 1.00 0.00 C ATOM 737 CG LYS A 47 -9.401 5.283 -5.663 1.00 0.00 C ATOM 738 CD LYS A 47 -10.340 5.301 -6.872 1.00 0.00 C ATOM 739 CE LYS A 47 -11.809 5.410 -6.462 1.00 0.00 C ATOM 740 NZ LYS A 47 -12.087 6.784 -6.017 1.00 0.00 N ATOM 0 H LYS A 47 -7.381 5.517 -8.567 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.100 7.380 -6.472 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.719 4.422 -6.682 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.327 5.135 -5.130 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.618 4.402 -5.059 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.607 6.155 -5.042 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -10.082 6.140 -7.518 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -10.194 4.393 -7.456 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -12.453 5.150 -7.302 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -12.029 4.704 -5.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.113 6.910 -5.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -11.610 6.958 -5.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.735 7.457 -6.728 1.00 0.00 H new ATOM 754 N GLY A 48 -5.020 6.492 -6.989 1.00 0.00 N ATOM 755 CA GLY A 48 -3.612 6.785 -6.686 1.00 0.00 C ATOM 756 C GLY A 48 -3.292 8.281 -6.693 1.00 0.00 C ATOM 757 O GLY A 48 -2.440 8.753 -5.942 1.00 0.00 O ATOM 0 H GLY A 48 -5.143 5.927 -7.829 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -3.364 6.372 -5.708 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -2.978 6.281 -7.415 1.00 0.00 H new ATOM 761 N GLN A 49 -4.109 9.033 -7.425 1.00 0.00 N ATOM 762 CA GLN A 49 -4.071 10.500 -7.504 1.00 0.00 C ATOM 763 C GLN A 49 -4.237 11.206 -6.156 1.00 0.00 C ATOM 764 O GLN A 49 -3.643 12.257 -5.922 1.00 0.00 O ATOM 765 CB GLN A 49 -5.183 10.961 -8.449 1.00 0.00 C ATOM 766 CG GLN A 49 -4.808 10.673 -9.904 1.00 0.00 C ATOM 767 CD GLN A 49 -6.015 10.705 -10.844 1.00 0.00 C ATOM 768 OE1 GLN A 49 -7.064 11.288 -10.578 1.00 0.00 O ATOM 769 NE2 GLN A 49 -5.876 10.112 -12.026 1.00 0.00 N ATOM 0 H GLN A 49 -4.845 8.628 -8.003 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.080 10.771 -7.869 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.114 10.451 -8.200 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.360 12.029 -8.318 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -4.074 11.406 -10.237 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.331 9.695 -9.965 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.009 9.626 -12.254 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.637 10.143 -12.705 1.00 0.00 H new ATOM 778 N ASN A 50 -4.972 10.561 -5.255 1.00 0.00 N ATOM 779 CA ASN A 50 -5.191 11.054 -3.888 1.00 0.00 C ATOM 780 C ASN A 50 -4.414 10.293 -2.811 1.00 0.00 C ATOM 781 O ASN A 50 -4.428 10.699 -1.650 1.00 0.00 O ATOM 782 CB ASN A 50 -6.687 11.048 -3.570 1.00 0.00 C ATOM 783 CG ASN A 50 -7.411 12.158 -4.335 1.00 0.00 C ATOM 784 OD1 ASN A 50 -7.387 13.329 -3.957 1.00 0.00 O ATOM 785 ND2 ASN A 50 -8.053 11.858 -5.460 1.00 0.00 N ATOM 0 H ASN A 50 -5.438 9.675 -5.449 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.800 12.071 -3.865 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.115 10.081 -3.833 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.836 11.182 -2.499 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -8.515 12.593 -5.995 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.083 10.893 -5.788 1.00 0.00 H new ATOM 792 N ALA A 51 -3.575 9.354 -3.238 1.00 0.00 N ATOM 793 CA ALA A 51 -2.673 8.636 -2.326 1.00 0.00 C ATOM 794 C ALA A 51 -1.437 9.485 -2.026 1.00 0.00 C ATOM 795 O ALA A 51 -0.992 10.278 -2.855 1.00 0.00 O ATOM 796 CB ALA A 51 -2.231 7.301 -2.928 1.00 0.00 C ATOM 0 H ALA A 51 -3.497 9.067 -4.214 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.219 8.443 -1.403 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.565 6.791 -2.232 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -3.106 6.679 -3.115 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.707 7.481 -3.867 1.00 0.00 H new ATOM 802 N ASP A 52 -0.998 9.381 -0.774 1.00 0.00 N ATOM 803 CA ASP A 52 0.278 9.950 -0.315 1.00 0.00 C ATOM 804 C ASP A 52 1.412 8.942 -0.505 1.00 0.00 C ATOM 805 O ASP A 52 2.561 9.343 -0.687 1.00 0.00 O ATOM 806 CB ASP A 52 0.233 10.406 1.145 1.00 0.00 C ATOM 807 CG ASP A 52 -0.766 11.537 1.398 1.00 0.00 C ATOM 808 OD1 ASP A 52 -0.366 12.709 1.222 1.00 0.00 O ATOM 809 OD2 ASP A 52 -1.864 11.206 1.896 1.00 0.00 O ATOM 0 H ASP A 52 -1.517 8.898 -0.041 1.00 0.00 H new ATOM 0 HA ASP A 52 0.462 10.833 -0.926 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -0.025 9.555 1.776 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.227 10.736 1.446 1.00 0.00 H new ATOM 814 N VAL A 53 1.086 7.654 -0.435 1.00 0.00 N ATOM 815 CA VAL A 53 1.936 6.572 -0.952 1.00 0.00 C ATOM 816 C VAL A 53 1.050 5.446 -1.486 1.00 0.00 C ATOM 817 O VAL A 53 -0.048 5.175 -1.001 1.00 0.00 O ATOM 818 CB VAL A 53 2.946 6.094 0.093 1.00 0.00 C ATOM 819 CG1 VAL A 53 2.279 5.398 1.281 1.00 0.00 C ATOM 820 CG2 VAL A 53 4.017 5.209 -0.547 1.00 0.00 C ATOM 0 H VAL A 53 0.217 7.323 -0.015 1.00 0.00 H new ATOM 0 HA VAL A 53 2.537 6.949 -1.780 1.00 0.00 H new ATOM 0 HB VAL A 53 3.434 6.983 0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.042 5.079 1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.594 6.090 1.770 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.725 4.528 0.929 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.723 4.882 0.217 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.545 4.338 -1.002 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.547 5.775 -1.313 1.00 0.00 H new ATOM 830 N VAL A 54 1.554 4.884 -2.581 1.00 0.00 N ATOM 831 CA VAL A 54 0.981 3.716 -3.267 1.00 0.00 C ATOM 832 C VAL A 54 1.906 2.529 -2.986 1.00 0.00 C ATOM 833 O VAL A 54 3.114 2.572 -3.213 1.00 0.00 O ATOM 834 CB VAL A 54 0.901 3.999 -4.769 1.00 0.00 C ATOM 835 CG1 VAL A 54 0.306 2.819 -5.540 1.00 0.00 C ATOM 836 CG2 VAL A 54 0.069 5.247 -5.065 1.00 0.00 C ATOM 0 H VAL A 54 2.398 5.235 -3.034 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.026 3.498 -2.912 1.00 0.00 H new ATOM 0 HB VAL A 54 1.927 4.162 -5.100 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.267 3.061 -6.602 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.928 1.936 -5.392 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.702 2.618 -5.176 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.035 5.415 -6.141 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.944 5.107 -4.688 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.522 6.110 -4.577 1.00 0.00 H new ATOM 846 N LEU A 55 1.284 1.500 -2.419 1.00 0.00 N ATOM 847 CA LEU A 55 1.961 0.226 -2.134 1.00 0.00 C ATOM 848 C LEU A 55 1.409 -0.916 -2.989 1.00 0.00 C ATOM 849 O LEU A 55 0.204 -1.078 -3.174 