USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 738 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 111:sc= 1.3 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -130:sc= 0 (180deg=-0.985) USER MOD Single : A 52 SER OG : rot -16:sc= 1.2 USER MOD Single : A 53 LYS NZ :NH3+ -125:sc= 0.731 (180deg=-0.0112) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.11 K(o=-0.11,f=-1.2!) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0.567 K(o=0.57,f=-4.7!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0.727 K(o=0.73,f=-0.082) USER MOD Single : A 72 MET CE :methyl -169:sc= -0.0823 (180deg=-0.212) USER MOD Single : A 78 ASN : amide:sc= 1.2 K(o=1.2,f=-6.7!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 94:sc= 1.23 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl -130:sc= 0 (180deg=-0.983) USER MOD Single : B 52 SER OG : rot -38:sc= 1.19 USER MOD Single : B 53 LYS NZ :NH3+ -124:sc= 0.729 (180deg=-0.0161) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -0.136 K(o=-0.14,f=-1.3!) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0.581 K(o=0.58,f=-4.7!) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 GLN : amide:sc= 0.722 K(o=0.72,f=-0.075) USER MOD Single : B 72 MET CE :methyl -168:sc= -0.0879 (180deg=-0.216) USER MOD Single : B 78 ASN : amide:sc= 1.21 K(o=1.2,f=-6.5!) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 15.933 -8.023 -51.243 1.00 0.00 N ATOM 2 CA ASP A 38 15.421 -8.505 -49.965 1.00 0.00 C ATOM 3 C ASP A 38 14.690 -7.400 -49.214 1.00 0.00 C ATOM 4 O ASP A 38 13.903 -7.669 -48.306 1.00 0.00 O ATOM 5 CB ASP A 38 16.561 -9.050 -49.102 1.00 0.00 C ATOM 6 CG ASP A 38 17.215 -10.289 -49.697 1.00 0.00 C ATOM 7 OD1 ASP A 38 16.511 -11.101 -50.250 1.00 0.00 O ATOM 8 OD2 ASP A 38 18.412 -10.412 -49.593 1.00 0.00 O ATOM 0 HA ASP A 38 14.714 -9.308 -50.173 1.00 0.00 H new ATOM 0 HB2 ASP A 38 17.315 -8.274 -48.973 1.00 0.00 H new ATOM 0 HB3 ASP A 38 16.177 -9.289 -48.110 1.00 0.00 H new ATOM 13 N TYR A 39 14.954 -6.155 -49.597 1.00 0.00 N ATOM 14 CA TYR A 39 14.386 -5.004 -48.906 1.00 0.00 C ATOM 15 C TYR A 39 13.003 -4.665 -49.447 1.00 0.00 C ATOM 16 O TYR A 39 12.010 -4.724 -48.721 1.00 0.00 O ATOM 17 CB TYR A 39 15.315 -3.794 -49.028 1.00 0.00 C ATOM 18 CG TYR A 39 14.796 -2.554 -48.335 1.00 0.00 C ATOM 19 CD1 TYR A 39 14.788 -2.485 -46.950 1.00 0.00 C ATOM 20 CD2 TYR A 39 14.329 -1.485 -49.085 1.00 0.00 C ATOM 21 CE1 TYR A 39 14.314 -1.352 -46.317 1.00 0.00 C ATOM 22 CE2 TYR A 39 13.855 -0.352 -48.452 1.00 0.00 C ATOM 23 CZ TYR A 39 13.847 -0.284 -47.074 1.00 0.00 C ATOM 24 OH TYR A 39 13.375 0.844 -46.443 1.00 0.00 O ATOM 0 H TYR A 39 15.559 -5.918 -50.383 1.00 0.00 H new ATOM 0 HA TYR A 39 14.283 -5.263 -47.852 1.00 0.00 H new ATOM 0 HB2 TYR A 39 16.289 -4.052 -48.611 1.00 0.00 H new ATOM 0 HB3 TYR A 39 15.469 -3.571 -50.084 1.00 0.00 H new ATOM 0 HD1 TYR A 39 15.152 -3.317 -46.366 1.00 0.00 H new ATOM 0 HD2 TYR A 39 14.336 -1.538 -50.164 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.306 -1.297 -45.238 1.00 0.00 H new ATOM 0 HE2 TYR A 39 13.491 0.480 -49.036 1.00 0.00 H new ATOM 0 HH TYR A 39 13.087 1.498 -47.114 1.00 0.00 H new ATOM 34 N LEU A 40 12.944 -4.308 -50.725 1.00 0.00 N ATOM 35 CA LEU A 40 11.697 -3.875 -51.343 1.00 0.00 C ATOM 36 C LEU A 40 10.718 -5.034 -51.480 1.00 0.00 C ATOM 37 O LEU A 40 9.522 -4.882 -51.228 1.00 0.00 O ATOM 38 CB LEU A 40 11.973 -3.265 -52.724 1.00 0.00 C ATOM 39 CG LEU A 40 12.714 -1.922 -52.722 1.00 0.00 C ATOM 40 CD1 LEU A 40 13.031 -1.514 -54.154 1.00 0.00 C ATOM 41 CD2 LEU A 40 11.857 -0.871 -52.031 1.00 0.00 C ATOM 0 H LEU A 40 13.747 -4.310 -51.354 1.00 0.00 H new ATOM 0 HA LEU A 40 11.248 -3.121 -50.697 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.555 -3.979 -53.307 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.022 -3.133 -53.239 1.00 0.00 H new ATOM 0 HG LEU A 40 13.653 -2.015 -52.175 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.558 -0.560 -54.152 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.659 -2.274 -54.618 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.104 -1.416 -54.718 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.383 0.084 -52.029 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.912 -0.764 -52.564 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.661 -1.179 -51.004 1.00 0.00 H new ATOM 53 N PRO A 41 11.232 -6.192 -51.880 1.00 0.00 N ATOM 54 CA PRO A 41 10.416 -7.396 -51.986 1.00 0.00 C ATOM 55 C PRO A 41 9.621 -7.637 -50.709 1.00 0.00 C ATOM 56 O PRO A 41 8.457 -8.033 -50.756 1.00 0.00 O ATOM 57 CB PRO A 41 11.456 -8.496 -52.220 1.00 0.00 C ATOM 58 CG PRO A 41 12.552 -7.812 -52.963 1.00 0.00 C ATOM 59 CD PRO A 41 12.662 -6.461 -52.307 1.00 0.00 C ATOM 0 HA PRO A 41 9.668 -7.343 -52.777 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.813 -8.913 -51.278 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.039 -9.322 -52.797 1.00 0.00 H new ATOM 0 HG2 PRO A 41 13.488 -8.366 -52.890 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.317 -7.721 -54.023 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.344 -6.476 -51.457 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.030 -5.702 -52.998 1.00 0.00 H new ATOM 67 N THR A 42 10.258 -7.396 -49.567 1.00 0.00 N ATOM 68 CA THR A 42 9.602 -7.558 -48.275 1.00 0.00 C ATOM 69 C THR A 42 8.532 -6.495 -48.063 1.00 0.00 C ATOM 70 O THR A 42 7.420 -6.797 -47.632 1.00 0.00 O ATOM 71 CB THR A 42 10.623 -7.502 -47.124 1.00 0.00 C ATOM 72 OG1 THR A 42 11.571 -8.567 -47.271 1.00 0.00 O ATOM 73 CG2 THR A 42 9.921 -7.635 -45.781 1.00 0.00 C ATOM 0 H THR A 42 11.229 -7.088 -49.511 1.00 0.00 H new ATOM 0 HA THR A 42 9.126 -8.538 -48.276 1.00 0.00 H new ATOM 0 HB THR A 42 11.136 -6.541 -47.160 1.00 0.00 H new ATOM 0 HG1 THR A 42 12.446 -8.196 -47.511 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.658 -7.593 -44.979 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.208 -6.819 -45.661 1.00 0.00 H new ATOM 0 HG23 THR A 42 9.393 -8.588 -45.739 1.00 0.00 H new ATOM 81 N LEU A 43 8.876 -5.248 -48.368 1.00 0.00 N ATOM 82 CA LEU A 43 7.931 -4.143 -48.253 1.00 0.00 C ATOM 83 C LEU A 43 6.751 -4.327 -49.198 1.00 0.00 C ATOM 84 O LEU A 43 5.635 -3.901 -48.903 1.00 0.00 O ATOM 85 CB LEU A 43 8.633 -2.813 -48.554 1.00 0.00 C ATOM 86 CG LEU A 43 9.684 -2.368 -47.529 1.00 0.00 C ATOM 87 CD1 LEU A 43 10.373 -1.104 -48.023 1.00 0.00 C ATOM 88 CD2 LEU A 43 9.014 -2.136 -46.183 1.00 0.00 C ATOM 0 H LEU A 43 9.803 -4.977 -48.697 1.00 0.00 H new ATOM 0 HA LEU A 43 7.553 -4.130 -47.231 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.113 -2.890 -49.529 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.876 -2.033 -48.632 1.00 0.00 H new ATOM 0 HG LEU A 43 10.439 -3.145 -47.408 1.00 0.00 H new ATOM 0 HD11 LEU A 43 11.120 -0.788 -47.294 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.859 -1.304 -48.978 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.634 -0.313 -48.151 1.00 0.00 H new ATOM 0 HD21 LEU A 43 9.761 -1.820 -45.455 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.254 -1.361 -46.284 1.00 0.00 H new ATOM 0 HD23 LEU A 43 8.546 -3.061 -45.845 1.00 0.00 H new ATOM 100 N ARG A 44 7.005 -4.964 -50.336 1.00 0.00 N ATOM 101 CA ARG A 44 5.953 -5.251 -51.304 1.00 0.00 C ATOM 102 C ARG A 44 4.958 -6.265 -50.752 1.00 0.00 C ATOM 103 O ARG A 44 3.749 -6.123 -50.931 1.00 0.00 O ATOM 104 CB ARG A 44 6.548 -5.783 -52.600 1.00 0.00 C ATOM 105 CG ARG A 44 7.218 -4.734 -53.474 1.00 0.00 C ATOM 106 CD ARG A 44 8.099 -5.354 -54.497 1.00 0.00 C ATOM 107 NE ARG A 44 7.368 -6.267 -55.361 1.00 0.00 N ATOM 108 CZ ARG A 44 7.911 -6.944 -56.392 1.00 0.00 C ATOM 109 NH1 ARG A 44 9.187 -6.800 -56.674 1.00 0.00 N ATOM 110 NH2 ARG A 44 7.160 -7.752 -57.119 1.00 0.00 N ATOM 0 H ARG A 44 7.931 -5.292 -50.611 1.00 0.00 H new ATOM 0 HA ARG A 44 5.428 -4.317 -51.503 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.279 -6.554 -52.358 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.757 -6.264 -53.176 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.456 -4.130 -53.967 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.804 -4.060 -52.849 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.559 -4.572 -55.101 1.00 0.00 H new ATOM 0 HD3 ARG A 44 8.908 -5.892 -54.002 1.00 0.00 H new ATOM 0 HE ARG A 44 6.375 -6.405 -55.174 1.00 0.00 H new ATOM 0 HH11 ARG A 44 9.766 -6.176 -56.112 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.598 -7.312 -57.454 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.170 -7.863 -56.900 1.00 0.00 H new ATOM 0 HH22 ARG A 44 7.570 -8.265 -57.900 1.00 0.00 H new ATOM 124 N LYS A 45 5.475 -7.288 -50.081 1.00 0.00 N ATOM 125 CA LYS A 45 4.633 -8.242 -49.371 1.00 0.00 C ATOM 126 C LYS A 45 3.857 -7.564 -48.249 1.00 0.00 C ATOM 127 O LYS A 45 2.695 -7.888 -48.000 1.00 0.00 O ATOM 128 CB LYS A 45 5.476 -9.388 -48.809 1.00 0.00 C ATOM 129 CG LYS A 45 6.044 -10.327 -49.864 1.00 0.00 C ATOM 130 CD LYS A 45 6.915 -11.404 -49.235 1.00 0.00 C ATOM 131 CE LYS A 45 7.502 -12.330 -50.290 1.00 0.00 C ATOM 132 NZ LYS A 45 8.387 -13.365 -49.692 1.00 0.00 N ATOM 0 H LYS A 45 6.475 -7.478 -50.014 1.00 0.00 H new ATOM 0 HA LYS A 45 3.916 -8.648 -50.085 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.300 -8.968 -48.233 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.865 -9.967 -48.116 1.00 0.00 H new ATOM 0 HG2 LYS A 45 5.228 -10.793 -50.416 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.631 -9.756 -50.584 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.721 -10.937 -48.669 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.324 -11.985 -48.527 1.00 0.00 H new ATOM 0 HE2 LYS A 45 6.694 -12.816 -50.836 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.068 -11.743 -51.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.766 -13.975 -50.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.173 -12.903 -49.