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 Set 1.1: B 58 SER OG : rot -51:sc= 1.21 USER MOD Set 1.2: B 61 ASN : amide:sc= 1.09 K(o=2.3,f=-5.6!) USER MOD Set 2.1: A 58 SER OG : rot -53:sc= 1.2 USER MOD Set 2.2: A 61 ASN : amide:sc= 1.07 K(o=2.3,f=-5.5!) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 117:sc= 1.23 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 169:sc=-0.00353 (180deg=-0.19) USER MOD Single : A 52 SER OG : rot -39:sc= 1.25 USER MOD Single : A 53 LYS NZ :NH3+ -120:sc= 0.996 (180deg=-0.0714) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 65 SER OG : rot -152:sc= 0.766 USER MOD Single : A 66 GLN : amide:sc= 0.835 K(o=0.83,f=-3.5!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0.692 K(o=0.69,f=-0.056) USER MOD Single : A 72 MET CE :methyl -167:sc= -0.0179 (180deg=-0.236) USER MOD Single : A 78 ASN : amide:sc= 1.03 K(o=1,f=-1.5) USER MOD Single : A 80 THR OG1 : rot 180:sc=-0.00531 USER MOD Single : B 39 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 120:sc= 1.19 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl 169:sc=-0.00472 (180deg=-0.181) USER MOD Single : B 52 SER OG : rot -50:sc= 1.27 USER MOD Single : B 53 LYS NZ :NH3+ -119:sc= 0.99 (180deg=-0.0733) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 65 SER OG : rot -151:sc= 0.752 USER MOD Single : B 66 GLN : amide:sc= 0.825 K(o=0.83,f=-3.5!) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 GLN : amide:sc= 0.689 K(o=0.69,f=-0.04) USER MOD Single : B 72 MET CE :methyl -167:sc= -0.014 (180deg=-0.221) USER MOD Single : B 78 ASN : amide:sc= 1.03 K(o=1,f=-1.4) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 15.542 -8.401 -51.211 1.00 0.00 N ATOM 2 CA ASP A 38 15.853 -8.189 -49.802 1.00 0.00 C ATOM 3 C ASP A 38 15.053 -7.026 -49.230 1.00 0.00 C ATOM 4 O ASP A 38 14.305 -7.190 -48.266 1.00 0.00 O ATOM 5 CB ASP A 38 17.350 -7.925 -49.618 1.00 0.00 C ATOM 6 CG ASP A 38 18.206 -9.155 -49.887 1.00 0.00 C ATOM 7 OD1 ASP A 38 17.668 -10.236 -49.904 1.00 0.00 O ATOM 8 OD2 ASP A 38 19.389 -9.000 -50.074 1.00 0.00 O ATOM 0 HA ASP A 38 15.579 -9.096 -49.263 1.00 0.00 H new ATOM 0 HB2 ASP A 38 17.657 -7.121 -50.287 1.00 0.00 H new ATOM 0 HB3 ASP A 38 17.530 -7.579 -48.600 1.00 0.00 H new ATOM 13 N TYR A 39 15.213 -5.850 -49.829 1.00 0.00 N ATOM 14 CA TYR A 39 14.620 -4.630 -49.295 1.00 0.00 C ATOM 15 C TYR A 39 13.249 -4.371 -49.906 1.00 0.00 C ATOM 16 O TYR A 39 12.225 -4.512 -49.239 1.00 0.00 O ATOM 17 CB TYR A 39 15.545 -3.435 -49.538 1.00 0.00 C ATOM 18 CG TYR A 39 15.043 -2.144 -48.933 1.00 0.00 C ATOM 19 CD1 TYR A 39 15.059 -1.970 -47.557 1.00 0.00 C ATOM 20 CD2 TYR A 39 14.567 -1.132 -49.753 1.00 0.00 C ATOM 21 CE1 TYR A 39 14.602 -0.790 -47.003 1.00 0.00 C ATOM 22 CE2 TYR A 39 14.110 0.049 -49.200 1.00 0.00 C ATOM 23 CZ TYR A 39 14.125 0.221 -47.831 1.00 0.00 C ATOM 24 OH TYR A 39 13.670 1.396 -47.280 1.00 0.00 O ATOM 0 H TYR A 39 15.750 -5.717 -50.686 1.00 0.00 H new ATOM 0 HA TYR A 39 14.491 -4.762 -48.221 1.00 0.00 H new ATOM 0 HB2 TYR A 39 16.529 -3.660 -49.127 1.00 0.00 H new ATOM 0 HB3 TYR A 39 15.672 -3.297 -50.612 1.00 0.00 H new ATOM 0 HD1 TYR A 39 15.429 -2.758 -46.918 1.00 0.00 H new ATOM 0 HD2 TYR A 39 14.553 -1.267 -50.824 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.615 -0.653 -45.932 1.00 0.00 H new ATOM 0 HE2 TYR A 39 13.741 0.837 -49.839 1.00 0.00 H new ATOM 0 HH TYR A 39 13.372 1.998 -47.994 1.00 0.00 H new ATOM 34 N LEU A 40 13.237 -3.993 -51.180 1.00 0.00 N ATOM 35 CA LEU A 40 12.003 -3.602 -51.851 1.00 0.00 C ATOM 36 C LEU A 40 11.041 -4.777 -51.962 1.00 0.00 C ATOM 37 O LEU A 40 9.839 -4.632 -51.740 1.00 0.00 O ATOM 38 CB LEU A 40 12.312 -3.052 -53.249 1.00 0.00 C ATOM 39 CG LEU A 40 12.998 -1.680 -53.288 1.00 0.00 C ATOM 40 CD1 LEU A 40 13.394 -1.351 -54.721 1.00 0.00 C ATOM 41 CD2 LEU A 40 12.057 -0.626 -52.725 1.00 0.00 C ATOM 0 H LEU A 40 14.069 -3.949 -51.769 1.00 0.00 H new ATOM 0 HA LEU A 40 11.528 -2.824 -51.253 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.946 -3.770 -53.770 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.379 -2.987 -53.808 1.00 0.00 H new ATOM 0 HG LEU A 40 13.900 -1.697 -52.677 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.881 -0.376 -54.749 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.081 -2.111 -55.092 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.503 -1.329 -55.349 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.544 0.349 -52.753 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.147 -0.594 -53.324 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.805 -0.877 -51.695 1.00 0.00 H new ATOM 53 N PRO A 41 11.576 -5.944 -52.307 1.00 0.00 N ATOM 54 CA PRO A 41 10.775 -7.158 -52.396 1.00 0.00 C ATOM 55 C PRO A 41 9.959 -7.375 -51.128 1.00 0.00 C ATOM 56 O PRO A 41 8.793 -7.765 -51.187 1.00 0.00 O ATOM 57 CB PRO A 41 11.830 -8.254 -52.583 1.00 0.00 C ATOM 58 CG PRO A 41 12.933 -7.577 -53.321 1.00 0.00 C ATOM 59 CD PRO A 41 13.022 -6.212 -52.693 1.00 0.00 C ATOM 0 HA PRO A 41 10.041 -7.133 -53.202 1.00 0.00 H new ATOM 0 HB2 PRO A 41 12.173 -8.645 -51.625 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.432 -9.098 -53.147 1.00 0.00 H new ATOM 0 HG2 PRO A 41 13.871 -8.122 -53.221 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.715 -7.510 -54.387 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.683 -6.204 -51.827 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.402 -5.466 -53.391 1.00 0.00 H new ATOM 67 N THR A 42 10.579 -7.118 -49.981 1.00 0.00 N ATOM 68 CA THR A 42 9.890 -7.212 -48.700 1.00 0.00 C ATOM 69 C THR A 42 8.808 -6.146 -48.575 1.00 0.00 C ATOM 70 O THR A 42 7.691 -6.429 -48.145 1.00 0.00 O ATOM 71 CB THR A 42 10.879 -7.085 -47.527 1.00 0.00 C ATOM 72 OG1 THR A 42 11.837 -8.151 -47.588 1.00 0.00 O ATOM 73 CG2 THR A 42 10.143 -7.146 -46.198 1.00 0.00 C ATOM 0 H THR A 42 11.559 -6.843 -49.913 1.00 0.00 H new ATOM 0 HA THR A 42 9.420 -8.194 -48.659 1.00 0.00 H new ATOM 0 HB THR A 42 11.388 -6.124 -47.604 1.00 0.00 H new ATOM 0 HG1 THR A 42 12.733 -7.778 -47.723 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.859 -7.055 -45.381 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.423 -6.329 -46.143 1.00 0.00 H new ATOM 0 HG23 THR A 42 9.618 -8.098 -46.116 1.00 0.00 H new ATOM 81 N LEU A 43 9.149 -4.919 -48.954 1.00 0.00 N ATOM 82 CA LEU A 43 8.200 -3.813 -48.911 1.00 0.00 C ATOM 83 C LEU A 43 7.029 -4.054 -49.854 1.00 0.00 C ATOM 84 O LEU A 43 5.911 -3.607 -49.598 1.00 0.00 O ATOM 85 CB LEU A 43 8.900 -2.500 -49.281 1.00 0.00 C ATOM 86 CG LEU A 43 9.956 -2.004 -48.284 1.00 0.00 C ATOM 87 CD1 LEU A 43 10.628 -0.754 -48.835 1.00 0.00 C ATOM 88 CD2 LEU A 43 9.297 -1.725 -46.942 1.00 0.00 C ATOM 0 H LEU A 43 10.076 -4.665 -49.295 1.00 0.00 H new ATOM 0 HA LEU A 43 7.813 -3.744 -47.894 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.376 -2.625 -50.254 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.142 -1.725 -49.394 1.00 0.00 H new ATOM 0 HG LEU A 43 10.719 -2.769 -48.139 1.00 0.00 H new ATOM 0 HD11 LEU A 43 11.378 -0.402 -48.127 1.00 0.00 H new ATOM 0 HD12 LEU A 43 11.108 -0.988 -49.785 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.880 0.024 -48.988 1.00 0.00 H new ATOM 0 HD21 LEU A 43 10.048 -1.373 -46.234 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.528 -0.962 -47.066 1.00 0.00 H new ATOM 0 HD23 LEU A 43 8.842 -2.640 -46.563 1.00 0.00 H new ATOM 100 N ARG A 44 7.291 -4.766 -50.945 1.00 0.00 N ATOM 101 CA ARG A 44 6.245 -5.125 -51.895 1.00 0.00 C ATOM 102 C ARG A 44 5.248 -6.096 -51.275 1.00 0.00 C ATOM 103 O ARG A 44 4.039 -5.957 -51.455 1.00 0.00 O ATOM 104 CB ARG A 44 6.849 -5.751 -53.144 1.00 0.00 C ATOM 105 CG ARG A 44 7.552 -4.775 -54.073 1.00 0.00 C ATOM 106 CD ARG A 44 8.343 -5.479 -55.114 1.00 0.00 C ATOM 107 NE ARG A 44 7.503 -6.305 -55.967 1.00 0.00 N ATOM 108 CZ ARG A 44 7.960 -7.269 -56.789 1.00 0.00 C ATOM 109 NH1 ARG A 44 9.250 -7.517 -56.858 1.00 0.00 N ATOM 110 NH2 ARG A 44 7.114 -7.966 -57.526 1.00 0.00 N ATOM 0 H ARG A 44 8.220 -5.106 -51.193 1.00 0.00 H new ATOM 0 HA ARG A 44 5.720 -4.209 -52.167 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.561 -6.518 -52.840 1.00 0.00 H new ATOM 0 HB3 ARG A 44 6.057 -6.253 -53.700 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.813 -4.131 -54.551 1.00 0.00 H new ATOM 0 HG3 ARG A 44 8.210 -4.129 -53.492 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.872 -4.747 -55.725 1.00 0.00 H new ATOM 0 HD3 ARG A 44 9.099 -6.102 -54.636 1.00 0.00 H new ATOM 0 HE ARG A 44 6.496 -6.143 -55.941 1.00 0.00 H new ATOM 0 HH11 ARG A 44 9.904 -6.979 -56.289 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.596 -8.247 -57.480 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.114 -7.774 -57.473 1.00 0.00 H new ATOM 0 HH22 ARG A 44 7.461 -8.696 -58.148 1.00 0.00 H new ATOM 124 N LYS A 45 5.764 -7.079 -50.544 1.00 0.00 N ATOM 125 CA LYS A 45 4.919 -7.998 -49.792 1.00 0.00 C ATOM 126 C LYS A 45 4.139 -7.266 -48.706 1.00 0.00 C ATOM 127 O LYS A 45 2.971 -7.567 -48.457 1.00 0.00 O ATOM 128 CB LYS A 45 5.760 -9.115 -49.172 1.00 0.00 C ATOM 129 CG LYS A 45 6.337 -10.100 -50.180 1.00 0.00 C ATOM 130 CD LYS A 45 7.196 -11.152 -49.494 1.00 0.00 C ATOM 131 CE LYS A 45 7.792 -12.124 -50.502 1.00 0.00 C ATOM 132 NZ LYS A 45 8.667 -13.136 -49.850 1.00 0.00 N ATOM 0 H LYS A 45 6.764 -7.259 -50.457 1.00 0.00 H new ATOM 0 HA LYS A 45 4.205 -8.438 -50.488 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.579 -8.667 -48.610 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.145 -9.663 -48.458 1.00 0.00 H new ATOM 0 HG2 LYS A 45 5.526 -10.586 -50.722 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.935 -9.562 -50.916 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.997 -10.664 -48.939 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.594 -11.700 -48.770 1.00 0.00 H new ATOM 0 HE2 LYS A 45 6.988 -12.630 -51.037 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.368 -11.570 -51.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.052 -13.778 -50.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.449 -12.655 -49.