1.00 0.00 O ATOM 850 CB LEU A 55 1.846 -0.129 -0.650 1.00 0.00 C ATOM 851 CG LEU A 55 2.640 0.823 0.246 1.00 0.00 C ATOM 852 CD1 LEU A 55 2.203 0.590 1.694 1.00 0.00 C ATOM 853 CD2 LEU A 55 4.154 0.636 0.128 1.00 0.00 C ATOM 0 H LEU A 55 0.302 1.519 -2.143 1.00 0.00 H new ATOM 0 HA LEU A 55 3.013 0.358 -2.389 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.797 -0.109 -0.356 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.201 -1.148 -0.495 1.00 0.00 H new ATOM 0 HG LEU A 55 2.430 1.843 -0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.756 1.259 2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.135 0.789 1.788 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.405 -0.444 1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.660 1.340 0.788 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.418 -0.382 0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.464 0.817 -0.901 1.00 0.00 H new ATOM 865 N LEU A 56 2.361 -1.653 -3.554 1.00 0.00 N ATOM 866 CA LEU A 56 2.095 -2.759 -4.486 1.00 0.00 C ATOM 867 C LEU A 56 2.429 -4.124 -3.880 1.00 0.00 C ATOM 868 O LEU A 56 3.417 -4.294 -3.168 1.00 0.00 O ATOM 869 CB LEU A 56 2.949 -2.624 -5.748 1.00 0.00 C ATOM 870 CG LEU A 56 2.897 -1.239 -6.396 1.00 0.00 C ATOM 871 CD1 LEU A 56 3.995 -1.130 -7.455 1.00 0.00 C ATOM 872 CD2 LEU A 56 1.546 -0.956 -7.055 1.00 0.00 C ATOM 0 H LEU A 56 3.354 -1.502 -3.379 1.00 0.00 H new ATOM 0 HA LEU A 56 1.031 -2.702 -4.714 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.984 -2.858 -5.499 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.621 -3.366 -6.476 1.00 0.00 H new ATOM 0 HG LEU A 56 3.046 -0.505 -5.604 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.958 -0.143 -7.917 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.968 -1.275 -6.986 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.842 -1.894 -8.218 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.560 0.039 -7.500 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.357 -1.698 -7.831 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.757 -1.007 -6.304 1.00 0.00 H new ATOM 884 N GLY A 57 1.574 -5.082 -4.225 1.00 0.00 N ATOM 885 CA GLY A 57 1.784 -6.515 -3.975 1.00 0.00 C ATOM 886 C GLY A 57 2.986 -7.031 -4.767 1.00 0.00 C ATOM 887 O GLY A 57 3.076 -6.717 -5.953 1.00 0.00 O ATOM 0 H GLY A 57 0.692 -4.884 -4.698 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.944 -6.684 -2.910 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.891 -7.073 -4.255 1.00 0.00 H new ATOM 891 N PRO A 58 3.858 -7.849 -4.184 1.00 0.00 N ATOM 892 CA PRO A 58 5.040 -8.368 -4.887 1.00 0.00 C ATOM 893 C PRO A 58 4.729 -9.115 -6.185 1.00 0.00 C ATOM 894 O PRO A 58 5.474 -9.016 -7.158 1.00 0.00 O ATOM 895 CB PRO A 58 5.792 -9.240 -3.877 1.00 0.00 C ATOM 896 CG PRO A 58 4.790 -9.500 -2.750 1.00 0.00 C ATOM 897 CD PRO A 58 3.861 -8.284 -2.779 1.00 0.00 C ATOM 0 HA PRO A 58 5.652 -7.533 -5.229 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.124 -10.173 -4.332 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.682 -8.733 -3.504 1.00 0.00 H new ATOM 0 HG2 PRO A 58 4.238 -10.426 -2.914 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.291 -9.594 -1.787 1.00 0.00 H new ATOM 0 HD2 PRO A 58 2.857 -8.545 -2.443 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.222 -7.494 -2.121 1.00 0.00 H new ATOM 905 N GLN A 59 3.539 -9.705 -6.262 1.00 0.00 N ATOM 906 CA GLN A 59 2.994 -10.358 -7.461 1.00 0.00 C ATOM 907 C GLN A 59 2.798 -9.435 -8.666 1.00 0.00 C ATOM 908 O GLN A 59 3.026 -9.859 -9.797 1.00 0.00 O ATOM 909 CB GLN A 59 1.692 -11.103 -7.162 1.00 0.00 C ATOM 910 CG GLN A 59 0.589 -10.305 -6.464 1.00 0.00 C ATOM 911 CD GLN A 59 0.656 -10.363 -4.937 1.00 0.00 C ATOM 912 OE1 GLN A 59 1.713 -10.363 -4.307 1.00 0.00 O ATOM 913 NE2 GLN A 59 -0.500 -10.312 -4.283 1.00 0.00 N ATOM 0 H GLN A 59 2.901 -9.746 -5.467 1.00 0.00 H new ATOM 0 HA GLN A 59 3.768 -11.071 -7.746 1.00 0.00 H new ATOM 0 HB2 GLN A 59 1.294 -11.483 -8.103 1.00 0.00 H new ATOM 0 HB3 GLN A 59 1.929 -11.968 -6.543 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.650 -9.264 -6.782 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.381 -10.681 -6.790 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.379 -10.312 -4.800 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.508 -10.273 -3.264 1.00 0.00 H new ATOM 922 N ILE A 60 2.559 -8.152 -8.414 1.00 0.00 N ATOM 923 CA ILE A 60 2.450 -7.157 -9.492 1.00 0.00 C ATOM 924 C ILE A 60 3.591 -6.139 -9.447 1.00 0.00 C ATOM 925 O ILE A 60 3.528 -5.063 -10.039 1.00 0.00 O ATOM 926 CB ILE A 60 1.091 -6.455 -9.535 1.00 0.00 C ATOM 927 CG1 ILE A 60 0.781 -5.669 -8.259 1.00 0.00 C ATOM 928 CG2 ILE A 60 -0.011 -7.460 -9.876 1.00 0.00 C ATOM 929 CD1 ILE A 60 -0.166 -4.498 -8.531 1.00 0.00 C ATOM 0 H ILE A 60 2.436 -7.770 -7.476 1.00 0.00 H new ATOM 0 HA ILE A 60 2.536 -7.723 -10.420 1.00 0.00 H new ATOM 0 HB ILE A 60 1.134 -5.708 -10.328 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.334 -6.335 -7.521 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.709 -5.294 -7.828 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.973 -6.949 -9.904 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.192 -7.906 -10.850 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.037 -8.242 -9.118 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.362 -3.965 -7.601 1.00 0.00 H new ATOM 0 HD12 ILE A 60 0.293 -3.818 -9.249 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.104 -4.876 -8.937 1.00 0.00 H new ATOM 941 N ALA A 61 4.723 -6.569 -8.898 1.00 0.00 N ATOM 942 CA ALA A 61 5.933 -5.740 -8.789 1.00 0.00 C ATOM 943 C ALA A 61 6.544 -5.374 -10.144 1.00 0.00 C ATOM 944 O ALA A 61 7.059 -4.270 -10.309 1.00 0.00 O ATOM 945 CB ALA A 61 6.983 -6.471 -7.951 1.00 0.00 C ATOM 0 H ALA A 61 4.834 -7.507 -8.512 1.00 0.00 H new ATOM 0 HA ALA A 61 5.628 -4.809 -8.312 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.879 -5.855 -7.872 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.585 -6.662 -6.955 1.00 0.00 H new ATOM 0 HB3 ALA A 61 7.235 -7.418 -8.429 1.00 0.00 H new ATOM 951 N TYR A 62 6.394 -6.261 -11.124 1.00 0.00 N ATOM 952 CA TYR A 62 6.810 -5.985 -12.506 1.00 0.00 C ATOM 953 C TYR A 62 6.061 -4.816 -13.147 1.00 0.00 C ATOM 954 O TYR A 62 6.565 -4.182 -14.073 1.00 0.00 O ATOM 955 CB TYR A 62 6.694 -7.247 -13.364 1.00 0.00 C ATOM 956 CG TYR A 62 5.266 -7.677 -13.706 1.00 0.00 C ATOM 957 CD1 TYR A 62 4.485 -8.333 -12.761 1.00 0.00 C ATOM 958 CD2 TYR A 62 4.781 -7.374 -14.972 1.00 0.00 C ATOM 959 CE1 TYR A 62 3.173 -8.660 -13.081 1.00 0.00 C ATOM 960 CE2 TYR A 62 3.477 -7.722 -15.306 1.00 0.00 C ATOM 961 CZ TYR A 62 2.692 -8.357 -14.350 1.00 0.00 C ATOM 962 OH TYR A 62 1.430 -8.743 -14.676 1.00 0.00 O ATOM 0 H TYR A 62 5.985 -7.186 -10.990 1.00 0.00 H new ATOM 0 HA TYR A 62 7.855 -5.680 -12.458 