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.842 -13.942 -49.021 1.00 0.00 H new ATOM 146 N GLU A 46 4.506 -6.622 -47.573 1.00 0.00 N ATOM 147 CA GLU A 46 3.852 -5.838 -46.532 1.00 0.00 C ATOM 148 C GLU A 46 2.682 -5.041 -47.095 1.00 0.00 C ATOM 149 O GLU A 46 1.640 -4.913 -46.453 1.00 0.00 O ATOM 150 CB GLU A 46 4.853 -4.907 -45.863 1.00 0.00 C ATOM 0 H GLU A 46 5.485 -6.383 -47.728 1.00 0.00 H new ATOM 0 HA GLU A 46 3.460 -6.530 -45.786 1.00 0.00 H new ATOM 155 N LEU A 47 2.861 -4.507 -48.298 1.00 0.00 N ATOM 156 CA LEU A 47 1.805 -3.759 -48.970 1.00 0.00 C ATOM 157 C LEU A 47 0.607 -4.650 -49.274 1.00 0.00 C ATOM 158 O LEU A 47 -0.541 -4.217 -49.180 1.00 0.00 O ATOM 159 CB LEU A 47 2.335 -3.144 -50.271 1.00 0.00 C ATOM 160 CG LEU A 47 3.297 -1.961 -50.103 1.00 0.00 C ATOM 161 CD1 LEU A 47 3.913 -1.612 -51.451 1.00 0.00 C ATOM 162 CD2 LEU A 47 2.544 -0.773 -49.522 1.00 0.00 C ATOM 0 H LEU A 47 3.729 -4.578 -48.829 1.00 0.00 H new ATOM 0 HA LEU A 47 1.481 -2.963 -48.299 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.842 -3.923 -50.840 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.485 -2.815 -50.869 1.00 0.00 H new ATOM 0 HG LEU A 47 4.100 -2.228 -49.416 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.597 -0.771 -51.332 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.460 -2.473 -51.835 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.124 -1.341 -52.153 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.227 0.068 -49.402 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.735 -0.490 -50.196 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.129 -1.044 -48.551 1.00 0.00 H new ATOM 174 N MET A 48 0.882 -5.898 -49.638 1.00 0.00 N ATOM 175 CA MET A 48 -0.171 -6.882 -49.859 1.00 0.00 C ATOM 176 C MET A 48 -1.019 -7.071 -48.608 1.00 0.00 C ATOM 177 O MET A 48 -2.248 -7.103 -48.678 1.00 0.00 O ATOM 178 CB MET A 48 0.434 -8.213 -50.300 1.00 0.00 C ATOM 179 CG MET A 48 1.116 -8.175 -51.660 1.00 0.00 C ATOM 180 SD MET A 48 1.849 -9.760 -52.115 1.00 0.00 S ATOM 181 CE MET A 48 0.394 -10.672 -52.622 1.00 0.00 C ATOM 0 H MET A 48 1.827 -6.252 -49.786 1.00 0.00 H new ATOM 0 HA MET A 48 -0.821 -6.511 -50.651 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.160 -8.534 -49.552 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.354 -8.966 -50.323 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.389 -7.884 -52.418 1.00 0.00 H new ATOM 0 HG3 MET A 48 1.892 -7.409 -51.652 1.00 0.00 H new ATOM 0 HE1 MET A 48 0.378 -11.640 -52.121 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.500 -10.109 -52.353 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.417 -10.823 -53.701 1.00 0.00 H new ATOM 191 N GLU A 49 -0.356 -7.197 -47.463 1.00 0.00 N ATOM 192 CA GLU A 49 -1.047 -7.265 -46.181 1.00 0.00 C ATOM 193 C GLU A 49 -1.917 -6.034 -45.959 1.00 0.00 C ATOM 194 O GLU A 49 -3.074 -6.146 -45.554 1.00 0.00 O ATOM 195 CB GLU A 49 -0.039 -7.401 -45.038 1.00 0.00 C ATOM 196 CG GLU A 49 -0.664 -7.459 -43.652 1.00 0.00 C ATOM 197 CD GLU A 49 0.356 -7.592 -42.555 1.00 0.00 C ATOM 198 OE1 GLU A 49 1.519 -7.699 -42.862 1.00 0.00 O ATOM 199 OE2 GLU A 49 -0.028 -7.587 -41.410 1.00 0.00 O ATOM 0 H GLU A 49 0.660 -7.254 -47.397 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.692 -8.144 -46.196 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.551 -8.304 -45.195 1.00 0.00 H new ATOM 0 HB3 GLU A 49 0.652 -6.559 -45.077 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.253 -6.557 -43.486 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -1.353 -8.302 -43.605 1.00 0.00 H new ATOM 206 N VAL A 50 -1.354 -4.861 -46.226 1.00 0.00 N ATOM 207 CA VAL A 50 -2.068 -3.605 -46.029 1.00 0.00 C ATOM 208 C VAL A 50 -3.339 -3.557 -46.867 1.00 0.00 C ATOM 209 O VAL A 50 -4.382 -3.093 -46.405 1.00 0.00 O ATOM 210 CB VAL A 50 -1.166 -2.413 -46.401 1.00 0.00 C ATOM 211 CG1 VAL A 50 -1.977 -1.127 -46.449 1.00 0.00 C ATOM 212 CG2 VAL A 50 -0.026 -2.296 -45.402 1.00 0.00 C ATOM 0 H VAL A 50 -0.403 -4.754 -46.580 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.342 -3.541 -44.976 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.745 -2.583 -47.392 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.324 -0.295 -46.713 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.765 -1.221 -47.196 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.424 -0.942 -45.472 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.608 -1.451 -45.671 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.432 -2.141 -44.403 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.565 -3.212 -45.415 1.00 0.00 H new ATOM 222 N LEU A 51 -3.247 -4.040 -48.101 1.00 0.00 N ATOM 223 CA LEU A 51 -4.389 -4.049 -49.008 1.00 0.00 C ATOM 224 C LEU A 51 -5.462 -5.020 -48.533 1.00 0.00 C ATOM 225 O LEU A 51 -6.656 -4.747 -48.651 1.00 0.00 O ATOM 226 CB LEU A 51 -3.938 -4.428 -50.424 1.00 0.00 C ATOM 227 CG LEU A 51 -3.048 -3.401 -51.136 1.00 0.00 C ATOM 228 CD1 LEU A 51 -2.443 -4.031 -52.383 1.00 0.00 C ATOM 229 CD2 LEU A 51 -3.873 -2.173 -51.490 1.00 0.00 C ATOM 0 H LEU A 51 -2.392 -4.431 -48.497 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.815 -3.046 -49.020 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.400 -5.374 -50.373 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.825 -4.598 -51.035 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.236 -3.092 -50.478 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.811 -3.301 -52.889 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.844 -4.896 -52.099 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.241 -4.347 -53.055 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.241 -1.443 -51.996 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.692 -2.462 -52.149 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.279 -1.732 -50.579 1.00 0.00 H new ATOM 241 N SER A 52 -5.029 -6.155 -47.995 1.00 0.00 N ATOM 242 CA SER A 52 -5.952 -7.163 -47.487 1.00 0.00 C ATOM 243 C SER A 52 -6.666 -6.674 -46.234 1.00 0.00 C ATOM 244 O SER A 52 -7.708 -7.208 -45.853 1.00 0.00 O ATOM 245 CB SER A 52 -5.206 -8.449 -47.185 1.00 0.00 C ATOM 246 OG SER A 52 -4.388 -8.302 -46.057 1.00 0.00 O ATOM 0 H SER A 52 -4.043 -6.400 -47.899 1.00 0.00 H new ATOM 0 HA SER A 52 -6.701 -7.351 -48.256 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.919 -9.257 -47.019 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.599 -8.732 -48.045 1.00 0.00 H new ATOM 0 HG SER A 52 -4.268 -7.349 -45.862 1.00 0.00 H new ATOM 252 N LYS A 53 -6.100 -5.655 -45.596 1.00 0.00 N ATOM 253 CA LYS A 53 -6.721 -5.044 -44.426 1.00 0.00 C ATOM 254 C LYS A 53 -7.591 -3.858 -44.821 1.00 0.00 C ATOM 255 O LYS A 53 -8.639 -3.618 -44.222 1.00 0.00 O ATOM 256 CB LYS A 53 -5.654 -4.602 -43.423 1.00 0.00 C ATOM 257 CG LYS A 53 -4.922 -5.749 -42.738 1.00 0.00 C ATOM 258 CD LYS A 53 -3.857 -5.232 -41.783 1.00 0.00 C ATOM 259 CE LYS A 53 -3.160 -6.374 -41.058 1.00 0.00 C ATOM 260 NZ LYS A 53 -2.055 -5.889 -40.187 1.00 0.00 N ATOM 0 H LYS A 53 -5.212 -5.235 -45.869 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.359 -5.794 -43.957 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -4.924 -3.978 -43.939 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.124 -3.980 -42.661 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.636 -6.364 -42.191 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.460 -6.389 -43.490 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -3.122 -4.648 -42.337 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.314 -4.562 -41.055 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.887 -6.917 -40.453 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.763 -7.079 -41.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -1.173 -6.379 -40.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -1.932 -4.865 -40.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -2.286 -6.084 -39.192 1.00 0.00 H new ATOM 274 N TYR A 54 -7.150 -3.118 -45.833 1.00 0.00 N ATOM 275 CA TYR A 54 -7.880 -1.945 -46.299 1.00 0.00 C ATOM 276 C TYR A 54 -9.140 -2.345 -47.057 1.00 0.00 C ATOM 277 O TYR A 54 -10.255 -2.147 -46.574 1.00 0.00 O ATOM 278 CB TYR A 54 -6.985 -1.073 -47.182 1.00 0.00 C ATOM 279 CG TYR A 54 -6.003 -0.224 -46.406 1.00 0.00 C ATOM 280 CD1 TYR A 54 -5.928 -0.337 -45.025 1.00 0.00 C ATOM 281 CD2 TYR A 54 -5.177 0.667 -47.074 1.00 0.00 C ATOM 282 CE1 TYR A 54 -5.031 0.438 -44.316 1.00 0.00 C ATOM 283 CE2 TYR A 54 -4.280 1.442 -46.365 1.00 0.00 C ATOM 284 CZ TYR A 54 -4.206 1.330 -44.992 1.00 0.00 C ATOM 285 OH TYR A 54 -3.312 2.103 -44.286 1.00 0.00 O ATOM 0 H TYR A 54 -6.290 -3.310 -46.346 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.180 -1.369 -45.424 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.433 -1.714 -47.869 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.614 -0.422 -47.789 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -6.571 -1.031 -44.504 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -5.235 0.755 -48.149 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -4.971 0.351 -43.241 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.636 2.136 -46.886 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.810 2.672 -44.906 1.00 0.00 H new ATOM 295 N VAL A 55 -8.955 -2.909 -48.245 1.00 0.00 N ATOM 296 CA VAL A 55 -10.068 -3.174 -49.149 1.00 0.00 C ATOM 297 C VAL A 55 -10.456 -4.647 -49.127 1.00 0.00 C ATOM 298 O VAL A 55 -11.328 -5.081 -49.881 1.00 0.00 O ATOM 299 CB VAL A 55 -9.699 -2.765 -50.587 1.00 0.00 C ATOM 300 CG1 VAL A 55 -9.390 -1.277 -50.654 1.00 0.00 C ATOM 301 CG2 VAL A 55 -8.512 -3.584 -51.070 1.00 0.00 C ATOM 0 H VAL A 55 -8.044 -3.192 -48.605 1.00 0.00 H new ATOM 0 HA VAL A 55 -10.919 -2.583 -48.809 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.549 -2.964 -51.240 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.131 -1.005 -51.677 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -10.265 -0.709 -50.338 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.552 -1.049 -49.995 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.257 -3.289 -52.088 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.658 -3.408 -50.416 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.769 -4.643 -51.053 1.00 0.00 H new ATOM 311 N ASN A 56 -9.805 -5.413 -48.259 1.00 0.00 N ATOM 312 CA ASN A 56 -10.155 -6.814 -48.058 1.00 0.00 C ATOM 313 C ASN A 56 -10.011 -7.608 -49.350 1.00 0.00 C ATOM 314 O ASN A 56 -10.703 -8.605 -49.558 1.00 0.00 O ATOM 315 CB ASN A 56 -11.565 -6.938 -47.510 1.00 0.00 C ATOM 316 CG ASN A 56 -11.711 -6.323 -46.146 1.00 0.00 C ATOM 317 OD1 ASN A 56 -10.849 -6.500 -45.276 1.00 0.00 O ATOM 318 ND2 ASN A 56 -12.784 -5.604 -45.941 1.00 0.00 N ATOM 0 H ASN A 56 -9.030 -5.086 -47.682 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.461 -7.232 -47.328 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -12.262 -6.458 -48.197 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -11.841 -7.991 -47.461 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -12.936 -5.162 -45.034 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -13.469 -5.485 -46.688 1.00 0.00 H new ATOM 325 N VAL A 57 -9.107 -7.161 -50.216 1.00 0.00 N ATOM 326 CA VAL A 57 -8.798 -7.885 -51.443 1.00 0.00 C ATOM 327 C VAL A 57 -8.013 -9.157 -51.149 1.00 0.00 C ATOM 328 O VAL A 57 -7.302 -9.241 -50.148 1.00 0.00 O ATOM 329 CB VAL A 57 -7.984 -6.992 -52.399 1.00 0.00 C ATOM 330 CG1 VAL A 57 -6.596 -6.732 -51.833 1.00 0.00 C ATOM 331 CG2 VAL A 57 -7.894 -7.648 -53.768 1.00 0.00 C ATOM 0 H VAL A 57 -8.575 -6.300 -50.090 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.742 -8.159 -51.913 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.490 -6.032 -52.504 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -6.035 -6.100 -52.521 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.684 -6.230 -50.869 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.073 -7.679 -51.702 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.317 -7.012 -54.439 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.403 -8.617 -53.676 