USER MOD reduce.3.24.130724 H: found=0, std=0, add=856, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 856 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 41 GLN : amide:sc= -3.65! C(o=-3.4!,f=-6.3!) USER MOD Set 1.2: A 71 ASN : amide:sc= 0.286 X(o=-3.4,f=-3.8) USER MOD Set 2.1: A 32 MET CE :methyl -160:sc= -0.136 (180deg=-0.631) USER MOD Set 2.2: A 97 ASN : amide:sc= 1.11 K(o=0.98,f=-0.15) USER MOD Set 3.1: A 11 CYS SG : rot -85:sc= 0.565 USER MOD Set 3.2: A 13 THR OG1 : rot 47:sc= 0.228 USER MOD Set 3.3: A 17 HIS : no HE2:sc= 0.524 K(o=1.3,f=-2.9) USER MOD Set 4.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 2 LYS NZ :NH3+ 166:sc= 0.559 (180deg=0.414) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -156:sc= 1.18 (180deg=0.843) USER MOD Single : A 9 THR OG1 : rot -54:sc= 0.822 USER MOD Single : A 18 THR OG1 : rot 163:sc= -0.837 USER MOD Single : A 19 TYR OH : rot 57:sc= 1.28 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -1.51! C(o=-1.5!,f=-1.6!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 162:sc= -0.0339 (180deg=-0.35) USER MOD Single : A 30 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0889) USER MOD Single : A 31 LYS NZ :NH3+ -174:sc= 0.586 (180deg=0.517) USER MOD Single : A 34 ASN : amide:sc= -2.08! C(o=-2.1!,f=-3.6!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 51 THR OG1 : rot -101:sc= 0.762 USER MOD Single : A 53 LYS NZ :NH3+ -168:sc= -0.0249 (180deg=-0.238) USER MOD Single : A 56 ASN : amide:sc= 1.23 K(o=1.2,f=-0.058) USER MOD Single : A 67 THR OG1 : rot 36:sc= 0.269 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -168:sc= -0.023 (180deg=-0.238) USER MOD Single : A 78 LYS NZ :NH3+ 172:sc= 1.26 (180deg=0.983) USER MOD Single : A 86 SER OG : rot 180:sc= 0.126 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0691) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.819 2.747 -6.087 1.00 0.00 N ATOM 2 CA MET A 1 -16.555 1.701 -7.103 1.00 0.00 C ATOM 3 C MET A 1 -15.104 1.255 -7.032 1.00 0.00 C ATOM 4 O MET A 1 -14.804 0.134 -6.618 1.00 0.00 O ATOM 5 CB MET A 1 -16.861 2.222 -8.510 1.00 0.00 C ATOM 6 CG MET A 1 -16.779 1.148 -9.586 1.00 0.00 C ATOM 7 SD MET A 1 -16.872 1.818 -11.257 1.00 0.00 S ATOM 8 CE MET A 1 -17.031 0.310 -12.212 1.00 0.00 C ATOM 0 H1 MET A 1 -17.814 3.044 -6.145 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.626 2.366 -5.139 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.202 3.566 -6.263 1.00 0.00 H new ATOM 0 HA MET A 1 -17.206 0.852 -6.893 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.860 2.658 -8.518 1.00 0.00 H new ATOM 0 HB3 MET A 1 -16.162 3.022 -8.753 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.845 0.598 -9.472 1.00 0.00 H new ATOM 0 HG3 MET A 1 -17.589 0.433 -9.441 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.100 0.556 -13.272 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.159 -0.322 -12.042 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.931 -0.223 -11.904 1.00 0.00 H new ATOM 20 N LYS A 2 -14.206 2.142 -7.432 1.00 0.00 N ATOM 21 CA LYS A 2 -12.784 1.850 -7.410 1.00 0.00 C ATOM 22 C LYS A 2 -12.092 2.742 -6.396 1.00 0.00 C ATOM 23 O LYS A 2 -11.808 3.909 -6.679 1.00 0.00 O ATOM 24 CB LYS A 2 -12.151 2.066 -8.786 1.00 0.00 C ATOM 25 CG LYS A 2 -12.832 1.320 -9.920 1.00 0.00 C ATOM 26 CD LYS A 2 -12.015 1.425 -11.199 1.00 0.00 C ATOM 27 CE LYS A 2 -12.734 0.813 -12.389 1.00 0.00 C ATOM 28 NZ LYS A 2 -13.865 1.656 -12.858 1.00 0.00 N ATOM 0 H LYS A 2 -14.440 3.073 -7.777 1.00 0.00 H new ATOM 0 HA LYS A 2 -12.661 0.803 -7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -12.161 3.132 -9.013 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -11.106 1.759 -8.743 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -12.959 0.272 -9.648 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -13.829 1.729 -10.085 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -11.800 2.473 -11.406 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -11.057 0.925 -11.059 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -12.026 0.672 -13.205 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -13.108 -0.174 -12.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -14.173 1.332 -13.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -14.657 1.578 -12.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -13.558 2.648 -12.917 1.00 0.00 H new ATOM 42 N ARG A 3 -11.849 2.208 -5.211 1.00 0.00 N ATOM 43 CA ARG A 3 -11.170 2.955 -4.167 1.00 0.00 C ATOM 44 C ARG A 3 -9.752 3.297 -4.601 1.00 0.00 C ATOM 45 O ARG A 3 -9.038 2.449 -5.142 1.00 0.00 O ATOM 46 CB ARG A 3 -11.140 2.156 -2.863 1.00 0.00 C ATOM 47 CG ARG A 3 -10.552 2.927 -1.695 1.00 0.00 C ATOM 48 CD ARG A 3 -11.369 4.169 -1.396 1.00 0.00 C ATOM 49 NE ARG A 3 -12.748 3.850 -1.034 1.00 0.00 N ATOM 50 CZ ARG A 3 -13.662 4.757 -0.696 1.00 0.00 C ATOM 51 NH1 ARG A 3 -13.394 6.054 -0.788 1.00 0.00 N ATOM 52 NH2 ARG A 3 -14.867 4.364 -0.307 1.00 0.00 N ATOM 0 H ARG A 3 -12.112 1.258 -4.948 1.00 0.00 H new ATOM 0 HA ARG A 3 -11.721 3.880 -3.994 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -12.155 1.848 -2.611 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -10.560 1.246 -3.017 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -10.519 2.288 -0.813 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -9.524 3.210 -1.922 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -10.901 4.722 -0.582 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -11.366 4.822 -2.269 1.00 0.00 H new ATOM 0 HE ARG A 3 -13.028 2.869 -1.041 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -12.481 6.364 -1.120 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -14.101 6.741 -0.526 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -15.091 3.370 -0.267 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -15.570 5.056 -0.047 1.00 0.00 H new ATOM 66 N LYS A 4 -9.363 4.542 -4.380 1.00 0.00 N ATOM 67 CA LYS A 4 -8.025 4.992 -4.723 1.00 0.00 C ATOM 68 C LYS A 4 -7.056 4.591 -3.617 1.00 0.00 C ATOM 69 O LYS A 4 -7.116 5.121 -2.507 1.00 0.00 O ATOM 70 CB LYS A 4 -8.002 6.509 -4.908 1.00 0.00 C ATOM 71 CG LYS A 4 -9.169 7.053 -5.718 1.00 0.00 C ATOM 72 CD LYS A 4 -9.213 6.476 -7.124 1.00 0.00 C ATOM 73 CE LYS A 4 -10.433 6.978 -7.881 1.00 0.00 C ATOM 74 NZ LYS A 4 -11.704 6.600 -7.205 1.00 0.00 N ATOM 0 H LYS A 4 -9.956 5.260 -3.964 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.724 4.524 -5.660 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.002 6.984 -3.927 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.070 6.790 -5.399 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -10.103 6.825 -5.204 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -9.094 8.139 -5.775 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -8.307 6.753 -7.663 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.234 5.387 -7.074 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.381 8.063 -7.974 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.425 6.571 -8.