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.240 -7.086 -14.294 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.188 -8.067 -12.843 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.892 -8.585 -11.793 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.412 -6.872 -15.691 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.536 -9.143 -12.355 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.082 -7.504 -16.287 1.00 0.00 H new ATOM 0 HH TYR A 62 0.795 -8.047 -14.405 1.00 0.00 H new ATOM 972 N MET A 63 4.891 -4.490 -12.602 1.00 0.00 N ATOM 973 CA MET A 63 4.062 -3.351 -13.021 1.00 0.00 C ATOM 974 C MET A 63 4.421 -2.031 -12.336 1.00 0.00 C ATOM 975 O MET A 63 3.897 -0.988 -12.726 1.00 0.00 O ATOM 976 CB MET A 63 2.605 -3.722 -12.733 1.00 0.00 C ATOM 977 CG MET A 63 2.079 -4.721 -13.765 1.00 0.00 C ATOM 978 SD MET A 63 0.565 -5.608 -13.243 1.00 0.00 S ATOM 979 CE MET A 63 -0.629 -4.289 -13.229 1.00 0.00 C ATOM 0 H MET A 63 4.478 -5.022 -11.836 1.00 0.00 H new ATOM 0 HA MET A 63 4.238 -3.173 -14.082 1.00 0.00 H new ATOM 0 HB2 MET A 63 2.526 -4.150 -11.734 1.00 0.00 H new ATOM 0 HB3 MET A 63 1.988 -2.823 -12.744 1.00 0.00 H new ATOM 0 HG2 MET A 63 1.874 -4.192 -14.696 1.00 0.00 H new ATOM 0 HG3 MET A 63 2.860 -5.451 -13.979 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.042 -4.182 -12.226 1.00 0.00 H new ATOM 0 HE2 MET A 63 -0.146 -3.358 -13.524 1.00 0.00 H new ATOM 0 HE3 MET A 63 -1.432 -4.518 -13.929 1.00 0.00 H new ATOM 989 N LEU A 64 5.413 -2.039 -11.451 1.00 0.00 N ATOM 990 CA LEU A 64 5.977 -0.818 -10.857 1.00 0.00 C ATOM 991 C LEU A 64 6.402 0.202 -11.914 1.00 0.00 C ATOM 992 O LEU A 64 5.792 1.268 -11.857 1.00 0.00 O ATOM 993 CB LEU A 64 7.055 -1.195 -9.838 1.00 0.00 C ATOM 994 CG LEU A 64 7.864 0.029 -9.402 1.00 0.00 C ATOM 995 CD1 LEU A 64 7.111 0.862 -8.362 1.00 0.00 C ATOM 996 CD2 LEU A 64 9.253 -0.358 -8.890 1.00 0.00 C ATOM 0 H LEU A 64 5.856 -2.896 -11.119 1.00 0.00 H new ATOM 0 HA LEU A 64 5.203 -0.288 -10.302 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.589 -1.654 -8.966 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.723 -1.939 -10.271 1.00 0.00 H new ATOM 0 HG LEU A 64 8.001 0.647 -10.289 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.717 1.722 -8.077 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.168 1.207 -8.786 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.911 0.251 -7.482 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.794 0.540 -8.591 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.152 -1.023 -8.033 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.804 -0.867 -9.681 1.00 0.00 H new ATOM 1008 N PRO A 65 7.170 -0.107 -12.955 1.00 0.00 N ATOM 1009 CA PRO A 65 7.468 0.850 -14.031 1.00 0.00 C ATOM 1010 C PRO A 65 6.224 1.467 -14.673 1.00 0.00 C ATOM 1011 O PRO A 65 6.143 2.689 -14.794 1.00 0.00 O ATOM 1012 CB PRO A 65 8.260 0.069 -15.080 1.00 0.00 C ATOM 1013 CG PRO A 65 8.930 -1.048 -14.277 1.00 0.00 C ATOM 1014 CD PRO A 65 7.910 -1.357 -13.179 1.00 0.00 C ATOM 0 HA PRO A 65 8.021 1.692 -13.615 1.00 0.00 H new ATOM 0 HB2 PRO A 65 7.608 -0.332 -15.856 1.00 0.00 H new ATOM 0 HB3 PRO A 65 8.996 0.701 -15.577 1.00 0.00 H new ATOM 0 HG2 PRO A 65 9.131 -1.922 -14.896 1.00 0.00 H new ATOM 0 HG3 PRO A 65 9.884 -0.726 -13.860 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.238 -2.159 -13.484 1.00 0.00 H new ATOM 0 HD3 PRO A 65 8.406 -1.686 -12.266 1.00 0.00 H new ATOM 1022 N GLU A 66 5.174 0.666 -14.836 1.00 0.00 N ATOM 1023 CA GLU A 66 3.957 1.085 -15.546 1.00 0.00 C ATOM 1024 C GLU A 66 3.038 1.969 -14.701 1.00 0.00 C ATOM 1025 O GLU A 66 2.407 2.904 -15.192 1.00 0.00 O ATOM 1026 CB GLU A 66 3.211 -0.170 -16.004 1.00 0.00 C ATOM 1027 CG GLU A 66 2.272 0.102 -17.180 1.00 0.00 C ATOM 1028 CD GLU A 66 3.013 0.388 -18.487 1.00 0.00 C ATOM 1029 OE1 GLU A 66 3.211 -0.581 -19.251 1.00 0.00 O ATOM 1030 OE2 GLU A 66 3.208 1.589 -18.774 1.00 0.00 O ATOM 0 H GLU A 66 5.137 -0.290 -14.483 1.00 0.00 H new ATOM 0 HA GLU A 66 4.258 1.695 -16.398 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.934 -0.934 -16.290 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.636 -0.571 -15.170 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.618 -0.758 -17.321 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.633 0.952 -16.938 1.00 0.00 H new ATOM 1037 N ILE A 67 2.955 1.649 -13.413 1.00 0.00 N ATOM 1038 CA ILE A 67 2.212 2.418 -12.405 1.00 0.00 C ATOM 1039 C ILE A 67 2.974 3.686 -12.015 1.00 0.00 C ATOM 1040 O ILE A 67 2.364 4.736 -11.814 1.00 0.00 O ATOM 1041 CB ILE A 67 1.856 1.501 -11.233 1.00 0.00 C ATOM 1042 CG1 ILE A 67 0.835 0.496 -11.772 1.00 0.00 C ATOM 1043 CG2 ILE A 67 1.301 2.284 -10.041 1.00 0.00 C ATOM 1044 CD1 ILE A 67 0.382 -0.621 -10.830 1.00 0.00 C ATOM 0 H ILE A 67 3.414 0.825 -13.025 1.00 0.00 H new ATOM 0 HA ILE A 67 1.268 2.778 -12.815 1.00 0.00 H new ATOM 0 HB ILE A 67 2.744 0.995 -10.855 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -0.049 1.050 -12.087 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.256 0.034 -12.665 1.00 0.00 H new ATOM 0 HG21 ILE A 67 1.062 1.594 -9.232 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.047 3.001 -9.698 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.399 2.816 -10.343 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.340 -1.258 -11.341 1.00 0.00 H new ATOM 0 HD12 ILE A 67 1.244 -1.217 -10.531 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.081 -0.185 -9.945 1.00 0.00 H new ATOM 1056 N GLN A 68 4.301 3.595 -12.014 1.00 0.00 N ATOM 1057 CA GLN A 68 5.198 4.756 -11.914 1.00 0.00 C ATOM 1058 C GLN A 68 4.944 5.732 -13.065 1.00 0.00 C ATOM 1059 O GLN A 68 4.724 6.919 -12.832 1.00 0.00 O ATOM 1060 CB GLN A 68 6.654 4.292 -11.966 1.00 0.00 C ATOM 1061 CG GLN A 68 7.470 4.756 -10.758 1.00 0.00 C ATOM 1062 CD GLN A 68 7.616 6.278 -10.693 1.00 0.00 C ATOM 1063 OE1 GLN A 68 8.021 6.945 -11.643 1.00 0.00 O ATOM 1064 NE2 GLN A 68 7.260 6.872 -9.557 1.00 0.00 N ATOM 0 H GLN A 68 4.795 2.705 -12.083 1.00 0.00 H new ATOM 0 HA GLN A 68 5.003 5.260 -10.968 1.00 0.00 H new ATOM 0 HB2 GLN A 68 6.682 3.204 -12.020 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.118 4.669 -12.878 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.993 4.402 -9.844 1.00 0.00 H new ATOM 0 HG3 GLN A 68 8.460 4.302 -10.797 1.00 0.00 H new ATOM 0 HE21 GLN A 68 6.925 6.313 -8.772 1.00 0.00 H new ATOM 0 HE22 GLN A 68 7.322 7.886 -9.471 1.00 0.00 H new ATOM 1073 N ARG A 69 4.733 5.181 -14.257 1.00 0.00 N ATOM 1074 CA ARG A 69 4.346 5.924 -15.465 1.00 0.00 C ATOM 1075 C ARG A 69 3.006 6.638 -15.277 1.00 0.00 C ATOM 1076 O ARG A 69 2.812 7.756 -15.750 1.00 0.00 O ATOM 1077 CB ARG A 69 4.326 4.900 -16.601 1.00 0.00 C ATOM 1078 CG ARG A 69 3.944 5.413 -17.991 1.00 0.00 C ATOM 1079 CD ARG A 69 2.439 5.473 -18.261 1.00 0.00 C ATOM 1080 NE ARG A 69 1.835 4.133 -18.318 1.00 