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.897 -7.786 -54.172 1.00 0.00 H new ATOM 341 N SER A 58 -8.147 -10.145 -52.027 1.00 0.00 N ATOM 342 CA SER A 58 -7.458 -11.419 -51.858 1.00 0.00 C ATOM 343 C SER A 58 -6.044 -11.360 -52.421 1.00 0.00 C ATOM 344 O SER A 58 -5.778 -10.640 -53.384 1.00 0.00 O ATOM 345 CB SER A 58 -8.237 -12.527 -52.538 1.00 0.00 C ATOM 346 OG SER A 58 -7.535 -13.739 -52.487 1.00 0.00 O ATOM 0 H SER A 58 -8.727 -10.088 -52.864 1.00 0.00 H new ATOM 0 HA SER A 58 -7.392 -11.626 -50.790 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.207 -12.644 -52.055 1.00 0.00 H new ATOM 0 HB3 SER A 58 -8.429 -12.257 -53.577 1.00 0.00 H new ATOM 0 HG SER A 58 -8.058 -14.439 -52.930 1.00 0.00 H new ATOM 352 N LEU A 59 -5.139 -12.121 -51.815 1.00 0.00 N ATOM 353 CA LEU A 59 -3.731 -12.084 -52.192 1.00 0.00 C ATOM 354 C LEU A 59 -3.544 -12.452 -53.658 1.00 0.00 C ATOM 355 O LEU A 59 -2.733 -11.848 -54.361 1.00 0.00 O ATOM 356 CB LEU A 59 -2.921 -13.043 -51.310 1.00 0.00 C ATOM 357 CG LEU A 59 -2.837 -12.670 -49.824 1.00 0.00 C ATOM 358 CD1 LEU A 59 -2.145 -13.789 -49.058 1.00 0.00 C ATOM 359 CD2 LEU A 59 -2.085 -11.357 -49.672 1.00 0.00 C ATOM 0 H LEU A 59 -5.356 -12.772 -51.060 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.372 -11.066 -52.045 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.357 -14.039 -51.392 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.908 -13.105 -51.708 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.839 -12.541 -49.415 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.085 -13.524 -48.002 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.714 -14.712 -49.169 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.140 -13.933 -49.454 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.025 -11.092 -48.616 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.079 -11.465 -50.076 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.611 -10.571 -50.214 1.00 0.00 H new ATOM 371 N ASP A 60 -4.298 -13.446 -54.115 1.00 0.00 N ATOM 372 CA ASP A 60 -4.266 -13.851 -55.515 1.00 0.00 C ATOM 373 C ASP A 60 -4.739 -12.725 -56.425 1.00 0.00 C ATOM 374 O ASP A 60 -4.411 -12.693 -57.611 1.00 0.00 O ATOM 375 CB ASP A 60 -5.134 -15.092 -55.734 1.00 0.00 C ATOM 376 CG ASP A 60 -4.529 -16.353 -55.132 1.00 0.00 C ATOM 377 OD1 ASP A 60 -3.369 -16.329 -54.796 1.00 0.00 O ATOM 378 OD2 ASP A 60 -5.232 -17.328 -55.015 1.00 0.00 O ATOM 0 H ASP A 60 -4.940 -13.987 -53.535 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.232 -14.088 -55.767 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -6.118 -14.923 -55.296 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.282 -15.241 -56.804 1.00 0.00 H new ATOM 383 N ASN A 61 -5.513 -11.802 -55.863 1.00 0.00 N ATOM 384 CA ASN A 61 -6.054 -10.686 -56.629 1.00 0.00 C ATOM 385 C ASN A 61 -5.183 -9.445 -56.483 1.00 0.00 C ATOM 386 O ASN A 61 -5.597 -8.340 -56.835 1.00 0.00 O ATOM 387 CB ASN A 61 -7.481 -10.390 -56.206 1.00 0.00 C ATOM 388 CG ASN A 61 -8.447 -11.454 -56.649 1.00 0.00 C ATOM 389 OD1 ASN A 61 -8.240 -12.109 -57.677 1.00 0.00 O ATOM 390 ND2 ASN A 61 -9.499 -11.639 -55.892 1.00 0.00 N ATOM 0 H ASN A 61 -5.780 -11.805 -54.878 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.057 -10.971 -57.681 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -7.522 -10.296 -55.121 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.788 -9.430 -56.621 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.189 -12.347 -56.142 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.629 -11.075 -55.052 1.00 0.00 H new ATOM 397 N ILE A 62 -3.975 -9.633 -55.963 1.00 0.00 N ATOM 398 CA ILE A 62 -2.981 -8.567 -55.930 1.00 0.00 C ATOM 399 C ILE A 62 -1.809 -8.878 -56.852 1.00 0.00 C ATOM 400 O ILE A 62 -1.181 -9.931 -56.740 1.00 0.00 O ATOM 401 CB ILE A 62 -2.462 -8.345 -54.497 1.00 0.00 C ATOM 402 CG1 ILE A 62 -3.621 -8.006 -53.556 1.00 0.00 C ATOM 403 CG2 ILE A 62 -1.415 -7.242 -54.476 1.00 0.00 C ATOM 404 CD1 ILE A 62 -3.236 -7.992 -52.094 1.00 0.00 C ATOM 0 H ILE A 62 -3.660 -10.515 -55.558 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.469 -7.657 -56.278 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.996 -9.267 -54.150 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -4.022 -7.029 -53.826 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.421 -8.731 -53.704 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.059 -7.098 -53.456 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.579 -7.522 -55.116 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.856 -6.314 -54.841 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.109 -7.744 -51.490 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.863 -8.975 -51.806 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.458 -7.247 -51.930 1.00 0.00 H new ATOM 416 N ARG A 63 -1.520 -7.956 -57.764 1.00 0.00 N ATOM 417 CA ARG A 63 -0.365 -8.084 -58.644 1.00 0.00 C ATOM 418 C ARG A 63 0.602 -6.922 -58.455 1.00 0.00 C ATOM 419 O ARG A 63 0.242 -5.763 -58.660 1.00 0.00 O ATOM 420 CB ARG A 63 -0.803 -8.144 -60.099 1.00 0.00 C ATOM 421 CG ARG A 63 0.312 -8.428 -61.093 1.00 0.00 C ATOM 422 CD ARG A 63 -0.187 -8.437 -62.492 1.00 0.00 C ATOM 423 NE ARG A 63 -0.495 -7.097 -62.966 1.00 0.00 N ATOM 424 CZ ARG A 63 -0.922 -6.806 -64.210 1.00 0.00 C ATOM 425 NH1 ARG A 63 -1.086 -7.768 -65.091 1.00 0.00 N ATOM 426 NH2 ARG A 63 -1.176 -5.553 -64.545 1.00 0.00 N ATOM 0 H ARG A 63 -2.071 -7.111 -57.913 1.00 0.00 H new ATOM 0 HA ARG A 63 0.145 -9.011 -58.382 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.566 -8.915 -60.202 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.271 -7.195 -60.362 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.092 -7.674 -60.990 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.768 -9.391 -60.863 1.00 0.00 H new ATOM 0 HD2 ARG A 63 0.562 -8.889 -63.142 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.080 -9.059 -62.555 1.00 0.00 H new ATOM 0 HE ARG A 63 -0.380 -6.324 -62.311 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -0.890 -8.735 -64.833 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.409 -7.547 -66.033 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.049 -4.807 -63.862 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.499 -5.332 -65.487 1.00 0.00 H new ATOM 440 N ILE A 64 1.832 -7.240 -58.065 1.00 0.00 N ATOM 441 CA ILE A 64 2.850 -6.221 -57.836 1.00 0.00 C ATOM 442 C ILE A 64 4.072 -6.457 -58.716 1.00 0.00 C ATOM 443 O ILE A 64 4.618 -7.559 -58.754 1.00 0.00 O ATOM 444 CB ILE A 64 3.279 -6.195 -56.358 1.00 0.00 C ATOM 445 CG1 ILE A 64 2.065 -5.965 -55.454 1.00 0.00 C ATOM 446 CG2 ILE A 64 4.329 -5.120 -56.127 1.00 0.00 C ATOM 447 CD1 ILE A 64 2.392 -5.971 -53.978 1.00 0.00 C ATOM 0 H ILE A 64 2.148 -8.196 -57.901 1.00 0.00 H new ATOM 0 HA ILE A 64 2.410 -5.258 -58.096 1.00 0.00 H new ATOM 0 HB ILE A 64 3.717 -7.161 -56.108 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.608 -5.009 -55.711 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.323 -6.737 -55.655 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.621 -5.116 -55.077 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.203 -5.326 -56.745 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.918 -4.146 -56.393 1.00 0.00 H new ATOM 0 HD11 ILE A 64 1.482 -5.802 -53.403 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.820 -6.935 -53.704 1.00 0.00 H new ATOM 0 HD13 ILE A 64 3.110 -5.180 -53.761 1.00 0.00 H new ATOM 459 N SER A 65 4.496 -5.414 -59.422 1.00 0.00 N ATOM 460 CA SER A 65 5.580 -5.534 -60.390 1.00 0.00 C ATOM 461 C SER A 65 6.675 -4.511 -60.120 1.00 0.00 C ATOM 462 O SER A 65 6.396 -3.376 -59.734 1.00 0.00 O ATOM 463 CB SER A 65 5.044 -5.357 -61.797 1.00 0.00 C ATOM 464 OG SER A 65 6.081 -5.404 -62.738 1.00 0.00 O ATOM 0 H SER A 65 4.105 -4.475 -59.342 1.00 0.00 H new ATOM 0 HA SER A 65 6.012 -6.530 -60.291 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.316 -6.138 -62.014 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.521 -4.404 -61.874 1.00 0.00 H new ATOM 0 HG SER A 65 5.711 -5.289 -63.638 1.00 0.00 H new ATOM 470 N GLN A 66 7.923 -4.919 -60.326 1.00 0.00 N ATOM 471 CA GLN A 66 9.060 -4.023 -60.153 1.00 0.00 C ATOM 472 C GLN A 66 9.947 -4.013 -61.391 1.00 0.00 C ATOM 473 O GLN A 66 10.390 -5.063 -61.857 1.00 0.00 O ATOM 474 CB GLN A 66 9.880 -4.429 -58.926 1.00 0.00 C ATOM 475 CG GLN A 66 11.083 -3.540 -58.660 1.00 0.00 C ATOM 476 CD GLN A 66 11.823 -3.931 -57.394 1.00 0.00 C ATOM 477 OE1 GLN A 66 11.403 -4.836 -56.667 1.00 0.00 O ATOM 478 NE2 GLN A 66 12.931 -3.251 -57.123 1.00 0.00 N ATOM 0 H GLN A 66 8.172 -5.865 -60.613 1.00 0.00 H new ATOM 0 HA GLN A 66 8.670 -3.016 -60.003 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.232 -4.417 -58.049 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.222 -5.456 -59.055 1.00 0.00 H new ATOM 0 HG2 GLN A 66 11.766 -3.594 -59.508 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.755 -2.504 -58.580 1.00 0.00 H new ATOM 0 HE21 GLN A 66 13.242 -2.511 -57.752 1.00 0.00 H new ATOM 0 HE22 GLN A 66 13.471 -3.469 -56.286 1.00 0.00 H new ATOM 487 N GLU A 67 10.202 -2.822 -61.921 1.00 0.00 N ATOM 488 CA GLU A 67 11.000 -2.677 -63.133 1.00 0.00 C ATOM 489 C GLU A 67 11.728 -1.339 -63.156 1.00 0.00 C ATOM 490 O GLU A 67 11.394 -0.426 -62.401 1.00 0.00 O ATOM 491 CB GLU A 67 10.114 -2.809 -64.373 1.00 0.00 C ATOM 492 CG GLU A 67 9.079 -1.703 -64.527 1.00 0.00 C ATOM 493 CD GLU A 67 8.213 -1.878 -65.743 1.00 0.00 C ATOM 494 OE1 GLU A 67 8.406 -2.834 -66.455 1.00 0.00 O ATOM 495 OE2 GLU A 67 7.356 -1.054 -65.961 1.00 0.00 O ATOM 0 H GLU A 67 9.867 -1.942 -61.530 1.00 0.00 H new ATOM 0 HA GLU A 67 11.745 -3.473 -63.139 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.749 -2.821 -65.259 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.599 -3.769 -64.336 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.448 -1.676 -63.639 1.00 0.00 H new ATOM 0 HG3 GLU A 67 9.588 -0.741 -64.585 1.00 0.00 H new ATOM 502 N LYS A 68 12.724 -1.229 -64.029 1.00 0.00 N ATOM 503 CA LYS A 68 13.499 0.000 -64.155 1.00 0.00 C ATOM 504 C LYS A 68 13.294 0.642 -65.521 1.00 0.00 C ATOM 505 O LYS A 68 13.769 0.132 -66.535 1.00 0.00 O ATOM 506 CB LYS A 68 14.985 -0.277 -63.922 1.00 0.00 C ATOM 507 CG LYS A 68 15.871 0.961 -63.968 1.00 0.00 C ATOM 508 CD LYS A 68 17.323 0.612 -63.680 1.00 0.00 C ATOM 509 CE LYS A 68 18.213 1.844 -63.748 1.00 0.00 C ATOM 510 NZ LYS A 68 19.637 1.519 -63.460 1.00 0.00 N ATOM 0 H LYS A 68 13.014 -1.976 -64.660 1.00 0.00 H new ATOM 0 HA LYS A 68 13.146 0.696 -63.394 1.00 0.00 H new ATOM 0 HB2 LYS A 68 15.104 -0.758 -62.951 1.00 0.00 H new ATOM 0 HB3 LYS A 68 15.332 -0.985 -64.674 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.795 1.429 -64.949 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.518 1.690 -63.239 1.00 0.00 H new ATOM 0 HD2 LYS A 68 17.401 0.159 -62.692 1.00 0.00 H new ATOM 0 HD3 LYS A 68 17.670 -0.130 -64.399 1.00 0.00 H new ATOM 0 HE2 LYS A 68 18.137 2.292 -64.739 1.00 0.00 H new ATOM 0 HE3 LYS A 68 17.859 2.587 -63.