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -12.476 6.583 -7.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.603 5.657 -6.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.923 7.295 -6.463 1.00 0.00 H new ATOM 88 N ILE A 5 -6.186 3.644 -3.912 1.00 0.00 N ATOM 89 CA ILE A 5 -5.264 3.130 -2.915 1.00 0.00 C ATOM 90 C ILE A 5 -3.819 3.405 -3.304 1.00 0.00 C ATOM 91 O ILE A 5 -3.415 3.149 -4.437 1.00 0.00 O ATOM 92 CB ILE A 5 -5.445 1.607 -2.722 1.00 0.00 C ATOM 93 CG1 ILE A 5 -6.887 1.288 -2.317 1.00 0.00 C ATOM 94 CG2 ILE A 5 -4.471 1.082 -1.679 1.00 0.00 C ATOM 95 CD1 ILE A 5 -7.167 -0.193 -2.177 1.00 0.00 C ATOM 0 H ILE A 5 -6.098 3.215 -4.833 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.490 3.645 -1.981 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.234 1.111 -3.670 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.106 1.781 -1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.565 1.708 -3.060 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.613 0.008 -1.556 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.449 1.278 -2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.652 1.583 -0.728 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -8.208 -0.341 -1.888 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.980 -0.690 -3.129 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.515 -0.616 -1.413 1.00 0.00 H new ATOM 107 N ILE A 6 -3.050 3.944 -2.371 1.00 0.00 N ATOM 108 CA ILE A 6 -1.609 4.035 -2.538 1.00 0.00 C ATOM 109 C ILE A 6 -0.943 3.177 -1.472 1.00 0.00 C ATOM 110 O ILE A 6 -1.233 3.306 -0.284 1.00 0.00 O ATOM 111 CB ILE A 6 -1.052 5.487 -2.490 1.00 0.00 C ATOM 112 CG1 ILE A 6 -1.340 6.186 -1.147 1.00 0.00 C ATOM 113 CG2 ILE A 6 -1.613 6.304 -3.647 1.00 0.00 C ATOM 114 CD1 ILE A 6 -2.754 6.706 -1.003 1.00 0.00 C ATOM 0 H ILE A 6 -3.399 4.324 -1.492 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.377 3.672 -3.539 1.00 0.00 H new ATOM 0 HB ILE A 6 0.032 5.420 -2.586 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -1.139 5.485 -0.336 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -0.646 7.018 -1.028 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -1.216 7.318 -3.603 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.325 5.843 -4.592 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -2.700 6.337 -3.576 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -2.869 7.183 -0.029 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -2.956 7.433 -1.789 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -3.457 5.877 -1.086 1.00 0.00 H new ATOM 126 N ALA A 7 -0.088 2.273 -1.899 1.00 0.00 N ATOM 127 CA ALA A 7 0.511 1.320 -0.985 1.00 0.00 C ATOM 128 C ALA A 7 2.008 1.239 -1.197 1.00 0.00 C ATOM 129 O ALA A 7 2.480 1.253 -2.327 1.00 0.00 O ATOM 130 CB ALA A 7 -0.125 -0.049 -1.164 1.00 0.00 C ATOM 0 H ALA A 7 0.208 2.176 -2.870 1.00 0.00 H new ATOM 0 HA ALA A 7 0.331 1.661 0.035 1.00 0.00 H new ATOM 0 HB1 ALA A 7 0.333 -0.756 -0.472 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -1.194 0.017 -0.961 1.00 0.00 H new ATOM 0 HB3 ALA A 7 0.029 -0.391 -2.187 1.00 0.00 H new ATOM 136 N VAL A 8 2.751 1.160 -0.110 1.00 0.00 N ATOM 137 CA VAL A 8 4.196 1.053 -0.191 1.00 0.00 C ATOM 138 C VAL A 8 4.666 -0.247 0.437 1.00 0.00 C ATOM 139 O VAL A 8 4.317 -0.560 1.577 1.00 0.00 O ATOM 140 CB VAL A 8 4.905 2.236 0.505 1.00 0.00 C ATOM 141 CG1 VAL A 8 6.418 2.129 0.359 1.00 0.00 C ATOM 142 CG2 VAL A 8 4.408 3.563 -0.050 1.00 0.00 C ATOM 0 H VAL A 8 2.379 1.168 0.840 1.00 0.00 H new ATOM 0 HA VAL A 8 4.457 1.072 -1.249 1.00 0.00 H new ATOM 0 HB VAL A 8 4.663 2.194 1.567 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.892 2.974 0.858 1.00 0.00 H new ATOM 0 HG12 VAL A 8 6.763 1.200 0.813 1.00 0.00 H new ATOM 0 HG13 VAL A 8 6.683 2.136 -0.698 1.00 0.00 H new ATOM 0 HG21 VAL A 8 4.920 4.383 0.454 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.613 3.610 -1.120 1.00 0.00 H new ATOM 0 HG23 VAL A 8 3.334 3.648 0.118 1.00 0.00 H new ATOM 152 N THR A 9 5.430 -1.011 -0.319 1.00 0.00 N ATOM 153 CA THR A 9 6.059 -2.207 0.202 1.00 0.00 C ATOM 154 C THR A 9 7.549 -1.956 0.371 1.00 0.00 C ATOM 155 O THR A 9 8.195 -1.426 -0.532 1.00 0.00 O ATOM 156 CB THR A 9 5.825 -3.430 -0.714 1.00 0.00 C ATOM 157 OG1 THR A 9 6.205 -3.131 -2.065 1.00 0.00 O ATOM 158 CG2 THR A 9 4.366 -3.859 -0.681 1.00 0.00 C ATOM 0 H THR A 9 5.630 -0.823 -1.301 1.00 0.00 H new ATOM 0 HA THR A 9 5.607 -2.436 1.167 1.00 0.00 H new ATOM 0 HB THR A 9 6.443 -4.247 -0.341 1.00 0.00 H new ATOM 0 HG1 THR A 9 5.735 -2.326 -2.367 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.225 -4.721 -1.333 1.00 0.00 H new ATOM 0 HG22 THR A 9 4.088 -4.126 0.339 1.00 0.00 H new ATOM 0 HG23 THR A 9 3.737 -3.038 -1.025 1.00 0.00 H new ATOM 166 N ALA A 10 8.090 -2.298 1.529 1.00 0.00 N ATOM 167 CA ALA A 10 9.496 -2.038 1.808 1.00 0.00 C ATOM 168 C ALA A 10 10.094 -3.130 2.672 1.00 0.00 C ATOM 169 O ALA A 10 9.729 -3.284 3.837 1.00 0.00 O ATOM 170 CB ALA A 10 9.668 -0.683 2.480 1.00 0.00 C ATOM 0 H ALA A 10 7.582 -2.753 2.287 1.00 0.00 H new ATOM 0 HA ALA A 10 10.027 -2.028 0.856 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.725 -0.508 2.680 1.00 0.00 H new ATOM 0 HB2 ALA A 10 9.288 0.100 1.823 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.114 -0.669 3.419 1.00 0.00 H new ATOM 176 N CYS A 11 11.010 -3.888 2.103 1.00 0.00 N ATOM 177 CA CYS A 11 11.669 -4.954 2.832 1.00 0.00 C ATOM 178 C CYS A 11 13.058 -5.191 2.255 1.00 0.00 C ATOM 179 O CYS A 11 13.216 -5.375 1.047 1.00 0.00 O ATOM 180 CB CYS A 11 10.831 -6.236 2.767 1.00 0.00 C ATOM 181 SG CYS A 11 11.408 -7.559 3.853 1.00 0.00 S ATOM 0 H CYS A 11 11.316 -3.785 1.135 1.00 0.00 H new ATOM 0 HA CYS A 11 11.770 -4.664 3.878 1.00 0.00 H new ATOM 0 HB2 CYS A 11 9.800 -5.995 3.024 1.00 0.00 H new ATOM 0 HB3 CYS A 11 10.826 -6.601 1.740 1.00 0.00 H new ATOM 0 HG CYS A 11 12.342 -8.236 3.253 1.00 0.00 H new ATOM 187 N ALA A 12 14.059 -5.167 3.118 1.00 0.00 N ATOM 188 CA ALA A 12 15.436 -5.358 2.693 1.00 0.00 C ATOM 189 C ALA A 12 15.913 -6.766 3.027 1.00 0.00 C ATOM 190 O ALA A 12 16.868 -7.271 2.435 1.00 0.00 O ATOM 191 CB ALA A 12 16.336 -4.319 3.344 1.00 0.00 C ATOM 0 H ALA A 12 13.944 -5.017 4.120 1.00 0.00 H new ATOM 0 HA ALA A 12 15.485 -5.232 1.611 1.00 0.00 H new ATOM 0 HB1 ALA A 12 17.365 -4.473 3.018 1.00 0.00 H new ATOM 0 HB2 ALA A 12 16.009 -3.321 3.053 1.00 0.00 H new ATOM 0 HB3 ALA A 12 16.281 -4.418 4.428 1.00 0.00 H new ATOM 197 N THR A 13 15.243 -7.391 3.985 1.00 0.00 N ATOM 198 CA THR A 13 15.549 -8.757 4.372 1.00 0.00 C ATOM 199 C THR A 13 14.648 -9.734 3.629 1.00 0.00 C ATOM 200 O THR A 13 13.448 -9.817 3.892 1.00 0.00 O ATOM 201 CB THR A 13 15.384 -8.958 5.887 1.00 0.00 C ATOM 202 OG1 THR A 13 14.123 -8.429 6.325 1.00 