0.00 N ATOM 1081 CZ ARG A 69 0.555 3.805 -18.533 1.00 0.00 C ATOM 1082 NH1 ARG A 69 -0.383 4.733 -18.767 1.00 0.00 N ATOM 1083 NH2 ARG A 69 0.205 2.512 -18.596 1.00 0.00 N ATOM 0 H ARG A 69 4.828 4.179 -14.420 1.00 0.00 H new ATOM 0 HA ARG A 69 5.052 6.723 -15.693 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.315 4.448 -16.667 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.630 4.106 -16.330 1.00 0.00 H new ATOM 0 HG2 ARG A 69 4.363 6.411 -18.122 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.408 4.771 -18.740 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.953 6.056 -17.479 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.260 5.992 -19.203 1.00 0.00 H new ATOM 0 HE ARG A 69 2.475 3.352 -18.175 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.130 5.721 -18.785 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.350 4.451 -18.927 1.00 0.00 H new ATOM 0 HH21 ARG A 69 0.912 1.786 -18.480 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -0.768 2.255 -18.759 1.00 0.00 H new ATOM 1097 N LEU A 70 2.045 5.915 -14.708 1.00 0.00 N ATOM 1098 CA LEU A 70 0.698 6.416 -14.395 1.00 0.00 C ATOM 1099 C LEU A 70 0.704 7.539 -13.355 1.00 0.00 C ATOM 1100 O LEU A 70 -0.113 8.457 -13.415 1.00 0.00 O ATOM 1101 CB LEU A 70 -0.137 5.261 -13.837 1.00 0.00 C ATOM 1102 CG LEU A 70 -0.652 4.303 -14.913 1.00 0.00 C ATOM 1103 CD1 LEU A 70 -1.216 3.030 -14.281 1.00 0.00 C ATOM 1104 CD2 LEU A 70 -1.776 4.934 -15.737 1.00 0.00 C ATOM 0 H LEU A 70 2.179 4.939 -14.443 1.00 0.00 H new ATOM 0 HA LEU A 70 0.282 6.818 -15.319 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.465 4.701 -13.121 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.986 5.669 -13.289 1.00 0.00 H new ATOM 0 HG LEU A 70 0.199 4.074 -15.554 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.576 2.364 -15.065 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.434 2.530 -13.710 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -2.041 3.288 -13.617 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.117 4.225 -16.491 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.607 5.193 -15.081 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.406 5.835 -16.227 1.00 0.00 H new ATOM 1116 N LEU A 71 1.521 7.338 -12.325 1.00 0.00 N ATOM 1117 CA LEU A 71 1.646 8.219 -11.155 1.00 0.00 C ATOM 1118 C LEU A 71 3.095 8.672 -10.967 1.00 0.00 C ATOM 1119 O LEU A 71 3.714 8.377 -9.946 1.00 0.00 O ATOM 1120 CB LEU A 71 1.158 7.458 -9.920 1.00 0.00 C ATOM 1121 CG LEU A 71 -0.238 6.848 -10.068 1.00 0.00 C ATOM 1122 CD1 LEU A 71 -0.441 5.774 -8.998 1.00 0.00 C ATOM 1123 CD2 LEU A 71 -1.349 7.897 -10.000 1.00 0.00 C ATOM 0 H LEU A 71 2.140 6.529 -12.275 1.00 0.00 H new ATOM 0 HA LEU A 71 1.040 9.112 -11.304 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.868 6.662 -9.694 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.157 8.136 -9.067 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.300 6.398 -11.059 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.435 5.339 -9.103 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.311 4.994 -9.118 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.344 6.222 -8.009 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.317 7.409 -10.111 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.308 8.409 -9.038 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.214 8.622 -10.803 1.00 0.00 H new ATOM 1135 N PRO A 72 3.601 9.538 -11.840 1.00 0.00 N ATOM 1136 CA PRO A 72 5.009 9.959 -11.794 1.00 0.00 C ATOM 1137 C PRO A 72 5.348 10.967 -10.694 1.00 0.00 C ATOM 1138 O PRO A 72 6.519 11.145 -10.359 1.00 0.00 O ATOM 1139 CB PRO A 72 5.279 10.531 -13.187 1.00 0.00 C ATOM 1140 CG PRO A 72 3.924 11.111 -13.604 1.00 0.00 C ATOM 1141 CD PRO A 72 2.915 10.134 -12.997 1.00 0.00 C ATOM 0 HA PRO A 72 5.645 9.111 -11.541 1.00 0.00 H new ATOM 0 HB2 PRO A 72 6.053 11.298 -13.163 1.00 0.00 H new ATOM 0 HB3 PRO A 72 5.616 9.759 -13.879 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.785 12.122 -13.220 1.00 0.00 H new ATOM 0 HG3 PRO A 72 3.827 11.166 -14.688 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.004 10.648 -12.692 1.00 0.00 H new ATOM 0 HD3 PRO A 72 2.624 9.370 -13.718 1.00 0.00 H new ATOM 1149 N ASN A 73 4.312 11.475 -10.034 1.00 0.00 N ATOM 1150 CA ASN A 73 4.481 12.461 -8.956 1.00 0.00 C ATOM 1151 C ASN A 73 4.165 11.924 -7.558 1.00 0.00 C ATOM 1152 O ASN A 73 4.135 12.669 -6.580 1.00 0.00 O ATOM 1153 CB ASN A 73 3.599 13.686 -9.208 1.00 0.00 C ATOM 1154 CG ASN A 73 3.845 14.335 -10.572 1.00 0.00 C ATOM 1155 OD1 ASN A 73 4.964 14.425 -11.074 1.00 0.00 O ATOM 1156 ND2 ASN A 73 2.797 14.801 -11.244 1.00 0.00 N ATOM 0 H ASN A 73 3.342 11.223 -10.223 1.00 0.00 H new ATOM 0 HA ASN A 73 5.539 12.721 -8.975 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.552 13.393 -9.136 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.778 14.422 -8.425 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.928 15.226 -12.162 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.862 14.734 -10.841 1.00 0.00 H new ATOM 1163 N LYS A 74 3.872 10.629 -7.481 1.00 0.00 N ATOM 1164 CA LYS A 74 3.443 9.980 -6.234 1.00 0.00 C ATOM 1165 C LYS A 74 4.428 8.852 -5.919 1.00 0.00 C ATOM 1166 O LYS A 74 4.840 8.160 -6.848 1.00 0.00 O ATOM 1167 CB LYS A 74 2.039 9.401 -6.421 1.00 0.00 C ATOM 1168 CG LYS A 74 0.926 10.422 -6.662 1.00 0.00 C ATOM 1169 CD LYS A 74 0.617 11.270 -5.426 1.00 0.00 C ATOM 1170 CE LYS A 74 -0.608 12.159 -5.650 1.00 0.00 C ATOM 1171 NZ LYS A 74 -0.940 12.857 -4.399 1.00 0.00 N ATOM 0 H LYS A 74 3.924 9.995 -8.278 1.00 0.00 H new ATOM 0 HA LYS A 74 3.424 10.701 -5.416 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.061 8.709 -7.263 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.786 8.818 -5.536 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.213 11.078 -7.484 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.022 9.899 -6.973 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.443 10.618 -4.570 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.480 11.891 -5.184 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.407 12.882 -6.440 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.454 11.555 -5.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -1.847 13.354 -4.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -1.016 12.166 -3.