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.112 -13.683 -49.161 1.00 0.00 H new ATOM 146 N GLU A 46 4.791 -6.304 -48.063 1.00 0.00 N ATOM 147 CA GLU A 46 4.135 -5.469 -47.064 1.00 0.00 C ATOM 148 C GLU A 46 2.954 -4.716 -47.664 1.00 0.00 C ATOM 149 O GLU A 46 1.902 -4.591 -47.037 1.00 0.00 O ATOM 150 CB GLU A 46 5.130 -4.493 -46.453 1.00 0.00 C ATOM 0 H GLU A 46 5.775 -6.083 -48.216 1.00 0.00 H new ATOM 0 HA GLU A 46 3.754 -6.122 -46.278 1.00 0.00 H new ATOM 155 N LEU A 47 3.135 -4.216 -48.882 1.00 0.00 N ATOM 156 CA LEU A 47 2.069 -3.518 -49.590 1.00 0.00 C ATOM 157 C LEU A 47 0.895 -4.447 -49.873 1.00 0.00 C ATOM 158 O LEU A 47 -0.264 -4.047 -49.775 1.00 0.00 O ATOM 159 CB LEU A 47 2.599 -2.937 -50.906 1.00 0.00 C ATOM 160 CG LEU A 47 3.532 -1.727 -50.771 1.00 0.00 C ATOM 161 CD1 LEU A 47 4.168 -1.422 -52.121 1.00 0.00 C ATOM 162 CD2 LEU A 47 2.744 -0.531 -50.256 1.00 0.00 C ATOM 0 H LEU A 47 4.011 -4.282 -49.400 1.00 0.00 H new ATOM 0 HA LEU A 47 1.719 -2.707 -48.952 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.130 -3.724 -51.441 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.748 -2.649 -51.524 1.00 0.00 H new ATOM 0 HG LEU A 47 4.326 -1.948 -50.058 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.831 -0.562 -52.025 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.741 -2.286 -52.457 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.388 -1.199 -52.849 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.408 0.328 -50.160 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.943 -0.294 -50.956 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.316 -0.769 -49.282 1.00 0.00 H new ATOM 174 N MET A 48 1.204 -5.691 -50.226 1.00 0.00 N ATOM 175 CA MET A 48 0.177 -6.700 -50.453 1.00 0.00 C ATOM 176 C MET A 48 -0.676 -6.908 -49.208 1.00 0.00 C ATOM 177 O MET A 48 -1.904 -6.910 -49.279 1.00 0.00 O ATOM 178 CB MET A 48 0.817 -8.017 -50.887 1.00 0.00 C ATOM 179 CG MET A 48 1.477 -7.976 -52.258 1.00 0.00 C ATOM 180 SD MET A 48 2.364 -9.496 -52.649 1.00 0.00 S ATOM 181 CE MET A 48 1.003 -10.643 -52.840 1.00 0.00 C ATOM 0 H MET A 48 2.159 -6.024 -50.361 1.00 0.00 H new ATOM 0 HA MET A 48 -0.476 -6.345 -51.251 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.563 -8.305 -50.147 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.053 -8.795 -50.888 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.716 -7.799 -53.018 1.00 0.00 H new ATOM 0 HG3 MET A 48 2.170 -7.135 -52.298 1.00 0.00 H new ATOM 0 HE1 MET A 48 1.370 -11.574 -53.272 1.00 0.00 H new ATOM 0 HE2 MET A 48 0.558 -10.845 -51.866 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.251 -10.209 -53.499 1.00 0.00 H new ATOM 191 N GLU A 49 -0.016 -7.081 -48.068 1.00 0.00 N ATOM 192 CA GLU A 49 -0.712 -7.248 -46.798 1.00 0.00 C ATOM 193 C GLU A 49 -1.631 -6.067 -46.514 1.00 0.00 C ATOM 194 O GLU A 49 -2.814 -6.244 -46.222 1.00 0.00 O ATOM 195 CB GLU A 49 0.293 -7.411 -45.656 1.00 0.00 C ATOM 196 CG GLU A 49 -0.339 -7.576 -44.281 1.00 0.00 C ATOM 197 CD GLU A 49 0.679 -7.722 -43.183 1.00 0.00 C ATOM 198 OE1 GLU A 49 1.841 -7.833 -43.488 1.00 0.00 O ATOM 199 OE2 GLU A 49 0.291 -7.722 -42.038 1.00 0.00 O ATOM 0 H GLU A 49 1.001 -7.109 -47.998 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.322 -8.148 -46.869 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.920 -8.279 -45.861 1.00 0.00 H new ATOM 0 HB3 GLU A 49 0.949 -6.541 -45.639 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.971 -6.713 -44.071 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.987 -8.452 -44.287 1.00 0.00 H new ATOM 206 N VAL A 50 -1.080 -4.860 -46.602 1.00 0.00 N ATOM 207 CA VAL A 50 -1.828 -3.652 -46.281 1.00 0.00 C ATOM 208 C VAL A 50 -3.063 -3.518 -47.163 1.00 0.00 C ATOM 209 O VAL A 50 -4.138 -3.147 -46.691 1.00 0.00 O ATOM 210 CB VAL A 50 -0.937 -2.409 -46.460 1.00 0.00 C ATOM 211 CG1 VAL A 50 -1.773 -1.139 -46.389 1.00 0.00 C ATOM 212 CG2 VAL A 50 0.153 -2.396 -45.399 1.00 0.00 C ATOM 0 H VAL A 50 -0.117 -4.694 -46.893 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.148 -3.727 -45.242 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.467 -2.450 -47.443 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.127 -0.271 -46.517 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.524 -1.153 -47.179 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.268 -1.083 -45.419 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.779 -1.514 -45.532 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.303 -2.372 -44.409 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.765 -3.293 -45.495 1.00 0.00 H new ATOM 222 N LEU A 51 -2.904 -3.822 -48.446 1.00 0.00 N ATOM 223 CA LEU A 51 -3.991 -3.687 -49.408 1.00 0.00 C ATOM 224 C LEU A 51 -5.062 -4.747 -49.183 1.00 0.00 C ATOM 225 O LEU A 51 -6.256 -4.467 -49.276 1.00 0.00 O ATOM 226 CB LEU A 51 -3.450 -3.793 -50.839 1.00 0.00 C ATOM 227 CG LEU A 51 -4.488 -3.626 -51.956 1.00 0.00 C ATOM 228 CD1 LEU A 51 -5.207 -2.294 -51.788 1.00 0.00 C ATOM 229 CD2 LEU A 51 -3.795 -3.707 -53.309 1.00 0.00 C ATOM 0 H LEU A 51 -2.030 -4.165 -48.845 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.444 -2.706 -49.264 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.675 -3.038 -50.972 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.971 -4.765 -50.956 1.00 0.00 H new ATOM 0 HG LEU A 51 -5.228 -4.425 -51.900 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -5.944 -2.176 -52.582 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.709 -2.271 -50.821 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -4.483 -1.481 -51.841 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.532 -3.588 -54.103 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.050 -2.915 -53.384 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -3.306 -4.676 -53.410 1.00 0.00 H new ATOM 241 N SER A 52 -4.625 -5.967 -48.885 1.00 0.00 N ATOM 242 CA SER A 52 -5.545 -7.070 -48.637 1.00 0.00 C ATOM 243 C SER A 52 -6.414 -6.798 -47.416 1.00 0.00 C ATOM 244 O SER A 52 -7.536 -7.297 -47.317 1.00 0.00 O ATOM 245 CB SER A 52 -4.773 -8.360 -48.443 1.00 0.00 C ATOM 246 OG SER A 52 -4.093 -8.359 -47.218 1.00 0.00 O ATOM 0 H SER A 52 -3.639 -6.216 -48.810 1.00 0.00 H new ATOM 0 HA SER A 52 -6.197 -7.166 -49.505 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.458 -9.207 -48.482 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.061 -8.488 -49.258 1.00 0.00 H new ATOM 0 HG SER A 52 -3.729 -7.466 -47.047 1.00 0.00 H new ATOM 252 N LYS A 53 -5.890 -6.006 -46.487 1.00 0.00 N ATOM 253 CA LYS A 53 -6.619 -5.663 -45.272 1.00 0.00 C ATOM 254 C LYS A 53 -7.611 -4.535 -45.525 1.00 0.00 C ATOM 255 O LYS A 53 -8.649 -4.449 -44.868 1.00 0.00 O ATOM 256 CB LYS A 53 -5.648 -5.269 -44.158 1.00 0.00 C ATOM 257 CG LYS A 53 -4.838 -6.427 -43.590 1.00 0.00 C ATOM 258 CD LYS A 53 -3.875 -5.952 -42.513 1.00 0.00 C ATOM 259 CE LYS A 53 -3.124 -7.119 -41.887 1.00 0.00 C ATOM 260 NZ LYS A 53 -2.116 -6.662 -40.892 1.00 0.00 N ATOM 0 H LYS A 53 -4.961 -5.589 -46.553 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.178 -6.545 -44.959 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -4.961 -4.515 -44.542 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.212 -4.805 -43.349 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.512 -7.175 -43.174 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.280 -6.911 -44.392 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -3.163 -5.248 -42.944 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.426 -5.415 -41.741 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.834 -7.789 -41.403 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.627 -7.692 -42.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -1.169 -6.974 -41.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -2.135 -5.624 -40.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -2.338 -7.068 -39.961 1.00 0.00 H new ATOM 274 N TYR A 54 -7.287 -3.673 -46.482 1.00 0.00 N ATOM 275 CA TYR A 54 -8.150 -2.549 -46.824 1.00 0.00 C ATOM 276 C TYR A 54 -9.460 -3.026 -47.436 1.00 0.00 C ATOM 277 O TYR A 54 -10.531 -2.510 -47.115 1.00 0.00 O ATOM 278 CB TYR A 54 -7.433 -1.596 -47.784 1.00 0.00 C ATOM 279 CG TYR A 54 -6.403 -0.714 -47.113 1.00 0.00 C ATOM 280 CD1 TYR A 54 -6.258 -0.745 -45.734 1.00 0.00 C ATOM 281 CD2 TYR A 54 -5.605 0.125 -47.876 1.00 0.00 C ATOM 282 CE1 TYR A 54 -5.318 0.061 -45.121 1.00 0.00 C ATOM 283 CE2 TYR A 54 -4.665 0.930 -47.263 1.00 0.00 C ATOM 284 CZ TYR A 54 -4.520 0.899 -45.891 1.00 0.00 C ATOM 285 OH TYR A 54 -3.583 1.702 -45.281 1.00 0.00 O ATOM 0 H TYR A 54 -6.432 -3.731 -47.035 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.382 -2.014 -45.903 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.945 -2.180 -48.564 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -8.174 -0.965 -48.275 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -6.879 -1.399 -45.140 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -5.719 0.149 -48.950 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.204 0.040 -44.047 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.044 1.584 -47.857 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.109 2.225 -45.960 1.00 0.00 H new ATOM 295 N VAL A 55 -9.370 -4.015 -48.318 1.00 0.00 N ATOM 296 CA VAL A 55 -10.551 -4.578 -48.962 1.00 0.00 C ATOM 297 C VAL A 55 -10.820 -5.997 -48.475 1.00 0.00 C ATOM 298 O VAL A 55 -11.690 -6.691 -49.003 1.00 0.00 O ATOM 299 CB VAL A 55 -10.373 -4.589 -50.491 1.00 0.00 C ATOM 300 CG1 VAL A 55 -10.258 -3.168 -51.024 1.00 0.00 C ATOM 301 CG2 VAL A 55 -9.145 -5.405 -50.864 1.00 0.00 C ATOM 0 H VAL A 55 -8.490 -4.444 -48.604 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.402 -3.951 -48.698 1.00 0.00 H new ATOM 0 HB VAL A 55 -11.250 -5.051 -50.945 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -10.133 -3.194 -52.106 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.163 -2.612 -50.777 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -9.396 -2.678 -50.571 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -9.026 -5.408 -51.947 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -8.261 -4.964 -50.403 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -9.267 -6.428 -50.509 1.00 0.00 H new ATOM 311 N ASN A 56 -10.067 -6.424 -47.467 1.00 0.00 N ATOM 312 CA ASN A 56 -10.366 -7.662 -46.758 1.00 0.00 C ATOM 313 C ASN A 56 -10.393 -8.850 -47.711 1.00 0.00 C ATOM 314 O ASN A 56 -11.268 -9.712 -47.620 1.00 0.00 O ATOM 315 CB ASN A 56 -11.683 -7.546 -46.012 1.00 0.00 C ATOM 316 CG ASN A 56 -11.628 -6.543 -44.894 1.00 0.00 C ATOM 317 OD1 ASN A 56 -10.714 -6.574 -44.061 1.00 0.00 O ATOM 318 ND2 ASN A 56 -12.586 -5.654 -44.858 1.00 0.00 N ATOM 0 H ASN A 56 -9.244 -5.930 -47.122 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.571 -7.832 -46.032 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -12.469 -7.262 -46.712 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -11.954 -8.521 -45.607 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -12.599 -4.948 -44.122 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -13.320 -5.666 -45.566 1.00 0.00 H new ATOM 325 N VAL A 57 -9.430 -8.890 -48.626 1.00 0.00 N ATOM 326 CA VAL A 57 -9.241 -10.050 -49.489 1.00 0.00 C ATOM 327 C VAL A 57 -7.993 -10.831 -49.097 1.00 0.00 C ATOM 328 O VAL A 57 -7.385 -10.568 -48.059 1.00 0.00 O ATOM 329 CB VAL A 57 -9.125 -9.608 -50.960 1.00 0.00 C ATOM 330 CG1 VAL A 57 -10.382 -8.869 -51.394 1.00 0.00 C ATOM 331 CG2 VAL A 57 -7.894 -8.733 -51.142 1.00 0.00 C ATOM 0 H VAL A 57 -8.768 -8.132 -48.789 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.110 -10.697 -49.369 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.020 -10.492 -51.588 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -10.283 -8.564 -52.436 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -11.245 -9.526 -51.289 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.519 -7.987 -50.769 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.818 -8.424 -52.185 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.978 -7.851 -50.507 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -7.003 -9.296 -50.865 1.00 0.00 H new ATOM 341 N SER A 58 -7.616 -11.791 -49.933 1.00 0.00 N ATOM 342 CA SER A 58 -6.421 -12.592 -49.692 1.00 0.00 C ATOM 343 C SER A 58 -5.231 -12.054 -50.477 1.00 0.00 C ATOM 344 O SER A 58 -5.389 -11.227 -51.374 1.00 0.00 O ATOM 345 CB SER A 58 -6.676 -14.038 -50.068 1.00 0.00 C ATOM 346 OG SER A 58 -6.801 -14.181 -51.457 1.00 0.00 O ATOM 0 H SER A 58 -8.121 -12.034 -50.785 1.00 0.00 H new ATOM 0 HA SER A 58 -6.185 -12.533 -48.630 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.858 -14.661 -49.707 1.00 0.00 H new ATOM 0 HB3 SER A 58 -7.585 -14.390 -49.579 1.00 0.00 H new ATOM 0 HG SER A 58 -7.481 -13.558 -51.790 1.00 0.00 H new ATOM 352 N LEU A 59 -4.039 -12.531 -50.134 1.00 0.00 N ATOM 353 CA LEU A 59 -2.816 -12.075 -50.784 1.00 0.00 C ATOM 354 C LEU A 59 -2.805 -12.445 -52.261 1.00 0.00 C ATOM 355 O LEU A 59 -2.115 -11.816 -53.064 1.00 0.00 O ATOM 356 CB LEU A 59 -1.590 -12.679 -50.089 1.00 0.00 C ATOM 357 CG LEU A 59 -1.319 -12.181 -48.664 1.00 0.00 C ATOM 358 CD1 LEU A 59 -0.151 -12.956 -48.068 1.00 0.00 C ATOM 359 CD2 LEU A 59 -1.025 -10.689 -48.695 1.00 0.00 C ATOM 0 H LEU A 59 -3.894 -13.234 -49.409 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.779 -10.989 -50.703 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.710 -13.762 -50.059 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.711 -12.472 -50.699 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.196 -12.346 -48.039 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.042 -12.602 -47.055 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.395 -14.018 -48.041 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.737 -12.803 -48.681 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.832 -10.335 -47.682 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.149 -10.504 -49.317 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.882 -10.158 -49.108 1.00 0.00 H new ATOM 371 N ASP A 60 -3.575 -13.468 -52.615 1.00 0.00 N ATOM 372 CA ASP A 60 -3.619 -13.955 -53.989 1.00 0.00 C ATOM 373 C ASP A 60 -4.498 -13.066 -54.859 1.00 0.00 C ATOM 374 O ASP A 60 -4.587 -13.262 -56.071 1.00 0.00 O ATOM 375 CB ASP A 60 -4.138 -15.394 -54.032 1.00 0.00 C ATOM 376 CG ASP A 60 -3.161 -16.394 -53.429 1.00 0.00 C ATOM 377 OD1 ASP A 60 -1.997 -16.081 -53.341 1.00 0.00 O ATOM 378 OD2 ASP A 60 -3.587 -17.464 -53.062 1.00 0.00 O ATOM 0 H ASP A 60 -4.178 -13.977 -51.969 1.00 0.00 H new ATOM 0 HA ASP A 60 -2.603 -13.929 -54.382 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.085 -15.450 -53.495 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.341 -15.671 -55.066 1.00 0.00 H new ATOM 383 N ASN A 61 -5.145 -12.088 -54.234 1.00 0.00 N ATOM 384 CA ASN A 61 -5.985 -11.141 -54.958 1.00 0.00 C ATOM 385 C ASN A 61 -5.216 -9.872 -55.300 1.00 0.00 C ATOM 386 O ASN A 61 -5.770 -8.934 -55.874 1.00 0.00 O ATOM 387 CB ASN A 61 -7.230 -10.811 -54.155 1.00 0.00 C ATOM 388 CG ASN A 61 -8.135 -11.999 -53.978 1.00 0.00 C ATOM 389 OD1 ASN A 61 -8.356 -12.464 -52.854 1.00 0.00 O ATOM 390 ND2 ASN A 61 -8.663 -12.498 -55.067 1.00 0.00 N ATOM 0 H ASN A 61 -5.104 -11.930 -53.227 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.290 -11.610 -55.894 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -6.937 -10.433 -53.176 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.779 -10.012 -54.654 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -9.286 -13.304 -55.009 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -8.452 -12.081 -55.974 1.00 0.00 H new ATOM 397 N ILE A 62 -3.936 -9.847 -54.943 1.00 0.00 N ATOM 398 CA ILE A 62 -3.091 -8.688 -55.203 1.00 0.00 C ATOM 399 C ILE A 62 -1.953 -9.039 -56.153 1.00 0.00 C ATOM 400 O ILE A 62 -1.353 -10.109 -56.052 1.00 0.00 O ATOM 401 CB ILE A 62 -2.511 -8.127 -53.892 1.00 0.00 C ATOM 402 CG1 ILE A 62 -3.631 -7.584 -53.001 1.00 0.00 C ATOM 403 CG2 ILE A 62 -1.487 -7.040 -54.185 1.00 0.00 C ATOM 404 CD1 ILE A 62 -4.164 -8.592 -52.009 1.00 0.00 C ATOM 0 H ILE A 62 -3.461 -10.617 -54.472 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.717 -7.928 -55.670 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.010 -8.937 -53.361 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.261 -6.714 -52.458 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.451 -7.241 -53.632 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.087 -6.654 -53.247 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.675 -7.456 -54.782 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.964 -6.230 -54.736 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.954 -8.134 -51.414 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -4.565 -9.452 -52.545 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.357 -8.918 -51.352 1.00 0.00 H new ATOM 416 N ARG A 63 -1.660 -8.129 -57.077 1.00 0.00 N ATOM 417 CA ARG A 63 -0.513 -8.282 -57.965 1.00 0.00 C ATOM 418 C ARG A 63 0.382 -7.050 -57.926 1.00 0.00 C ATOM 419 O ARG A 63 -0.081 -5.929 -58.138 1.00 0.00 O ATOM 420 CB ARG A 63 -0.973 -8.528 -59.395 1.00 0.00 C ATOM 421 CG ARG A 63 -1.746 -9.820 -59.606 1.00 0.00 C ATOM 422 CD ARG A 63 -0.873 -11.012 -59.461 1.00 0.00 C ATOM 423 NE ARG A 63 -1.591 -12.246 -59.729 1.00 0.00 N ATOM 424 CZ ARG A 63 -2.325 -12.919 -58.820 1.00 0.00 C ATOM 425 NH1 ARG A 63 -2.425 -12.463 -57.591 1.00 0.00 N ATOM 426 NH2 ARG A 63 -2.942 -14.035 -59.164 1.00 0.00 N ATOM 0 H ARG A 63 -2.201 -7.278 -57.230 1.00 0.00 H new ATOM 0 HA ARG A 63 0.060 -9.141 -57.616 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.598 -7.692 -59.709 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.099 -8.534 -60.046 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.563 -9.877 -58.886 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.196 -9.817 -60.599 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.028 -10.928 -60.144 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -0.464 -11.042 -58.451 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.536 -12.631 -60.672 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.948 -11.601 -57.326 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.980 -12.971 -56.902 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.863 -14.388 -60.118 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.497 -14.544 -58.476 1.00 0.00 H new ATOM 440 N ILE A 64 1.665 -7.265 -57.656 1.00 0.00 N ATOM 441 CA ILE A 64 2.630 -6.174 -57.607 1.00 0.00 C ATOM 442 C ILE A 64 3.894 -6.522 -58.384 1.00 0.00 C ATOM 443 O ILE A 64 4.428 -7.624 -58.257 1.00 0.00 O ATOM 444 CB ILE A 64 2.999 -5.831 -56.152 1.00 0.00 C ATOM 445 CG1 ILE A 64 3.911 -4.603 -56.108 1.00 0.00 C ATOM 446 CG2 ILE A 64 3.670 -7.020 -55.479 1.00 0.00 C ATOM 447 CD1 ILE A 64 4.015 -3.968 -54.739 1.00 0.00 C ATOM 0 H ILE A 64 2.061 -8.186 -57.468 1.00 0.00 H new ATOM 0 HA ILE A 64 2.161 -5.305 -58.069 1.00 0.00 H new ATOM 0 HB ILE A 64 2.083 -5.600 -55.608 1.00 0.00 H new ATOM 0 HG12 ILE A 64 4.908 -4.891 -56.441 1.00 0.00 H new ATOM 0 HG13 ILE A 64 3.540 -3.861 -56.815 1.00 0.00 H new ATOM 0 HG21 ILE A 64 3.924 -6.761 -54.451 1.00 0.00 H new ATOM 0 HG22 ILE A 64 2.989 -7.871 -55.481 1.00 0.00 H new ATOM 0 HG23 ILE A 64 4.578 -7.281 -56.023 1.00 0.00 H new ATOM 0 HD11 ILE A 64 4.678 -3.104 -54.788 1.00 0.00 H new ATOM 0 HD12 ILE A 64 3.026 -3.648 -54.410 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.416 -4.693 -54.031 1.00 0.00 H new ATOM 459 N SER A 65 4.368 -5.576 -59.188 1.00 0.00 N ATOM 460 CA SER A 65 5.482 -5.828 -60.094 1.00 0.00 C ATOM 461 C SER A 65 6.613 -4.833 -59.867 1.00 0.00 C ATOM 462 O SER A 65 6.373 -3.647 -59.642 1.00 0.00 O ATOM 463 CB SER A 65 5.010 -5.752 -61.533 1.00 0.00 C ATOM 464 OG SER A 65 6.069 -5.981 -62.421 1.00 0.00 O ATOM 0 H SER A 65 3.997 -4.627 -59.230 1.00 0.00 H new ATOM 0 HA SER A 65 5.862 -6.829 -59.890 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.224 -6.488 -61.701 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.575 -4.771 -61.725 1.00 0.00 H new ATOM 0 HG SER A 65 5.896 -5.513 -63.265 1.00 0.00 H new ATOM 470 N GLN A 66 7.846 -5.324 -59.928 1.00 0.00 N ATOM 471 CA GLN A 66 9.018 -4.464 -59.822 1.00 0.00 C ATOM 472 C GLN A 66 9.814 -4.455 -61.120 1.00 0.00 C ATOM 473 O GLN A 66 10.452 -5.446 -61.476 1.00 0.00 O ATOM 474 CB GLN A 66 9.912 -4.917 -58.664 1.00 0.00 C ATOM 475 CG GLN A 66 11.143 -4.053 -58.453 1.00 0.00 C ATOM 476 CD GLN A 66 11.969 -4.503 -57.263 1.00 0.00 C ATOM 477 OE1 GLN A 66 11.609 -5.454 -56.564 1.00 0.00 O ATOM 478 NE2 GLN A 66 13.083 -3.819 -57.024 1.00 0.00 N ATOM 0 H GLN A 66 8.059 -6.314 -60.050 1.00 0.00 H new ATOM 0 HA GLN A 66 8.669 -3.450 -59.627 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.324 -4.922 -57.746 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.229 -5.944 -58.845 1.00 0.00 H new ATOM 0 HG2 GLN A 66 11.760 -4.080 -59.351 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.836 -3.017 -58.308 1.00 0.00 H new ATOM 0 HE21 GLN A 66 13.342 -3.039 -57.628 1.00 0.00 H new ATOM 0 HE22 GLN A 66 13.679 -4.074 -56.236 1.00 0.00 H new ATOM 487 N GLU A 67 9.773 -3.329 -61.826 1.00 0.00 N ATOM 488 CA GLU A 67 10.284 -3.261 -63.189 1.00 0.00 C ATOM 489 C GLU A 67 11.247 -2.092 -63.359 1.00 0.00 C ATOM 490 O GLU A 67 11.066 -1.035 -62.756 1.00 0.00 O ATOM 491 CB GLU A 67 9.130 -3.133 -64.186 1.00 0.00 C ATOM 492 CG GLU A 67 8.147 -4.294 -64.164 1.00 0.00 C ATOM 493 CD GLU A 67 7.001 -4.110 -65.119 1.00 0.00 C ATOM 494 OE1 GLU A 67 7.115 -3.297 -66.004 1.00 0.00 O ATOM 495 OE2 GLU A 67 6.010 -4.783 -64.963 1.00 0.00 O ATOM 0 H GLU A 67 9.391 -2.451 -61.475 1.00 0.00 H new ATOM 0 HA GLU A 67 10.827 -4.185 -63.387 1.00 0.00 H new ATOM 0 HB2 GLU A 67 8.588 -2.210 -63.979 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.543 -3.042 -65.191 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.675 -5.215 -64.412 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.756 -4.413 -63.154 1.00 0.00 H new ATOM 502 N LYS A 68 12.270 -2.291 -64.183 1.00 0.00 N ATOM 503 CA LYS A 68 13.219 -1.229 -64.495 1.00 0.00 C ATOM 504 C LYS A 68 12.929 -0.614 -65.858 1.00 0.00 C ATOM 505 O LYS A 68 13.011 -1.290 -66.884 1.00 0.00 O ATOM 506 CB LYS A 68 14.652 -1.761 -64.451 1.00 0.00 C ATOM 507 CG LYS A 68 15.724 -0.705 -64.690 1.00 0.00 C ATOM 508 CD LYS A 68 17.119 -1.302 -64.593 1.00 0.00 C ATOM 509 CE LYS A 68 18.190 -0.246 -64.823 1.00 0.00 C ATOM 510 NZ LYS A 68 19.562 -0.817 -64.732 1.00 0.00 N ATOM 0 H LYS A 68 12.463 -3.179 -64.647 1.00 0.00 H new ATOM 0 HA LYS A 68 13.108 -0.451 -63.740 1.00 0.00 H new ATOM 0 HB2 LYS A 68 14.825 -2.223 -63.479 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.758 -2.545 -65.201 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.585 -0.259 -65.675 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.617 0.096 -63.959 1.00 0.00 H new ATOM 0 HD2 LYS A 68 17.256 -1.754 -63.611 1.00 0.00 H new ATOM 0 HD3 LYS A 68 17.228 -2.099 -65.328 1.00 0.00 H new ATOM 0 HE2 LYS A 68 18.049 0.206 -65.805 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.079 0.550 -64.