0.00 O ATOM 203 CG2 THR A 13 16.518 -8.290 6.648 1.00 0.00 C ATOM 0 H THR A 13 14.478 -6.968 4.511 1.00 0.00 H new ATOM 0 HA THR A 13 16.589 -8.949 4.108 1.00 0.00 H new ATOM 0 HB THR A 13 15.412 -10.028 6.092 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.413 -8.737 5.724 1.00 0.00 H new ATOM 0 HG21 THR A 13 16.380 -8.446 7.718 1.00 0.00 H new ATOM 0 HG22 THR A 13 17.469 -8.723 6.338 1.00 0.00 H new ATOM 0 HG23 THR A 13 16.520 -7.221 6.434 1.00 0.00 H new ATOM 211 N GLY A 14 15.230 -10.486 2.711 1.00 0.00 N ATOM 212 CA GLY A 14 14.431 -11.303 1.830 1.00 0.00 C ATOM 213 C GLY A 14 13.695 -10.434 0.839 1.00 0.00 C ATOM 214 O GLY A 14 12.481 -10.264 0.931 1.00 0.00 O ATOM 0 H GLY A 14 16.237 -10.545 2.561 1.00 0.00 H new ATOM 0 HA2 GLY A 14 15.069 -12.011 1.301 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.718 -11.888 2.411 1.00 0.00 H new ATOM 218 N VAL A 15 14.453 -9.869 -0.093 1.00 0.00 N ATOM 219 CA VAL A 15 13.939 -8.912 -1.078 1.00 0.00 C ATOM 220 C VAL A 15 12.704 -9.441 -1.828 1.00 0.00 C ATOM 221 O VAL A 15 11.888 -8.660 -2.323 1.00 0.00 O ATOM 222 CB VAL A 15 15.047 -8.522 -2.092 1.00 0.00 C ATOM 223 CG1 VAL A 15 15.443 -9.709 -2.956 1.00 0.00 C ATOM 224 CG2 VAL A 15 14.612 -7.344 -2.951 1.00 0.00 C ATOM 0 H VAL A 15 15.450 -10.060 -0.191 1.00 0.00 H new ATOM 0 HA VAL A 15 13.628 -8.028 -0.521 1.00 0.00 H new ATOM 0 HB VAL A 15 15.925 -8.216 -1.523 1.00 0.00 H new ATOM 0 HG11 VAL A 15 16.221 -9.406 -3.657 1.00 0.00 H new ATOM 0 HG12 VAL A 15 15.819 -10.511 -2.321 1.00 0.00 H new ATOM 0 HG13 VAL A 15 14.573 -10.062 -3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 15 15.407 -7.092 -3.652 1.00 0.00 H new ATOM 0 HG22 VAL A 15 13.711 -7.610 -3.504 1.00 0.00 H new ATOM 0 HG23 VAL A 15 14.405 -6.485 -2.313 1.00 0.00 H new ATOM 234 N ALA A 16 12.552 -10.764 -1.884 1.00 0.00 N ATOM 235 CA ALA A 16 11.389 -11.380 -2.519 1.00 0.00 C ATOM 236 C ALA A 16 10.093 -10.939 -1.841 1.00 0.00 C ATOM 237 O ALA A 16 9.034 -10.923 -2.464 1.00 0.00 O ATOM 238 CB ALA A 16 11.507 -12.894 -2.488 1.00 0.00 C ATOM 0 H ALA A 16 13.221 -11.430 -1.497 1.00 0.00 H new ATOM 0 HA ALA A 16 11.360 -11.049 -3.557 1.00 0.00 H new ATOM 0 HB1 ALA A 16 10.633 -13.337 -2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 16 12.406 -13.200 -3.023 1.00 0.00 H new ATOM 0 HB3 ALA A 16 11.567 -13.233 -1.454 1.00 0.00 H new ATOM 244 N HIS A 17 10.193 -10.567 -0.565 1.00 0.00 N ATOM 245 CA HIS A 17 9.041 -10.100 0.202 1.00 0.00 C ATOM 246 C HIS A 17 8.413 -8.889 -0.457 1.00 0.00 C ATOM 247 O HIS A 17 7.207 -8.850 -0.691 1.00 0.00 O ATOM 248 CB HIS A 17 9.446 -9.728 1.630 1.00 0.00 C ATOM 249 CG HIS A 17 9.805 -10.902 2.477 1.00 0.00 C ATOM 250 ND1 HIS A 17 10.730 -10.844 3.496 1.00 0.00 N ATOM 251 CD2 HIS A 17 9.334 -12.167 2.470 1.00 0.00 C ATOM 252 CE1 HIS A 17 10.809 -12.022 4.080 1.00 0.00 C ATOM 253 NE2 HIS A 17 9.971 -12.842 3.478 1.00 0.00 N ATOM 0 H HIS A 17 11.067 -10.581 -0.039 1.00 0.00 H new ATOM 0 HA HIS A 17 8.319 -10.916 0.232 1.00 0.00 H new ATOM 0 HB2 HIS A 17 10.295 -9.046 1.591 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.625 -9.188 2.102 1.00 0.00 H new ATOM 0 HD1 HIS A 17 11.269 -10.018 3.757 1.00 0.00 H new ATOM 0 HD2 HIS A 17 8.593 -12.571 1.796 1.00 0.00 H new ATOM 0 HE1 HIS A 17 11.451 -12.273 4.911 1.00 0.00 H new ATOM 262 N THR A 18 9.251 -7.913 -0.769 1.00 0.00 N ATOM 263 CA THR A 18 8.799 -6.659 -1.339 1.00 0.00 C ATOM 264 C THR A 18 8.125 -6.875 -2.692 1.00 0.00 C ATOM 265 O THR A 18 7.258 -6.104 -3.099 1.00 0.00 O ATOM 266 CB THR A 18 9.990 -5.702 -1.497 1.00 0.00 C ATOM 267 OG1 THR A 18 10.831 -5.805 -0.343 1.00 0.00 O ATOM 268 CG2 THR A 18 9.524 -4.265 -1.651 1.00 0.00 C ATOM 0 H THR A 18 10.260 -7.970 -0.634 1.00 0.00 H new ATOM 0 HA THR A 18 8.065 -6.223 -0.662 1.00 0.00 H new ATOM 0 HB THR A 18 10.540 -5.982 -2.395 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.713 -5.428 -0.546 1.00 0.00 H new ATOM 0 HG21 THR A 18 10.390 -3.612 -1.761 1.00 0.00 H new ATOM 0 HG22 THR A 18 8.891 -4.180 -2.534 1.00 0.00 H new ATOM 0 HG23 THR A 18 8.956 -3.970 -0.768 1.00 0.00 H new ATOM 276 N TYR A 19 8.504 -7.946 -3.375 1.00 0.00 N ATOM 277 CA TYR A 19 7.958 -8.226 -4.692 1.00 0.00 C ATOM 278 C TYR A 19 6.711 -9.089 -4.593 1.00 0.00 C ATOM 279 O TYR A 19 5.704 -8.816 -5.250 1.00 0.00 O ATOM 280 CB TYR A 19 9.006 -8.891 -5.582 1.00 0.00 C ATOM 281 CG TYR A 19 10.154 -7.973 -5.932 1.00 0.00 C ATOM 282 CD1 TYR A 19 9.930 -6.793 -6.631 1.00 0.00 C ATOM 283 CD2 TYR A 19 11.458 -8.279 -5.566 1.00 0.00 C ATOM 284 CE1 TYR A 19 10.969 -5.949 -6.960 1.00 0.00 C ATOM 285 CE2 TYR A 19 12.506 -7.437 -5.892 1.00 0.00 C ATOM 286 CZ TYR A 19 12.253 -6.273 -6.588 1.00 0.00 C ATOM 287 OH TYR A 19 13.291 -5.433 -6.921 1.00 0.00 O ATOM 0 H TYR A 19 9.183 -8.630 -3.041 1.00 0.00 H new ATOM 0 HA TYR A 19 7.675 -7.277 -5.147 1.00 0.00 H new ATOM 0 HB2 TYR A 19 9.396 -9.774 -5.076 1.00 0.00 H new ATOM 0 HB3 TYR A 19 8.530 -9.234 -6.500 1.00 0.00 H new ATOM 0 HD1 TYR A 19 8.923 -6.532 -6.922 1.00 0.00 H new ATOM 0 HD2 TYR A 19 11.657 -9.188 -5.018 1.00 0.00 H new ATOM 0 HE1 TYR A 19 10.776 -5.038 -7.507 1.00 0.00 H new ATOM 0 HE2 TYR A 19 13.516 -7.689 -5.604 1.00 0.00 H new ATOM 0 HH TYR A 19 13.114 -4.537 -6.566 1.00 0.00 H new ATOM 297 N MET A 20 6.773 -10.116 -3.753 1.00 0.00 N ATOM 298 CA MET A 20 5.643 -11.010 -3.558 1.00 0.00 C ATOM 299 C MET A 20 4.468 -10.251 -2.958 1.00 0.00 C ATOM 300 O MET A 20 3.325 -10.431 -3.374 1.00 0.00 O ATOM 301 CB MET A 20 6.030 -12.180 -2.652 1.00 0.00 C ATOM 302 CG MET A 20 4.937 -13.225 -2.517 1.00 0.00 C ATOM 303 SD MET A 20 4.564 -14.039 -4.083 1.00 0.00 S ATOM 304 CE MET A 20 3.263 -15.164 -3.577 1.00 0.00 C ATOM 0 H MET A 20 7.596 -10.348 -3.197 1.00 0.00 H new ATOM 0 HA MET A 20 5.349 -11.407 -4.529 1.00 0.00 H new ATOM 0 HB2 MET A 20 6.929 -12.654 -3.047 1.00 0.00 H new ATOM 0 HB3 MET A 20 6.280 -11.797 -1.663 1.00 0.00 H new ATOM 0 HG2 MET A 20 5.242 -13.973 -1.786 1.00 0.00 H new ATOM 0 HG3 MET A 20 4.033 -12.753 -2.132 1.00 0.00 H new ATOM 0 HE1 MET A 20 2.926 -15.741 -4.438 1.00 0.00 H new ATOM 0 HE2 MET A 20 3.645 -15.842 -2.813 1.00 0.00 H new ATOM 0 HE3 MET A 20 2.427 -14.594 -3.172 1.00 0.00 H new ATOM 314 N ALA A 21 4.759 -9.386 -1.993 1.00 0.00 N ATOM 315 CA ALA A 21 3.725 -8.588 -1.350 1.00 0.00 C ATOM 316 C ALA A 21 3.076 -7.637 -2.344 1.00 0.00 C ATOM 317 O ALA A 21 1.857 -7.534 -2.395 1.00 0.00 O ATOM 318 CB ALA A 21 4.297 -7.816 -0.171 1.00 0.00 C ATOM 0 H ALA A 21 5.702 -9.220 -1.640 1.00 0.00 H new ATOM 0 HA ALA A 21 2.958 -9.268 -0.978 1.00 0.00 H new ATOM 0 HB1 ALA A 21 3.508 -7.226 0.295 1.00 0.00 H new ATOM 0 HB2 ALA A 21 4.706 -8.516 0.558 1.00 0.00 H new ATOM 0 HB3 ALA A 21 5.088 -7.152 -0.520 1.00 0.00 H new ATOM 324 N ALA A 22 3.895 -6.966 -3.148 1.00 0.00 N ATOM 325 CA ALA A 22 3.396 -6.003 -4.124 1.00 0.00 C ATOM 326 C ALA A 22 2.485 -6.669 -5.150 1.00 0.00 C