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.193 13.545 -4.177 1.00 0.00 H new ATOM 1185 N PRO A 75 4.890 8.729 -4.677 1.00 0.00 N ATOM 1186 CA PRO A 75 5.810 7.651 -4.290 1.00 0.00 C ATOM 1187 C PRO A 75 5.098 6.298 -4.304 1.00 0.00 C ATOM 1188 O PRO A 75 3.993 6.126 -3.790 1.00 0.00 O ATOM 1189 CB PRO A 75 6.343 8.045 -2.910 1.00 0.00 C ATOM 1190 CG PRO A 75 5.241 8.938 -2.338 1.00 0.00 C ATOM 1191 CD PRO A 75 4.654 9.652 -3.558 1.00 0.00 C ATOM 0 HA PRO A 75 6.637 7.533 -4.990 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.516 7.170 -2.283 1.00 0.00 H new ATOM 0 HB3 PRO A 75 7.292 8.577 -2.984 1.00 0.00 H new ATOM 0 HG2 PRO A 75 4.483 8.351 -1.819 1.00 0.00 H new ATOM 0 HG3 PRO A 75 5.642 9.650 -1.616 1.00 0.00 H new ATOM 0 HD2 PRO A 75 3.591 9.852 -3.427 1.00 0.00 H new ATOM 0 HD3 PRO A 75 5.140 10.613 -3.727 1.00 0.00 H new ATOM 1199 N VAL A 76 5.644 5.479 -5.200 1.00 0.00 N ATOM 1200 CA VAL A 76 5.098 4.146 -5.494 1.00 0.00 C ATOM 1201 C VAL A 76 6.187 3.111 -5.203 1.00 0.00 C ATOM 1202 O VAL A 76 7.122 2.941 -5.983 1.00 0.00 O ATOM 1203 CB VAL A 76 4.651 4.053 -6.954 1.00 0.00 C ATOM 1204 CG1 VAL A 76 3.978 2.708 -7.232 1.00 0.00 C ATOM 1205 CG2 VAL A 76 3.685 5.159 -7.385 1.00 0.00 C ATOM 0 H VAL A 76 6.474 5.715 -5.744 1.00 0.00 H new ATOM 0 HA VAL A 76 4.224 3.959 -4.870 1.00 0.00 H new ATOM 0 HB VAL A 76 5.568 4.166 -7.532 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.669 2.665 -8.276 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.681 1.900 -7.028 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.104 2.599 -6.590 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.417 5.020 -8.432 1.00 0.00 H new ATOM 0 HG22 VAL A 76 2.785 5.115 -6.772 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.164 6.130 -7.258 1.00 0.00 H new ATOM 1215 N GLU A 77 5.878 2.308 -4.188 1.00 0.00 N ATOM 1216 CA GLU A 77 6.779 1.259 -3.691 1.00 0.00 C ATOM 1217 C GLU A 77 6.071 -0.093 -3.600 1.00 0.00 C ATOM 1218 O GLU A 77 4.850 -0.208 -3.498 1.00 0.00 O ATOM 1219 CB GLU A 77 7.306 1.624 -2.301 1.00 0.00 C ATOM 1220 CG GLU A 77 8.189 2.872 -2.229 1.00 0.00 C ATOM 1221 CD GLU A 77 9.516 2.782 -2.986 1.00 0.00 C ATOM 1222 OE1 GLU A 77 10.399 2.029 -2.523 1.00 0.00 O ATOM 1223 OE2 GLU A 77 9.699 3.615 -3.900 1.00 0.00 O ATOM 0 H GLU A 77 4.994 2.363 -3.682 1.00 0.00 H new ATOM 0 HA GLU A 77 7.603 1.182 -4.400 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.454 1.766 -1.636 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.874 0.778 -1.915 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.624 3.719 -2.619 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.402 3.086 -1.182 1.00 0.00 H new ATOM 1230 N VAL A 78 6.905 -1.128 -3.680 1.00 0.00 N ATOM 1231 CA VAL A 78 6.486 -2.532 -3.561 1.00 0.00 C ATOM 1232 C VAL A 78 6.700 -2.999 -2.120 1.00 0.00 C ATOM 1233 O VAL A 78 7.699 -2.676 -1.478 1.00 0.00 O ATOM 1234 CB VAL A 78 7.295 -3.391 -4.534 1.00 0.00 C ATOM 1235 CG1 VAL A 78 6.864 -4.858 -4.504 1.00 0.00 C ATOM 1236 CG2 VAL A 78 7.189 -2.915 -5.985 1.00 0.00 C ATOM 0 H VAL A 78 7.908 -1.018 -3.832 1.00 0.00 H new ATOM 0 HA VAL A 78 5.429 -2.630 -3.810 1.00 0.00 H new ATOM 0 HB VAL A 78 8.325 -3.290 -4.192 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.466 -5.429 -5.211 1.00 0.00 H new ATOM 0 HG12 VAL A 78 7.006 -5.258 -3.500 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.812 -4.934 -4.779 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.785 -3.565 -6.626 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.147 -2.948 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.560 -1.893 -6.061 1.00 0.00 H new ATOM 1246 N ILE A 79 5.742 -3.774 -1.620 1.00 0.00 N ATOM 1247 CA ILE A 79 5.836 -4.455 -0.320 1.00 0.00 C ATOM 1248 C ILE A 79 6.799 -5.636 -0.476 1.00 0.00 C ATOM 1249 O ILE A 79 6.625 -6.490 -1.342 1.00 0.00 O ATOM 1250 CB ILE A 79 4.465 -4.949 0.148 1.00 0.00 C ATOM 1251 CG1 ILE A 79 3.474 -3.788 0.253 1.00 0.00 C ATOM 1252 CG2 ILE A 79 4.575 -5.654 1.501 1.00 0.00 C ATOM 1253 CD1 ILE A 79 2.022 -4.233 0.059 1.00 0.00 C ATOM 0 H ILE A 79 4.864 -3.953 -2.108 1.00 0.00 H new ATOM 0 HA ILE A 79 6.202 -3.757 0.433 1.00 0.00 H new ATOM 0 HB ILE A 79 4.099 -5.659 -0.593 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.577 -3.314 1.229 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.722 -3.035 -0.495 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.589 -5.997 1.814 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.245 -6.509 1.412 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.970 -4.959 2.242 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.362 -3.369 0.144 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.908 -4.682 -0.928 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.761 -4.965 0.823 1.00 0.00 H new ATOM 1265 N ASP A 80 7.752 -5.675 0.450 1.00 0.00 N ATOM 1266 CA ASP A 80 8.722 -6.775 0.559 1.00 0.00 C ATOM 1267 C ASP A 80 8.040 -8.132 0.741 1.00 0.00 C ATOM 1268 O ASP A 80 7.141 -8.324 1.558 1.00 0.00 O ATOM 1269 CB ASP A 80 9.699 -6.504 1.706 1.00 0.00 C ATOM 1270 CG ASP A 80 10.631 -7.697 1.928 1.00 0.00 C ATOM 1271 OD1 ASP A 80 11.417 -7.999 1.004 1.00 0.00 O ATOM 1272 OD2 ASP A 80 10.342 -8.446 2.885 1.00 0.00 O ATOM 0 H ASP A 80 7.879 -4.945 1.151 1.00 0.00 H new ATOM 0 HA ASP A 80 9.274 -6.820 -0.380 1.00 0.00 H new ATOM 0 HB2 ASP A 80 10.288 -5.614 1.484 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.143 -6.298 2.621 1.00 0.00 H new ATOM 1277 N SER A 81 8.520 -9.045 -0.098 1.00 0.00 N ATOM 1278 CA SER A 81 8.069 -10.441 -0.182 1.00 0.00 C ATOM 1279 C SER A 81 7.980 -11.145 1.173 1.00 0.00 C ATOM 1280 O SER A 81 6.918 -11.629 1.562 1.00 0.00 O ATOM 1281 CB SER A 81 9.016 -11.207 -1.110 1.00 0.00 C ATOM 1282 OG SER A 81 8.668 -12.592 -1.170 1.00 0.00 O ATOM 0 H SER A 81 9.261 -8.831 -0.765 1.00 0.00 H new ATOM 0 HA SER A 81 7.053 -10.429 -0.577 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.978 -10.776 -2.110 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.042 -11.101 -0.756 1.00 0.00 H new ATOM 0 HG SER A 81 9.286 -13.059 -1.770 1.00 0.00 H new ATOM 1288 N LEU A 82 9.029 -10.992 1.977 1.00 0.00 N ATOM 1289 CA LEU A 82 9.157 -11.635 3.292 1.00 0.00 C ATOM 1290 C LEU A 82 8.190 -11.039 4.317 1.00 0.00 C ATOM 1291 O LEU A 82 7.509 -11.792 5.011 1.00 0.00 O ATOM 1292 CB LEU A 82 10.629 -11.510 3.689 1.00 0.00 C ATOM 1293 CG LEU A 82 10.951 -12.069 5.078 1.00 0.00 C ATOM 1294 CD1 LEU A 82 10.745 -13.583 5.150 1.00 0.00 C ATOM 1295 CD2 LEU A 82 12.391 -11.751 5.483 1.00 0.00 C ATOM 0 H LEU A 82 9.830 -10.409 1.734 1.00 0.00 H new ATOM 0 HA LEU A 82 8.875 -12.687 3.252 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.239 -12.029 2.950 1.00 0.00 H new ATOM 0 HB3 LEU A 82 10.915 -10.459 3.657 1.00 0.00 H new ATOM 0 HG LEU A 82 10.259 -11.586 5.768 1.00 0.00 H new ATOM 0 HD11 LEU A 82 10.985 -13.936 6.153 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.706 -13.820 4.921 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.397 -14.074 4.427 1.00 0.00 H new ATOM 0 HD21 LEU A 82 12.589 -12.161 6.473 1.00 0.00 H new ATOM 0 HD22 LEU A 82 13.078 -12.195 4.762 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.533 -10.671 5.502 1.00 0.00 H new ATOM 1307 N LEU A 83 8.062 -9.716 4.360 1.00 0.00 N ATOM 1308 CA LEU A 83 7.089 -9.010 5.207 1.00 0.00 C ATOM 1309 C