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 20.262 -0.065 -64.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 19.706 -1.226 -63.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 19.677 -1.559 -65.451 1.00 0.00 H new ATOM 524 N GLN A 69 12.591 0.671 -65.863 1.00 0.00 N ATOM 525 CA GLN A 69 12.215 1.359 -67.092 1.00 0.00 C ATOM 526 C GLN A 69 12.805 2.763 -67.139 1.00 0.00 C ATOM 527 O GLN A 69 12.656 3.541 -66.197 1.00 0.00 O ATOM 528 CB GLN A 69 10.692 1.428 -67.223 1.00 0.00 C ATOM 529 CG GLN A 69 10.206 2.158 -68.463 1.00 0.00 C ATOM 530 CD GLN A 69 10.479 1.382 -69.737 1.00 0.00 C ATOM 531 OE1 GLN A 69 10.098 0.216 -69.863 1.00 0.00 O ATOM 532 NE2 GLN A 69 11.144 2.026 -70.689 1.00 0.00 N ATOM 0 H GLN A 69 12.570 1.257 -65.029 1.00 0.00 H new ATOM 0 HA GLN A 69 12.618 0.789 -67.929 1.00 0.00 H new ATOM 0 HB2 GLN A 69 10.293 0.414 -67.233 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.285 1.922 -66.341 1.00 0.00 H new ATOM 0 HG2 GLN A 69 9.135 2.343 -68.376 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.693 3.131 -68.522 1.00 0.00 H new ATOM 0 HE21 GLN A 69 11.440 2.991 -70.541 1.00 0.00 H new ATOM 0 HE22 GLN A 69 11.359 1.556 -71.568 1.00 0.00 H new ATOM 541 N ASP A 70 13.475 3.081 -68.242 1.00 0.00 N ATOM 542 CA ASP A 70 14.108 4.384 -68.405 1.00 0.00 C ATOM 543 C ASP A 70 15.158 4.626 -67.329 1.00 0.00 C ATOM 544 O ASP A 70 15.417 5.766 -66.946 1.00 0.00 O ATOM 545 CB ASP A 70 13.058 5.499 -68.362 1.00 0.00 C ATOM 546 CG ASP A 70 12.022 5.379 -69.470 1.00 0.00 C ATOM 547 OD1 ASP A 70 12.301 4.733 -70.452 1.00 0.00 O ATOM 548 OD2 ASP A 70 10.960 5.938 -69.325 1.00 0.00 O ATOM 0 H ASP A 70 13.593 2.453 -69.037 1.00 0.00 H new ATOM 0 HA ASP A 70 14.602 4.392 -69.377 1.00 0.00 H new ATOM 0 HB2 ASP A 70 12.554 5.479 -67.396 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.557 6.465 -68.441 1.00 0.00 H new ATOM 553 N GLY A 71 15.760 3.545 -66.844 1.00 0.00 N ATOM 554 CA GLY A 71 16.873 3.643 -65.906 1.00 0.00 C ATOM 555 C GLY A 71 16.375 3.783 -64.474 1.00 0.00 C ATOM 556 O GLY A 71 17.164 3.965 -63.547 1.00 0.00 O ATOM 0 H GLY A 71 15.496 2.590 -67.085 1.00 0.00 H new ATOM 0 HA2 GLY A 71 17.502 2.757 -65.990 1.00 0.00 H new ATOM 0 HA3 GLY A 71 17.494 4.501 -66.163 1.00 0.00 H new ATOM 560 N MET A 72 15.060 3.696 -64.298 1.00 0.00 N ATOM 561 CA MET A 72 14.447 3.886 -62.989 1.00 0.00 C ATOM 562 C MET A 72 13.692 2.639 -62.548 1.00 0.00 C ATOM 563 O MET A 72 13.208 1.869 -63.378 1.00 0.00 O ATOM 564 CB MET A 72 13.513 5.094 -63.014 1.00 0.00 C ATOM 565 CG MET A 72 14.197 6.412 -63.351 1.00 0.00 C ATOM 566 SD MET A 72 13.028 7.771 -63.547 1.00 0.00 S ATOM 567 CE MET A 72 12.293 7.361 -65.127 1.00 0.00 C ATOM 0 H MET A 72 14.398 3.495 -65.047 1.00 0.00 H new ATOM 0 HA MET A 72 15.242 4.069 -62.266 1.00 0.00 H new ATOM 0 HB2 MET A 72 12.723 4.912 -63.743 1.00 0.00 H new ATOM 0 HB3 MET A 72 13.033 5.187 -62.040 1.00 0.00 H new ATOM 0 HG2 MET A 72 14.908 6.660 -62.563 1.00 0.00 H new ATOM 0 HG3 MET A 72 14.770 6.295 -64.271 1.00 0.00 H new ATOM 0 HE1 MET A 72 11.724 8.215 -65.496 1.00 0.00 H new ATOM 0 HE2 MET A 72 13.079 7.112 -65.840 1.00 0.00 H new ATOM 0 HE3 MET A 72 11.628 6.506 -65.008 1.00 0.00 H new ATOM 577 N ASP A 73 13.594 2.445 -61.237 1.00 0.00 N ATOM 578 CA ASP A 73 12.904 1.287 -60.683 1.00 0.00 C ATOM 579 C ASP A 73 11.494 1.648 -60.235 1.00 0.00 C ATOM 580 O ASP A 73 11.310 2.356 -59.244 1.00 0.00 O ATOM 581 CB ASP A 73 13.689 0.707 -59.503 1.00 0.00 C ATOM 582 CG ASP A 73 13.070 -0.570 -58.951 1.00 0.00 C ATOM 583 OD1 ASP A 73 11.916 -0.810 -59.213 1.00 0.00 O ATOM 584 OD2 ASP A 73 13.760 -1.293 -58.273 1.00 0.00 O ATOM 0 H ASP A 73 13.985 3.076 -60.538 1.00 0.00 H new ATOM 0 HA ASP A 73 12.835 0.536 -61.470 1.00 0.00 H new ATOM 0 HB2 ASP A 73 14.712 0.502 -59.819 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.744 1.451 -58.709 1.00 0.00 H new ATOM 589 N VAL A 74 10.500 1.160 -60.970 1.00 0.00 N ATOM 590 CA VAL A 74 9.115 1.558 -60.748 1.00 0.00 C ATOM 591 C VAL A 74 8.285 0.394 -60.221 1.00 0.00 C ATOM 592 O VAL A 74 8.191 -0.653 -60.862 1.00 0.00 O ATOM 593 CB VAL A 74 8.493 2.078 -62.057 1.00 0.00 C ATOM 594 CG1 VAL A 74 7.041 2.475 -61.835 1.00 0.00 C ATOM 595 CG2 VAL A 74 9.300 3.255 -62.582 1.00 0.00 C ATOM 0 H VAL A 74 10.629 0.487 -61.726 1.00 0.00 H new ATOM 0 HA VAL A 74 9.114 2.353 -60.002 1.00 0.00 H new ATOM 0 HB VAL A 74 8.515 1.281 -62.801 1.00 0.00 H new ATOM 0 HG11 VAL A 74 6.617 2.840 -62.770 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.475 1.608 -61.494 1.00 0.00 H new ATOM 0 HG13 VAL A 74 6.990 3.261 -61.082 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.854 3.618 -63.508 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.300 4.055 -61.842 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.325 2.937 -62.773 1.00 0.00 H new ATOM 605 N LEU A 75 7.686 0.584 -59.051 1.00 0.00 N ATOM 606 CA LEU A 75 6.767 -0.402 -58.492 1.00 0.00 C ATOM 607 C LEU A 75 5.343 -0.163 -58.975 1.00 0.00 C ATOM 608 O LEU A 75 4.877 0.975 -59.027 1.00 0.00 O ATOM 609 CB LEU A 75 6.809 -0.355 -56.960 1.00 0.00 C ATOM 610 CG LEU A 75 8.170 -0.661 -56.321 1.00 0.00 C ATOM 611 CD1 LEU A 75 8.066 -0.514 -54.809 1.00 0.00 C ATOM 612 CD2 LEU A 75 8.606 -2.068 -56.705 1.00 0.00 C ATOM 0 H LEU A 75 7.820 1.412 -58.470 1.00 0.00 H new ATOM 0 HA LEU A 75 7.084 -1.387 -58.833 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.491 0.636 -56.637 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.079 -1.066 -56.573 1.00 0.00 H new ATOM 0 HG LEU A 75 8.919 0.043 -56.684 1.00 0.00 H new ATOM 0 HD11 LEU A 75 9.033 -0.731 -54.355 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.770 0.506 -54.562 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.320 -1.211 -54.426 1.00 0.00 H new ATOM 0 HD21 LEU A 75 9.573 -2.286 -56.251 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.868 -2.787 -56.350 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.690 -2.140 -57.789 1.00 0.00 H new ATOM 624 N GLU A 76 4.655 -1.244 -59.328 1.00 0.00 N ATOM 625 CA GLU A 76 3.261 -1.161 -59.750 1.00 0.00 C ATOM 626 C GLU A 76 2.389 -2.128 -58.960 1.00 0.00 C ATOM 627 O GLU A 76 2.587 -3.342 -59.012 1.00 0.00 O ATOM 628 CB GLU A 76 3.139 -1.454 -61.247 1.00 0.00 C ATOM 629 CG GLU A 76 1.720 -1.362 -61.791 1.00 0.00 C ATOM 630 CD GLU A 76 1.643 -1.626 -63.269 1.00 0.00 C ATOM 631 OE1 GLU A 76 2.377 -1.008 -64.003 1.00 0.00 O ATOM 632 OE2 GLU A 76 0.848 -2.445 -63.665 1.00 0.00 O ATOM 0 H GLU A 76 5.040 -2.188 -59.330 1.00 0.00 H new ATOM 0 HA GLU A 76 2.913 -0.147 -59.554 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.771 -0.755 -61.795 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.526 -2.454 -61.442 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.088 -2.078 -61.266 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.320 -0.370 -61.583 1.00 0.00 H new ATOM 639 N LEU A 77 1.422 -1.583 -58.229 1.00 0.00 N ATOM 640 CA LEU A 77 0.542 -2.393 -57.396 1.00 0.00 C ATOM 641 C LEU A 77 -0.895 -2.339 -57.899 1.00 0.00 C ATOM 642 O LEU A 77 -1.502 -1.270 -57.959 1.00 0.00 O ATOM 643 CB LEU A 77 0.599 -1.913 -55.941 1.00 0.00 C ATOM 644 CG LEU A 77 -0.379 -2.595 -54.976 1.00 0.00 C ATOM 645 CD1 LEU A 77 -0.012 -4.066 -54.833 1.00 0.00 C ATOM 646 CD2 LEU A 77 -0.341 -1.888 -53.629 1.00 0.00 C ATOM 0 H LEU A 77 1.228 -0.582 -58.197 1.00 0.00 H new ATOM 0 HA LEU A 77 0.887 -3.425 -57.450 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.612 -2.063 -55.568 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.408 -0.840 -55.924 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.394 -2.531 -55.369 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.708 -4.550 -54.147 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.067 -4.551 -55.808 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.002 -4.152 -54.442 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.036 -2.373 -52.944 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.668 -1.940 -53.219 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.627 -0.844 -53.758 1.00 0.00 H new ATOM 658 N ASN A 78 -1.435 -3.500 -58.258 1.00 0.00 N ATOM 659 CA ASN A 78 -2.754 -3.572 -58.876 1.00 0.00 C ATOM 660 C ASN A 78 -3.708 -4.416 -58.042 1.00 0.00 C ATOM 661 O ASN A 78 -3.293 -5.364 -57.376 1.00 0.00 O ATOM 662 CB ASN A 78 -2.652 -4.119 -60.288 1.00 0.00 C ATOM 663 CG ASN A 78 -1.847 -3.231 -61.196 1.00 0.00 C ATOM 664 OD1 ASN A 78 -2.043 -2.010 -61.223 1.00 0.00 O ATOM 665 ND2 ASN A 78 -0.946 -3.819 -61.940 1.00 0.00 N ATOM 0 H ASN A 78 -0.979 -4.404 -58.131 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.157 -2.560 -58.924 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.197 -5.109 -60.258 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.654 -4.241 -60.700 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.370 -3.267 -62.576 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.819 -4.830 -61.884 1.00 0.00 H new ATOM 672 N ILE A 79 -4.989 -4.066 -58.081 1.00 0.00 N ATOM 673 CA ILE A 79 -6.032 -4.904 -57.501 1.00 0.00 C ATOM 674 C ILE A 79 -7.375 -4.658 -58.176 1.00 0.00 C ATOM 675 O ILE A 79 -7.762 -3.513 -58.410 1.00 0.00 O ATOM 676 CB ILE A 79 -6.161 -4.650 -55.988 1.00 0.00 C ATOM 677 CG1 ILE A 79 -7.124 -5.661 -55.359 1.00 0.00 C ATOM 678 CG2 ILE A 79 -6.633 -3.228 -55.726 1.00 0.00 C ATOM 679 CD1 ILE A 79 -7.063 -5.702 -53.849 1.00 0.00 C ATOM 0 H ILE A 79 -5.331 -3.206 -58.509 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.744 -5.942 -57.664 1.00 0.00 H new ATOM 0 HB ILE A 79 -5.180 -4.776 -55.530 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -8.142 -5.419 -55.666 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -6.900 -6.654 -55.750 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.719 -3.065 -54.652 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.914 -2.523 -56.143 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.605 -3.075 -56.195 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -7.773 -6.441 -53.476 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -6.056 -5.974 -53.533 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -7.316 -4.721 -53.448 1.00 0.00 H new ATOM 691 N THR A 80 -8.081 -5.740 -58.486 1.00 0.00 N ATOM 692 CA THR A 80 -9.361 -5.646 -59.180 1.00 0.00 C ATOM 693 C THR A 80 -10.523 -5.880 -58.225 1.00 0.00 C ATOM 694 O THR A 80 -10.539 -6.859 -57.479 1.00 0.00 O ATOM 695 CB THR A 80 -9.435 -6.653 -60.343 1.00 0.00 C ATOM 696 OG1 THR A 80 -8.394 -6.374 -61.288 1.00 0.00 O ATOM 697 CG2 THR A 80 -10.785 -6.563 -61.040 1.00 0.00 C ATOM 0 H THR A 80 -7.789 -6.693 -58.268 1.00 0.00 H new ATOM 0 HA THR A 80 -9.437 -4.636 -59.583 1.00 0.00 H new ATOM 0 HB THR A 80 -9.310 -7.659 -59.942 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.442 -7.017 -62.026 1.00 0.00 H new ATOM 0 HG21 THR A 80 -10.820 -7.281 -61.859 1.00 0.00 H new ATOM 0 HG22 THR A 80 -11.578 -6.787 -60.327 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.925 -5.556 -61.434 1.00 0.00 H new ATOM 705 N LEU A 81 -11.496 -4.975 -58.253 1.00 0.00 N ATOM 706 CA LEU A 81 -12.670 -5.085 -57.395 1.00 0.00 C ATOM 707 C LEU A 81 -13.948 -5.182 -58.219 1.00 0.00 C ATOM 708 O LEU A 81 -14.655 -6.146 -58.118 1.00 0.00 O ATOM 709 CB LEU A 81 -12.752 -3.879 -56.451 1.00 0.00 C ATOM 710 CG LEU A 81 -13.958 -3.857 -55.503 1.00 0.00 C ATOM 711 CD1 LEU A 81 -13.853 -5.017 -54.522 1.00 0.00 C ATOM 712 CD2 LEU A 81 -14.004 -2.525 -54.771 1.00 0.00 C ATOM 0 H LEU A 81 -11.494 -4.156 -58.861 1.00 0.00 H new ATOM 0 HA LEU A 81 -12.570 -5.998 -56.808 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -11.842 -3.847 -55.852 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -12.770 -2.970 -57.053 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.881 -3.969 -56.071 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -14.709 -5.002 -53.848 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.840 -5.958 -55.072 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.934 -4.922 -53.943 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -14.861 -2.509 -54.097 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -13.088 -2.394 -54.195 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -14.097 -1.715 -55.495 1.00 0.00 H new TER 724 LEU A 81 ATOM 725 N ASP B 38 -15.542 8.401 -51.211 1.00 0.00 N ATOM 726 CA ASP B 38 -15.853 8.189 -49.802 1.00 0.00 C ATOM 727 C ASP B 38 -15.053 7.026 -49.230 1.00 0.00 C ATOM 728 O ASP B 38 -14.305 7.190 -48.266 1.00 0.00 O ATOM 729 CB ASP B 38 -17.350 7.925 -49.618 1.00 0.00 C ATOM 730 CG ASP B 38 -18.206 9.155 -49.887 1.00 0.00 C ATOM 731 OD1 ASP B 38 -17.668 10.236 -49.904 1.00 0.00 O ATOM 732 OD2 ASP B 38 -19.389 9.000 -50.074 1.00 0.00 O ATOM 0 HA ASP B 38 -15.579 9.096 -49.263 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -17.657 7.121 -50.287 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -17.530 7.579 -48.600 1.00 0.00 H new ATOM 737 N TYR B 39 -15.213 5.850 -49.829 1.00 0.00 N ATOM 738 CA TYR B 39 -14.620 4.630 -49.295 1.00 0.00 C ATOM 739 C TYR B 39 -13.249 4.371 -49.906 1.00 0.00 C ATOM 740 O TYR B 39 -12.225 4.512 -49.239 1.00 0.00 O ATOM 741 CB TYR B 39 -15.545 3.435 -49.538 1.00 0.00 C ATOM 742 CG TYR B 39 -15.043 2.144 -48.933 1.00 0.00 C ATOM 743 CD1 TYR B 39 -15.059 1.970 -47.557 1.00 0.00 C ATOM 744 CD2 TYR B 39 -14.567 1.132 -49.753 1.00 0.00 C ATOM 745 CE1 TYR B 39 -14.602 0.790 -47.003 1.00 0.00 C ATOM 746 CE2 TYR B 39 -14.110 -0.049 -49.200 1.00 0.00 C ATOM 747 CZ TYR B 39 -14.125 -0.221 -47.831 1.00 0.00 C ATOM 748 OH TYR B 39 -13.670 -1.396 -47.280 1.00 0.00 O ATOM 0 H TYR B 39 -15.750 5.717 -50.686 1.00 0.00 H new ATOM 0 HA TYR B 39 -14.491 4.762 -48.221 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -16.529 3.660 -49.127 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -15.672 3.297 -50.612 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -15.429 2.758 -46.918 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -14.553 1.267 -50.824 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -14.615 0.653 -45.932 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -13.741 -0.837 -49.839 1.00 0.00 H new ATOM 0 HH TYR B 39 -13.372 -1.998 -47.994 1.00 0.00 H new ATOM 758 N LEU B 40 -13.237 3.993 -51.180 1.00 0.00 N ATOM 759 CA LEU B 40 -12.003 3.602 -51.851 1.00 0.00 C ATOM 760 C LEU B 40 -11.041 4.777 -51.962 1.00 0.00 C ATOM 761 O LEU B 40 -9.839 4.632 -51.740 1.00 0.00 O ATOM 762 CB LEU B 40 -12.312 3.052 -53.249 1.00 0.00 C ATOM 763 CG LEU B 40 -12.998 1.680 -53.288 1.00 0.00 C ATOM 764 CD1 LEU B 40 -13.394 1.351 -54.721 1.00 0.00 C ATOM 765 CD2 LEU B 40 -12.057 0.626 -52.725 1.00 0.00 C ATOM 0 H LEU B 40 -14.069 3.949 -51.769 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.528 2.824 -51.253 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.946 3.770 -53.770 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.379 2.987 -53.808 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.900 1.697 -52.677 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.881 0.376 -54.749 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -14.081 2.111 -55.092 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.503 1.329 -55.349 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.544 -0.349 -52.753 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -11.147 0.594 -53.324 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.805 0.877 -51.695 1.00 0.00 H new ATOM 777 N PRO B 41 -11.576 5.944 -52.307 1.00 0.00 N ATOM 778 CA PRO B 41 -10.775 7.158 -52.396 1.00 0.00 C ATOM 779 C PRO B 41 -9.959 7.375 -51.128 1.00 0.00 C ATOM 780 O PRO B 41 -8.793 7.765 -51.187 1.00 0.00 O ATOM 781 CB PRO B 41 -11.830 8.254 -52.583 1.00 0.00 C ATOM 782 CG PRO B 41 -12.933 7.577 -53.321 1.00 0.00 C ATOM 783 CD PRO B 41 -13.022 6.212 -52.693 1.00 0.00 C ATOM 0 HA PRO B 41 -10.041 7.133 -53.202 1.00 0.00 H new ATOM 0 HB2 PRO B 41 -12.173 8.645 -51.625 1.00 0.00 H new ATOM 0 HB3 PRO B 41 -11.432 9.098 -53.147 1.00 0.00 H new ATOM 0 HG2 PRO B 41 -13.871 8.122 -53.221 1.00 0.00 H new ATOM 0 HG3 PRO B 41 -12.715 7.510 -54.387 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -13.683 6.204 -51.827 1.00 0.00 H new ATOM 0 HD3 PRO B 41 -13.402 5.466 -53.391 1.00 0.00 H new ATOM 791 N THR B 42 -10.579 7.118 -49.981 1.00 0.00 N ATOM 792 CA THR B 42 -9.890 7.212 -48.700 1.00 0.00 C ATOM 793 C THR B 42 -8.808 6.146 -48.575 1.00 0.00 C ATOM 794 O THR B 42 -7.691 6.429 -48.145 1.00 0.00 O ATOM 795 CB THR B 42 -10.879 7.085 -47.527 1.00 0.00 C ATOM 796 OG1 THR B 42 -11.837 8.151 -47.588 1.00 0.00 O ATOM 797 CG2 THR B 42 -10.143 7.146 -46.198 1.00 0.00 C ATOM 0 H THR B 42 -11.559 6.843 -49.913 1.00 0.00 H new ATOM 0 HA THR B 42 -9.420 8.194 -48.659 1.00 0.00 H new ATOM 0 HB THR B 42 -11.388 6.124 -47.604 1.00 0.00 H new ATOM 0 HG1 THR B 42 -12.738 7.776 -47.675 1.00 0.00 H new ATOM 0 HG21 THR B 42 -10.859 7.055 -45.381 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.423 6.329 -46.143 1.00 0.00 H new ATOM 0 HG23 THR B 42 -9.618 8.098 -46.116 1.00 0.00 H new ATOM 805 N LEU B 43 -9.149 4.919 -48.954 1.00 0.00 N ATOM 806 CA LEU B 43 -8.200 3.813 -48.911 1.00 0.00 C ATOM 807 C LEU B 43 -7.029 4.054 -49.854 1.00 0.00 C ATOM 808 O LEU B 43 -5.911 3.607 -49.598 1.00 0.00 O ATOM 809 CB LEU B 43 -8.900 2.500 -49.281 1.00 0.00 C ATOM 810 CG LEU B 43 -9.956 2.004 -48.284 1.00 0.00 C ATOM 811 CD1 LEU B 43 -10.628 0.754 -48.835 1.00 0.00 C ATOM 812 CD2 LEU B 43 -9.297 1.725 -46.942 1.00 0.00 C ATOM 0 H LEU B 43 -10.076 4.665 -49.295 1.00 0.00 H new ATOM 0 HA LEU B 43 -7.813 3.744 -47.894 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.376 2.625 -50.254 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -8.142 1.725 -49.394 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.719 2.769 -48.139 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.378 0.402 -48.127 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -11.108 0.988 -49.785 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -9.880 -0.024 -48.988 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -10.048 1.373 -46.234 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -8.528 0.962 -47.066 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -8.842 2.640 -46.563 1.00 0.00 H new ATOM 824 N ARG B 44 -7.291 4.766 -50.945 1.00 0.00 N ATOM 825 CA ARG B 44 -6.245 5.125 -51.895 1.00 0.00 C ATOM 826 C ARG B 44 -5.248 6.096 -51.275 1.00 0.00 C ATOM 827 O ARG B 44 -4.039 5.957 -51.455 1.00 0.00 O ATOM 828 CB ARG B 44 -6.849 5.751 -53.144 1.00 0.00 C ATOM 829 CG ARG B 44 -7.552 4.775 -54.073 1.00 0.00 C ATOM 830 CD ARG B 44 -8.343 5.479 -55.114 1.00 0.00 C ATOM 831 NE ARG B 44 -7.503 6.305 -55.967 1.00 0.00 N ATOM 832 CZ ARG B 44 -7.960 7.269 -56.789 1.00 0.00 C ATOM 833 NH1 ARG B 44 -9.250 7.517 -56.858 1.00 0.00 N ATOM 834 NH2 ARG B 44 -7.114 7.966 -57.526 1.00 0.00 N ATOM 0 H ARG B 44 -8.220 5.106 -51.193 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.720 4.209 -52.167 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.561 6.518 -52.840 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -6.057 6.253 -53.700 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -6.813 4.131 -54.551 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -8.210 4.129 -53.492 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -8.872 4.747 -55.725 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -9.099 6.102 -54.636 1.00 0.00 H new ATOM 0 HE ARG B 44 -6.496 6.143 -55.941 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -9.904 6.979 -56.289 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -9.596 8.247 -57.480 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -6.114 7.774 -57.473 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -7.461 8.696 -58.148 1.00 0.00 H new ATOM 848 N LYS B 45 -5.764 7.079 -50.544 1.00 0.00 N ATOM 849 CA LYS B 45 -4.919 7.998 -49.792 1.00 0.00 C ATOM 850 C LYS B 45 -4.139 7.266 -48.706 1.00 0.00 C ATOM 851 O LYS B 45 -2.971 7.567 -48.457 1.00 0.00 O ATOM 852 CB LYS B 45 -5.760 9.115 -49.172 1.00 0.00 C ATOM 853 CG LYS B 45 -6.337 10.100 -50.180 1.00 0.00 C ATOM 854 CD LYS B 45 -7.196 11.152 -49.494 1.00 0.00 C ATOM 855 CE LYS B 45 -7.792 12.124 -50.502 1.00 0.00 C ATOM 856 NZ LYS B 45 -8.667 13.136 -49.850 1.00 0.00 N ATOM 0 H LYS B 45 -6.764 7.259 -50.457 1.00 0.00 H new ATOM 0 HA LYS B 45 -4.205 8.438 -50.488 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -6.579 8.667 -48.610 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -5.145 9.663 -48.458 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -5.526 10.586 -50.722 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -6.935 9.562 -50.916 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -7.997 10.664 -48.939 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -6.594 11.700 -48.770 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -6.988 12.630 -51.037 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -8.368 11.570 -51.243 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -9.052 13.778 -50.572 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -9.449 12.655 -49.361 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -8.112 13.683 -49.161 1.00 0.00 H new ATOM 870 N GLU B 46 -4.791 6.304 -48.063 1.00 0.00 N ATOM 871 CA GLU B 46 -4.135 5.469 -47.064 1.00 0.00 C ATOM 872 C GLU B 46 -2.954 4.716 -47.664 1.00 0.00 C ATOM 873 O GLU B 46 -1.902 4.591 -47.037 1.00 0.00 O ATOM 874 CB GLU B 46 -5.130 4.493 -46.453 1.00 0.00 C ATOM 0 H GLU B 46 -5.775 6.083 -48.216 1.00 0.00 H new ATOM 0 HA GLU B 46 -3.754 6.122 -46.278 1.00 0.00 H new ATOM 879 N LEU B 47 -3.135 4.216 -48.882 1.00 0.00 N ATOM 880 CA LEU B 47 -2.069 3.518 -49.590 1.00 0.00 C ATOM 881 C LEU B 47 -0.895 4.447 -49.873 1.00 0.00 C ATOM 882 O LEU