ATOM 327 O ALA A 22 1.427 -6.136 -5.485 1.00 0.00 O ATOM 328 CB ALA A 22 4.558 -5.316 -4.826 1.00 0.00 C ATOM 0 H ALA A 22 4.909 -7.072 -3.143 1.00 0.00 H new ATOM 0 HA ALA A 22 2.809 -5.258 -3.587 1.00 0.00 H new ATOM 0 HB1 ALA A 22 4.173 -4.600 -5.552 1.00 0.00 H new ATOM 0 HB2 ALA A 22 5.170 -4.794 -4.091 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.165 -6.062 -5.339 1.00 0.00 H new ATOM 334 N GLN A 23 2.884 -7.839 -5.641 1.00 0.00 N ATOM 335 CA GLN A 23 2.101 -8.522 -6.664 1.00 0.00 C ATOM 336 C GLN A 23 0.870 -9.193 -6.064 1.00 0.00 C ATOM 337 O GLN A 23 -0.188 -9.219 -6.688 1.00 0.00 O ATOM 338 CB GLN A 23 2.942 -9.542 -7.435 1.00 0.00 C ATOM 339 CG GLN A 23 3.498 -10.672 -6.584 1.00 0.00 C ATOM 340 CD GLN A 23 4.163 -11.752 -7.412 1.00 0.00 C ATOM 341 OE1 GLN A 23 5.111 -12.396 -6.968 1.00 0.00 O ATOM 342 NE2 GLN A 23 3.663 -11.967 -8.619 1.00 0.00 N ATOM 0 H GLN A 23 3.732 -8.327 -5.352 1.00 0.00 H new ATOM 0 HA GLN A 23 1.768 -7.761 -7.369 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.332 -9.970 -8.231 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.772 -9.022 -7.914 1.00 0.00 H new ATOM 0 HG2 GLN A 23 4.220 -10.267 -5.875 1.00 0.00 H new ATOM 0 HG3 GLN A 23 2.690 -11.113 -6.000 1.00 0.00 H new ATOM 0 HE21 GLN A 23 2.875 -11.411 -8.951 1.00 0.00 H new ATOM 0 HE22 GLN A 23 4.066 -12.689 -9.217 1.00 0.00 H new ATOM 351 N ALA A 24 1.003 -9.732 -4.855 1.00 0.00 N ATOM 352 CA ALA A 24 -0.130 -10.351 -4.178 1.00 0.00 C ATOM 353 C ALA A 24 -1.148 -9.291 -3.785 1.00 0.00 C ATOM 354 O ALA A 24 -2.355 -9.488 -3.922 1.00 0.00 O ATOM 355 CB ALA A 24 0.335 -11.126 -2.955 1.00 0.00 C ATOM 0 H ALA A 24 1.877 -9.752 -4.329 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.605 -11.053 -4.864 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -0.525 -11.580 -2.464 1.00 0.00 H new ATOM 0 HB2 ALA A 24 1.032 -11.906 -3.262 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.832 -10.448 -2.262 1.00 0.00 H new ATOM 361 N LEU A 25 -0.642 -8.160 -3.311 1.00 0.00 N ATOM 362 CA LEU A 25 -1.475 -7.014 -2.978 1.00 0.00 C ATOM 363 C LEU A 25 -2.176 -6.488 -4.226 1.00 0.00 C ATOM 364 O LEU A 25 -3.351 -6.118 -4.181 1.00 0.00 O ATOM 365 CB LEU A 25 -0.609 -5.920 -2.348 1.00 0.00 C ATOM 366 CG LEU A 25 -1.336 -4.653 -1.907 1.00 0.00 C ATOM 367 CD1 LEU A 25 -2.362 -4.967 -0.827 1.00 0.00 C ATOM 368 CD2 LEU A 25 -0.326 -3.630 -1.410 1.00 0.00 C ATOM 0 H LEU A 25 0.354 -8.012 -3.147 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.238 -7.320 -2.263 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.101 -6.342 -1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.163 -5.640 -3.064 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.870 -4.237 -2.761 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.868 -4.049 -0.528 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.094 -5.675 -1.215 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -1.859 -5.402 0.037 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.848 -2.726 -1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.225 -4.043 -0.565 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.370 -3.386 -2.213 1.00 0.00 H new ATOM 380 N LYS A 26 -1.451 -6.476 -5.339 1.00 0.00 N ATOM 381 CA LYS A 26 -2.009 -6.064 -6.619 1.00 0.00 C ATOM 382 C LYS A 26 -3.147 -7.002 -7.022 1.00 0.00 C ATOM 383 O LYS A 26 -4.179 -6.563 -7.532 1.00 0.00 O ATOM 384 CB LYS A 26 -0.914 -6.068 -7.688 1.00 0.00 C ATOM 385 CG LYS A 26 -1.325 -5.423 -9.000 1.00 0.00 C ATOM 386 CD LYS A 26 -0.208 -5.511 -10.029 1.00 0.00 C ATOM 387 CE LYS A 26 1.069 -4.846 -9.531 1.00 0.00 C ATOM 388 NZ LYS A 26 2.215 -5.084 -10.451 1.00 0.00 N ATOM 0 H LYS A 26 -0.469 -6.749 -5.379 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.407 -5.054 -6.526 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.039 -5.548 -7.298 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.613 -7.098 -7.880 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.218 -5.914 -9.386 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.584 -4.378 -8.829 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -0.007 -6.557 -10.260 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.529 -5.036 -10.956 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.903 -3.774 -9.428 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.314 -5.228 -8.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 3.064 -4.615 -10.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.390 -6.106 -10.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.992 -4.697 -11.390 1.00 0.00 H new ATOM 402 N LYS A 27 -2.950 -8.297 -6.781 1.00 0.00 N ATOM 403 CA LYS A 27 -3.988 -9.292 -7.023 1.00 0.00 C ATOM 404 C LYS A 27 -5.195 -9.029 -6.138 1.00 0.00 C ATOM 405 O LYS A 27 -6.329 -9.008 -6.611 1.00 0.00 O ATOM 406 CB LYS A 27 -3.466 -10.700 -6.756 1.00 0.00 C ATOM 407 CG LYS A 27 -2.420 -11.176 -7.749 1.00 0.00 C ATOM 408 CD LYS A 27 -2.958 -11.203 -9.170 1.00 0.00 C ATOM 409 CE LYS A 27 -1.954 -11.818 -10.131 1.00 0.00 C ATOM 410 NZ LYS A 27 -1.681 -13.244 -9.808 1.00 0.00 N ATOM 0 H LYS A 27 -2.078 -8.681 -6.417 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.283 -9.215 -8.070 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.040 -10.733 -5.753 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -4.306 -11.395 -6.769 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.550 -10.520 -7.703 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -2.082 -12.174 -7.470 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.887 -11.772 -9.198 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.196 -10.189 -9.490 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -2.333 -11.742 -11.150 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.023 -11.253 -10.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -1.249 -13.710 -10.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -1.030 -13.298 -8.