LEU A 83 5.642 -9.398 4.897 1.00 0.00 C ATOM 1310 O LEU A 83 4.826 -9.510 5.811 1.00 0.00 O ATOM 1311 CB LEU A 83 7.188 -7.491 5.056 1.00 0.00 C ATOM 1312 CG LEU A 83 8.479 -6.885 5.610 1.00 0.00 C ATOM 1313 CD1 LEU A 83 8.455 -5.372 5.387 1.00 0.00 C ATOM 1314 CD2 LEU A 83 8.667 -7.169 7.101 1.00 0.00 C ATOM 0 H LEU A 83 8.639 -9.088 3.800 1.00 0.00 H new ATOM 0 HA LEU A 83 7.343 -9.310 6.223 1.00 0.00 H new ATOM 0 HB2 LEU A 83 7.106 -7.237 3.999 1.00 0.00 H new ATOM 0 HB3 LEU A 83 6.339 -7.031 5.562 1.00 0.00 H new ATOM 0 HG LEU A 83 9.313 -7.346 5.081 1.00 0.00 H new ATOM 0 HD11 LEU A 83 9.372 -4.932 5.779 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.379 -5.163 4.320 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.597 -4.942 5.903 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.598 -6.717 7.443 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.832 -6.747 7.660 1.00 0.00 H new ATOM 0 HD23 LEU A 83 8.705 -8.246 7.264 1.00 0.00 H new ATOM 1326 N TYR A 84 5.358 -9.573 3.610 1.00 0.00 N ATOM 1327 CA TYR A 84 4.049 -9.998 3.089 1.00 0.00 C ATOM 1328 C TYR A 84 3.749 -11.450 3.467 1.00 0.00 C ATOM 1329 O TYR A 84 2.679 -11.721 4.010 1.00 0.00 O ATOM 1330 CB TYR A 84 3.998 -9.818 1.572 1.00 0.00 C ATOM 1331 CG TYR A 84 2.579 -9.814 0.999 1.00 0.00 C ATOM 1332 CD1 TYR A 84 1.972 -11.012 0.643 1.00 0.00 C ATOM 1333 CD2 TYR A 84 1.968 -8.595 0.732 1.00 0.00 C ATOM 1334 CE1 TYR A 84 0.752 -10.992 -0.024 1.00 0.00 C ATOM 1335 CE2 TYR A 84 0.750 -8.564 0.062 1.00 0.00 C ATOM 1336 CZ TYR A 84 0.158 -9.768 -0.306 1.00 0.00 C ATOM 1337 OH TYR A 84 -0.956 -9.765 -1.088 1.00 0.00 O ATOM 0 H TYR A 84 6.047 -9.420 2.874 1.00 0.00 H new ATOM 0 HA TYR A 84 3.283 -9.369 3.543 1.00 0.00 H new ATOM 0 HB2 TYR A 84 4.489 -8.881 1.310 1.00 0.00 H new ATOM 0 HB3 TYR A 84 4.568 -10.619 1.101 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.445 -11.953 0.883 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.438 -7.674 1.044 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.273 -11.914 -0.318 1.00 0.00 H new ATOM 0 HE2 TYR A 84 0.273 -7.623 -0.168 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.659 -9.237 -0.654 1.00 0.00 H new ATOM 1347 N GLY A 85 4.722 -12.340 3.297 1.00 0.00 N ATOM 1348 CA GLY A 85 4.638 -13.758 3.678 1.00 0.00 C ATOM 1349 C GLY A 85 4.458 -13.960 5.185 1.00 0.00 C ATOM 1350 O GLY A 85 3.784 -14.888 5.628 1.00 0.00 O ATOM 0 H GLY A 85 5.619 -12.094 2.879 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.803 -14.222 3.152 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.544 -14.271 3.353 1.00 0.00 H new ATOM 1354 N LYS A 86 5.103 -13.086 5.953 1.00 0.00 N ATOM 1355 CA LYS A 86 5.046 -13.054 7.421 1.00 0.00 C ATOM 1356 C LYS A 86 3.820 -12.312 7.957 1.00 0.00 C ATOM 1357 O LYS A 86 3.426 -12.497 9.108 1.00 0.00 O ATOM 1358 CB LYS A 86 6.342 -12.373 7.865 1.00 0.00 C ATOM 1359 CG LYS A 86 6.762 -12.701 9.299 1.00 0.00 C ATOM 1360 CD LYS A 86 8.122 -12.093 9.648 1.00 0.00 C ATOM 1361 CE LYS A 86 8.080 -10.568 9.768 1.00 0.00 C ATOM 1362 NZ LYS A 86 9.385 -10.048 10.200 1.00 0.00 N ATOM 0 H LYS A 86 5.700 -12.356 5.564 1.00 0.00 H new ATOM 0 HA LYS A 86 4.952 -14.064 7.820 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.144 -12.666 7.187 1.00 0.00 H new ATOM 0 HB3 LYS A 86 6.223 -11.294 7.771 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.009 -12.327 9.992 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.804 -13.783 9.427 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.473 -12.517 10.589 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.846 -12.372 8.883 1.00 0.00 H new ATOM 0 HE2 LYS A 86 7.807 -10.129 8.808 1.00 0.00 H new ATOM 0 HE3 LYS A 86 7.311 -10.275 10.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 9.338 -9.012 10.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 9.630 -10.452 11.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.111 -10.311 9.504 1.00 0.00 H new ATOM 1376 N VAL A 87 3.201 -11.524 7.083 1.00 0.00 N ATOM 1377 CA VAL A 87 2.090 -10.592 7.322 1.00 0.00 C ATOM 1378 C VAL A 87 2.335 -9.756 8.580 1.00 0.00 C ATOM 1379 O VAL A 87 1.574 -9.748 9.547 1.00 0.00 O ATOM 1380 CB VAL A 87 0.723 -11.281 7.342 1.00 0.00 C ATOM 1381 CG1 VAL A 87 -0.404 -10.252 7.227 1.00 0.00 C ATOM 1382 CG2 VAL A 87 0.528 -12.289 6.208 1.00 0.00 C ATOM 0 H VAL A 87 3.484 -11.516 6.103 1.00 0.00 H new ATOM 0 HA VAL A 87 2.061 -9.911 6.471 1.00 0.00 H new ATOM 0 HB VAL A 87 0.690 -11.812 8.293 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.367 -10.763 7.243 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -0.348 -9.556 8.064 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.301 -9.702 6.291 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.462 -12.737 6.286 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.621 -11.780 5.249 1.00 0.00 H new ATOM 0 HG23 VAL A 87 1.286 -13.069 6.280 1.00 0.00 H new ATOM 1392 N ASP A 88 3.384 -8.946 8.460 1.00 0.00 N ATOM 1393 CA ASP A 88 3.849 -8.047 9.526 1.00 0.00 C ATOM 1394 C ASP A 88 3.406 -6.612 9.234 1.00 0.00 C ATOM 1395 O ASP A 88 4.024 -5.842 8.500 1.00 0.00 O ATOM 1396 CB ASP A 88 5.370 -8.159 9.648 1.00 0.00 C ATOM 1397 CG ASP A 88 5.889 -7.500 10.927 1.00 0.00 C ATOM 1398 OD1 ASP A 88 6.024 -6.257 10.933 1.00 0.00 O ATOM 1399 OD2 ASP A 88 6.185 -8.270 11.866 1.00 0.00 O ATOM 0 H ASP A 88 3.946 -8.891 7.610 1.00 0.00 H new ATOM 0 HA ASP A 88 3.406 -8.336 10.479 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.659 -9.210 9.638 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.839 -7.691 8.782 1.00 0.00 H new ATOM 1404 N GLY A 89 2.250 -6.320 9.825 1.00 0.00 N ATOM 1405 CA GLY A 89 1.533 -5.051 9.638 1.00 0.00 C ATOM 1406 C GLY A 89 2.364 -3.814 9.983 1.00 0.00 C ATOM 1407 O GLY A 89 2.513 -2.919 9.152 1.00 0.00 O ATOM 0 H GLY A 89 1.774 -6.964 10.457 1.00 0.00 H new ATOM 0 HA2 GLY A 89 1.206 -4.979 8.601 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.635 -5.058 10.256 1.00 0.00 H new ATOM 1411 N LEU A 90 3.085 -3.904 11.097 1.00 0.00 N ATOM 1412 CA LEU A 90 3.875 -2.782 11.627 1.00 0.00 C ATOM 1413 C LEU A 90 5.052 -2.424 10.716 1.00 0.00 C ATOM 1414 O LEU A 90 5.280 -1.251 10.429 1.00 0.00 O ATOM 1415 CB LEU A 90 4.331 -3.143 13.042 1.00 0.00 C ATOM 1416 CG LEU A 90 5.181 -2.048 13.689 1.00 0.00 C ATOM 1417 CD1 LEU A 90 4.415 -0.737 13.882 1.00 0.00 C ATOM 1418 CD2 LEU A 90 5.727 -2.528 15.035 1.00 0.00 C ATOM 0 H LEU A 90 3.142 -4.752 11.661 1.00 0.00 H new ATOM 0 HA LEU A 90 3.255 -1.886 11.663 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.456 -3.332 13.664 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.904 -4.069 13.009 1.00 0.00 H new ATOM 0 HG LEU A 90 6.003 -1.844 13.003 1.00 0.00 H new ATOM 0 HD11 LEU A 90 5.069 0.002 14.345 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.077 -0.367 12.914 