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 20.209 2.386 -63.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 19.715 1.115 -62.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 19.983 0.829 -64.157 1.00 0.00 H new ATOM 524 N GLN A 69 12.584 1.765 -65.541 1.00 0.00 N ATOM 525 CA GLN A 69 12.212 2.415 -66.792 1.00 0.00 C ATOM 526 C GLN A 69 12.521 3.906 -66.752 1.00 0.00 C ATOM 527 O GLN A 69 12.190 4.592 -65.786 1.00 0.00 O ATOM 528 CB GLN A 69 10.725 2.197 -67.087 1.00 0.00 C ATOM 529 CG GLN A 69 10.234 2.886 -68.349 1.00 0.00 C ATOM 530 CD GLN A 69 10.810 2.267 -69.608 1.00 0.00 C ATOM 531 OE1 GLN A 69 10.738 1.051 -69.808 1.00 0.00 O ATOM 532 NE2 GLN A 69 11.387 3.101 -70.466 1.00 0.00 N ATOM 0 H GLN A 69 12.254 2.245 -64.703 1.00 0.00 H new ATOM 0 HA GLN A 69 12.803 1.965 -67.589 1.00 0.00 H new ATOM 0 HB2 GLN A 69 10.536 1.127 -67.173 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.141 2.556 -66.239 1.00 0.00 H new ATOM 0 HG2 GLN A 69 9.146 2.835 -68.388 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.502 3.942 -68.311 1.00 0.00 H new ATOM 0 HE21 GLN A 69 11.424 4.099 -70.260 1.00 0.00 H new ATOM 0 HE22 GLN A 69 11.793 2.743 -71.331 1.00 0.00 H new ATOM 541 N ASP A 70 13.158 4.401 -67.807 1.00 0.00 N ATOM 542 CA ASP A 70 13.538 5.807 -67.883 1.00 0.00 C ATOM 543 C ASP A 70 14.498 6.179 -66.761 1.00 0.00 C ATOM 544 O ASP A 70 14.538 7.329 -66.322 1.00 0.00 O ATOM 545 CB ASP A 70 12.297 6.701 -67.820 1.00 0.00 C ATOM 546 CG ASP A 70 11.340 6.470 -68.982 1.00 0.00 C ATOM 547 OD1 ASP A 70 11.777 5.982 -69.997 1.00 0.00 O ATOM 548 OD2 ASP A 70 10.182 6.784 -68.843 1.00 0.00 O ATOM 0 H ASP A 70 13.423 3.849 -68.623 1.00 0.00 H new ATOM 0 HA ASP A 70 14.044 5.963 -68.836 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.772 6.520 -66.882 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.608 7.746 -67.814 1.00 0.00 H new ATOM 553 N GLY A 71 15.269 5.201 -66.299 1.00 0.00 N ATOM 554 CA GLY A 71 16.338 5.455 -65.341 1.00 0.00 C ATOM 555 C GLY A 71 15.876 5.184 -63.915 1.00 0.00 C ATOM 556 O GLY A 71 16.692 4.973 -63.018 1.00 0.00 O ATOM 0 H GLY A 71 15.173 4.223 -66.573 1.00 0.00 H new ATOM 0 HA2 GLY A 71 17.196 4.824 -65.574 1.00 0.00 H new ATOM 0 HA3 GLY A 71 16.670 6.490 -65.428 1.00 0.00 H new ATOM 560 N MET A 72 14.563 5.190 -63.713 1.00 0.00 N ATOM 561 CA MET A 72 13.994 5.095 -62.374 1.00 0.00 C ATOM 562 C MET A 72 13.438 3.702 -62.109 1.00 0.00 C ATOM 563 O MET A 72 13.039 2.996 -63.036 1.00 0.00 O ATOM 564 CB MET A 72 12.904 6.148 -62.188 1.00 0.00 C ATOM 565 CG MET A 72 13.339 7.570 -62.513 1.00 0.00 C ATOM 566 SD MET A 72 14.658 8.158 -61.432 1.00 0.00 S ATOM 567 CE MET A 72 13.768 8.360 -59.892 1.00 0.00 C ATOM 0 H MET A 72 13.872 5.260 -64.460 1.00 0.00 H new ATOM 0 HA MET A 72 14.791 5.280 -61.654 1.00 0.00 H new ATOM 0 HB2 MET A 72 12.054 5.888 -62.819 1.00 0.00 H new ATOM 0 HB3 MET A 72 12.557 6.115 -61.155 1.00 0.00 H new ATOM 0 HG2 MET A 72 13.676 7.615 -63.549 1.00 0.00 H new ATOM 0 HG3 MET A 72 12.481 8.237 -62.428 1.00 0.00 H new ATOM 0 HE1 MET A 72 14.392 8.899 -59.179 1.00 0.00 H new ATOM 0 HE2 MET A 72 12.853 8.924 -60.072 1.00 0.00 H new ATOM 0 HE3 MET A 72 13.517 7.380 -59.486 1.00 0.00 H new ATOM 577 N ASP A 73 13.414 3.311 -60.840 1.00 0.00 N ATOM 578 CA ASP A 73 12.851 2.026 -60.444 1.00 0.00 C ATOM 579 C ASP A 73 11.415 2.180 -59.959 1.00 0.00 C ATOM 580 O ASP A 73 11.165 2.759 -58.902 1.00 0.00 O ATOM 581 CB ASP A 73 13.700 1.382 -59.346 1.00 0.00 C ATOM 582 CG ASP A 73 13.201 0.001 -58.943 1.00 0.00 C ATOM 583 OD1 ASP A 73 12.089 -0.329 -59.280 1.00 0.00 O ATOM 584 OD2 ASP A 73 13.937 -0.711 -58.302 1.00 0.00 O ATOM 0 H ASP A 73 13.779 3.867 -60.066 1.00 0.00 H new ATOM 0 HA ASP A 73 12.853 1.381 -61.322 1.00 0.00 H new ATOM 0 HB2 ASP A 73 14.731 1.304 -59.690 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.705 2.031 -58.470 1.00 0.00 H new ATOM 589 N VAL A 74 10.473 1.658 -60.738 1.00 0.00 N ATOM 590 CA VAL A 74 9.058 1.933 -60.519 1.00 0.00 C ATOM 591 C VAL A 74 8.325 0.690 -60.033 1.00 0.00 C ATOM 592 O VAL A 74 8.367 -0.359 -60.676 1.00 0.00 O ATOM 593 CB VAL A 74 8.404 2.437 -61.819 1.00 0.00 C ATOM 594 CG1 VAL A 74 6.917 2.682 -61.606 1.00 0.00 C ATOM 595 CG2 VAL A 74 9.098 3.706 -62.290 1.00 0.00 C ATOM 0 H VAL A 74 10.665 1.041 -61.528 1.00 0.00 H new ATOM 0 HA VAL A 74 8.985 2.703 -59.751 1.00 0.00 H new ATOM 0 HB VAL A 74 8.514 1.674 -62.590 1.00 0.00 H new ATOM 0 HG11 VAL A 74 6.470 3.038 -62.534 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.435 1.752 -61.304 1.00 0.00 H new ATOM 0 HG13 VAL A 74 6.780 3.432 -60.827 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.630 4.057 -63.210 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.010 4.475 -61.522 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.152 3.497 -62.476 1.00 0.00 H new ATOM 605 N LEU A 75 7.651 0.813 -58.894 1.00 0.00 N ATOM 606 CA LEU A 75 6.761 -0.236 -58.413 1.00 0.00 C ATOM 607 C LEU A 75 5.339 -0.025 -58.916 1.00 0.00 C ATOM 608 O LEU A 75 4.858 1.105 -58.993 1.00 0.00 O ATOM 609 CB LEU A 75 6.766 -0.274 -56.879 1.00 0.00 C ATOM 610 CG LEU A 75 8.130 -0.531 -56.225 1.00 0.00 C ATOM 611 CD1 LEU A 75 8.007 -0.376 -54.716 1.00 0.00 C ATOM 612 CD2 LEU A 75 8.615 -1.925 -56.594 1.00 0.00 C ATOM 0 H LEU A 75 7.705 1.631 -58.286 1.00 0.00 H new ATOM 0 HA LEU A 75 7.126 -1.187 -58.800 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.379 0.676 -56.509 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.074 -1.050 -56.551 1.00 0.00 H new ATOM 0 HG LEU A 75 8.859 0.194 -56.587 1.00 0.00 H new ATOM 0 HD11 LEU A 75 8.976 -0.559 -54.251 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.676 0.635 -54.480 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.281 -1.094 -54.335 1.00 0.00 H new ATOM 0 HD21 LEU A 75 9.584 -2.108 -56.130 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.898 -2.665 -56.240 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.711 -2.002 -57.677 1.00 0.00 H new ATOM 624 N GLU A 76 4.669 -1.121 -59.259 1.00 0.00 N ATOM 625 CA GLU A 76 3.268 -1.070 -59.657 1.00 0.00 C ATOM 626 C GLU A 76 2.434 -2.071 -58.867 1.00 0.00 C ATOM 627 O GLU A 76 2.775 -3.251 -58.789 1.00 0.00 O ATOM 628 CB GLU A 76 3.128 -1.344 -61.156 1.00 0.00 C ATOM 629 CG GLU A 76 1.693 -1.335 -61.665 1.00 0.00 C ATOM 630 CD GLU A 76 1.593 -1.635 -63.135 1.00 0.00 C ATOM 631 OE1 GLU A 76 2.609 -1.663 -63.787 1.00 0.00 O ATOM 632 OE2 GLU A 76 0.498 -1.836 -63.606 1.00 0.00 O ATOM 0 H GLU A 76 5.075 -2.056 -59.269 1.00 0.00 H new ATOM 0 HA GLU A 76 2.897 -0.068 -59.441 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.700 -0.596 -61.705 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.574 -2.313 -61.379 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.111 -2.070 -61.109 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.248 -0.360 -61.467 1.00 0.00 H new ATOM 639 N LEU A 77 1.341 -1.593 -58.283 1.00 0.00 N ATOM 640 CA LEU A 77 0.390 -2.466 -57.605 1.00 0.00 C ATOM 641 C LEU A 77 -0.959 -2.467 -58.313 1.00 0.00 C ATOM 642 O LEU A 77 -1.508 -1.411 -58.624 1.00 0.00 O ATOM 643 CB LEU A 77 0.210 -2.023 -56.148 1.00 0.00 C ATOM 644 CG LEU A 77 1.422 -2.236 -55.233 1.00 0.00 C ATOM 645 CD1 LEU A 77 2.328 -1.013 -55.296 1.00 0.00 C ATOM 646 CD2 LEU A 77 0.946 -2.492 -53.810 1.00 0.00 C ATOM 0 H LEU A 77 1.091 -0.604 -58.265 1.00 0.00 H new ATOM 0 HA LEU A 77 0.791 -3.479 -57.628 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.047 -0.964 -56.139 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.639 -2.561 -55.726 1.00 0.00 H new ATOM 0 HG LEU A 77 1.992 -3.103 -55.566 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.189 -1.164 -54.646 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.669 -0.865 -56.321 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.775 -0.133 -54.967 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.808 -2.643 -53.160 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.372 -1.634 -53.458 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.317 -3.382 -53.791 1.00 0.00 H new ATOM 658 N ASN A 78 -1.488 -3.660 -58.565 1.00 0.00 N ATOM 659 CA ASN A 78 -2.796 -3.800 -59.194 1.00 0.00 C ATOM 660 C ASN A 78 -3.772 -4.530 -58.280 1.00 0.00 C ATOM 661 O ASN A 78 -3.534 -5.672 -57.887 1.00 0.00 O ATOM 662 CB ASN A 78 -2.673 -4.517 -60.526 1.00 0.00 C ATOM 663 CG ASN A 78 -1.706 -3.842 -61.459 1.00 0.00 C ATOM 664 OD1 ASN A 78 -0.736 -4.456 -61.918 1.00 0.00 O ATOM 665 ND2 ASN A 78 -1.952 -2.590 -61.748 1.00 0.00 N ATOM 0 H ASN A 78 -1.030 -4.544 -58.343 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.190 -2.800 -59.374 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.349 -5.543 -60.353 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.654 -4.567 -60.999 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -1.331 -2.080 -62.376 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -2.765 -2.124 -61.345 1.00 0.00 H new ATOM 672 N ILE A 79 -4.871 -3.864 -57.944 1.00 0.00 N ATOM 673 CA ILE A 79 -5.846 -4.415 -57.011 1.00 0.00 C ATOM 674 C ILE A 79 -7.210 -4.575 -57.669 1.00 0.00 C ATOM 675 O ILE A 79 -7.869 -3.589 -58.002 1.00 0.00 O ATOM 676 CB ILE A 79 -5.978 -3.522 -55.764 1.00 0.00 C ATOM 677 CG1 ILE A 79 -4.614 -3.331 -55.096 1.00 0.00 C ATOM 678 CG2 ILE A 79 -6.975 -4.121 -54.783 1.00 0.00 C ATOM 679 CD1 ILE A 79 -3.875 -2.097 -55.559 1.00 0.00 C ATOM 0 H ILE A 79 -5.109 -2.940 -58.305 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.486 -5.398 -56.709 1.00 0.00 H new ATOM 0 HB ILE A 79 -6.348 -2.545 -56.076 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.753 -3.276 -54.016 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.997 -4.208 -55.293 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.056 -3.477 -53.907 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.950 -4.206 -55.262 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.634 -5.110 -54.476 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.918 -2.030 -55.041 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.703 -2.158 -56.634 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.470 -1.211 -55.337 1.00 0.00 H new ATOM 691 N THR A 80 -7.630 -5.822 -57.854 1.00 0.00 N ATOM 692 CA THR A 80 -8.904 -6.113 -58.501 1.00 0.00 C ATOM 693 C THR A 80 -10.024 -6.240 -57.477 1.00 0.00 C ATOM 694 O THR A 80 -10.026 -7.156 -56.654 1.00 0.00 O ATOM 695 CB THR A 80 -8.819 -7.404 -59.337 1.00 0.00 C ATOM 696 OG1 THR A 80 -7.827 -7.248 -60.360 1.00 0.00 O ATOM 697 CG2 THR A 80 -10.162 -7.712 -59.981 1.00 0.00 C ATOM 0 H THR A 80 -7.106 -6.648 -57.565 1.00 0.00 H new ATOM 0 HA THR A 80 -9.128 -5.278 -59.164 1.00 0.00 H new ATOM 0 HB THR A 80 -8.546 -8.229 -58.679 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.772 -8.070 -60.890 1.00 0.00 H new ATOM 0 HG21 THR A 80 -10.083 -8.627 -60.568 1.00 0.00 H new ATOM 0 HG22 THR A 80 -10.916 -7.842 -59.205 