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.573 -13.722 -9.568 1.00 0.00 H new ATOM 424 N GLY A 28 -4.938 -8.833 -4.852 1.00 0.00 N ATOM 425 CA GLY A 28 -6.000 -8.544 -3.902 1.00 0.00 C ATOM 426 C GLY A 28 -6.775 -7.292 -4.265 1.00 0.00 C ATOM 427 O GLY A 28 -7.993 -7.229 -4.087 1.00 0.00 O ATOM 0 H GLY A 28 -4.004 -8.869 -4.444 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.684 -9.391 -3.857 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -5.572 -8.427 -2.907 1.00 0.00 H new ATOM 431 N ALA A 29 -6.070 -6.293 -4.782 1.00 0.00 N ATOM 432 CA ALA A 29 -6.700 -5.050 -5.202 1.00 0.00 C ATOM 433 C ALA A 29 -7.636 -5.289 -6.379 1.00 0.00 C ATOM 434 O ALA A 29 -8.768 -4.800 -6.390 1.00 0.00 O ATOM 435 CB ALA A 29 -5.646 -4.013 -5.560 1.00 0.00 C ATOM 0 H ALA A 29 -5.060 -6.321 -4.920 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.291 -4.669 -4.369 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -6.135 -3.090 -5.872 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -5.019 -3.816 -4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -5.028 -4.389 -6.375 1.00 0.00 H new ATOM 441 N LYS A 30 -7.162 -6.045 -7.363 1.00 0.00 N ATOM 442 CA LYS A 30 -7.973 -6.382 -8.527 1.00 0.00 C ATOM 443 C LYS A 30 -9.091 -7.348 -8.136 1.00 0.00 C ATOM 444 O LYS A 30 -10.146 -7.383 -8.769 1.00 0.00 O ATOM 445 CB LYS A 30 -7.110 -6.998 -9.625 1.00 0.00 C ATOM 446 CG LYS A 30 -7.741 -6.892 -11.000 1.00 0.00 C ATOM 447 CD LYS A 30 -6.891 -7.552 -12.066 1.00 0.00 C ATOM 448 CE LYS A 30 -7.353 -7.148 -13.455 1.00 0.00 C ATOM 449 NZ LYS A 30 -8.796 -7.441 -13.680 1.00 0.00 N ATOM 0 H LYS A 30 -6.220 -6.436 -7.378 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.418 -5.463 -8.909 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.139 -6.503 -9.637 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -6.930 -8.048 -9.393 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.727 -7.356 -10.983 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.888 -5.842 -11.252 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -5.847 -7.271 -11.930 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -6.946 -8.636 -11.961 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -7.175 -6.082 -13.599 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.757 -7.675 -14.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -9.017 -7.341 -14.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.005 -8.413 -13.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -9.375 -6.774 -13.132 1.00 0.00 H new ATOM 463 N LYS A 31 -8.842 -8.126 -7.088 1.00 0.00 N ATOM 464 CA LYS A 31 -9.820 -9.069 -6.556 1.00 0.00 C ATOM 465 C LYS A 31 -11.055 -8.323 -6.071 1.00 0.00 C ATOM 466 O LYS A 31 -12.189 -8.752 -6.293 1.00 0.00 O ATOM 467 CB LYS A 31 -9.190 -9.856 -5.399 1.00 0.00 C ATOM 468 CG LYS A 31 -10.139 -10.800 -4.674 1.00 0.00 C ATOM 469 CD LYS A 31 -10.467 -12.030 -5.503 1.00 0.00 C ATOM 470 CE LYS A 31 -11.327 -13.008 -4.718 1.00 0.00 C ATOM 471 NZ LYS A 31 -10.627 -13.534 -3.511 1.00 0.00 N ATOM 0 H LYS A 31 -7.956 -8.121 -6.583 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.119 -9.762 -7.342 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -8.351 -10.434 -5.787 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.783 -9.148 -4.677 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.691 -11.109 -3.730 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.061 -10.271 -4.431 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -10.989 -11.731 -6.412 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.544 -12.520 -5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.250 -12.514 -4.414 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.609 -13.840 -5.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.210 -14.271 -3.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.711 -13.939 -3.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.471 -12.759 -2.835 1.00 0.00 H new ATOM 485 N MET A 32 -10.820 -7.192 -5.423 1.00 0.00 N ATOM 486 CA MET A 32 -11.899 -6.393 -4.863 1.00 0.00 C ATOM 487 C MET A 32 -12.346 -5.305 -5.836 1.00 0.00 C ATOM 488 O MET A 32 -13.355 -4.638 -5.610 1.00 0.00 O ATOM 489 CB MET A 32 -11.454 -5.769 -3.541 1.00 0.00 C ATOM 490 CG MET A 32 -11.099 -6.793 -2.477 1.00 0.00 C ATOM 491 SD MET A 32 -12.488 -7.855 -2.034 1.00 0.00 S ATOM 492 CE MET A 32 -13.682 -6.644 -1.469 1.00 0.00 C ATOM 0 H MET A 32 -9.888 -6.806 -5.272 1.00 0.00 H new ATOM 0 HA MET A 32 -12.750 -7.050 -4.682 1.00 0.00 H new ATOM 0 HB2 MET A 32 -10.589 -5.131 -3.723 1.00 0.00 H new ATOM 0 HB3 MET A 32 -12.251 -5.127 -3.165 1.00 0.00 H new ATOM 0 HG2 MET A 32 -10.275 -7.411 -2.835 1.00 0.00 H new ATOM 0 HG3 MET A 32 -10.745 -6.275 -1.585 1.00 0.00 H new ATOM 0 HE1 MET A 32 -14.430 -7.134 -0.845 1.00 0.00 H new ATOM 0 HE2 MET A 32 -13.173 -5.875 -0.888 1.00 0.00 H new ATOM 0 HE3 MET A 32 -14.170 -6.186 -2.329 1.00 0.00 H new ATOM 502 N GLY A 33 -11.582 -5.124 -6.906 1.00 0.00 N ATOM 503 CA GLY A 33 -11.940 -4.156 -7.926 1.00 0.00 C ATOM 504 C GLY A 33 -11.625 -2.726 -7.523 1.00 0.00 C ATOM 505 O GLY A 33 -12.517 -1.878 -7.479 1.00 0.00 O ATOM 0 H GLY A 33 -10.717 -5.633 -7.086 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.408 -4.394 -8.847 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -13.005 -4.241 -8.142 1.00 0.00 H new ATOM 509 N ASN A 34 -10.359 -2.459 -7.230 1.00 0.00 N ATOM 510 CA ASN A 34 -9.930 -1.117 -6.843 1.00 0.00 C ATOM 511 C ASN A 34 -8.809 -0.632 -7.753 1.00 0.00 C ATOM 512 O ASN A 34 -8.366 -1.355 -8.650 1.00 0.00 O ATOM 513 CB ASN A 34 -9.444 -1.097 -5.386 1.00 0.00 C ATOM 514 CG ASN A 34 -10.479 -1.605 -4.405 1.00 0.00 C ATOM 515 OD1 ASN A 34 -11.337 -0.858 -3.940 1.00 0.00 O ATOM 516 ND2 ASN A 34 -10.394 -2.881 -4.069 1.00 0.00 N ATOM 0 H ASN A 34 -9.610 -3.151 -7.252 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.789 -0.453 -6.941 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -8.544 -1.705 -5.302 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -9.167 -0.078 -5.116 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -11.055 -3.278 -3.401 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -9.667 -3.469 -4.477 1.00 0.00 H new ATOM 523 N LEU A 35 -8.361 0.593 -7.517 1.00 0.00 N ATOM 524 CA LEU A 35 -7.232 1.161 -8.243 1.00 0.00 C ATOM 525 C LEU A 35 -6.087 1.394 -7.276 1.00 0.00 C ATOM 526 O LEU A 35 -6.191 2.221 -6.366 1.00 0.00 O ATOM 527 CB LEU A 35 -7.625 2.478 -8.914 1.00 0.00 C ATOM 528 CG LEU A 35 -8.694 2.362 -10.001 1.00 0.00 C ATOM 529 CD1 LEU A 35 -9.041 3.735 -10.558 1.00 0.00 C ATOM 530 CD2 LEU A 35 -8.228 1.436 -11.117 1.00 0.00 C ATOM 0 H LEU A 35 -8.767 1.219 -6.821 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.923 0.463 -9.021 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.983 3.165 -8.147 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -6.732 2.925 -9.351 1.00 0.00 H new ATOM 0 HG LEU A 35 -9.591 1.935 -9.553 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -9.803 3.632 -11.330 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -9.420 4.368 -9.756 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -8.148 4.190 -10.988 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -9.003 1.367 -11.880 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -7.315 1.833 -11.562 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -8.032 0.445 -10.709 1.00 0.00 H new ATOM 542 N ILE A 36 -5.000 0.665 -7.460 1.00 0.00 N ATOM 543 CA ILE A 36 -3.916 0.693 -6.503 1.00 0.00 C ATOM 544 C ILE A 36 -2.622 1.198 -7.130 1.00 0.00 C ATOM 545 O ILE A 36 -2.306 0.902 -8.284 1.00 0.00 O ATOM 546 CB ILE A 36 -3.688 -0.696 -5.869 1.00 0.00 C ATOM 547 CG1 ILE A 36 -2.705 -0.591 -4.702 1.00 0.00 C ATOM 548 CG2 ILE A 36 -3.192 -1.697 -6.910 1.00 0.00 C ATOM 549 CD1 ILE A 36 -2.555 -1.875 -3.920 1.00 0.00 C ATOM 0 H ILE A 36 -4.848 