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.552 -0.911 14.525 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.330 -1.739 15.485 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.897 -2.773 15.698 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.343 -3.414 14.883 1.00 0.00 H new ATOM 1430 N GLY A 91 5.757 -3.445 10.235 1.00 0.00 N ATOM 1431 CA GLY A 91 6.880 -3.351 9.291 1.00 0.00 C ATOM 1432 C GLY A 91 6.494 -2.591 8.021 1.00 0.00 C ATOM 1433 O GLY A 91 7.073 -1.550 7.714 1.00 0.00 O ATOM 0 H GLY A 91 5.555 -4.408 10.502 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.719 -2.850 9.773 1.00 0.00 H new ATOM 0 HA3 GLY A 91 7.217 -4.353 9.026 1.00 0.00 H new ATOM 1437 N VAL A 92 5.356 -2.989 7.460 1.00 0.00 N ATOM 1438 CA VAL A 92 4.801 -2.391 6.238 1.00 0.00 C ATOM 1439 C VAL A 92 4.302 -0.970 6.506 1.00 0.00 C ATOM 1440 O VAL A 92 4.597 -0.058 5.735 1.00 0.00 O ATOM 1441 CB VAL A 92 3.696 -3.279 5.661 1.00 0.00 C ATOM 1442 CG1 VAL A 92 3.143 -2.730 4.345 1.00 0.00 C ATOM 1443 CG2 VAL A 92 4.197 -4.694 5.368 1.00 0.00 C ATOM 0 H VAL A 92 4.783 -3.743 7.840 1.00 0.00 H new ATOM 0 HA VAL A 92 5.594 -2.322 5.493 1.00 0.00 H new ATOM 0 HB VAL A 92 2.918 -3.295 6.424 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.362 -3.393 3.974 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.727 -1.737 4.512 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.946 -2.668 3.610 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.382 -5.291 4.960 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.011 -4.649 4.645 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.556 -5.151 6.290 1.00 0.00 H new ATOM 1453 N LEU A 93 3.674 -0.756 7.659 1.00 0.00 N ATOM 1454 CA LEU A 93 3.179 0.559 8.089 1.00 0.00 C ATOM 1455 C LEU A 93 4.329 1.560 8.220 1.00 0.00 C ATOM 1456 O LEU A 93 4.297 2.637 7.627 1.00 0.00 O ATOM 1457 CB LEU A 93 2.443 0.413 9.422 1.00 0.00 C ATOM 1458 CG LEU A 93 1.680 1.666 9.856 1.00 0.00 C ATOM 1459 CD1 LEU A 93 0.488 1.965 8.945 1.00 0.00 C ATOM 1460 CD2 LEU A 93 1.193 1.533 11.300 1.00 0.00 C ATOM 0 H LEU A 93 3.490 -1.498 8.334 1.00 0.00 H new ATOM 0 HA LEU A 93 2.490 0.940 7.335 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.742 -0.419 9.348 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.165 0.154 10.197 1.00 0.00 H new ATOM 0 HG LEU A 93 2.381 2.497 9.780 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.021 2.863 9.295 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.840 2.121 7.925 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.205 1.124 8.965 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.653 2.436 11.587 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.530 0.672 11.382 1.00 0.00 H new ATOM 0 HD23 LEU A 93 2.049 1.396 11.961 1.00 0.00 H new ATOM 1472 N LYS A 94 5.418 1.104 8.832 1.00 0.00 N ATOM 1473 CA LYS A 94 6.658 1.879 8.980 1.00 0.00 C ATOM 1474 C LYS A 94 7.300 2.211 7.631 1.00 0.00 C ATOM 1475 O LYS A 94 7.678 3.363 7.422 1.00 0.00 O ATOM 1476 CB LYS A 94 7.676 1.112 9.827 1.00 0.00 C ATOM 1477 CG LYS A 94 7.394 1.275 11.322 1.00 0.00 C ATOM 1478 CD LYS A 94 8.370 0.465 12.177 1.00 0.00 C ATOM 1479 CE LYS A 94 8.275 0.823 13.661 1.00 0.00 C ATOM 1480 NZ LYS A 94 9.195 -0.033 14.424 1.00 0.00 N ATOM 0 H LYS A 94 5.470 0.174 9.247 1.00 0.00 H new ATOM 0 HA LYS A 94 6.381 2.811 9.472 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.648 0.055 9.563 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.681 1.470 9.604 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.463 2.329 11.592 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.374 0.957 11.536 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.167 -0.598 12.048 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.388 0.640 11.828 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.527 1.873 13.811 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.253 0.687 14.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.134 0.206 15.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.934 -1.031 14.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.168 0.119 14.090 1.00 0.00 H new ATOM 1494 N ALA A 95 7.281 1.253 6.709 1.00 0.00 N ATOM 1495 CA ALA A 95 7.821 1.438 5.355 1.00 0.00 C ATOM 1496 C ALA A 95 7.017 2.461 4.549 1.00 0.00 C ATOM 1497 O ALA A 95 7.578 3.418 4.018 1.00 0.00 O ATOM 1498 CB ALA A 95 7.824 0.080 4.650 1.00 0.00 C ATOM 0 H ALA A 95 6.892 0.325 6.874 1.00 0.00 H new ATOM 0 HA ALA A 95 8.835 1.831 5.430 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.222 0.194 3.642 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.447 -0.619 5.209 1.00 0.00 H new ATOM 0 HB3 ALA A 95 6.805 -0.305 4.597 1.00 0.00 H new ATOM 1504 N ALA A 96 5.702 2.415 4.743 1.00 0.00 N ATOM 1505 CA ALA A 96 4.736 3.333 4.125 1.00 0.00 C ATOM 1506 C ALA A 96 4.918 4.775 4.603 1.00 0.00 C ATOM 1507 O ALA A 96 5.217 5.671 3.815 1.00 0.00 O ATOM 1508 CB ALA A 96 3.329 2.832 4.456 1.00 0.00 C ATOM 0 H ALA A 96 5.262 1.722 5.349 1.00 0.00 H new ATOM 0 HA ALA A 96 4.899 3.344 3.047 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.591 3.497 4.008 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.198 1.825 4.059 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.194 2.816 5.537 1.00 0.00 H new ATOM 1514 N VAL A 97 5.049 4.925 5.919 1.00 0.00 N ATOM 1515 CA VAL A 97 5.268 6.206 6.605 1.00 0.00 C ATOM 1516 C VAL A 97 6.635 6.782 6.235 1.00 0.00 C ATOM 1517 O VAL A 97 6.794 7.989 6.063 1.00 0.00 O ATOM 1518 CB VAL A 97 5.103 5.890 8.094 1.00 0.00 C ATOM 1519 CG1 VAL A 97 5.673 6.978 9.006 1.00 0.00 C ATOM 1520 CG2 VAL A 97 3.628 5.730 8.468 1.00 0.00 C ATOM 0 H VAL A 97 5.005 4.135 6.563 1.00 0.00 H new ATOM 0 HA VAL A 97 4.562 6.983 6.313 1.00 0.00 H new ATOM 0 HB VAL A 97 5.655 4.962 8.245 1.00 0.00 H new ATOM 0 HG11 VAL A 97 5.525 6.694 10.048 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.739 7.095 8.810 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.162 7.921 8.811 1.00 0.00 H new ATOM 0 HG21 VAL A 97 3.545 5.506 9.532 1.00 0.00 H new ATOM 0 HG22 VAL A 97 3.095 6.655 8.249 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.193 4.915 7.890 1.00 0.00 H new ATOM 1530 N ALA A 98 7.611 5.883 6.143 1.00 0.00 N ATOM 1531 CA ALA A 98 8.995 6.187 5.750 1.00 0.00 C ATOM 1532 C ALA A 98 9.051 6.729 4.321 1.00 0.00 C ATOM 1533 O ALA A 98 9.712 7.737 4.077 1.00 0.00 O ATOM 1534 CB ALA A 98 9.833 4.909 5.825 1.00 0.00 C ATOM 0 H ALA A 98 7.463 4.894 6.344 1.00 0.00 H new ATOM 0 HA ALA A 98 9.388 6.943 6.430 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.860 5.130 5.534 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.819 4.524 6.845 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.418 4.161 5.149 1.00 0.00 H new ATOM 1540 N ALA A 99 8.260 6.137 3.429 1.00 0.00 N ATOM 1541 CA ALA A 99 8.148 6.550 2.024 1.00 0.00 C ATOM 