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.451 -6.887 -60.633 1.00 0.00 H new ATOM 705 N LEU A 81 -10.977 -5.316 -57.532 1.00 0.00 N ATOM 706 CA LEU A 81 -12.113 -5.330 -56.618 1.00 0.00 C ATOM 707 C LEU A 81 -13.418 -5.577 -57.364 1.00 0.00 C ATOM 708 O LEU A 81 -14.091 -6.533 -57.096 1.00 0.00 O ATOM 709 CB LEU A 81 -12.196 -4.002 -55.855 1.00 0.00 C ATOM 710 CG LEU A 81 -10.961 -3.635 -55.022 1.00 0.00 C ATOM 711 CD1 LEU A 81 -11.149 -2.252 -54.416 1.00 0.00 C ATOM 712 CD2 LEU A 81 -10.749 -4.683 -53.940 1.00 0.00 C ATOM 0 H LEU A 81 -10.985 -4.546 -58.201 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.962 -6.145 -55.910 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -12.378 -3.202 -56.573 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.061 -4.038 -55.192 1.00 0.00 H new ATOM 0 HG LEU A 81 -10.076 -3.613 -55.658 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.271 -1.992 -53.824 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -11.279 -1.520 -55.213 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.031 -2.252 -53.776 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.872 -4.422 -53.348 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.625 -4.720 -53.293 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.598 -5.658 -54.403 1.00 0.00 H new TER 724 LEU A 81 ATOM 725 N ASP B 38 -15.933 8.023 -51.243 1.00 0.00 N ATOM 726 CA ASP B 38 -15.421 8.505 -49.965 1.00 0.00 C ATOM 727 C ASP B 38 -14.690 7.400 -49.214 1.00 0.00 C ATOM 728 O ASP B 38 -13.903 7.669 -48.306 1.00 0.00 O ATOM 729 CB ASP B 38 -16.561 9.050 -49.102 1.00 0.00 C ATOM 730 CG ASP B 38 -17.215 10.289 -49.697 1.00 0.00 C ATOM 731 OD1 ASP B 38 -16.511 11.101 -50.250 1.00 0.00 O ATOM 732 OD2 ASP B 38 -18.412 10.412 -49.593 1.00 0.00 O ATOM 0 HA ASP B 38 -14.714 9.308 -50.173 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -17.315 8.274 -48.973 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -16.177 9.289 -48.110 1.00 0.00 H new ATOM 737 N TYR B 39 -14.954 6.155 -49.597 1.00 0.00 N ATOM 738 CA TYR B 39 -14.386 5.004 -48.906 1.00 0.00 C ATOM 739 C TYR B 39 -13.003 4.665 -49.447 1.00 0.00 C ATOM 740 O TYR B 39 -12.010 4.724 -48.721 1.00 0.00 O ATOM 741 CB TYR B 39 -15.315 3.794 -49.028 1.00 0.00 C ATOM 742 CG TYR B 39 -14.796 2.554 -48.335 1.00 0.00 C ATOM 743 CD1 TYR B 39 -14.788 2.485 -46.950 1.00 0.00 C ATOM 744 CD2 TYR B 39 -14.329 1.485 -49.085 1.00 0.00 C ATOM 745 CE1 TYR B 39 -14.314 1.352 -46.317 1.00 0.00 C ATOM 746 CE2 TYR B 39 -13.855 0.352 -48.452 1.00 0.00 C ATOM 747 CZ TYR B 39 -13.847 0.284 -47.074 1.00 0.00 C ATOM 748 OH TYR B 39 -13.375 -0.844 -46.443 1.00 0.00 O ATOM 0 H TYR B 39 -15.559 5.918 -50.383 1.00 0.00 H new ATOM 0 HA TYR B 39 -14.283 5.263 -47.852 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -16.289 4.052 -48.611 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -15.469 3.571 -50.084 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -15.152 3.317 -46.366 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -14.336 1.538 -50.164 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -14.306 1.297 -45.238 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -13.491 -0.480 -49.036 1.00 0.00 H new ATOM 0 HH TYR B 39 -13.087 -1.498 -47.114 1.00 0.00 H new ATOM 758 N LEU B 40 -12.944 4.308 -50.725 1.00 0.00 N ATOM 759 CA LEU B 40 -11.697 3.875 -51.343 1.00 0.00 C ATOM 760 C LEU B 40 -10.718 5.034 -51.480 1.00 0.00 C ATOM 761 O LEU B 40 -9.522 4.882 -51.228 1.00 0.00 O ATOM 762 CB LEU B 40 -11.973 3.265 -52.724 1.00 0.00 C ATOM 763 CG LEU B 40 -12.714 1.922 -52.722 1.00 0.00 C ATOM 764 CD1 LEU B 40 -13.031 1.514 -54.154 1.00 0.00 C ATOM 765 CD2 LEU B 40 -11.857 0.871 -52.031 1.00 0.00 C ATOM 0 H LEU B 40 -13.747 4.310 -51.354 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.248 3.121 -50.697 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.555 3.979 -53.307 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.022 3.133 -53.239 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.653 2.015 -52.175 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.558 0.560 -54.152 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.659 2.274 -54.618 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.104 1.416 -54.718 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.383 -0.084 -52.029 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.912 0.764 -52.564 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.661 1.179 -51.004 1.00 0.00 H new ATOM 777 N PRO B 41 -11.232 6.192 -51.880 1.00 0.00 N ATOM 778 CA PRO B 41 -10.416 7.396 -51.986 1.00 0.00 C ATOM 779 C PRO B 41 -9.621 7.637 -50.709 1.00 0.00 C ATOM 780 O PRO B 41 -8.457 8.033 -50.756 1.00 0.00 O ATOM 781 CB PRO B 41 -11.456 8.496 -52.220 1.00 0.00 C ATOM 782 CG PRO B 41 -12.552 7.812 -52.963 1.00 0.00 C ATOM 783 CD PRO B 41 -12.662 6.461 -52.307 1.00 0.00 C ATOM 0 HA PRO B 41 -9.668 7.343 -52.777 1.00 0.00 H new ATOM 0 HB2 PRO B 41 -11.813 8.913 -51.278 1.00 0.00 H new ATOM 0 HB3 PRO B 41 -11.039 9.322 -52.797 1.00 0.00 H new ATOM 0 HG2 PRO B 41 -13.488 8.366 -52.890 1.00 0.00 H new ATOM 0 HG3 PRO B 41 -12.317 7.721 -54.023 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -13.344 6.476 -51.457 1.00 0.00 H new ATOM 0 HD3 PRO B 41 -13.030 5.702 -52.998 1.00 0.00 H new ATOM 791 N THR B 42 -10.258 7.396 -49.567 1.00 0.00 N ATOM 792 CA THR B 42 -9.602 7.558 -48.275 1.00 0.00 C ATOM 793 C THR B 42 -8.532 6.495 -48.063 1.00 0.00 C ATOM 794 O THR B 42 -7.420 6.797 -47.632 1.00 0.00 O ATOM 795 CB THR B 42 -10.623 7.502 -47.124 1.00 0.00 C ATOM 796 OG1 THR B 42 -11.571 8.567 -47.271 1.00 0.00 O ATOM 797 CG2 THR B 42 -9.921 7.635 -45.781 1.00 0.00 C ATOM 0 H THR B 42 -11.229 7.088 -49.511 1.00 0.00 H new ATOM 0 HA THR B 42 -9.126 8.538 -48.276 1.00 0.00 H new ATOM 0 HB THR B 42 -11.136 6.541 -47.160 1.00 0.00 H new ATOM 0 HG1 THR B 42 -12.354 8.243 -47.764 1.00 0.00 H new ATOM 0 HG21 THR B 42 -10.658 7.593 -44.979 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.208 6.819 -45.661 1.00 0.00 H new ATOM 0 HG23 THR B 42 -9.393 8.588 -45.739 1.00 0.00 H new ATOM 805 N LEU B 43 -8.876 5.248 -48.368 1.00 0.00 N ATOM 806 CA LEU B 43 -7.931 4.143 -48.253 1.00 0.00 C ATOM 807 C LEU B 43 -6.751 4.327 -49.198 1.00 0.00 C ATOM 808 O LEU B 43 -5.635 3.901 -48.903 1.00 0.00 O ATOM 809 CB LEU B 43 -8.633 2.813 -48.554 1.00 0.00 C ATOM 810 CG LEU B 43 -9.684 2.368 -47.529 1.00 0.00 C ATOM 811 CD1 LEU B 43 -10.373 1.104 -48.023 1.00 0.00 C ATOM 812 CD2 LEU B 43 -9.014 2.136 -46.183 1.00 0.00 C ATOM 0 H LEU B 43 -9.803 4.977 -48.697 1.00 0.00 H new ATOM 0 HA LEU B 43 -7.553 4.130 -47.231 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.113 2.890 -49.529 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -7.876 2.033 -48.632 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.439 3.145 -47.408 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.120 0.788 -47.294 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -10.859 1.304 -48.978 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -9.634 0.313 -48.151 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -9.761 1.820 -45.455 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -8.254 1.361 -46.284 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -8.546 3.061 -45.845 1.00 0.00 H new ATOM 824 N ARG B 44 -7.005 4.964 -50.336 1.00 0.00 N ATOM 825 CA ARG B 44 -5.953 5.251 -51.304 1.00 0.00 C ATOM 826 C ARG B 44 -4.958 6.265 -50.752 1.00 0.00 C ATOM 827 O ARG B 44 -3.749 6.123 -50.931 1.00 0.00 O ATOM 828 CB ARG B 44 -6.548 5.783 -52.600 1.00 0.00 C ATOM 829 CG ARG B 44 -7.218 4.734 -53.474 1.00 0.00 C ATOM 830 CD ARG B 44 -8.099 5.354 -54.497 1.00 0.00 C ATOM 831 NE ARG B 44 -7.368 6.267 -55.361 1.00 0.00 N ATOM 832 CZ ARG B 44 -7.911 6.944 -56.392 1.00 0.00 C ATOM 833 NH1 ARG B 44 -9.187 6.800 -56.674 1.00 0.00 N ATOM 834 NH2 ARG B 44 -7.160 7.752 -57.119 1.00 0.00 N ATOM 0 H ARG B 44 -7.931 5.292 -50.611 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.428 4.317 -51.503 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.279 6.554 -52.358 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -5.757 6.264 -53.176 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -6.456 4.130 -53.967 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -7.804 4.060 -52.849 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -8.559 4.572 -55.101 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -8.908 5.892 -54.002 1.00 0.00 H new ATOM 0 HE ARG B 44 -6.375 6.405 -55.174 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -9.766 6.176 -56.112 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -9.598 7.312 -57.454 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -6.170 7.863 -56.900 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -7.570 8.265 -57.900 1.00 0.00 H new ATOM 848 N LYS B 45 -5.475 7.288 -50.081 1.00 0.00 N ATOM 849 CA LYS B 45 -4.633 8.242 -49.371 1.00 0.00 C ATOM 850 C LYS B 45 -3.857 7.564 -48.249 1.00 0.00 C ATOM 851 O LYS B 45 -2.695 7.888 -48.000 1.00 0.00 O ATOM 852 CB LYS B 45 -5.476 9.388 -48.809 1.00 0.00 C ATOM 853 CG LYS B 45 -6.044 10.327 -49.864 1.00 0.00 C ATOM 854 CD LYS B 45 -6.915 11.404 -49.235 1.00 0.00 C ATOM 855 CE LYS B 45 -7.502 12.330 -50.290 1.00 0.00 C ATOM 856 NZ LYS B 45 -8.387 13.365 -49.692 1.00 0.00 N ATOM 0 H LYS B 45 -6.475 7.478 -50.014 1.00 0.00 H new ATOM 0 HA LYS B 45 -3.916 8.648 -50.085 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -6.300 8.968 -48.233 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -4.865 9.967 -48.116 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -5.228 10.793 -50.416 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -6.631 9.756 -50.584 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -7.721 10.937 -48.669 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -6.324 11.985 -48.527 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -6.694 12.816 -50.836 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -8.068 11.743 -51.