0.051 -8.260 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.209 1.390 -5.718 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.641 -1.060 -5.486 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -1.729 -0.293 -5.086 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.037 0.198 -4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.039 -2.667 -6.438 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.932 -1.793 -7.704 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.250 -1.346 -7.332 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -1.843 -1.726 -3.109 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.521 -2.164 -3.506 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.193 -2.663 -4.580 1.00 0.00 H new ATOM 561 N LYS A 37 -1.905 1.987 -6.356 1.00 0.00 N ATOM 562 CA LYS A 37 -0.592 2.483 -6.723 1.00 0.00 C ATOM 563 C LYS A 37 0.429 1.927 -5.731 1.00 0.00 C ATOM 564 O LYS A 37 0.535 2.416 -4.606 1.00 0.00 O ATOM 565 CB LYS A 37 -0.609 4.016 -6.687 1.00 0.00 C ATOM 566 CG LYS A 37 0.730 4.689 -6.957 1.00 0.00 C ATOM 567 CD LYS A 37 0.990 4.931 -8.436 1.00 0.00 C ATOM 568 CE LYS A 37 1.259 3.648 -9.200 1.00 0.00 C ATOM 569 NZ LYS A 37 1.701 3.933 -10.588 1.00 0.00 N ATOM 0 H LYS A 37 -2.222 2.307 -5.441 1.00 0.00 H new ATOM 0 HA LYS A 37 -0.322 2.163 -7.730 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.331 4.372 -7.422 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.967 4.336 -5.708 1.00 0.00 H new ATOM 0 HG2 LYS A 37 0.764 5.641 -6.428 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.529 4.070 -6.550 1.00 0.00 H new ATOM 0 HD2 LYS A 37 0.129 5.437 -8.874 1.00 0.00 H new ATOM 0 HD3 LYS A 37 1.843 5.600 -8.546 1.00 0.00 H new ATOM 0 HE2 LYS A 37 2.024 3.068 -8.684 1.00 0.00 H new ATOM 0 HE3 LYS A 37 0.356 3.038 -9.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 1.878 3.038 -11.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 0.960 4.466 -11.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 2.576 4.495 -10.565 1.00 0.00 H new ATOM 583 N VAL A 38 1.147 0.882 -6.132 1.00 0.00 N ATOM 584 CA VAL A 38 2.063 0.201 -5.219 1.00 0.00 C ATOM 585 C VAL A 38 3.513 0.639 -5.436 1.00 0.00 C ATOM 586 O VAL A 38 4.009 0.677 -6.562 1.00 0.00 O ATOM 587 CB VAL A 38 1.952 -1.346 -5.329 1.00 0.00 C ATOM 588 CG1 VAL A 38 2.269 -1.834 -6.736 1.00 0.00 C ATOM 589 CG2 VAL A 38 2.853 -2.027 -4.305 1.00 0.00 C ATOM 0 H VAL A 38 1.114 0.490 -7.073 1.00 0.00 H new ATOM 0 HA VAL A 38 1.763 0.493 -4.213 1.00 0.00 H new ATOM 0 HB VAL A 38 0.918 -1.616 -5.113 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.181 -2.920 -6.773 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.568 -1.389 -7.442 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.285 -1.543 -7.002 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.759 -3.109 -4.400 1.00 0.00 H new ATOM 0 HG22 VAL A 38 3.889 -1.736 -4.481 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.556 -1.724 -3.301 1.00 0.00 H new ATOM 599 N GLU A 39 4.172 0.987 -4.341 1.00 0.00 N ATOM 600 CA GLU A 39 5.577 1.362 -4.358 1.00 0.00 C ATOM 601 C GLU A 39 6.421 0.178 -3.899 1.00 0.00 C ATOM 602 O GLU A 39 5.957 -0.658 -3.117 1.00 0.00 O ATOM 603 CB GLU A 39 5.807 2.563 -3.436 1.00 0.00 C ATOM 604 CG GLU A 39 6.818 3.573 -3.962 1.00 0.00 C ATOM 605 CD GLU A 39 8.218 3.020 -4.074 1.00 0.00 C ATOM 606 OE1 GLU A 39 8.972 3.110 -3.092 1.00 0.00 O ATOM 607 OE2 GLU A 39 8.567 2.502 -5.158 1.00 0.00 O ATOM 0 H GLU A 39 3.747 1.017 -3.414 1.00 0.00 H new ATOM 0 HA GLU A 39 5.868 1.639 -5.371 1.00 0.00 H new ATOM 0 HB2 GLU A 39 4.855 3.070 -3.275 1.00 0.00 H new ATOM 0 HB3 GLU A 39 6.144 2.201 -2.465 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.494 3.923 -4.942 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.830 4.441 -3.302 1.00 0.00 H new ATOM 614 N THR A 40 7.650 0.113 -4.371 1.00 0.00 N ATOM 615 CA THR A 40 8.538 -0.985 -4.053 1.00 0.00 C ATOM 616 C THR A 40 9.871 -0.459 -3.534 1.00 0.00 C ATOM 617 O THR A 40 10.735 -0.057 -4.312 1.00 0.00 O ATOM 618 CB THR A 40 8.783 -1.866 -5.291 1.00 0.00 C ATOM 619 OG1 THR A 40 7.531 -2.219 -5.896 1.00 0.00 O ATOM 620 CG2 THR A 40 9.541 -3.132 -4.925 1.00 0.00 C ATOM 0 H THR A 40 8.059 0.818 -4.984 1.00 0.00 H new ATOM 0 HA THR A 40 8.062 -1.587 -3.279 1.00 0.00 H new ATOM 0 HB THR A 40 9.386 -1.293 -5.996 1.00 0.00 H new ATOM 0 HG1 THR A 40 7.695 -2.778 -6.684 1.00 0.00 H new ATOM 0 HG21 THR A 40 9.699 -3.733 -5.820 1.00 0.00 H new ATOM 0 HG22 THR A 40 10.505 -2.866 -4.492 1.00 0.00 H new ATOM 0 HG23 THR A 40 8.963 -3.705 -4.200 1.00 0.00 H new ATOM 628 N GLN A 41 10.023 -0.427 -2.223 1.00 0.00 N ATOM 629 CA GLN A 41 11.289 -0.050 -1.628 1.00 0.00 C ATOM 630 C GLN A 41 12.111 -1.291 -1.325 1.00 0.00 C ATOM 631 O GLN A 41 11.794 -2.051 -0.405 1.00 0.00 O ATOM 632 CB GLN A 41 11.094 0.765 -0.348 1.00 0.00 C ATOM 633 CG GLN A 41 10.666 2.208 -0.579 1.00 0.00 C ATOM 634 CD GLN A 41 10.730 3.042 0.688 1.00 0.00 C ATOM 635 OE1 GLN A 41 9.975 4.006 0.859 1.00 0.00 O ATOM 636 NE2 GLN A 41 11.637 2.680 1.588 1.00 0.00 N ATOM 0 H GLN A 41 9.288 -0.657 -1.554 1.00 0.00 H new ATOM 0 HA GLN A 41 11.818 0.576 -2.347 1.00 0.00 H new ATOM 0 HB2 GLN A 41 10.345 0.272 0.272 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.027 0.762 0.216 1.00 0.00 H new ATOM 0 HG2 GLN A 41 11.306 2.657 -1.338 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.649 2.224 -0.970 1.00 0.00 H new ATOM 0 HE21 GLN A 41 12.241 1.878 1.409 1.00 0.00 H new ATOM 0 HE22 GLN A 41 11.729 3.204 2.458 1.00 0.00 H new ATOM 645 N GLY A 42 13.162 -1.498 -2.108 1.00 0.00 N ATOM 646 CA GLY A 42 14.052 -2.630 -1.879 1.00 0.00 C ATOM 647 C GLY A 42 14.901 -2.428 -0.639 1.00 0.00 C ATOM 648 O GLY A 42 15.563 -3.347 -0.153 1.00 0.00 O ATOM 0 H GLY A 42 13.418 -0.905 -2.898 1.00 0.00 H new ATOM 0 HA2 GLY A 42 13.463 -3.541 -1.774 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.699 -2.767 -2.746 1.00 0.00 H new ATOM 652 N ALA A 43 14.863 -1.204 -0.141 1.00 0.00 N ATOM 653 CA ALA A 43 15.580 -0.802 1.052 1.00 0.00 C ATOM 654 C ALA A 43 15.082 0.579 1.455 1.00 0.00 C ATOM 655 O ALA A 43 13.876 0.798 1.557 1.00 0.00 O ATOM 656 CB ALA A 43 17.083 -0.792 0.797 1.00 0.00 C ATOM 0 H ALA A 43 14.322 -0.450 -0.564 1.00 0.00 H new ATOM 0 HA ALA A 43 15.398 -1.510 1.860 1.00 0.00 H new ATOM 0 HB1 ALA A 43 17.604 -0.488 1.705 1.00 0.00 H new ATOM 0 HB2 ALA A 43 17.410 -1.791 0.509 1.00 0.00 H new ATOM 0 HB3 ALA A 43 17.311 -0.090 -0.005 1.00 0.00 H new ATOM 662 N THR A 44 15.995 1.516 1.654 1.00 0.00 N ATOM 663 CA THR A 44 15.612 2.898 1.884 1.00 0.00 C ATOM 664 C THR A 44 15.427 3.605 0.535 1.00 0.00 C ATOM 665 O THR A 44 14.994 4.756 0.467 1.00 0.00 O ATOM 666 CB THR A 44 16.678 3.629 2.722 1.00 0.00 C ATOM 667 OG1 THR A 44 17.249 2.712 3.669 1.00 0.00 O ATOM 668 CG2 THR A 44 16.070 4.809 3.468 1.00 0.00 C ATOM 0 H THR A 44 17.001 1.346 1.661 1.00 