1542 C ALA A 99 7.471 7.913 1.867 1.00 0.00 C ATOM 1543 O ALA A 99 8.005 8.790 1.190 1.00 0.00 O ATOM 1544 CB ALA A 99 7.377 5.475 1.255 1.00 0.00 C ATOM 0 H ALA A 99 7.666 5.341 3.663 1.00 0.00 H new ATOM 0 HA ALA A 99 9.154 6.657 1.618 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.287 5.770 0.209 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.911 4.527 1.320 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.383 5.361 1.687 1.00 0.00 H new ATOM 1550 N ILE A 100 6.449 8.157 2.683 1.00 0.00 N ATOM 1551 CA ILE A 100 5.764 9.455 2.774 1.00 0.00 C ATOM 1552 C ILE A 100 6.785 10.522 3.173 1.00 0.00 C ATOM 1553 O ILE A 100 6.830 11.616 2.613 1.00 0.00 O ATOM 1554 CB ILE A 100 4.615 9.346 3.778 1.00 0.00 C ATOM 1555 CG1 ILE A 100 3.531 8.387 3.284 1.00 0.00 C ATOM 1556 CG2 ILE A 100 4.021 10.720 4.094 1.00 0.00 C ATOM 1557 CD1 ILE A 100 2.507 7.970 4.342 1.00 0.00 C ATOM 0 H ILE A 100 6.063 7.452 3.311 1.00 0.00 H new ATOM 0 HA ILE A 100 5.335 9.743 1.814 1.00 0.00 H new ATOM 0 HB ILE A 100 5.028 8.937 4.700 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.003 8.856 2.454 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.011 7.491 2.891 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.207 10.608 4.810 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.793 11.361 4.519 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.639 11.171 3.178 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.780 7.291 3.897 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.017 7.468 5.164 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.993 8.854 4.720 1.00 0.00 H new ATOM 1569 N LYS A 101 7.555 10.207 4.210 1.00 0.00 N ATOM 1570 CA LYS A 101 8.645 11.079 4.672 1.00 0.00 C ATOM 1571 C LYS A 101 9.817 11.222 3.700 1.00 0.00 C ATOM 1572 O LYS A 101 10.298 12.348 3.586 1.00 0.00 O ATOM 1573 CB LYS A 101 9.166 10.620 6.035 1.00 0.00 C ATOM 1574 CG LYS A 101 8.253 11.194 7.120 1.00 0.00 C ATOM 1575 CD LYS A 101 8.868 10.890 8.487 1.00 0.00 C ATOM 1576 CE LYS A 101 8.127 11.584 9.632 1.00 0.00 C ATOM 1577 NZ LYS A 101 8.315 13.040 9.554 1.00 0.00 N ATOM 0 H LYS A 101 7.448 9.350 4.753 1.00 0.00 H new ATOM 0 HA LYS A 101 8.193 12.068 4.745 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.180 9.531 6.088 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.191 10.960 6.183 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.138 12.270 6.988 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.258 10.756 7.047 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.860 9.813 8.654 1.00 0.00 H new ATOM 0 HD3 LYS A 101 9.911 11.205 8.490 1.00 0.00 H new ATOM 0 HE2 LYS A 101 7.065 11.345 9.584 1.00 0.00 H new ATOM 0 HE3 LYS A 101 8.495 11.214 10.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.001 13.479 10.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.321 13.252 9.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.756 13.420 8.764 1.00 0.00 H new ATOM 1591 N LYS A 102 10.082 10.225 2.860 1.00 0.00 N ATOM 1592 CA LYS A 102 11.133 10.316 1.838 1.00 0.00 C ATOM 1593 C LYS A 102 10.635 11.003 0.565 1.00 0.00 C ATOM 1594 O LYS A 102 11.199 10.904 -0.524 1.00 0.00 O ATOM 1595 CB LYS A 102 11.599 8.884 1.567 1.00 0.00 C ATOM 1596 CG LYS A 102 12.940 8.845 0.834 1.00 0.00 C ATOM 1597 CD LYS A 102 13.117 7.515 0.097 1.00 0.00 C ATOM 1598 CE LYS A 102 14.493 7.431 -0.568 1.00 0.00 C ATOM 1599 NZ LYS A 102 14.566 6.205 -1.375 1.00 0.00 N ATOM 0 H LYS A 102 9.582 9.336 2.864 1.00 0.00 H new ATOM 0 HA LYS A 102 11.960 10.932 2.190 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.687 8.347 2.511 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.847 8.365 0.974 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.996 9.670 0.124 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.753 8.982 1.546 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.998 6.689 0.798 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.338 7.408 -0.658 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.660 8.305 -1.197 1.00 0.00 H new ATOM 0 HE3 LYS A 102 15.277 7.429 0.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.500 6.143 -1.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 14.424 5.377 -0.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.826 6.226 -2.106 1.00 0.00 H new ATOM 1613 N ALA A 103 9.459 11.603 0.731 1.00 0.00 N ATOM 1614 CA ALA A 103 8.784 12.447 -0.266 1.00 0.00 C ATOM 1615 C ALA A 103 8.578 13.873 0.248 1.00 0.00 C ATOM 1616 O ALA A 103 8.790 14.843 -0.479 1.00 0.00 O ATOM 1617 CB ALA A 103 7.438 11.828 -0.646 1.00 0.00 C ATOM 0 H ALA A 103 8.925 11.515 1.595 1.00 0.00 H new ATOM 0 HA ALA A 103 9.423 12.501 -1.147 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.943 12.458 -1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 103 7.600 10.835 -1.066 1.00 0.00 H new ATOM 0 HB3 ALA A 103 6.810 11.749 0.242 1.00 0.00 H new ATOM 1623 N ALA A 104 8.008 13.982 1.445 1.00 0.00 N ATOM 1624 CA ALA A 104 7.776 15.250 2.151 1.00 0.00 C ATOM 1625 C ALA A 104 9.036 15.939 2.679 1.00 0.00 C ATOM 1626 O ALA A 104 8.996 17.128 2.992 1.00 0.00 O ATOM 1627 CB ALA A 104 6.855 14.908 3.324 1.00 0.00 C ATOM 0 H ALA A 104 7.683 13.170 1.970 1.00 0.00 H new ATOM 0 HA ALA A 104 7.351 15.962 1.444 1.00 0.00 H new ATOM 0 HB1 ALA A 104 6.641 15.812 3.894 1.00 0.00 H new ATOM 0 HB2 ALA A 104 5.923 14.489 2.945 1.00 0.00 H new ATOM 0 HB3 ALA A 104 7.344 14.179 3.970 1.00 0.00 H new ATOM 1633 N ALA A 105 10.090 15.159 2.905 1.00 0.00 N ATOM 1634 CA ALA A 105 11.309 15.563 3.620 1.00 0.00 C ATOM 1635 C ALA A 105 12.426 14.562 3.317 1.00 0.00 C ATOM 1636 O ALA A 105 12.297 13.750 2.401 1.00 0.00 O ATOM 1637 CB ALA A 105 10.946 15.546 5.106 1.00 0.00 C ATOM 0 H ALA A 105 10.125 14.191 2.585 1.00 0.00 H new ATOM 0 HA ALA A 105 11.662 16.549 3.319 1.00 0.00 H new ATOM 0 HB1 ALA A 105 11.814 15.839 5.696 1.00 0.00 H new ATOM 0 HB2 ALA A 105 10.130 16.245 5.289 1.00 0.00 H new ATOM 0 HB3 ALA A 105 10.634 14.542 5.393 1.00 0.00 H new ATOM 1643 N ASN A 106 13.501 14.700 4.087 1.00 0.00 N ATOM 1644 CA ASN A 106 14.648 13.786 4.195 1.00 0.00 C ATOM 1645 C ASN A 106 15.593 13.856 2.993 1.00 0.00 C ATOM 1646 O ASN A 106 15.415 14.778 2.169 1.00 0.00 O ATOM 1647 CB ASN A 106 14.207 12.345 4.458 1.00 0.00 C ATOM 1648 CG ASN A 106 13.443 12.174 5.773 1.00 0.00 C ATOM 1649 OD1 ASN A 106 12.321 11.675 5.846 1.00 0.00 O ATOM 1650 ND2 ASN A 106 14.063 12.521 6.897 1.00 0.00 N ATOM 1651 OXT ASN A 106 16.580 13.089 3.005 1.00 0.00 O ATOM 0 H ASN A 106 13.607 15.510 4.698 1.00 0.00 H new ATOM 0 HA ASN A 106 15.215 14.132 5.059 1.00 0.00 H new ATOM 0 HB2 ASN A 106 13.577 12.009 3.634 1.00 0.00 H new ATOM 0 HB3 ASN A 106 15.086 11.700 4.470 1.00 0.00 H new ATOM 0 HD21 ASN A 106 13.608 12.372 7.798 1.00 0.00 H new ATOM 0 HD22 ASN A 106 14.994 12.936 6.859 1.00 0.00 H new TER 1658 ASN A 106