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -8.766 13.975 -50.445 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -9.173 12.903 -49.192 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -7.842 13.942 -49.021 1.00 0.00 H new ATOM 870 N GLU B 46 -4.506 6.622 -47.573 1.00 0.00 N ATOM 871 CA GLU B 46 -3.852 5.838 -46.532 1.00 0.00 C ATOM 872 C GLU B 46 -2.682 5.041 -47.095 1.00 0.00 C ATOM 873 O GLU B 46 -1.640 4.913 -46.453 1.00 0.00 O ATOM 874 CB GLU B 46 -4.853 4.907 -45.863 1.00 0.00 C ATOM 0 H GLU B 46 -5.485 6.383 -47.728 1.00 0.00 H new ATOM 0 HA GLU B 46 -3.460 6.530 -45.786 1.00 0.00 H new ATOM 879 N LEU B 47 -2.861 4.507 -48.298 1.00 0.00 N ATOM 880 CA LEU B 47 -1.805 3.759 -48.970 1.00 0.00 C ATOM 881 C LEU B 47 -0.607 4.650 -49.274 1.00 0.00 C ATOM 882 O LEU B 47 0.541 4.217 -49.180 1.00 0.00 O ATOM 883 CB LEU B 47 -2.335 3.144 -50.271 1.00 0.00 C ATOM 884 CG LEU B 47 -3.297 1.961 -50.103 1.00 0.00 C ATOM 885 CD1 LEU B 47 -3.913 1.612 -51.451 1.00 0.00 C ATOM 886 CD2 LEU B 47 -2.544 0.773 -49.522 1.00 0.00 C ATOM 0 H LEU B 47 -3.729 4.578 -48.829 1.00 0.00 H new ATOM 0 HA LEU B 47 -1.481 2.963 -48.299 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.842 3.923 -50.840 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.485 2.815 -50.869 1.00 0.00 H new ATOM 0 HG LEU B 47 -4.100 2.228 -49.416 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -4.597 0.771 -51.332 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -4.460 2.473 -51.835 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -3.124 1.341 -52.153 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -3.227 -0.068 -49.402 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.735 0.490 -50.196 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.129 1.044 -48.551 1.00 0.00 H new ATOM 898 N MET B 48 -0.882 5.898 -49.638 1.00 0.00 N ATOM 899 CA MET B 48 0.171 6.882 -49.859 1.00 0.00 C ATOM 900 C MET B 48 1.019 7.071 -48.608 1.00 0.00 C ATOM 901 O MET B 48 2.248 7.103 -48.678 1.00 0.00 O ATOM 902 CB MET B 48 -0.434 8.213 -50.300 1.00 0.00 C ATOM 903 CG MET B 48 -1.116 8.175 -51.660 1.00 0.00 C ATOM 904 SD MET B 48 -1.849 9.760 -52.115 1.00 0.00 S ATOM 905 CE MET B 48 -0.394 10.672 -52.622 1.00 0.00 C ATOM 0 H MET B 48 -1.827 6.252 -49.786 1.00 0.00 H new ATOM 0 HA MET B 48 0.821 6.511 -50.651 1.00 0.00 H new ATOM 0 HB2 MET B 48 -1.160 8.534 -49.552 1.00 0.00 H new ATOM 0 HB3 MET B 48 0.354 8.966 -50.323 1.00 0.00 H new ATOM 0 HG2 MET B 48 -0.389 7.884 -52.418 1.00 0.00 H new ATOM 0 HG3 MET B 48 -1.892 7.409 -51.652 1.00 0.00 H new ATOM 0 HE1 MET B 48 -0.378 11.640 -52.121 1.00 0.00 H new ATOM 0 HE2 MET B 48 0.500 10.109 -52.353 1.00 0.00 H new ATOM 0 HE3 MET B 48 -0.417 10.823 -53.701 1.00 0.00 H new ATOM 915 N GLU B 49 0.356 7.197 -47.463 1.00 0.00 N ATOM 916 CA GLU B 49 1.047 7.265 -46.181 1.00 0.00 C ATOM 917 C GLU B 49 1.917 6.034 -45.959 1.00 0.00 C ATOM 918 O GLU B 49 3.074 6.146 -45.554 1.00 0.00 O ATOM 919 CB GLU B 49 0.039 7.401 -45.038 1.00 0.00 C ATOM 920 CG GLU B 49 0.664 7.459 -43.652 1.00 0.00 C ATOM 921 CD GLU B 49 -0.356 7.592 -42.555 1.00 0.00 C ATOM 922 OE1 GLU B 49 -1.519 7.699 -42.862 1.00 0.00 O ATOM 923 OE2 GLU B 49 0.028 7.587 -41.410 1.00 0.00 O ATOM 0 H GLU B 49 -0.660 7.254 -47.397 1.00 0.00 H new ATOM 0 HA GLU B 49 1.692 8.144 -46.196 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -0.551 8.304 -45.195 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -0.652 6.559 -45.077 1.00 0.00 H new ATOM 0 HG2 GLU B 49 1.253 6.557 -43.486 1.00 0.00 H new ATOM 0 HG3 GLU B 49 1.353 8.302 -43.605 1.00 0.00 H new ATOM 930 N VAL B 50 1.354 4.861 -46.226 1.00 0.00 N ATOM 931 CA VAL B 50 2.068 3.605 -46.029 1.00 0.00 C ATOM 932 C VAL B 50 3.339 3.557 -46.867 1.00 0.00 C ATOM 933 O VAL B 50 4.382 3.093 -46.405 1.00 0.00 O ATOM 934 CB VAL B 50 1.166 2.413 -46.401 1.00 0.00 C ATOM 935 CG1 VAL B 50 1.977 1.127 -46.449 1.00 0.00 C ATOM 936 CG2 VAL B 50 0.026 2.296 -45.402 1.00 0.00 C ATOM 0 H VAL B 50 0.403 4.754 -46.580 1.00 0.00 H new ATOM 0 HA VAL B 50 2.342 3.541 -44.976 1.00 0.00 H new ATOM 0 HB VAL B 50 0.745 2.583 -47.392 1.00 0.00 H new ATOM 0 HG11 VAL B 50 1.324 0.295 -46.713 1.00 0.00 H new ATOM 0 HG12 VAL B 50 2.765 1.221 -47.196 1.00 0.00 H new ATOM 0 HG13 VAL B 50 2.424 0.942 -45.472 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.608 1.451 -45.671 1.00 0.00 H new ATOM 0 HG22 VAL B 50 0.432 2.141 -44.403 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -0.565 3.212 -45.415 1.00 0.00 H new ATOM 946 N LEU B 51 3.247 4.040 -48.101 1.00 0.00 N ATOM 947 CA LEU B 51 4.389 4.049 -49.008 1.00 0.00 C ATOM 948 C LEU B 51 5.462 5.020 -48.533 1.00 0.00 C ATOM 949 O LEU B 51 6.656 4.747 -48.651 1.00 0.00 O ATOM 950 CB LEU B 51 3.938 4.428 -50.424 1.00 0.00 C ATOM 951 CG LEU B 51 3.048 3.401 -51.136 1.00 0.00 C ATOM 952 CD1 LEU B 51 2.443 4.031 -52.383 1.00 0.00 C ATOM 953 CD2 LEU B 51 3.873 2.173 -51.490 1.00 0.00 C ATOM 0 H LEU B 51 2.392 4.431 -48.497 1.00 0.00 H new ATOM 0 HA LEU B 51 4.815 3.046 -49.020 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.400 5.374 -50.373 1.00 0.00 H new ATOM 0 HB3 LEU B 51 4.825 4.598 -51.035 1.00 0.00 H new ATOM 0 HG LEU B 51 2.236 3.092 -50.478 1.00 0.00 H new ATOM 0 HD11 LEU B 51 1.811 3.301 -52.889 1.00 0.00 H new ATOM 0 HD12 LEU B 51 1.844 4.896 -52.099 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.241 4.347 -53.055 1.00 0.00 H new ATOM 0 HD21 LEU B 51 3.241 1.443 -51.996 1.00 0.00 H new ATOM 0 HD22 LEU B 51 4.692 2.462 -52.149 1.00 0.00 H new ATOM 0 HD23 LEU B 51 4.279 1.732 -50.579 1.00 0.00 H new ATOM 965 N SER B 52 5.029 6.155 -47.995 1.00 0.00 N ATOM 966 CA SER B 52 5.952 7.163 -47.487 1.00 0.00 C ATOM 967 C SER B 52 6.666 6.674 -46.234 1.00 0.00 C ATOM 968 O SER B 52 7.708 7.208 -45.853 1.00 0.00 O ATOM 969 CB SER B 52 5.206 8.449 -47.185 1.00 0.00 C ATOM 970 OG SER B 52 4.388 8.302 -46.057 1.00 0.00 O ATOM 0 H SER B 52 4.043 6.400 -47.899 1.00 0.00 H new ATOM 0 HA SER B 52 6.701 7.351 -48.256 1.00 0.00 H new ATOM 0 HB2 SER B 52 5.919 9.257 -47.019 1.00 0.00 H new ATOM 0 HB3 SER B 52 4.599 8.732 -48.045 1.00 0.00 H new ATOM 0 HG SER B 52 3.983 7.409 -46.060 1.00 0.00 H new ATOM 976 N LYS B 53 6.100 5.655 -45.596 1.00 0.00 N ATOM 977 CA LYS B 53 6.721 5.044 -44.426 1.00 0.00 C ATOM 978 C LYS B 53 7.591 3.858 -44.821 1.00 0.00 C ATOM 979 O LYS B 53 8.639 3.618 -44.222 1.00 0.00 O ATOM 980 CB LYS B 53 5.654 4.602 -43.423 1.00 0.00 C ATOM 981 CG LYS B 53 4.922 5.749 -42.738 1.00 0.00 C ATOM 982 CD LYS B 53 3.857 5.232 -41.783 1.00 0.00 C ATOM 983 CE LYS B 53 3.160 6.374 -41.058 1.00 0.00 C ATOM 984 NZ LYS B 53 2.055 5.889 -40.187 1.00 0.00 N ATOM 0 H LYS B 53 5.212 5.235 -45.869 1.00 0.00 H new ATOM 0 HA LYS B 53 7.359 5.794 -43.957 1.00 0.00 H new ATOM 0 HB2 LYS B 53 4.924 3.978 -43.939 1.00 0.00 H new ATOM 0 HB3 LYS B 53 6.124 3.980 -42.661 1.00 0.00 H new ATOM 0 HG2 LYS B 53 5.636 6.364 -42.191 1.00 0.00 H new ATOM 0 HG3 LYS B 53 4.460 6.389 -43.490 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.122 4.648 -42.337 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.314 4.562 -41.055 1.00 0.00 H new ATOM 0 HE2 LYS B 53 3.887 6.917 -40.453 1.00 0.00 H new ATOM 0 HE3 LYS B 53 2.763 7.079 -41.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 1.170 6.367 -40.451 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 1.943 4.862 -40.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.279 6.099 -39.193 1.00 0.00 H new ATOM 998 N TYR B 54 7.150 3.118 -45.833 1.00 0.00 N ATOM 999 CA TYR B 54 7.880 1.945 -46.299 1.00 0.00 C ATOM 1000 C TYR B 54 9.140 2.345 -47.057 1.00 0.00 C ATOM 1001 O TYR B 54 10.255 2.147 -46.574 1.00 0.00 O ATOM 1002 CB TYR B 54 6.985 1.073 -47.182 1.00 0.00 C ATOM 1003 CG TYR B 54 6.003 0.224 -46.406 1.00 0.00 C ATOM 1004 CD1 TYR B 54 5.928 0.337 -45.025 1.00 0.00 C ATOM 1005 CD2 TYR B 54 5.177 -0.667 -47.074 1.00 0.00 C ATOM 1006 CE1 TYR B 54 5.031 -0.438 -44.316 1.00 0.00 C ATOM 1007 CE2 TYR B 54 4.280 -1.442 -46.365 1.00 0.00 C ATOM 1008 CZ TYR B 54 4.206 -1.330 -44.992 1.00 0.00 C ATOM 1009 OH TYR B 54 3.312 -2.103 -44.286 1.00 0.00 O ATOM 0 H TYR B 54 6.290 3.310 -46.346 1.00 0.00 H new ATOM 0 HA TYR B 54 8.180 1.369 -45.424 1.00 0.00 H new ATOM 0 HB2 TYR B 54 6.433 1.714 -47.869 1.00 0.00 H new ATOM 0 HB3 TYR B 54 7.614 0.422 -47.789 1.00 0.00 H new ATOM 0 HD1 TYR B 54 6.571 1.031 -44.504 1.00 0.00 H new ATOM 0 HD2 TYR B 54 5.235 -0.755 -48.149 1.00 0.00 H new ATOM 0 HE1 TYR B 54 4.971 -0.351 -43.241 1.00 0.00 H new ATOM 0 HE2 TYR B 54 3.636 -2.136 -46.886 1.00 0.00 H new ATOM 0 HH TYR B 54 2.810 -2.672 -44.906 1.00 0.00 H new ATOM 1019 N VAL B 55 8.955 2.909 -48.245 1.00 0.00 N ATOM 1020 CA VAL B 55 10.068 3.174 -49.149 1.00 0.00 C ATOM 1021 C VAL B 55 10.456 4.647 -49.127 1.00 0.00 C ATOM 1022 O VAL B 55 11.328 5.081 -49.881 1.00 0.00 O ATOM 1023 CB VAL B 55 9.699 2.765 -50.587 1.00 0.00 C ATOM 1024 CG1 VAL B 55 9.390 1.277 -50.654 1.00 0.00 C ATOM 1025 CG2 VAL B 55 8.512 3.584 -51.070 1.00 0.00 C ATOM 0 H VAL B 55 8.044 3.192 -48.605 1.00 0.00 H new ATOM 0 HA VAL B 55 10.919 2.583 -48.809 1.00 0.00 H new ATOM 0 HB VAL B 55 10.549 2.964 -51.240 1.00 0.00 H new ATOM 0 HG11 VAL B 55 9.131 1.005 -51.677 1.00 0.00 H new ATOM 0 HG12 VAL B 55 10.265 0.709 -50.338 1.00 0.00 H new ATOM 0 HG13 VAL B 55 8.552 1.049 -49.995 1.00 0.00 H new ATOM 0 HG21 VAL B 55 8.257 3.289 -52.088 1.00 0.00 H new ATOM 0 HG22 VAL B 55 7.658 3.408 -50.416 1.00 0.00 H new ATOM 0 HG23 VAL B 55 8.769 4.643 -51.053 1.00 0.00 H new ATOM 1035 N ASN B 56 9.805 5.413 -48.259 1.00 0.00 N ATOM 1036 CA ASN B 56 10.155 6.814 -48.058 1.00 0.00 C ATOM 1037 C ASN B 56 10.011 7.608 -49.350 1.00 0.00 C ATOM 1038 O ASN B 56 10.703 8.605 -49.558 1.00 0.00 O ATOM 1039 CB ASN B 56 11.565 6.938 -47.510 1.00 0.00 C ATOM 1040 CG ASN B 56 11.711 6.323 -46.146 1.00 0.00 C ATOM 1041 OD1 ASN B 56 10.849 6.500 -45.276 1.00 0.00 O ATOM 1042 ND2 ASN B 56 12.784 5.604 -45.941 1.00 0.00 N ATOM 0 H ASN B 56 9.030 5.086 -47.682 1.00 0.00 H new ATOM 0 HA ASN B 56 9.461 7.232 -47.328 1.00 0.00 H new ATOM 0 HB2 ASN B 56 12.262 6.458 -48.197 1.00 0.00 H new ATOM 0 HB3 ASN B 56 11.841 7.991 -47.461 1.00 0.00 H new ATOM 0 HD21 ASN B 56 12.936 5.162 -45.034 1.00 0.00 H new ATOM 0 HD22 ASN B 56 13.469 5.485 -46.688 1.00 0.00 H new ATOM 1049 N VAL B 57 9.107 7.161 -50.216 1.00 0.00 N ATOM 1050 CA VAL B 57 8.798 7.885 -51.443 1.00 0.00 C ATOM 1051 C VAL B 57 8.013 9.157 -51.149 1.00 0.00 C ATOM 1052 O VAL B 57 7.302 9.241 -50.148 1.00 0.00 O ATOM 1053 CB VAL B 57 7.984 6.992 -52.399 1.00 0.00 C ATOM 1054 CG1 VAL B 57 6.596 6.732 -51.833 1.00 0.00 C ATOM 1055 CG2 VAL B 57 7.894 7.648 -53.768 1.00 0.00 C ATOM 0 H VAL B 57 8.575 6.300 -50.090 1.00 0.00 H new ATOM 0 HA VAL B 57 9.742 8.159 -51.913 1.00 0.00 H new ATOM 0 HB VAL B 57 8.490 6.032 -52.504 1.00 0.00 H new ATOM 0 HG11 VAL B 57 6.035 6.100 -52.521 1.00 0.00 H new ATOM 0 HG12 VAL B 57 6.684 6.230 -50.869 1.00 0.00 H new ATOM 0 HG13 VAL B 57 6.073 7.679 -51.702 1.00 0.00 H new ATOM 0 HG21 VAL B 57 7.317 7.012 -54.439 1.00 0.00 H new ATOM 0 HG22 VAL B 57 7.403 8.617 -53.676 1.00 0.00 H new ATOM 0 HG23 VAL B 57 8.897 7.786 -54.172 1.00 0.00 H new ATOM 1065 N SER B 58 8.147 10.145 -52.027 1.00 0.00 N ATOM 1066 CA SER B 58 7.458 11.419 -51.858 1.00 0.00 C ATOM 1067 C SER B 58 6.044 11.360 -52.421 1.00 0.00 C ATOM 1068 O SER B 58 5.778 10.640 -53.384 1.00 0.00 O ATOM 1069 CB SER B 58 8.237 12.527 -52.538 1.00 0.00 C ATOM 1070 OG SER B 58 7.535 13.739 -52.487 1.00 0.00 O ATOM 0 H SER B 58 8.727 10.088 -52.864 1.00 0.00 H new ATOM 0 HA SER B 58 7.392 11.626 -50.790 1.00 0.00 H new ATOM 0 HB2 SER B 58 9.207 12.644 -52.055 1.00 0.00 H new ATOM 0 HB3 SER B 58 8.429 12.257 -53.577 1.00 0.00 H new ATOM 0 HG SER B 58 8.058 14.439 -52.930 1.00 0.00 H new ATOM 1076 N LEU B 59 5.139 12.121 -51.815 1.00 0.00 N ATOM 1077 CA LEU B 59 3.731 12.084 -52.192 1.00 0.00 C ATOM 1078 C LEU B 59 3.544 