B 47 0.264 4.047 -49.775 1.00 0.00 O ATOM 883 CB LEU B 47 -2.599 2.937 -50.906 1.00 0.00 C ATOM 884 CG LEU B 47 -3.532 1.727 -50.771 1.00 0.00 C ATOM 885 CD1 LEU B 47 -4.168 1.422 -52.121 1.00 0.00 C ATOM 886 CD2 LEU B 47 -2.744 0.531 -50.256 1.00 0.00 C ATOM 0 H LEU B 47 -4.011 4.282 -49.400 1.00 0.00 H new ATOM 0 HA LEU B 47 -1.719 2.707 -48.952 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.130 3.724 -51.441 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.748 2.649 -51.524 1.00 0.00 H new ATOM 0 HG LEU B 47 -4.326 1.948 -50.058 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -4.831 0.562 -52.025 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -4.741 2.286 -52.457 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -3.388 1.199 -52.849 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -3.408 -0.328 -50.160 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.943 0.294 -50.956 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.316 0.769 -49.282 1.00 0.00 H new ATOM 898 N MET B 48 -1.204 5.691 -50.226 1.00 0.00 N ATOM 899 CA MET B 48 -0.177 6.700 -50.453 1.00 0.00 C ATOM 900 C MET B 48 0.676 6.908 -49.208 1.00 0.00 C ATOM 901 O MET B 48 1.904 6.910 -49.279 1.00 0.00 O ATOM 902 CB MET B 48 -0.817 8.017 -50.887 1.00 0.00 C ATOM 903 CG MET B 48 -1.477 7.976 -52.258 1.00 0.00 C ATOM 904 SD MET B 48 -2.364 9.496 -52.649 1.00 0.00 S ATOM 905 CE MET B 48 -1.003 10.643 -52.840 1.00 0.00 C ATOM 0 H MET B 48 -2.159 6.024 -50.361 1.00 0.00 H new ATOM 0 HA MET B 48 0.476 6.345 -51.251 1.00 0.00 H new ATOM 0 HB2 MET B 48 -1.563 8.305 -50.147 1.00 0.00 H new ATOM 0 HB3 MET B 48 -0.053 8.795 -50.888 1.00 0.00 H new ATOM 0 HG2 MET B 48 -0.716 7.799 -53.018 1.00 0.00 H new ATOM 0 HG3 MET B 48 -2.170 7.135 -52.298 1.00 0.00 H new ATOM 0 HE1 MET B 48 -1.370 11.574 -53.272 1.00 0.00 H new ATOM 0 HE2 MET B 48 -0.558 10.845 -51.866 1.00 0.00 H new ATOM 0 HE3 MET B 48 -0.251 10.209 -53.499 1.00 0.00 H new ATOM 915 N GLU B 49 0.016 7.081 -48.068 1.00 0.00 N ATOM 916 CA GLU B 49 0.712 7.248 -46.798 1.00 0.00 C ATOM 917 C GLU B 49 1.631 6.067 -46.514 1.00 0.00 C ATOM 918 O GLU B 49 2.814 6.244 -46.222 1.00 0.00 O ATOM 919 CB GLU B 49 -0.293 7.411 -45.656 1.00 0.00 C ATOM 920 CG GLU B 49 0.339 7.576 -44.281 1.00 0.00 C ATOM 921 CD GLU B 49 -0.679 7.722 -43.183 1.00 0.00 C ATOM 922 OE1 GLU B 49 -1.841 7.833 -43.488 1.00 0.00 O ATOM 923 OE2 GLU B 49 -0.291 7.722 -42.038 1.00 0.00 O ATOM 0 H GLU B 49 -1.001 7.109 -47.998 1.00 0.00 H new ATOM 0 HA GLU B 49 1.322 8.148 -46.869 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -0.920 8.279 -45.861 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -0.949 6.541 -45.639 1.00 0.00 H new ATOM 0 HG2 GLU B 49 0.971 6.713 -44.071 1.00 0.00 H new ATOM 0 HG3 GLU B 49 0.987 8.452 -44.287 1.00 0.00 H new ATOM 930 N VAL B 50 1.080 4.860 -46.602 1.00 0.00 N ATOM 931 CA VAL B 50 1.828 3.652 -46.281 1.00 0.00 C ATOM 932 C VAL B 50 3.063 3.518 -47.163 1.00 0.00 C ATOM 933 O VAL B 50 4.138 3.147 -46.691 1.00 0.00 O ATOM 934 CB VAL B 50 0.937 2.409 -46.460 1.00 0.00 C ATOM 935 CG1 VAL B 50 1.773 1.139 -46.389 1.00 0.00 C ATOM 936 CG2 VAL B 50 -0.153 2.396 -45.399 1.00 0.00 C ATOM 0 H VAL B 50 0.117 4.694 -46.893 1.00 0.00 H new ATOM 0 HA VAL B 50 2.148 3.727 -45.242 1.00 0.00 H new ATOM 0 HB VAL B 50 0.467 2.450 -47.443 1.00 0.00 H new ATOM 0 HG11 VAL B 50 1.127 0.271 -46.517 1.00 0.00 H new ATOM 0 HG12 VAL B 50 2.524 1.153 -47.179 1.00 0.00 H new ATOM 0 HG13 VAL B 50 2.268 1.083 -45.419 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.779 1.514 -45.532 1.00 0.00 H new ATOM 0 HG22 VAL B 50 0.303 2.372 -44.409 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -0.765 3.293 -45.495 1.00 0.00 H new ATOM 946 N LEU B 51 2.904 3.822 -48.446 1.00 0.00 N ATOM 947 CA LEU B 51 3.991 3.687 -49.408 1.00 0.00 C ATOM 948 C LEU B 51 5.062 4.747 -49.183 1.00 0.00 C ATOM 949 O LEU B 51 6.256 4.467 -49.276 1.00 0.00 O ATOM 950 CB LEU B 51 3.450 3.793 -50.839 1.00 0.00 C ATOM 951 CG LEU B 51 4.488 3.626 -51.956 1.00 0.00 C ATOM 952 CD1 LEU B 51 5.207 2.294 -51.788 1.00 0.00 C ATOM 953 CD2 LEU B 51 3.795 3.707 -53.309 1.00 0.00 C ATOM 0 H LEU B 51 2.030 4.165 -48.845 1.00 0.00 H new ATOM 0 HA LEU B 51 4.444 2.706 -49.264 1.00 0.00 H new ATOM 0 HB2 LEU B 51 2.675 3.038 -50.972 1.00 0.00 H new ATOM 0 HB3 LEU B 51 2.971 4.765 -50.956 1.00 0.00 H new ATOM 0 HG LEU B 51 5.228 4.425 -51.900 1.00 0.00 H new ATOM 0 HD11 LEU B 51 5.944 2.176 -52.582 1.00 0.00 H new ATOM 0 HD12 LEU B 51 5.709 2.271 -50.821 1.00 0.00 H new ATOM 0 HD13 LEU B 51 4.483 1.481 -51.841 1.00 0.00 H new ATOM 0 HD21 LEU B 51 4.532 3.588 -54.103 1.00 0.00 H new ATOM 0 HD22 LEU B 51 3.050 2.915 -53.384 1.00 0.00 H new ATOM 0 HD23 LEU B 51 3.306 4.676 -53.410 1.00 0.00 H new ATOM 965 N SER B 52 4.625 5.967 -48.885 1.00 0.00 N ATOM 966 CA SER B 52 5.545 7.070 -48.637 1.00 0.00 C ATOM 967 C SER B 52 6.414 6.798 -47.416 1.00 0.00 C ATOM 968 O SER B 52 7.536 7.297 -47.317 1.00 0.00 O ATOM 969 CB SER B 52 4.773 8.360 -48.443 1.00 0.00 C ATOM 970 OG SER B 52 4.093 8.359 -47.218 1.00 0.00 O ATOM 0 H SER B 52 3.639 6.216 -48.810 1.00 0.00 H new ATOM 0 HA SER B 52 6.197 7.166 -49.505 1.00 0.00 H new ATOM 0 HB2 SER B 52 5.458 9.207 -48.482 1.00 0.00 H new ATOM 0 HB3 SER B 52 4.061 8.488 -49.258 1.00 0.00 H new ATOM 0 HG SER B 52 3.583 7.527 -47.127 1.00 0.00 H new ATOM 976 N LYS B 53 5.890 6.006 -46.487 1.00 0.00 N ATOM 977 CA LYS B 53 6.619 5.663 -45.272 1.00 0.00 C ATOM 978 C LYS B 53 7.611 4.535 -45.525 1.00 0.00 C ATOM 979 O LYS B 53 8.649 4.449 -44.868 1.00 0.00 O ATOM 980 CB LYS B 53 5.648 5.269 -44.158 1.00 0.00 C ATOM 981 CG LYS B 53 4.838 6.427 -43.590 1.00 0.00 C ATOM 982 CD LYS B 53 3.875 5.952 -42.513 1.00 0.00 C ATOM 983 CE LYS B 53 3.124 7.119 -41.887 1.00 0.00 C ATOM 984 NZ LYS B 53 2.116 6.662 -40.892 1.00 0.00 N ATOM 0 H LYS B 53 4.961 5.589 -46.553 1.00 0.00 H new ATOM 0 HA LYS B 53 7.178 6.545 -44.959 1.00 0.00 H new ATOM 0 HB2 LYS B 53 4.961 4.515 -44.542 1.00 0.00 H new ATOM 0 HB3 LYS B 53 6.212 4.805 -43.349 1.00 0.00 H new ATOM 0 HG2 LYS B 53 5.512 7.175 -43.174 1.00 0.00 H new ATOM 0 HG3 LYS B 53 4.280 6.911 -44.392 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.163 5.248 -42.944 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.426 5.415 -41.741 1.00 0.00 H new ATOM 0 HE2 LYS B 53 3.834 7.789 -41.403 1.00 0.00 H new ATOM 0 HE3 LYS B 53 2.627 7.692 -42.670 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 1.167 6.959 -41.197 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 2.147 5.625 -40.818 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.329 7.082 -39.965 1.00 0.00 H new ATOM 998 N TYR B 54 7.287 3.673 -46.482 1.00 0.00 N ATOM 999 CA TYR B 54 8.150 2.549 -46.824 1.00 0.00 C ATOM 1000 C TYR B 54 9.460 3.026 -47.436 1.00 0.00 C ATOM 1001 O TYR B 54 10.531 2.510 -47.115 1.00 0.00 O ATOM 1002 CB TYR B 54 7.433 1.596 -47.784 1.00 0.00 C ATOM 1003 CG TYR B 54 6.403 0.714 -47.113 1.00 0.00 C ATOM 1004 CD1 TYR B 54 6.258 0.745 -45.734 1.00 0.00 C ATOM 1005 CD2 TYR B 54 5.605 -0.125 -47.876 1.00 0.00 C ATOM 1006 CE1 TYR B 54 5.318 -0.061 -45.121 1.00 0.00 C ATOM 1007 CE2 TYR B 54 4.665 -0.930 -47.263 1.00 0.00 C ATOM 1008 CZ TYR B 54 4.520 -0.899 -45.891 1.00 0.00 C ATOM 1009 OH TYR B 54 3.583 -1.702 -45.281 1.00 0.00 O ATOM 0 H TYR B 54 6.432 3.731 -47.035 1.00 0.00 H new ATOM 0 HA TYR B 54 8.382 2.014 -45.903 1.00 0.00 H new ATOM 0 HB2 TYR B 54 6.945 2.180 -48.564 1.00 0.00 H new ATOM 0 HB3 TYR B 54 8.174 0.965 -48.275 1.00 0.00 H new ATOM 0 HD1 TYR B 54 6.879 1.399 -45.140 1.00 0.00 H new ATOM 0 HD2 TYR B 54 5.719 -0.149 -48.950 1.00 0.00 H new ATOM 0 HE1 TYR B 54 5.204 -0.040 -44.047 1.00 0.00 H new ATOM 0 HE2 TYR B 54 4.044 -1.584 -47.857 1.00 0.00 H new ATOM 0 HH TYR B 54 3.109 -2.225 -45.960 1.00 0.00 H new ATOM 1019 N VAL B 55 9.370 4.015 -48.318 1.00 0.00 N ATOM 1020 CA VAL B 55 10.551 4.578 -48.962 1.00 0.00 C ATOM 1021 C VAL B 55 10.820 5.997 -48.475 1.00 0.00 C ATOM 1022 O VAL B 55 11.690 6.691 -49.003 1.00 0.00 O ATOM 1023 CB VAL B 55 10.373 4.589 -50.491 1.00 0.00 C ATOM 1024 CG1 VAL B 55 10.258 3.168 -51.024 1.00 0.00 C ATOM 1025 CG2 VAL B 55 9.145 5.405 -50.864 1.00 0.00 C ATOM 0 H VAL B 55 8.490 4.444 -48.604 1.00 0.00 H new ATOM 0 HA VAL B 55 11.402 3.951 -48.698 1.00 0.00 H new ATOM 0 HB VAL B 55 11.250 5.051 -50.945 1.00 0.00 H new ATOM 0 HG11 VAL B 55 10.133 3.194 -52.106 1.00 0.00 H new ATOM 0 HG12 VAL B 55 11.163 2.612 -50.777 1.00 0.00 H new ATOM 0 HG13 VAL B 55 9.396 2.678 -50.571 1.00 0.00 H new ATOM 0 HG21 VAL B 55 9.026 5.408 -51.947 1.00 0.00 H new ATOM 0 HG22 VAL B 55 8.261 4.964 -50.403 1.00 0.00 H new ATOM 0 HG23 VAL B 55 9.267 6.428 -50.509 1.00 0.00 H new ATOM 1035 N ASN B 56 10.067 6.424 -47.467 1.00 0.00 N ATOM 1036 CA ASN B 56 10.366 7.662 -46.758 1.00 0.00 C ATOM 1037 C ASN B 56 10.393 8.850 -47.711 1.00 0.00 C ATOM 1038 O ASN B 56 11.268 9.712 -47.620 1.00 0.00 O ATOM 1039 CB ASN B 56 11.683 7.546 -46.012 1.00 0.00 C ATOM 1040 CG ASN B 56 11.628 6.543 -44.894 1.00 0.00 C ATOM 1041 OD1 ASN B 56 10.714 6.574 -44.061 1.00 0.00 O ATOM 1042 ND2 ASN B 56 12.586 5.654 -44.858 1.00 0.00 N ATOM 0 H ASN B 56 9.244 5.930 -47.122 1.00 0.00 H new ATOM 0 HA ASN B 56 9.571 7.832 -46.032 1.00 0.00 H new ATOM 0 HB2 ASN B 56 12.469 7.262 -46.712 1.00 0.00 H new ATOM 0 HB3 ASN B 56 11.954 8.521 -45.607 1.00 0.00 H new ATOM 0 HD21 ASN B 56 12.599 4.948 -44.122 1.00 0.00 H new ATOM 0 HD22 ASN B 56 13.320 5.666 -45.566 1.00 0.00 H new ATOM 1049 N VAL B 57 9.430 8.890 -48.626 1.00 0.00 N ATOM 1050 CA VAL B 57 9.241 10.050 -49.489 1.00 0.00 C ATOM 1051 C VAL B 57 7.993 10.831 -49.097 1.00 0.00 C ATOM 1052 O VAL B 57 7.385 10.568 -48.059 1.00 0.00 O ATOM 1053 CB VAL B 57 9.125 9.608 -50.960 1.00 0.00 C ATOM 1054 CG1 VAL B 57 10.382 8.869 -51.394 1.00 0.00 C ATOM 1055 CG2 VAL B 57 7.894 8.733 -51.142 1.00 0.00 C ATOM 0 H VAL B 57 8.768 8.132 -48.789 1.00 0.00 H new ATOM 0 HA VAL B 57 10.110 10.697 -49.369 1.00 0.00 H new ATOM 0 HB VAL B 57 9.020 10.492 -51.588 1.00 0.00 H new ATOM 0 HG11 VAL B 57 10.283 8.564 -52.436 1.00 0.00 H new ATOM 0 HG12 VAL B 57 11.245 9.526 -51.289 1.00 0.00 H new ATOM 0 HG13 VAL B 57 10.519 7.987 -50.769 1.00 0.00 H new ATOM 0 HG21 VAL B 57 7.818 8.424 -52.185 1.00 0.00 H new ATOM 0 HG22 VAL B 57 7.978 7.851 -50.507 1.00 0.00 H new ATOM 0 HG23 VAL B 57 7.003 9.296 -50.865 1.00 0.00 H new ATOM 1065 N SER B 58 7.616 11.791 -49.933 1.00 0.00 N ATOM 1066 CA SER B 58 6.421 12.592 -49.692 1.00 0.00 C ATOM 1067 C SER B 58 5.231 12.054 -50.477 1.00 0.00 C ATOM 1068 O SER B 58 5.389 11.227 -51.374 1.00 0.00 O ATOM 1069 CB SER B 58 6.676 14.038 -50.068 1.00 0.00 C ATOM 1070 OG SER B 58 6.801 14.181 -51.457 1.00 0.00 O ATOM 0 H SER B 58 8.121 12.034 -50.785 1.00 0.00 H new ATOM 0 HA SER B 58 6.185 12.533 -48.630 1.00 0.00 H new ATOM 0 HB2 SER B 58 5.858 14.661 -49.707 1.00 0.00 H new ATOM 0 HB3 SER B 58 7.585 14.390 -49.579 1.00 0.00 H new ATOM 0 HG SER B 58 7.458 13.536 -51.794 1.00 0.00 