0.00 H new ATOM 0 HA THR A 44 14.674 2.916 2.439 1.00 0.00 H new ATOM 0 HB THR A 44 17.449 4.005 2.049 1.00 0.00 H new ATOM 0 HG1 THR A 44 17.929 3.174 4.203 1.00 0.00 H new ATOM 0 HG21 THR A 44 16.843 5.308 4.052 1.00 0.00 H new ATOM 0 HG22 THR A 44 15.645 5.513 2.752 1.00 0.00 H new ATOM 0 HG23 THR A 44 15.285 4.452 4.135 1.00 0.00 H new ATOM 676 N GLY A 45 15.745 2.879 -0.538 1.00 0.00 N ATOM 677 CA GLY A 45 15.620 3.416 -1.879 1.00 0.00 C ATOM 678 C GLY A 45 14.260 3.125 -2.480 1.00 0.00 C ATOM 679 O GLY A 45 13.546 2.245 -2.002 1.00 0.00 O ATOM 0 H GLY A 45 16.090 1.920 -0.497 1.00 0.00 H new ATOM 0 HA2 GLY A 45 15.783 4.493 -1.855 1.00 0.00 H new ATOM 0 HA3 GLY A 45 16.396 2.990 -2.514 1.00 0.00 H new ATOM 683 N ILE A 46 13.915 3.848 -3.538 1.00 0.00 N ATOM 684 CA ILE A 46 12.582 3.772 -4.125 1.00 0.00 C ATOM 685 C ILE A 46 12.643 3.248 -5.561 1.00 0.00 C ATOM 686 O ILE A 46 13.531 3.630 -6.326 1.00 0.00 O ATOM 687 CB ILE A 46 11.888 5.160 -4.118 1.00 0.00 C ATOM 688 CG1 ILE A 46 11.606 5.646 -2.690 1.00 0.00 C ATOM 689 CG2 ILE A 46 10.600 5.115 -4.912 1.00 0.00 C ATOM 690 CD1 ILE A 46 12.801 6.253 -1.988 1.00 0.00 C ATOM 0 H ILE A 46 14.544 4.498 -4.010 1.00 0.00 H new ATOM 0 HA ILE A 46 12.001 3.080 -3.516 1.00 0.00 H new ATOM 0 HB ILE A 46 12.572 5.868 -4.586 1.00 0.00 H new ATOM 0 HG12 ILE A 46 10.805 6.385 -2.722 1.00 0.00 H new ATOM 0 HG13 ILE A 46 11.241 4.806 -2.099 1.00 0.00 H new ATOM 0 HG21 ILE A 46 10.128 6.097 -4.895 1.00 0.00 H new ATOM 0 HG22 ILE A 46 10.817 4.834 -5.943 1.00 0.00 H new ATOM 0 HG23 ILE A 46 9.926 4.381 -4.471 1.00 0.00 H new ATOM 0 HD11 ILE A 46 12.512 6.569 -0.986 1.00 0.00 H new ATOM 0 HD12 ILE A 46 13.598 5.512 -1.919 1.00 0.00 H new ATOM 0 HD13 ILE A 46 13.155 7.116 -2.553 1.00 0.00 H new ATOM 702 N GLU A 47 11.697 2.382 -5.928 1.00 0.00 N ATOM 703 CA GLU A 47 11.655 1.824 -7.279 1.00 0.00 C ATOM 704 C GLU A 47 10.564 2.466 -8.129 1.00 0.00 C ATOM 705 O GLU A 47 10.849 3.093 -9.150 1.00 0.00 O ATOM 706 CB GLU A 47 11.420 0.314 -7.258 1.00 0.00 C ATOM 707 CG GLU A 47 12.643 -0.511 -6.909 1.00 0.00 C ATOM 708 CD GLU A 47 12.397 -1.994 -7.101 1.00 0.00 C ATOM 709 OE1 GLU A 47 11.472 -2.350 -7.868 1.00 0.00 O ATOM 710 OE2 GLU A 47 13.126 -2.810 -6.494 1.00 0.00 O ATOM 0 H GLU A 47 10.954 2.054 -5.312 1.00 0.00 H new ATOM 0 HA GLU A 47 12.629 2.039 -7.719 1.00 0.00 H new ATOM 0 HB2 GLU A 47 10.631 0.092 -6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.055 0.003 -8.237 1.00 0.00 H new ATOM 0 HG2 GLU A 47 13.482 -0.198 -7.531 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.926 -0.321 -5.874 1.00 0.00 H new ATOM 717 N ASN A 48 9.319 2.302 -7.703 1.00 0.00 N ATOM 718 CA ASN A 48 8.170 2.725 -8.495 1.00 0.00 C ATOM 719 C ASN A 48 7.938 4.217 -8.341 1.00 0.00 C ATOM 720 O ASN A 48 7.689 4.918 -9.325 1.00 0.00 O ATOM 721 CB ASN A 48 6.913 1.958 -8.064 1.00 0.00 C ATOM 722 CG ASN A 48 5.690 2.331 -8.885 1.00 0.00 C ATOM 723 OD1 ASN A 48 4.968 3.272 -8.559 1.00 0.00 O ATOM 724 ND2 ASN A 48 5.443 1.589 -9.952 1.00 0.00 N ATOM 0 H ASN A 48 9.077 1.877 -6.808 1.00 0.00 H new ATOM 0 HA ASN A 48 8.378 2.507 -9.542 1.00 0.00 H new ATOM 0 HB2 ASN A 48 7.096 0.887 -8.157 1.00 0.00 H new ATOM 0 HB3 ASN A 48 6.714 2.157 -7.011 1.00 0.00 H new ATOM 0 HD21 ASN A 48 4.631 1.789 -10.536 1.00 0.00 H new ATOM 0 HD22 ASN A 48 6.065 0.816 -10.191 1.00 0.00 H new ATOM 731 N GLU A 49 8.041 4.682 -7.097 1.00 0.00 N ATOM 732 CA GLU A 49 7.833 6.085 -6.747 1.00 0.00 C ATOM 733 C GLU A 49 6.363 6.470 -6.888 1.00 0.00 C ATOM 734 O GLU A 49 5.836 6.594 -7.996 1.00 0.00 O ATOM 735 CB GLU A 49 8.705 7.012 -7.602 1.00 0.00 C ATOM 736 CG GLU A 49 8.641 8.469 -7.181 1.00 0.00 C ATOM 737 CD GLU A 49 9.288 9.390 -8.191 1.00 0.00 C ATOM 738 OE1 GLU A 49 10.511 9.273 -8.411 1.00 0.00 O ATOM 739 OE2 GLU A 49 8.573 10.225 -8.783 1.00 0.00 O ATOM 0 H GLU A 49 8.273 4.091 -6.299 1.00 0.00 H new ATOM 0 HA GLU A 49 8.128 6.206 -5.705 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.740 6.673 -7.550 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.394 6.930 -8.644 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.599 8.759 -7.044 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.135 8.588 -6.217 1.00 0.00 H new ATOM 746 N LEU A 50 5.700 6.643 -5.758 1.00 0.00 N ATOM 747 CA LEU A 50 4.324 7.099 -5.762 1.00 0.00 C ATOM 748 C LEU A 50 4.306 8.609 -5.911 1.00 0.00 C ATOM 749 O LEU A 50 4.620 9.337 -4.967 1.00 0.00 O ATOM 750 CB LEU A 50 3.598 6.685 -4.478 1.00 0.00 C ATOM 751 CG LEU A 50 3.705 5.204 -4.112 1.00 0.00 C ATOM 752 CD1 LEU A 50 2.719 4.855 -3.009 1.00 0.00 C ATOM 753 CD2 LEU A 50 3.478 4.326 -5.332 1.00 0.00 C ATOM 0 H LEU A 50 6.091 6.475 -4.831 1.00 0.00 H new ATOM 0 HA LEU A 50 3.801 6.636 -6.599 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.993 7.276 -3.651 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.543 6.942 -4.578 1.00 0.00 H new ATOM 0 HG LEU A 50 4.714 5.017 -3.744 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.809 3.797 -2.762 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.935 5.454 -2.125 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.704 5.063 -3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.559 3.277 -5.046 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.484 4.516 -5.737 1.00 0.00 H new ATOM 0 HD23 LEU A 50 4.228 4.555 -6.089 1.00 0.00 H new ATOM 765 N THR A 51 3.970 9.070 -7.108 1.00 0.00 N ATOM 766 CA THR A 51 4.002 10.490 -7.420 1.00 0.00 C ATOM 767 C THR A 51 3.076 11.272 -6.497 1.00 0.00 C ATOM 768 O THR A 51 2.066 10.743 -6.027 1.00 0.00 O ATOM 769 CB THR A 51 3.602 10.753 -8.885 1.00 0.00 C ATOM 770 OG1 THR A 51 2.225 10.407 -9.092 1.00 0.00 O ATOM 771 CG2 THR A 51 4.481 9.955 -9.837 1.00 0.00 C ATOM 0 H THR A 51 3.671 8.477 -7.882 1.00 0.00 H new ATOM 0 HA THR A 51 5.028 10.827 -7.270 1.00 0.00 H new ATOM 0 HB THR A 51 3.741 11.815 -9.090 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.170 9.532 -9.531 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.180 10.157 -10.865 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.523 10.245 -9.700 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.370 8.891 -9.629 1.00 0.00 H new ATOM 779 N GLU A 52 3.424 12.526 -6.249 1.00 0.00 N ATOM 780 CA GLU A 52 2.655 13.381 -5.355 1.00 0.00 C ATOM 781 C GLU A 52 1.191 13.455 -5.802 1.00 0.00 C ATOM 782 O GLU A 52 0.276 13.458 -4.978 1.00 0.00 O ATOM 783 CB GLU A 52 3.281 14.780 -5.327 1.00 0.00 C ATOM 784 CG GLU A 52 2.726 15.694 -4.246 1.00 0.00 C ATOM 785 CD GLU A 52 3.018 15.198 -2.843 1.00 0.00 C ATOM 786 OE1 GLU A 52 4.207 14.989 -2.515 1.00 0.00 O ATOM 787 OE2 GLU A 52 2.061 15.047 -2.054 1.00 0.00 O ATOM 0 H GLU A 52 4.242 12.978 -6.658 1.00 0.00 H new ATOM 0 HA GLU A 52 2.676 12.958 -4.351 1.00 0.00 H new ATOM 0 HB2 GLU A 52 4.357 14.681 -5.185 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.130 15.252 -6.298 