12.452 -53.658 1.00 0.00 C ATOM 1079 O LEU B 59 2.733 11.848 -54.361 1.00 0.00 O ATOM 1080 CB LEU B 59 2.921 13.043 -51.310 1.00 0.00 C ATOM 1081 CG LEU B 59 2.837 12.670 -49.824 1.00 0.00 C ATOM 1082 CD1 LEU B 59 2.145 13.789 -49.058 1.00 0.00 C ATOM 1083 CD2 LEU B 59 2.085 11.357 -49.672 1.00 0.00 C ATOM 0 H LEU B 59 5.356 12.772 -51.060 1.00 0.00 H new ATOM 0 HA LEU B 59 3.372 11.066 -52.045 1.00 0.00 H new ATOM 0 HB2 LEU B 59 3.357 14.039 -51.392 1.00 0.00 H new ATOM 0 HB3 LEU B 59 1.908 13.105 -51.708 1.00 0.00 H new ATOM 0 HG LEU B 59 3.839 12.541 -49.415 1.00 0.00 H new ATOM 0 HD11 LEU B 59 2.085 13.524 -48.002 1.00 0.00 H new ATOM 0 HD12 LEU B 59 2.714 14.712 -49.169 1.00 0.00 H new ATOM 0 HD13 LEU B 59 1.140 13.933 -49.454 1.00 0.00 H new ATOM 0 HD21 LEU B 59 2.025 11.092 -48.616 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.079 11.465 -50.076 1.00 0.00 H new ATOM 0 HD23 LEU B 59 2.611 10.571 -50.214 1.00 0.00 H new ATOM 1095 N ASP B 60 4.298 13.446 -54.115 1.00 0.00 N ATOM 1096 CA ASP B 60 4.266 13.851 -55.515 1.00 0.00 C ATOM 1097 C ASP B 60 4.739 12.725 -56.425 1.00 0.00 C ATOM 1098 O ASP B 60 4.411 12.693 -57.611 1.00 0.00 O ATOM 1099 CB ASP B 60 5.134 15.092 -55.734 1.00 0.00 C ATOM 1100 CG ASP B 60 4.529 16.353 -55.132 1.00 0.00 C ATOM 1101 OD1 ASP B 60 3.369 16.329 -54.796 1.00 0.00 O ATOM 1102 OD2 ASP B 60 5.232 17.328 -55.015 1.00 0.00 O ATOM 0 H ASP B 60 4.940 13.987 -53.535 1.00 0.00 H new ATOM 0 HA ASP B 60 3.232 14.088 -55.767 1.00 0.00 H new ATOM 0 HB2 ASP B 60 6.118 14.923 -55.296 1.00 0.00 H new ATOM 0 HB3 ASP B 60 5.282 15.241 -56.804 1.00 0.00 H new ATOM 1107 N ASN B 61 5.513 11.802 -55.863 1.00 0.00 N ATOM 1108 CA ASN B 61 6.054 10.686 -56.629 1.00 0.00 C ATOM 1109 C ASN B 61 5.183 9.445 -56.483 1.00 0.00 C ATOM 1110 O ASN B 61 5.597 8.340 -56.835 1.00 0.00 O ATOM 1111 CB ASN B 61 7.481 10.390 -56.206 1.00 0.00 C ATOM 1112 CG ASN B 61 8.447 11.454 -56.649 1.00 0.00 C ATOM 1113 OD1 ASN B 61 8.240 12.109 -57.677 1.00 0.00 O ATOM 1114 ND2 ASN B 61 9.499 11.639 -55.892 1.00 0.00 N ATOM 0 H ASN B 61 5.780 11.805 -54.878 1.00 0.00 H new ATOM 0 HA ASN B 61 6.057 10.971 -57.681 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.522 10.296 -55.121 1.00 0.00 H new ATOM 0 HB3 ASN B 61 7.788 9.430 -56.621 1.00 0.00 H new ATOM 0 HD21 ASN B 61 10.189 12.347 -56.142 1.00 0.00 H new ATOM 0 HD22 ASN B 61 9.629 11.075 -55.052 1.00 0.00 H new ATOM 1121 N ILE B 62 3.975 9.633 -55.963 1.00 0.00 N ATOM 1122 CA ILE B 62 2.981 8.567 -55.930 1.00 0.00 C ATOM 1123 C ILE B 62 1.809 8.878 -56.852 1.00 0.00 C ATOM 1124 O ILE B 62 1.181 9.931 -56.740 1.00 0.00 O ATOM 1125 CB ILE B 62 2.462 8.345 -54.497 1.00 0.00 C ATOM 1126 CG1 ILE B 62 3.621 8.006 -53.556 1.00 0.00 C ATOM 1127 CG2 ILE B 62 1.415 7.242 -54.476 1.00 0.00 C ATOM 1128 CD1 ILE B 62 3.236 7.992 -52.094 1.00 0.00 C ATOM 0 H ILE B 62 3.660 10.515 -55.558 1.00 0.00 H new ATOM 0 HA ILE B 62 3.469 7.657 -56.278 1.00 0.00 H new ATOM 0 HB ILE B 62 1.996 9.267 -54.150 1.00 0.00 H new ATOM 0 HG12 ILE B 62 4.022 7.029 -53.826 1.00 0.00 H new ATOM 0 HG13 ILE B 62 4.421 8.731 -53.704 1.00 0.00 H new ATOM 0 HG21 ILE B 62 1.059 7.098 -53.456 1.00 0.00 H new ATOM 0 HG22 ILE B 62 0.579 7.522 -55.116 1.00 0.00 H new ATOM 0 HG23 ILE B 62 1.856 6.314 -54.841 1.00 0.00 H new ATOM 0 HD11 ILE B 62 4.109 7.744 -51.490 1.00 0.00 H new ATOM 0 HD12 ILE B 62 2.863 8.975 -51.806 1.00 0.00 H new ATOM 0 HD13 ILE B 62 2.458 7.247 -51.930 1.00 0.00 H new ATOM 1140 N ARG B 63 1.520 7.956 -57.764 1.00 0.00 N ATOM 1141 CA ARG B 63 0.365 8.084 -58.644 1.00 0.00 C ATOM 1142 C ARG B 63 -0.602 6.922 -58.455 1.00 0.00 C ATOM 1143 O ARG B 63 -0.242 5.763 -58.660 1.00 0.00 O ATOM 1144 CB ARG B 63 0.803 8.144 -60.099 1.00 0.00 C ATOM 1145 CG ARG B 63 -0.312 8.428 -61.093 1.00 0.00 C ATOM 1146 CD ARG B 63 0.187 8.437 -62.492 1.00 0.00 C ATOM 1147 NE ARG B 63 0.495 7.097 -62.966 1.00 0.00 N ATOM 1148 CZ ARG B 63 0.922 6.806 -64.210 1.00 0.00 C ATOM 1149 NH1 ARG B 63 1.086 7.768 -65.091 1.00 0.00 N ATOM 1150 NH2 ARG B 63 1.176 5.553 -64.545 1.00 0.00 N ATOM 0 H ARG B 63 2.071 7.111 -57.913 1.00 0.00 H new ATOM 0 HA ARG B 63 -0.145 9.011 -58.382 1.00 0.00 H new ATOM 0 HB2 ARG B 63 1.566 8.915 -60.202 1.00 0.00 H new ATOM 0 HB3 ARG B 63 1.271 7.195 -60.362 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -1.092 7.674 -60.990 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -0.768 9.391 -60.863 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -0.562 8.889 -63.142 1.00 0.00 H new ATOM 0 HD3 ARG B 63 1.080 9.059 -62.555 1.00 0.00 H new ATOM 0 HE ARG B 63 0.380 6.324 -62.311 1.00 0.00 H new ATOM 0 HH11 ARG B 63 0.890 8.735 -64.833 1.00 0.00 H new ATOM 0 HH12 ARG B 63 1.409 7.547 -66.033 1.00 0.00 H new ATOM 0 HH21 ARG B 63 1.049 4.807 -63.862 1.00 0.00 H new ATOM 0 HH22 ARG B 63 1.499 5.332 -65.487 1.00 0.00 H new ATOM 1164 N ILE B 64 -1.832 7.240 -58.065 1.00 0.00 N ATOM 1165 CA ILE B 64 -2.850 6.221 -57.836 1.00 0.00 C ATOM 1166 C ILE B 64 -4.072 6.457 -58.716 1.00 0.00 C ATOM 1167 O ILE B 64 -4.618 7.559 -58.754 1.00 0.00 O ATOM 1168 CB ILE B 64 -3.279 6.195 -56.358 1.00 0.00 C ATOM 1169 CG1 ILE B 64 -2.065 5.965 -55.454 1.00 0.00 C ATOM 1170 CG2 ILE B 64 -4.329 5.120 -56.127 1.00 0.00 C ATOM 1171 CD1 ILE B 64 -2.392 5.971 -53.978 1.00 0.00 C ATOM 0 H ILE B 64 -2.148 8.196 -57.901 1.00 0.00 H new ATOM 0 HA ILE B 64 -2.410 5.258 -58.096 1.00 0.00 H new ATOM 0 HB ILE B 64 -3.717 7.161 -56.108 1.00 0.00 H new ATOM 0 HG12 ILE B 64 -1.608 5.009 -55.711 1.00 0.00 H new ATOM 0 HG13 ILE B 64 -1.323 6.737 -55.655 1.00 0.00 H new ATOM 0 HG21 ILE B 64 -4.621 5.116 -55.077 1.00 0.00 H new ATOM 0 HG22 ILE B 64 -5.203 5.326 -56.745 1.00 0.00 H new ATOM 0 HG23 ILE B 64 -3.918 4.146 -56.393 1.00 0.00 H new ATOM 0 HD11 ILE B 64 -1.482 5.802 -53.403 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -2.820 6.935 -53.704 1.00 0.00 H new ATOM 0 HD13 ILE B 64 -3.110 5.180 -53.761 1.00 0.00 H new ATOM 1183 N SER B 65 -4.496 5.414 -59.422 1.00 0.00 N ATOM 1184 CA SER B 65 -5.580 5.534 -60.390 1.00 0.00 C ATOM 1185 C SER B 65 -6.675 4.511 -60.120 1.00 0.00 C ATOM 1186 O SER B 65 -6.396 3.376 -59.734 1.00 0.00 O ATOM 1187 CB SER B 65 -5.044 5.357 -61.797 1.00 0.00 C ATOM 1188 OG SER B 65 -6.081 5.404 -62.738 1.00 0.00 O ATOM 0 H SER B 65 -4.105 4.475 -59.342 1.00 0.00 H new ATOM 0 HA SER B 65 -6.012 6.530 -60.291 1.00 0.00 H new ATOM 0 HB2 SER B 65 -4.316 6.138 -62.014 1.00 0.00 H new ATOM 0 HB3 SER B 65 -4.521 4.404 -61.874 1.00 0.00 H new ATOM 0 HG SER B 65 -5.711 5.289 -63.638 1.00 0.00 H new ATOM 1194 N GLN B 66 -7.923 4.919 -60.326 1.00 0.00 N ATOM 1195 CA GLN B 66 -9.060 4.023 -60.153 1.00 0.00 C ATOM 1196 C GLN B 66 -9.947 4.013 -61.391 1.00 0.00 C ATOM 1197 O GLN B 66 -10.390 5.063 -61.857 1.00 0.00 O ATOM 1198 CB GLN B 66 -9.880 4.429 -58.926 1.00 0.00 C ATOM 1199 CG GLN B 66 -11.083 3.540 -58.660 1.00 0.00 C ATOM 1200 CD GLN B 66 -11.823 3.931 -57.394 1.00 0.00 C ATOM 1201 OE1 GLN B 66 -11.403 4.836 -56.667 1.00 0.00 O ATOM 1202 NE2 GLN B 66 -12.931 3.251 -57.123 1.00 0.00 N ATOM 0 H GLN B 66 -8.172 5.865 -60.613 1.00 0.00 H new ATOM 0 HA GLN B 66 -8.670 3.016 -60.003 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -9.232 4.417 -58.049 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.222 5.456 -59.055 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -11.766 3.594 -59.508 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -10.755 2.504 -58.580 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -13.242 2.511 -57.752 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -13.471 3.469 -56.286 1.00 0.00 H new ATOM 1211 N GLU B 67 -10.202 2.822 -61.921 1.00 0.00 N ATOM 1212 CA GLU B 67 -11.000 2.677 -63.133 1.00 0.00 C ATOM 1213 C GLU B 67 -11.728 1.339 -63.156 1.00 0.00 C ATOM 1214 O GLU B 67 -11.394 0.426 -62.401 1.00 0.00 O ATOM 1215 CB GLU B 67 -10.114 2.809 -64.373 1.00 0.00 C ATOM 1216 CG GLU B 67 -9.079 1.703 -64.527 1.00 0.00 C ATOM 1217 CD GLU B 67 -8.213 1.878 -65.743 1.00 0.00 C ATOM 1218 OE1 GLU B 67 -8.406 2.834 -66.455 1.00 0.00 O ATOM 1219 OE2 GLU B 67 -7.356 1.054 -65.961 1.00 0.00 O ATOM 0 H GLU B 67 -9.867 1.942 -61.530 1.00 0.00 H new ATOM 0 HA GLU B 67 -11.745 3.473 -63.139 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -10.749 2.821 -65.259 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -9.599 3.769 -64.336 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -8.448 1.676 -63.639 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -9.588 0.741 -64.585 1.00 0.00 H new ATOM 1226 N LYS B 68 -12.724 1.229 -64.029 1.00 0.00 N ATOM 1227 CA LYS B 68 -13.499 0.000 -64.155 1.00 0.00 C ATOM 1228 C LYS B 68 -13.294 -0.642 -65.521 1.00 0.00 C ATOM 1229 O LYS B 68 -13.769 -0.132 -66.535 1.00 0.00 O ATOM 1230 CB LYS B 68 -14.985 0.277 -63.922 1.00 0.00 C ATOM 1231 CG LYS B 68 -15.871 -0.961 -63.968 1.00 0.00 C ATOM 1232 CD LYS B 68 -17.323 -0.612 -63.680 1.00 0.00 C ATOM 1233 CE LYS B 68 -18.213 -1.844 -63.748 1.00 0.00 C ATOM 1234 NZ LYS B 68 -19.637 -1.519 -63.460 1.00 0.00 N ATOM 0 H LYS B 68 -13.014 1.976 -64.660 1.00 0.00 H new ATOM 0 HA LYS B 68 -13.146 -0.696 -63.394 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -15.104 0.758 -62.951 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -15.332 0.985 -64.674 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -15.795 -1.429 -64.949 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -15.518 -1.690 -63.239 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -17.401 -0.159 -62.692 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -17.670 0.130 -64.399 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -18.137 -2.292 -64.739 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -17.859 -2.587 -63.033 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -20.209 -2.386 -63.517 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -19.715 -1.115 -62.505 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -19.983 -0.829 -64.157 1.00 0.00 H new ATOM 1248 N GLN B 69 -12.584 -1.765 -65.541 1.00 0.00 N ATOM 1249 CA GLN B 69 -12.212 -2.415 -66.792 1.00 0.00 C ATOM 1250 C GLN B 69 -12.521 -3.906 -66.752 1.00 0.00 C ATOM 1251 O GLN B 69 -12.190 -4.592 -65.786 1.00 0.00 O ATOM 1252 CB GLN B 69 -10.725 -2.197 -67.087 1.00 0.00 C ATOM 1253 CG GLN B 69 -10.234 -2.886 -68.349 1.00 0.00 C ATOM 1254 CD GLN B 69 -10.810 -2.267 -69.608 1.00 0.00 C ATOM 1255 OE1 GLN B 69 -10.738 -1.051 -69.808 1.00 0.00 O ATOM 1256 NE2 GLN B 69 -11.387 -3.101 -70.466 1.00 0.00 N ATOM 0 H GLN B 69 -12.254 -2.245 -64.703 1.00 0.00 H new ATOM 0 HA GLN B 69 -12.803 -1.965 -67.589 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -10.536 -1.127 -67.173 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -10.141 -2.556 -66.239 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -9.146 -2.835 -68.388 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -10.502 -3.942 -68.311 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -11.424 -4.099 -70.260 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -11.793 -2.743 -71.331 1.00 0.00 H new ATOM 1265 N ASP B 70 -13.158 -4.401 -67.807 1.00 0.00 N ATOM 1266 CA ASP B 70 -13.538 -5.807 -67.883 1.00 0.00 C ATOM 1267 C ASP B 70 -14.498 -6.179 -66.761 1.00 0.00 C ATOM 1268 O ASP B 70 -14.538 -7.329 -66.322 1.00 0.00 O ATOM 1269 CB ASP B 70 -12.297 -6.701 -67.820 1.00 0.00 C ATOM 1270 CG ASP B 70 -11.340 -6.470 -68.982 1.00 0.00 C ATOM 1271 OD1 ASP B 70 -11.777 -5.982 -69.997 1.00 0.00 O ATOM 1272 OD2 ASP B 70 -10.182 -6.784 -68.843 1.00 0.00 O ATOM 0 H ASP B 70 -13.423 -3.849 -68.623 1.00 0.00 H new ATOM 0 HA ASP B 70 -14.044 -5.963 -68.836 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -11.772 -6.520 -66.882 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -12.608 -7.746 -67.814 1.00 0.00 H new ATOM 1277 N GLY B 71 -15.269 -5.201 -66.299 1.00 0.00 N ATOM 1278 CA GLY B 71 -16.338 -5.455 -65.341 1.00 0.00 C ATOM 1279 C GLY B 71 -15.876 -5.184 -63.915 1.00 0.00 C ATOM 1280 O GLY B 71 -16.692 -4.973 -63.018 1.00 0.00 O ATOM 0 H GLY B 71 -15.173 -4.223 -66.573 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -17.196 -4.824 -65.574 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -16.670 -6.490 -65.428 1.00 0.00 H new ATOM 1284 N MET B 72 -14.563 -5.190 -63.713 1.00 0.00 N ATOM 1285 CA MET B 72 -13.994 -5.095 -62.374 1.00 0.00 C ATOM 1286 C MET B 72 -13.438 -3.702 -62.109 1.00 0.00 C ATOM 1287 O MET B 72 -13.039 -2.996 -63.036 1.00 0.00 O ATOM 1288 CB MET B 72 -12.904 -6.148 -62.188 1.00 0.00 C ATOM 1289 CG MET B 72 -13.339 -7.570 -62.513 1.00 0.00 C ATOM 1290 SD MET B 72 -14.658 -8.158 -61.432 1.00 0.00 S ATOM 1291 CE MET B 72 -13.768 -8.360 -59.892 1.00 0.00 C ATOM 0 H MET B 72 -13.872 -5.260 -64.460 1.00 0.00 H new ATOM 0 HA MET B 72 -14.791 -5.280 -61.654 1.00 0.00 H new ATOM 0 HB2 MET B 72 -12.054 -5.888 -62.819 1.00 0.00 H new ATOM 0 HB3 MET B 72 -12.557 -6.115 -61.155 1.00 0.00 H new ATOM 0 HG2 MET B 72 -13.676 -7.615 -63.549 1.00 0.00 H new ATOM 0 HG3 MET B 72 -12.481 -8.237 -62.428 1.00 0.00 H new ATOM 0 HE1 MET B 72 -14.385 -8.915 -59.185 1.00 0.00 H new ATOM 0 HE2 MET B 72 -12.844 -8.908 -60.075 1.00 0.00 H new ATOM 0 HE3 MET B 72 -13.532 -7.380 -59.477 1.00 0.00 H new ATOM 1301 N ASP B 73 -13.414 -3.311 -60.840 1.00 0.00 N ATOM 1302 CA ASP B 73 -12.851 -2.026 -60.444 1.00 0.00 C ATOM 1303 C ASP B 73 -11.415 -2.180 -59.959 1.00 0.00 C ATOM 1304 O ASP B 73 -11.165 -2.759 -58.902 1.00 0.00 O ATOM 1305 CB ASP B 73 -13.700 -1.382 -59.346 1.00 0.00 C ATOM 1306 CG ASP B 73 -13.201 -0.001 -58.943 1.00 0.00 C ATOM 1307 OD1 ASP B 73 -12.089 0.329 -59.280 1.00 0.00 O ATOM 1308 OD2 ASP B 73 -13.937 0.711 -58.302 1.00 0.00 O ATOM 0 H ASP B 73 -13.779 -3.867 -60.066 1.00 0.00 H new ATOM 0 HA ASP B 73 -12.853 -1.381 -61.322 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -14.731 -1.304 -59.690 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -13.705 -2.031 -58.470 1.00 0.00 H new ATOM 1313 N VAL B 74 -10.473 -1.658 -60.738 1.00 0.00 N ATOM 1314 CA VAL B 74 -9.058 -1.933 -60.519 1.00 0.00 C ATOM 1315 C VAL B 74 -8.325 -0.690 -60.033 1.00 0.00 C ATOM 1316 O VAL B 74 -8.367 0.359 -60.676 1.00 0.00 O ATOM 1317 CB VAL B 74 -8.404 -2.437 -61.819 1.00 0.00 C ATOM 1318 CG1 VAL B 74 -6.917 -2.682 -61.606 1.00 0.00 C ATOM 1319 CG2 VAL B 74 -9.098 -3.706 -62.290 1.00 0.00 C ATOM 0 H VAL B 74 -10.665 -1.041 -61.528 1.00 0.00 H new ATOM 0 HA VAL B 74 -8.985 -2.703 -59.751 1.00 0.00 H new ATOM 0 HB VAL B 74 -8.514 -1.674 -62.590 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -6.470 -3.038 -62.534 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -6.435 -1.752 -61.304 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -6.780 -3.432 -60.827 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -8.630 -4.057 -63.210 1.00 0.00 H new ATOM 0 HG22 VAL B 74 -9.010 -4.475 -61.522 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -10.152 -3.497 -62.476 1.00 0.00 H new ATOM 1329 N LEU B 75 -7.651 -0.813 -58.894 1.00 0.00 N ATOM 1330 CA LEU B 75 -6.761 0.236 -58.413 1.00 0.00 C ATOM 1331 C LEU B 75 -5.339 0.025 -58.916 1.00 0.00 C ATOM 1332 O LEU B 75 -4.858 -1.105 -58.993 1.00 0.00 O ATOM 1333 CB LEU B 75 -6.766 0.274 -56.879 1.00 0.00 C ATOM 1334 CG LEU B 75 -8.130 0.531 -56.225 1.00 0.00 C ATOM 1335 CD1 LEU B 75 -8.007 0.376 -54.716 1.00 0.00 C ATOM 1336 CD2 LEU B 75 -8.615 1.925 -56.594 1.00 0.00 C ATOM 0 H LEU B 75 -7.705 -1.631 -58.286 1.00 0.00 H new ATOM 0 HA LEU B 75 -7.126 1.187 -58.800 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -6.379 -0.676 -56.509 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -6.074 1.050 -56.551 1.00 0.00 H new ATOM 0 HG LEU B 75 -8.859 -0.194 -56.587 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -8.976 0.559 -54.251 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -7.676 -0.635 -54.480 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -7.281 1.094 -54.335 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -9.584 2.108 -56.130 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -7.898 2.665 -56.240 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -8.711 2.002 -57.677 1.00 0.00 H new ATOM 1348 N GLU B 76 -4.669 1.121 -59.259 1.00 0.00 N ATOM 1349 CA GLU B 76 -3.268 1.070 -59.657 1.00 0.00 C ATOM 1350 C GLU B 76 -2.434 2.071 -58.867 1.00 0.00 C ATOM 1351 O GLU B 76 -2.775 3.251 -58.789 1.00 0.00 O ATOM 1352 CB GLU B 76 -3.128 1.344 -61.156 1.00 0.00 C ATOM 1353 CG GLU B 76 -1.693 1.335 -61.665 1.00 0.00 C ATOM 1354 CD GLU B 76 -1.593 1.635 -63.135 1.00 0.00 C ATOM 1355 OE1 GLU B 76 -2.609 1.663 -63.787 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -0.498 1.836 -63.606 1.00 0.00 O ATOM 0 H GLU B 76 -5.075 2.056 -59.269 1.00 0.00 H new ATOM 0 HA GLU B 76 -2.897 0.068 -59.441 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -3.700 0.596 -61.705 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -3.574 2.313 -61.379 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -1.111 2.070 -61.109 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -1.248 0.360 -61.467 1.00 0.00 H new ATOM 1363 N LEU B 77 -1.341 1.593 -58.283 1.00 0.00 N ATOM 1364 CA LEU B 77 -0.390 2.466 -57.605 1.00 0.00 C ATOM 1365 C LEU B 77 0.959 2.467 -58.313 1.00 0.00 C ATOM 1366 O LEU B 77 1.508 1.411 -58.624 1.00 0.00 O ATOM 1367 CB LEU B 77 -0.210 2.023 -56.148 1.00 0.00 C ATOM 1368 CG LEU B 77 -1.422 2.236 -55.233 1.00 0.00 C ATOM 1369 CD1 LEU B 77 -2.328 1.013 -55.296 1.00 0.00 C ATOM 1370 CD2 LEU B 77 -0.946 2.492 -53.810 1.00 0.00 C ATOM 0 H LEU B 77 -1.091 0.604 -58.265 1.00 0.00 H new ATOM 0 HA LEU B 77 -0.791 3.479 -57.628 1.00 0.00 H new ATOM 0 HB2 LEU B 77 0.047 0.964 -56.139 1.00 0.00 H new ATOM 0 HB3 LEU B 77 0.639 2.561 -55.726 1.00 0.00 H new ATOM 0 HG LEU B 77 -1.992 3.103 -55.566 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.189 1.164 -54.646 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -2.669 0.865 -56.321 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -1.775 0.133 -54.967 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -1.808 2.643 -53.160 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.372 1.634 -53.458 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -0.317 3.382 -53.791 1.00 0.00 H new ATOM 1382 N ASN B 78 1.488 3.660 -58.565 1.00 0.00 N ATOM 1383 CA ASN B 78 2.796 3.800 -59.194 1.00 0.00 C ATOM 1384 C ASN B 78 3.772 4.530 -58.280 1.00 0.00 C ATOM 1385 O ASN B 78 3.534 5.672 -57.887 1.00 0.00 O ATOM 1386 CB ASN B 78 2.673 4.517 -60.526 1.00 0.00 C ATOM 1387 CG ASN B 78 1.706 3.842 -61.459 1.00 0.00 C ATOM 1388 OD1 ASN B 78 0.736 4.456 -61.918 1.00 0.00 O ATOM 1389 ND2 ASN B 78 1.952 2.590 -61.748 1.00 0.00 N ATOM 0 H ASN B 78 1.030 4.544 -58.343 1.00 0.00 H new ATOM 0 HA ASN B 78 3.190 2.800 -59.374 1.00 0.00 H new ATOM 0 HB2 ASN B 78 2.349 5.543 -60.353 1.00 0.00 H new ATOM 0 HB3 ASN B 78 3.654 4.567 -60.999 1.00 0.00 H new ATOM 0 HD21 ASN B 78 1.331 2.080 -62.376 1.00 0.00 H new ATOM 0 HD22 ASN B 78 2.765 2.124 -61.345 1.00 0.00 H new ATOM 1396 N ILE B 79 4.871 3.864 -57.944 1.00 0.00 N ATOM 1397 CA ILE B 79 5.846 4.415 -57.011 1.00 0.00 C ATOM 1398 C ILE B 79 7.210 4.575 -57.669 1.00 0.00 C ATOM 1399 O ILE B 79 7.869 3.589 -58.002 1.00 0.00 O ATOM 1400 CB ILE B 79 5.978 3.522 -55.764 1.00 0.00 C ATOM 1401 CG1 ILE B 79 4.614 3.331 -55.096 1.00 0.00 C ATOM 1402 CG2 ILE B 79 6.975 4.121 -54.783 1.00 0.00 C ATOM 1403 CD1 ILE B 79 3.875 2.097 -55.559 1.00 0.00 C ATOM 0 H ILE B 79 5.109 2.940 -58.305 1.00 0.00 H new ATOM 0 HA ILE B 79 5.486 5.398 -56.709 1.00 0.00 H new ATOM 0 HB ILE B 79 6.348 2.545 -56.076 1.00 0.00 H new ATOM 0 HG12 ILE B 79 4.753 3.276 -54.016 1.00 0.00 H new ATOM 0 HG13 ILE B 79 3.997 4.208 -55.293 1.00 0.00 H new ATOM 0 HG21 ILE B 79 7.056 3.477 -53.907 1.00 0.00 H new ATOM 0 HG22 ILE B 79 7.950 4.206 -55.262 1.00 0.00 H new ATOM 0 HG23 ILE B 79 6.634 5.110 -54.476 1.00 0.00 H new ATOM 0 HD11 ILE B 79 2.918 2.030 -55.041 1.00 0.00 H new ATOM 0 HD12 ILE B 79 3.703 2.158 -56.634 1.00 0.00 H new ATOM 0 HD13 ILE B 79 4.470 1.211 -55.337 1.00 0.00 H new ATOM 1415 N THR B 80 7.630 5.822 -57.854 1.00 0.00 N ATOM 1416 CA THR B 80 8.904 6.113 -58.501 1.00 0.00 C ATOM 1417 C THR B 80 10.024 6.240 -57.477 1.00 0.00 C ATOM 1418 O THR B 80 10.026 7.156 -56.654 1.00 0.00 O ATOM 1419 CB THR B 80 8.819 7.404 -59.337 1.00 0.00 C ATOM 1420 OG1 THR B 80 7.827 7.248 -60.360 1.00 0.00 O ATOM 1421 CG2 THR B 80 10.162 7.712 -59.981 1.00 0.00 C ATOM 0 H THR B 80 7.106 6.648 -57.565 1.00 0.00 H new ATOM 0 HA THR B 80 9.128 5.278 -59.164 1.00 0.00 H new ATOM 0 HB THR B 80 8.546 8.229 -58.679 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.772 8.070 -60.890 1.00 0.00 H new ATOM 0 HG21 THR B 80 10.083 8.627 -60.568 1.00 0.00 H new ATOM 0 HG22 THR B 80 10.916 7.842 -59.205 1.00 0.00 H new ATOM 0 HG23 THR B 80 10.451 6.887 -60.633 1.00 0.00 H new ATOM 1429 N LEU B 81 10.977 5.316 -57.532 1.00 0.00 N ATOM 1430 CA LEU B 81 12.113 5.330 -56.618 1.00 0.00 C ATOM 1431 C LEU B 81 13.418 5.577 -57.364 1.00 0.00 C ATOM 1432 O LEU B 81 14.091 6.533 -57.096 1.00 0.00 O ATOM 1433 CB LEU B 81 12.196 4.002 -55.855 1.00 0.00 C ATOM 1434 CG LEU B 81 10.961 3.635 -55.022 1.00 0.00 C ATOM 1435 CD1 LEU B 81 11.149 2.252 -54.416 1.00 0.00 C ATOM 1436 CD2 LEU B 81 10.749 4.683 -53.940 1.00 0.00 C ATOM 0 H LEU B 81 10.985 4.546 -58.201 1.00 0.00 H new ATOM 0 HA LEU B 81 11.962 6.145 -55.910 1.00 0.00 H new ATOM 0 HB2 LEU B 81 12.378 3.202 -56.573 1.00 0.00 H new ATOM 0 HB3 LEU B 81 13.061 4.038 -55.192 1.00 0.00 H new ATOM 0 HG LEU B 81 10.076 3.613 -55.658 1.00 0.00 H new ATOM 0 HD11 LEU B 81 10.271 1.992 -53.824 1.00 0.00 H new ATOM 0 HD12 LEU B 81 11.279 1.520 -55.213 1.00 0.00 H new ATOM 0 HD13 LEU B 81 12.031 2.252 -53.776 1.00 0.00 H new ATOM 0 HD21 LEU B 81 9.872 4.422 -53.348 1.00 0.00 H new ATOM 0 HD22 LEU B 81 11.625 4.720 -53.293 1.00 0.00 H new ATOM 0 HD23 LEU B 81 10.598 5.658 -54.403 1.00 0.00 H new TER 1448 LEU B 81