H new ATOM 1076 N LEU B 59 4.039 12.531 -50.134 1.00 0.00 N ATOM 1077 CA LEU B 59 2.816 12.075 -50.784 1.00 0.00 C ATOM 1078 C LEU B 59 2.805 12.445 -52.261 1.00 0.00 C ATOM 1079 O LEU B 59 2.115 11.816 -53.064 1.00 0.00 O ATOM 1080 CB LEU B 59 1.590 12.679 -50.089 1.00 0.00 C ATOM 1081 CG LEU B 59 1.319 12.181 -48.664 1.00 0.00 C ATOM 1082 CD1 LEU B 59 0.151 12.956 -48.068 1.00 0.00 C ATOM 1083 CD2 LEU B 59 1.025 10.689 -48.695 1.00 0.00 C ATOM 0 H LEU B 59 3.894 13.234 -49.409 1.00 0.00 H new ATOM 0 HA LEU B 59 2.779 10.989 -50.703 1.00 0.00 H new ATOM 0 HB2 LEU B 59 1.710 13.762 -50.059 1.00 0.00 H new ATOM 0 HB3 LEU B 59 0.711 12.472 -50.699 1.00 0.00 H new ATOM 0 HG LEU B 59 2.196 12.346 -48.039 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -0.042 12.602 -47.055 1.00 0.00 H new ATOM 0 HD12 LEU B 59 0.395 14.018 -48.041 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -0.737 12.803 -48.681 1.00 0.00 H new ATOM 0 HD21 LEU B 59 0.832 10.335 -47.682 1.00 0.00 H new ATOM 0 HD22 LEU B 59 0.149 10.504 -49.317 1.00 0.00 H new ATOM 0 HD23 LEU B 59 1.882 10.158 -49.108 1.00 0.00 H new ATOM 1095 N ASP B 60 3.575 13.468 -52.615 1.00 0.00 N ATOM 1096 CA ASP B 60 3.619 13.955 -53.989 1.00 0.00 C ATOM 1097 C ASP B 60 4.498 13.066 -54.859 1.00 0.00 C ATOM 1098 O ASP B 60 4.587 13.262 -56.071 1.00 0.00 O ATOM 1099 CB ASP B 60 4.138 15.394 -54.032 1.00 0.00 C ATOM 1100 CG ASP B 60 3.161 16.394 -53.429 1.00 0.00 C ATOM 1101 OD1 ASP B 60 1.997 16.081 -53.341 1.00 0.00 O ATOM 1102 OD2 ASP B 60 3.587 17.464 -53.062 1.00 0.00 O ATOM 0 H ASP B 60 4.178 13.977 -51.969 1.00 0.00 H new ATOM 0 HA ASP B 60 2.603 13.929 -54.382 1.00 0.00 H new ATOM 0 HB2 ASP B 60 5.085 15.450 -53.495 1.00 0.00 H new ATOM 0 HB3 ASP B 60 4.341 15.671 -55.066 1.00 0.00 H new ATOM 1107 N ASN B 61 5.145 12.088 -54.234 1.00 0.00 N ATOM 1108 CA ASN B 61 5.985 11.141 -54.958 1.00 0.00 C ATOM 1109 C ASN B 61 5.216 9.872 -55.300 1.00 0.00 C ATOM 1110 O ASN B 61 5.770 8.934 -55.874 1.00 0.00 O ATOM 1111 CB ASN B 61 7.230 10.811 -54.155 1.00 0.00 C ATOM 1112 CG ASN B 61 8.135 11.999 -53.978 1.00 0.00 C ATOM 1113 OD1 ASN B 61 8.356 12.464 -52.854 1.00 0.00 O ATOM 1114 ND2 ASN B 61 8.663 12.498 -55.067 1.00 0.00 N ATOM 0 H ASN B 61 5.104 11.930 -53.227 1.00 0.00 H new ATOM 0 HA ASN B 61 6.290 11.610 -55.894 1.00 0.00 H new ATOM 0 HB2 ASN B 61 6.937 10.433 -53.176 1.00 0.00 H new ATOM 0 HB3 ASN B 61 7.779 10.012 -54.654 1.00 0.00 H new ATOM 0 HD21 ASN B 61 9.286 13.304 -55.009 1.00 0.00 H new ATOM 0 HD22 ASN B 61 8.452 12.081 -55.974 1.00 0.00 H new ATOM 1121 N ILE B 62 3.936 9.847 -54.943 1.00 0.00 N ATOM 1122 CA ILE B 62 3.091 8.688 -55.203 1.00 0.00 C ATOM 1123 C ILE B 62 1.953 9.039 -56.153 1.00 0.00 C ATOM 1124 O ILE B 62 1.353 10.109 -56.052 1.00 0.00 O ATOM 1125 CB ILE B 62 2.511 8.127 -53.892 1.00 0.00 C ATOM 1126 CG1 ILE B 62 3.631 7.584 -53.001 1.00 0.00 C ATOM 1127 CG2 ILE B 62 1.487 7.040 -54.185 1.00 0.00 C ATOM 1128 CD1 ILE B 62 4.164 8.592 -52.009 1.00 0.00 C ATOM 0 H ILE B 62 3.461 10.617 -54.472 1.00 0.00 H new ATOM 0 HA ILE B 62 3.717 7.928 -55.670 1.00 0.00 H new ATOM 0 HB ILE B 62 2.010 8.937 -53.361 1.00 0.00 H new ATOM 0 HG12 ILE B 62 3.261 6.714 -52.458 1.00 0.00 H new ATOM 0 HG13 ILE B 62 4.451 7.241 -53.632 1.00 0.00 H new ATOM 0 HG21 ILE B 62 1.087 6.654 -53.247 1.00 0.00 H new ATOM 0 HG22 ILE B 62 0.675 7.456 -54.782 1.00 0.00 H new ATOM 0 HG23 ILE B 62 1.964 6.230 -54.736 1.00 0.00 H new ATOM 0 HD11 ILE B 62 4.954 8.134 -51.414 1.00 0.00 H new ATOM 0 HD12 ILE B 62 4.565 9.452 -52.545 1.00 0.00 H new ATOM 0 HD13 ILE B 62 3.357 8.918 -51.352 1.00 0.00 H new ATOM 1140 N ARG B 63 1.660 8.129 -57.077 1.00 0.00 N ATOM 1141 CA ARG B 63 0.513 8.282 -57.965 1.00 0.00 C ATOM 1142 C ARG B 63 -0.382 7.050 -57.926 1.00 0.00 C ATOM 1143 O ARG B 63 0.081 5.929 -58.138 1.00 0.00 O ATOM 1144 CB ARG B 63 0.973 8.528 -59.395 1.00 0.00 C ATOM 1145 CG ARG B 63 1.746 9.820 -59.606 1.00 0.00 C ATOM 1146 CD ARG B 63 0.873 11.012 -59.461 1.00 0.00 C ATOM 1147 NE ARG B 63 1.591 12.246 -59.729 1.00 0.00 N ATOM 1148 CZ ARG B 63 2.325 12.919 -58.820 1.00 0.00 C ATOM 1149 NH1 ARG B 63 2.425 12.463 -57.591 1.00 0.00 N ATOM 1150 NH2 ARG B 63 2.942 14.035 -59.164 1.00 0.00 N ATOM 0 H ARG B 63 2.201 7.278 -57.230 1.00 0.00 H new ATOM 0 HA ARG B 63 -0.060 9.141 -57.616 1.00 0.00 H new ATOM 0 HB2 ARG B 63 1.598 7.692 -59.709 1.00 0.00 H new ATOM 0 HB3 ARG B 63 0.099 8.534 -60.046 1.00 0.00 H new ATOM 0 HG2 ARG B 63 2.563 9.877 -58.886 1.00 0.00 H new ATOM 0 HG3 ARG B 63 2.196 9.817 -60.599 1.00 0.00 H new ATOM 0 HD2 ARG B 63 0.028 10.928 -60.144 1.00 0.00 H new ATOM 0 HD3 ARG B 63 0.464 11.042 -58.451 1.00 0.00 H new ATOM 0 HE ARG B 63 1.536 12.631 -60.672 1.00 0.00 H new ATOM 0 HH11 ARG B 63 1.948 11.601 -57.326 1.00 0.00 H new ATOM 0 HH12 ARG B 63 2.980 12.971 -56.902 1.00 0.00 H new ATOM 0 HH21 ARG B 63 2.863 14.388 -60.118 1.00 0.00 H new ATOM 0 HH22 ARG B 63 3.497 14.544 -58.476 1.00 0.00 H new ATOM 1164 N ILE B 64 -1.665 7.265 -57.656 1.00 0.00 N ATOM 1165 CA ILE B 64 -2.630 6.174 -57.607 1.00 0.00 C ATOM 1166 C ILE B 64 -3.894 6.522 -58.384 1.00 0.00 C ATOM 1167 O ILE B 64 -4.428 7.624 -58.257 1.00 0.00 O ATOM 1168 CB ILE B 64 -2.999 5.831 -56.152 1.00 0.00 C ATOM 1169 CG1 ILE B 64 -3.911 4.603 -56.108 1.00 0.00 C ATOM 1170 CG2 ILE B 64 -3.670 7.020 -55.479 1.00 0.00 C ATOM 1171 CD1 ILE B 64 -4.015 3.968 -54.739 1.00 0.00 C ATOM 0 H ILE B 64 -2.061 8.186 -57.468 1.00 0.00 H new ATOM 0 HA ILE B 64 -2.161 5.305 -58.069 1.00 0.00 H new ATOM 0 HB ILE B 64 -2.083 5.600 -55.608 1.00 0.00 H new ATOM 0 HG12 ILE B 64 -4.908 4.891 -56.441 1.00 0.00 H new ATOM 0 HG13 ILE B 64 -3.540 3.861 -56.815 1.00 0.00 H new ATOM 0 HG21 ILE B 64 -3.924 6.761 -54.451 1.00 0.00 H new ATOM 0 HG22 ILE B 64 -2.989 7.871 -55.481 1.00 0.00 H new ATOM 0 HG23 ILE B 64 -4.578 7.281 -56.023 1.00 0.00 H new ATOM 0 HD11 ILE B 64 -4.678 3.104 -54.788 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -3.026 3.648 -54.410 1.00 0.00 H new ATOM 0 HD13 ILE B 64 -4.416 4.693 -54.031 1.00 0.00 H new ATOM 1183 N SER B 65 -4.368 5.576 -59.188 1.00 0.00 N ATOM 1184 CA SER B 65 -5.482 5.828 -60.094 1.00 0.00 C ATOM 1185 C SER B 65 -6.613 4.833 -59.867 1.00 0.00 C ATOM 1186 O SER B 65 -6.373 3.647 -59.642 1.00 0.00 O ATOM 1187 CB SER B 65 -5.010 5.752 -61.533 1.00 0.00 C ATOM 1188 OG SER B 65 -6.069 5.981 -62.421 1.00 0.00 O ATOM 0 H SER B 65 -3.997 4.627 -59.230 1.00 0.00 H new ATOM 0 HA SER B 65 -5.862 6.829 -59.890 1.00 0.00 H new ATOM 0 HB2 SER B 65 -4.224 6.488 -61.701 1.00 0.00 H new ATOM 0 HB3 SER B 65 -4.575 4.771 -61.725 1.00 0.00 H new ATOM 0 HG SER B 65 -5.903 5.500 -63.259 1.00 0.00 H new ATOM 1194 N GLN B 66 -7.846 5.324 -59.928 1.00 0.00 N ATOM 1195 CA GLN B 66 -9.018 4.464 -59.822 1.00 0.00 C ATOM 1196 C GLN B 66 -9.814 4.455 -61.120 1.00 0.00 C ATOM 1197 O GLN B 66 -10.452 5.446 -61.476 1.00 0.00 O ATOM 1198 CB GLN B 66 -9.912 4.917 -58.664 1.00 0.00 C ATOM 1199 CG GLN B 66 -11.143 4.053 -58.453 1.00 0.00 C ATOM 1200 CD GLN B 66 -11.969 4.503 -57.263 1.00 0.00 C ATOM 1201 OE1 GLN B 66 -11.609 5.454 -56.564 1.00 0.00 O ATOM 1202 NE2 GLN B 66 -13.083 3.819 -57.024 1.00 0.00 N ATOM 0 H GLN B 66 -8.059 6.314 -60.050 1.00 0.00 H new ATOM 0 HA GLN B 66 -8.669 3.450 -59.627 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -9.324 4.922 -57.746 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.229 5.944 -58.845 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -11.760 4.080 -59.351 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -10.836 3.017 -58.308 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -13.342 3.039 -57.628 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -13.679 4.074 -56.236 1.00 0.00 H new ATOM 1211 N GLU B 67 -9.773 3.329 -61.826 1.00 0.00 N ATOM 1212 CA GLU B 67 -10.284 3.261 -63.189 1.00 0.00 C ATOM 1213 C GLU B 67 -11.247 2.092 -63.359 1.00 0.00 C ATOM 1214 O GLU B 67 -11.066 1.035 -62.756 1.00 0.00 O ATOM 1215 CB GLU B 67 -9.130 3.133 -64.186 1.00 0.00 C ATOM 1216 CG GLU B 67 -8.147 4.294 -64.164 1.00 0.00 C ATOM 1217 CD GLU B 67 -7.001 4.110 -65.119 1.00 0.00 C ATOM 1218 OE1 GLU B 67 -7.115 3.297 -66.004 1.00 0.00 O ATOM 1219 OE2 GLU B 67 -6.010 4.783 -64.963 1.00 0.00 O ATOM 0 H GLU B 67 -9.391 2.451 -61.475 1.00 0.00 H new ATOM 0 HA GLU B 67 -10.827 4.185 -63.387 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -8.588 2.210 -63.979 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -9.543 3.042 -65.191 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -8.675 5.215 -64.412 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -7.756 4.413 -63.154 1.00 0.00 H new ATOM 1226 N LYS B 68 -12.270 2.291 -64.183 1.00 0.00 N ATOM 1227 CA LYS B 68 -13.219 1.229 -64.495 1.00 0.00 C ATOM 1228 C LYS B 68 -12.929 0.614 -65.858 1.00 0.00 C ATOM 1229 O LYS B 68 -13.011 1.290 -66.884 1.00 0.00 O ATOM 1230 CB LYS B 68 -14.652 1.761 -64.451 1.00 0.00 C ATOM 1231 CG LYS B 68 -15.724 0.705 -64.690 1.00 0.00 C ATOM 1232 CD LYS B 68 -17.119 1.302 -64.593 1.00 0.00 C ATOM 1233 CE LYS B 68 -18.190 0.246 -64.823 1.00 0.00 C ATOM 1234 NZ LYS B 68 -19.562 0.817 -64.732 1.00 0.00 N ATOM 0 H LYS B 68 -12.463 3.179 -64.647 1.00 0.00 H new ATOM 0 HA LYS B 68 -13.108 0.451 -63.740 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -14.825 2.223 -63.479 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -14.758 2.545 -65.201 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -15.585 0.259 -65.675 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -15.617 -0.096 -63.959 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -17.256 1.754 -63.611 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -17.228 2.099 -65.328 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -18.049 -0.206 -65.805 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -18.079 -0.550 -64.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -20.262 0.065 -64.895 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -19.706 1.226 -63.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -19.677 1.559 -65.451 1.00 0.00 H new ATOM 1248 N GLN B 69 -12.591 -0.671 -65.863 1.00 0.00 N ATOM 1249 CA GLN B 69 -12.215 -1.359 -67.092 1.00 0.00 C ATOM 1250 C GLN B 69 -12.805 -2.763 -67.139 1.00 0.00 C ATOM 1251 O GLN B 69 -12.656 -3.541 -66.197 1.00 0.00 O ATOM 1252 CB GLN B 69 -10.692 -1.428 -67.223 1.00 0.00 C ATOM 1253 CG GLN B 69 -10.206 -2.158 -68.463 1.00 0.00 C ATOM 1254 CD GLN B 69 -10.479 -1.382 -69.737 1.00 0.00 C ATOM 1255 OE1 GLN B 69 -10.098 -0.216 -69.863 1.00 0.00 O ATOM 1256 NE2 GLN B 69 -11.144 -2.026 -70.689 1.00 0.00 N ATOM 0 H GLN B 69 -12.570 -1.257 -65.029 1.00 0.00 H new ATOM 0 HA GLN B 69 -12.618 -0.789 -67.929 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -10.293 -0.414 -67.233 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -10.285 -1.922 -66.341 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -9.135 -2.343 -68.376 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -10.693 -3.131 -68.522 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -11.440 -2.991 -70.541 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -11.359 -1.556 -71.568 1.00 0.00 H new ATOM 1265 N ASP B 70 -13.475 -3.081 -68.242 1.00 0.00 N ATOM 1266 CA ASP B 70 -14.108 -4.384 -68.405 1.00 0.00 C ATOM 1267 C ASP B 70 -15.158 -4.626 -67.329 1.00 0.00 C ATOM 1268 O ASP B 70 -15.417 -5.766 -66.946 1.00 0.00 O ATOM 1269 CB ASP B 70 -13.058 -5.499 -68.362 1.00 0.00 C ATOM 1270 CG ASP B 70 -12.022 -5.379 -69.470 1.00 0.00 C ATOM 1271 OD1 ASP B 70 -12.301 -4.733 -70.452 1.00 0.00 O ATOM 1272 OD2 ASP B 70 -10.960 -5.938 -69.325 1.00 0.00 O ATOM 0 H ASP B 70 -13.593 -2.453 -69.037 1.00 0.00 H new ATOM 0 HA ASP B 70 -14.602 -4.392 -69.377 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -12.554 -5.479 -67.396 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -13.557 -6.465 -68.441 1.00 0.00 H new ATOM 1277 N GLY B 71 -15.760 -3.545 -66.844 1.00 0.00 N ATOM 1278 CA GLY B 71 -16.873 -3.643 -65.906 1.00 0.00 C ATOM 1279 C GLY B 71 -16.375 -3.783 -64.474 1.00 0.00 C ATOM 1280 O GLY B 71 -17.164 -3.965 -63.547 1.00 0.00 O ATOM 0 H GLY B 71 -15.496 -2.590 -67.085 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -17.502 -2.757 -65.990 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -17.494 -4.501 -66.163 1.00 0.00 H new ATOM 1284 N MET B 72 -15.060 -3.696 -64.298 1.00 0.00 N ATOM 1285 CA MET B 72 -14.447 -3.886 -62.989 1.00 0.00 C ATOM 1286 C MET B 72 -13.692 -2.639 -62.548 1.00 0.00 C ATOM 1287 O MET B 72 -13.208 -1.869 -63.378 1.00 0.00 O ATOM 1288 CB MET B 72 -13.513 -5.094 -63.014 1.00 0.00 C ATOM 1289 CG MET B 72 -14.197 -6.412 -63.351 1.00 0.00 C ATOM 1290 SD MET B 72 -13.028 -7.771 -63.547 1.00 0.00 S ATOM 1291 CE MET B 72 -12.293 -7.361 -65.127 1.00 0.00 C ATOM 0 H MET B 72 -14.398 -3.495 -65.047 1.00 0.00 H new ATOM 0 HA MET B 72 -15.242 -4.069 -62.266 1.00 0.00 H new ATOM 0 HB2 MET B 72 -12.723 -4.912 -63.743 1.00 0.00 H new ATOM 0 HB3 MET B 72 -13.033 -5.187 -62.040 1.00 0.00 H new ATOM 0 HG2 MET B 72 -14.908 -6.660 -62.563 1.00 0.00 H new ATOM 0 HG3 MET B 72 -14.770 -6.295 -64.271 1.00 0.00 H new ATOM 0 HE1 MET B 72 -11.724 -8.215 -65.496 1.00 0.00 H new ATOM 0 HE2 MET B 72 -13.079 -7.112 -65.840 1.00 0.00 H new ATOM 0 HE3 MET B 72 -11.628 -6.506 -65.008 1.00 0.00 H new ATOM 1301 N ASP B 73 -13.594 -2.445 -61.237 1.00 0.00 N ATOM 1302 CA ASP B 73 -12.904 -1.287 -60.683 1.00 0.00 C ATOM 1303 C ASP B 73 -11.494 -1.648 -60.235 1.00 0.00 C ATOM 1304 O ASP B 73 -11.310 -2.356 -59.244 1.00 0.00 O ATOM 1305 CB ASP B 73 -13.689 -0.707 -59.503 1.00 0.00 C ATOM 1306 CG ASP B 73 -13.070 0.570 -58.951 1.00 0.00 C ATOM 1307 OD1 ASP B 73 -11.916 0.810 -59.213 1.00 0.00 O ATOM 1308 OD2 ASP B 73 -13.760 1.293 -58.273 1.00 0.00 O ATOM 0 H ASP B 73 -13.985 -3.076 -60.538 1.00 0.00 H new ATOM 0 HA ASP B 73 -12.835 -0.536 -61.470 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -14.712 -0.502 -59.819 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -13.744 -1.451 -58.709 1.00 0.00 H new ATOM 1313 N VAL B 74 -10.500 -1.160 -60.970 1.00 0.00 N ATOM 1314 CA VAL B 74 -9.115 -1.558 -60.748 1.00 0.00 C ATOM 1315 C VAL B 74 -8.285 -0.394 -60.221 1.00 0.00 C ATOM 1316 O VAL B 74 -8.191 0.653 -60.862 1.00 0.00 O ATOM 1317 CB VAL B 74 -8.493 -2.078 -62.057 1.00 0.00 C ATOM 1318 CG1 VAL B 74 -7.041 -2.475 -61.835 1.00 0.00 C ATOM 1319 CG2 VAL B 74 -9.300 -3.255 -62.582 1.00 0.00 C ATOM 0 H VAL B 74 -10.629 -0.487 -61.726 1.00 0.00 H new ATOM 0 HA VAL B 74 -9.114 -2.353 -60.002 1.00 0.00 H new ATOM 0 HB VAL B 74 -8.515 -1.281 -62.801 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -6.617 -2.840 -62.770 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -6.475 -1.608 -61.494 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -6.990 -3.261 -61.082 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -8.854 -3.618 -63.508 1.00 0.00 H new ATOM 0 HG22 VAL B 74 -9.300 -4.055 -61.842 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -10.325 -2.937 -62.773 1.00 0.00 H new ATOM 1329 N LEU B 75 -7.686 -0.584 -59.051 1.00 0.00 N ATOM 1330 CA LEU B 75 -6.767 0.402 -58.492 1.00 0.00 C ATOM 1331 C LEU B 75 -5.343 0.163 -58.975 1.00 0.00 C ATOM 1332 O LEU B 75 -4.877 -0.975 -59.027 1.00 0.00 O ATOM 1333 CB LEU B 75 -6.809 0.355 -56.960 1.00 0.00 C ATOM 1334 CG LEU B 75 -8.170 0.661 -56.321 1.00 0.00 C ATOM 1335 CD1 LEU B 75 -8.066 0.514 -54.809 1.00 0.00 C ATOM 1336 CD2 LEU B 75 -8.606 2.068 -56.705 1.00 0.00 C ATOM 0 H LEU B 75 -7.820 -1.412 -58.470 1.00 0.00 H new ATOM 0 HA LEU B 75 -7.084 1.387 -58.833 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -6.491 -0.636 -56.637 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -6.079 1.066 -56.573 1.00 0.00 H new ATOM 0 HG LEU B 75 -8.919 -0.043 -56.684 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -9.033 0.731 -54.355 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -7.770 -0.506 -54.562 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -7.320 1.211 -54.426 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -9.573 2.286 -56.251 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -7.868 2.787 -56.350 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -8.690 2.140 -57.789 1.00 0.00 H new ATOM 1348 N GLU B 76 -4.655 1.244 -59.328 1.00 0.00 N ATOM 1349 CA GLU B 76 -3.261 1.161 -59.750 1.00 0.00 C ATOM 1350 C GLU B 76 -2.389 2.128 -58.960 1.00 0.00 C ATOM 1351 O GLU B 76 -2.587 3.342 -59.012 1.00 0.00 O ATOM 1352 CB GLU B 76 -3.139 1.454 -61.247 1.00 0.00 C ATOM 1353 CG GLU B 76 -1.720 1.362 -61.791 1.00 0.00 C ATOM 1354 CD GLU B 76 -1.643 1.626 -63.269 1.00 0.00 C ATOM 1355 OE1 GLU B 76 -2.377 1.008 -64.003 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -0.848 2.445 -63.665 1.00 0.00 O ATOM 0 H GLU B 76 -5.040 2.188 -59.330 1.00 0.00 H new ATOM 0 HA GLU B 76 -2.913 0.147 -59.554 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -3.771 0.755 -61.795 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -3.526 2.454 -61.442 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -1.088 2.078 -61.266 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -1.320 0.370 -61.583 1.00 0.00 H new ATOM 1363 N LEU B 77 -1.422 1.583 -58.229 1.00 0.00 N ATOM 1364 CA LEU B 77 -0.542 2.393 -57.396 1.00 0.00 C ATOM 1365 C LEU B 77 0.895 2.339 -57.899 1.00 0.00 C ATOM 1366 O LEU B 77 1.502 1.270 -57.959 1.00 0.00 O ATOM 1367 CB LEU B 77 -0.599 1.913 -55.941 1.00 0.00 C ATOM 1368 CG LEU B 77 0.379 2.595 -54.976 1.00 0.00 C ATOM 1369 CD1 LEU B 77 0.012 4.066 -54.833 1.00 0.00 C ATOM 1370 CD2 LEU B 77 0.341 1.888 -53.629 1.00 0.00 C ATOM 0 H LEU B 77 -1.228 0.582 -58.197 1.00 0.00 H new ATOM 0 HA LEU B 77 -0.887 3.425 -57.450 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -1.612 2.063 -55.568 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -0.408 0.840 -55.924 1.00 0.00 H new ATOM 0 HG LEU B 77 1.394 2.531 -55.369 1.00 0.00 H new ATOM 0 HD11 LEU B 77 0.708 4.550 -54.147 1.00 0.00 H new ATOM 0 HD12 LEU B 77 0.067 4.551 -55.808 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -1.002 4.152 -54.442 1.00 0.00 H new ATOM 0 HD21 LEU B 77 1.036 2.373 -52.944 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.668 1.940 -53.219 1.00 0.00 H new ATOM 0 HD23 LEU B 77 0.627 0.844 -53.758 1.00 0.00 H new ATOM 1382 N ASN B 78 1.435 3.500 -58.258 1.00 0.00 N ATOM 1383 CA ASN B 78 2.754 3.572 -58.876 1.00 0.00 C ATOM 1384 C ASN B 78 3.708 4.416 -58.042 1.00 0.00 C ATOM 1385 O ASN B 78 3.293 5.364 -57.376 1.00 0.00 O ATOM 1386 CB ASN B 78 2.652 4.119 -60.288 1.00 0.00 C ATOM 1387 CG ASN B 78 1.847 3.231 -61.196 1.00 0.00 C ATOM 1388 OD1 ASN B 78 2.043 2.010 -61.223 1.00 0.00 O ATOM 1389 ND2 ASN B 78 0.946 3.819 -61.940 1.00 0.00 N ATOM 0 H ASN B 78 0.979 4.404 -58.131 1.00 0.00 H new ATOM 0 HA ASN B 78 3.157 2.560 -58.924 1.00 0.00 H new ATOM 0 HB2 ASN B 78 2.197 5.109 -60.258 1.00 0.00 H new ATOM 0 HB3 ASN B 78 3.654 4.241 -60.700 1.00 0.00 H new ATOM 0 HD21 ASN B 78 0.370 3.267 -62.576 1.00 0.00 H new ATOM 0 HD22 ASN B 78 0.819 4.830 -61.884 1.00 0.00 H new ATOM 1396 N ILE B 79 4.989 4.066 -58.081 1.00 0.00 N ATOM 1397 CA ILE B 79 6.032 4.904 -57.501 1.00 0.00 C ATOM 1398 C ILE B 79 7.375 4.658 -58.176 1.00 0.00 C ATOM 1399 O ILE B 79 7.762 3.513 -58.410 1.00 0.00 O ATOM 1400 CB ILE B 79 6.161 4.650 -55.988 1.00 0.00 C ATOM 1401 CG1 ILE B 79 7.124 5.661 -55.359 1.00 0.00 C ATOM 1402 CG2 ILE B 79 6.633 3.228 -55.726 1.00 0.00 C ATOM 1403 CD1 ILE B 79 7.063 5.702 -53.849 1.00 0.00 C ATOM 0 H ILE B 79 5.331 3.206 -58.509 1.00 0.00 H new ATOM 0 HA ILE B 79 5.744 5.942 -57.664 1.00 0.00 H new ATOM 0 HB ILE B 79 5.180 4.776 -55.530 1.00 0.00 H new ATOM 0 HG12 ILE B 79 8.142 5.419 -55.666 1.00 0.00 H new ATOM 0 HG13 ILE B 79 6.900 6.654 -55.750 1.00 0.00 H new ATOM 0 HG21 ILE B 79 6.719 3.065 -54.652 1.00 0.00 H new ATOM 0 HG22 ILE B 79 5.914 2.523 -56.143 1.00 0.00 H new ATOM 0 HG23 ILE B 79 7.605 3.075 -56.195 1.00 0.00 H new ATOM 0 HD11 ILE B 79 7.773 6.441 -53.476 1.00 0.00 H new ATOM 0 HD12 ILE B 79 6.056 5.974 -53.533 1.00 0.00 H new ATOM 0 HD13 ILE B 79 7.316 4.721 -53.448 1.00 0.00 H new ATOM 1415 N THR B 80 8.081 5.740 -58.486 1.00 0.00 N ATOM 1416 CA THR B 80 9.361 5.646 -59.180 1.00 0.00 C ATOM 1417 C THR B 80 10.523 5.880 -58.225 1.00 0.00 C ATOM 1418 O THR B 80 10.539 6.859 -57.479 1.00 0.00 O ATOM 1419 CB THR B 80 9.435 6.653 -60.343 1.00 0.00 C ATOM 1420 OG1 THR B 80 8.394 6.374 -61.288 1.00 0.00 O ATOM 1421 CG2 THR B 80 10.785 6.563 -61.040 1.00 0.00 C ATOM 0 H THR B 80 7.789 6.693 -58.268 1.00 0.00 H new ATOM 0 HA THR B 80 9.437 4.636 -59.583 1.00 0.00 H new ATOM 0 HB THR B 80 9.310 7.659 -59.942 1.00 0.00 H new ATOM 0 HG1 THR B 80 8.442 7.017 -62.026 1.00 0.00 H new ATOM 0 HG21 THR B 80 10.820 7.281 -61.859 1.00 0.00 H new ATOM 0 HG22 THR B 80 11.578 6.787 -60.327 1.00 0.00 H new ATOM 0 HG23 THR B 80 10.925 5.556 -61.434 1.00 0.00 H new ATOM 1429 N LEU B 81 11.496 4.975 -58.253 1.00 0.00 N ATOM 1430 CA LEU B 81 12.670 5.085 -57.395 1.00 0.00 C ATOM 1431 C LEU B 81 13.948 5.182 -58.219 1.00 0.00 C ATOM 1432 O LEU B 81 14.655 6.146 -58.118 1.00 0.00 O ATOM 1433 CB LEU B 81 12.752 3.879 -56.451 1.00 0.00 C ATOM 1434 CG LEU B 81 13.958 3.857 -55.503 1.00 0.00 C ATOM 1435 CD1 LEU B 81 13.853 5.017 -54.522 1.00 0.00 C ATOM 1436 CD2 LEU B 81 14.004 2.525 -54.771 1.00 0.00 C ATOM 0 H LEU B 81 11.494 4.156 -58.861 1.00 0.00 H new ATOM 0 HA LEU B 81 12.570 5.998 -56.808 1.00 0.00 H new ATOM 0 HB2 LEU B 81 11.842 3.847 -55.852 1.00 0.00 H new ATOM 0 HB3 LEU B 81 12.770 2.970 -57.053 1.00 0.00 H new ATOM 0 HG LEU B 81 14.881 3.969 -56.071 1.00 0.00 H new ATOM 0 HD11 LEU B 81 14.709 5.002 -53.848 1.00 0.00 H new ATOM 0 HD12 LEU B 81 13.840 5.958 -55.072 1.00 0.00 H new ATOM 0 HD13 LEU B 81 12.934 4.922 -53.943 1.00 0.00 H new ATOM 0 HD21 LEU B 81 14.861 2.509 -54.097 1.00 0.00 H new ATOM 0 HD22 LEU B 81 13.088 2.394 -54.195 1.00 0.00 H new ATOM 0 HD23 LEU B 81 14.097 1.715 -55.495 1.00 0.00 H new TER 1448 LEU B 81