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.149 16.691 -4.368 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.648 15.787 -4.375 1.00 0.00 H new ATOM 794 N LYS A 53 0.979 13.479 -7.114 1.00 0.00 N ATOM 795 CA LYS A 53 -0.366 13.559 -7.671 1.00 0.00 C ATOM 796 C LYS A 53 -1.146 12.266 -7.430 1.00 0.00 C ATOM 797 O LYS A 53 -2.310 12.308 -7.035 1.00 0.00 O ATOM 798 CB LYS A 53 -0.305 13.890 -9.164 1.00 0.00 C ATOM 799 CG LYS A 53 0.357 15.229 -9.445 1.00 0.00 C ATOM 800 CD LYS A 53 0.351 15.568 -10.925 1.00 0.00 C ATOM 801 CE LYS A 53 1.104 16.861 -11.197 1.00 0.00 C ATOM 802 NZ LYS A 53 0.547 18.000 -10.422 1.00 0.00 N ATOM 0 H LYS A 53 1.722 13.444 -7.812 1.00 0.00 H new ATOM 0 HA LYS A 53 -0.897 14.362 -7.159 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.242 13.103 -9.684 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -1.316 13.897 -9.571 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -0.161 16.012 -8.892 1.00 0.00 H new ATOM 0 HG3 LYS A 53 1.385 15.208 -9.082 1.00 0.00 H new ATOM 0 HD2 LYS A 53 0.806 14.754 -11.489 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -0.677 15.662 -11.275 1.00 0.00 H new ATOM 0 HE2 LYS A 53 2.156 16.729 -10.943 1.00 0.00 H new ATOM 0 HE3 LYS A 53 1.059 17.090 -12.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 0.945 18.891 -10.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -0.488 18.017 -10.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 0.793 17.890 -9.418 1.00 0.00 H new ATOM 816 N ASP A 54 -0.502 11.118 -7.643 1.00 0.00 N ATOM 817 CA ASP A 54 -1.155 9.827 -7.399 1.00 0.00 C ATOM 818 C ASP A 54 -1.465 9.649 -5.923 1.00 0.00 C ATOM 819 O ASP A 54 -2.452 9.012 -5.554 1.00 0.00 O ATOM 820 CB ASP A 54 -0.293 8.654 -7.876 1.00 0.00 C ATOM 821 CG ASP A 54 -0.426 8.377 -9.359 1.00 0.00 C ATOM 822 OD1 ASP A 54 -1.536 8.024 -9.804 1.00 0.00 O ATOM 823 OD2 ASP A 54 0.586 8.497 -10.085 1.00 0.00 O ATOM 0 H ASP A 54 0.459 11.053 -7.980 1.00 0.00 H new ATOM 0 HA ASP A 54 -2.083 9.831 -7.970 1.00 0.00 H new ATOM 0 HB2 ASP A 54 0.752 8.862 -7.645 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.570 7.759 -7.320 1.00 0.00 H new ATOM 828 N VAL A 55 -0.617 10.212 -5.084 1.00 0.00 N ATOM 829 CA VAL A 55 -0.797 10.135 -3.644 1.00 0.00 C ATOM 830 C VAL A 55 -1.975 10.992 -3.187 1.00 0.00 C ATOM 831 O VAL A 55 -2.699 10.621 -2.264 1.00 0.00 O ATOM 832 CB VAL A 55 0.487 10.561 -2.909 1.00 0.00 C ATOM 833 CG1 VAL A 55 0.254 10.667 -1.413 1.00 0.00 C ATOM 834 CG2 VAL A 55 1.601 9.573 -3.201 1.00 0.00 C ATOM 0 H VAL A 55 0.210 10.732 -5.376 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.014 9.096 -3.394 1.00 0.00 H new ATOM 0 HB VAL A 55 0.778 11.547 -3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.179 10.969 -0.921 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.521 11.408 -1.217 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.064 9.699 -1.025 1.00 0.00 H new ATOM 0 HG21 VAL A 55 2.506 9.881 -2.678 1.00 0.00 H new ATOM 0 HG22 VAL A 55 1.305 8.580 -2.862 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.793 9.547 -4.274 1.00 0.00 H new ATOM 844 N ASN A 56 -2.170 12.132 -3.833 1.00 0.00 N ATOM 845 CA ASN A 56 -3.297 12.999 -3.507 1.00 0.00 C ATOM 846 C ASN A 56 -4.601 12.398 -4.017 1.00 0.00 C ATOM 847 O ASN A 56 -5.661 12.590 -3.417 1.00 0.00 O ATOM 848 CB ASN A 56 -3.095 14.405 -4.077 1.00 0.00 C ATOM 849 CG ASN A 56 -2.261 15.288 -3.164 1.00 0.00 C ATOM 850 OD1 ASN A 56 -2.793 16.006 -2.313 1.00 0.00 O ATOM 851 ND2 ASN A 56 -0.950 15.233 -3.319 1.00 0.00 N ATOM 0 H ASN A 56 -1.569 12.478 -4.581 1.00 0.00 H new ATOM 0 HA ASN A 56 -3.354 13.081 -2.422 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -2.609 14.333 -5.050 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -4.067 14.871 -4.239 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.342 15.796 -2.724 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.546 14.628 -4.033 1.00 0.00 H new ATOM 858 N ILE A 57 -4.519 11.665 -5.123 1.00 0.00 N ATOM 859 CA ILE A 57 -5.671 10.941 -5.645 1.00 0.00 C ATOM 860 C ILE A 57 -5.997 9.759 -4.735 1.00 0.00 C ATOM 861 O ILE A 57 -7.147 9.572 -4.337 1.00 0.00 O ATOM 862 CB ILE A 57 -5.426 10.443 -7.090 1.00 0.00 C ATOM 863 CG1 ILE A 57 -5.252 11.632 -8.041 1.00 0.00 C ATOM 864 CG2 ILE A 57 -6.567 9.546 -7.559 1.00 0.00 C ATOM 865 CD1 ILE A 57 -6.440 12.572 -8.061 1.00 0.00 C ATOM 0 H ILE A 57 -3.667 11.557 -5.674 1.00 0.00 H new ATOM 0 HA ILE A 57 -6.516 11.629 -5.669 1.00 0.00 H new ATOM 0 HB ILE A 57 -4.509 9.854 -7.096 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -4.362 12.191 -7.751 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.079 11.257 -9.050 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -6.370 9.210 -8.577 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.645 8.681 -6.900 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.502 10.105 -7.536 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -6.246 13.389 -8.756 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -7.329 12.028 -8.380 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -6.601 12.976 -7.062 1.00 0.00 H new ATOM 877 N GLY A 58 -4.972 8.981 -4.400 1.00 0.00 N ATOM 878 CA GLY A 58 -5.144 7.867 -3.487 1.00 0.00 C ATOM 879 C GLY A 58 -5.615 8.330 -2.125 1.00 0.00 C ATOM 880 O GLY A 58 -5.139 9.337 -1.610 1.00 0.00 O ATOM 0 H GLY A 58 -4.021 9.104 -4.747 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -5.866 7.164 -3.902 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.200 7.332 -3.384 1.00 0.00 H new ATOM 884 N GLU A 59 -6.538 7.599 -1.535 1.00 0.00 N ATOM 885 CA GLU A 59 -7.138 8.008 -0.278 1.00 0.00 C ATOM 886 C GLU A 59 -6.485 7.286 0.895 1.00 0.00 C ATOM 887 O GLU A 59 -5.914 7.920 1.785 1.00 0.00 O ATOM 888 CB GLU A 59 -8.641 7.740 -0.314 1.00 0.00 C ATOM 889 CG GLU A 59 -9.334 8.396 -1.497 1.00 0.00 C ATOM 890 CD GLU A 59 -10.825 8.153 -1.511 1.00 0.00 C ATOM 891 OE1 GLU A 59 -11.257 7.109 -2.040 1.00 0.00 O ATOM 892 OE2 GLU A 59 -11.572 9.012 -0.999 1.00 0.00 O ATOM 0 H GLU A 59 -6.891 6.716 -1.905 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.974 9.077 -0.140 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.812 6.664 -0.351 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.091 8.102 0.610 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.146 9.469 -1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.900 8.017 -2.422 1.00 0.00 H new ATOM 899 N VAL A 60 -6.548 5.962 0.877 1.00 0.00 N ATOM 900 CA VAL A 60 -5.966 5.158 1.944 1.00 0.00 C ATOM 901 C VAL A 60 -4.565 4.700 1.574 1.00 0.00 C ATOM 902 O VAL A 60 -4.302 4.331 0.426 1.00 0.00 O ATOM 903 CB VAL A 60 -6.831 3.925 2.291 1.00 0.00 C ATOM 904 CG1 VAL A 60 -8.062 4.341 3.078 1.00 0.00 C ATOM 905 CG2 VAL A 60 -7.230 3.172 1.031 1.00 0.00 C ATOM 0 H VAL A 60 -6.996 5.422 0.137 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.922 5.799 2.824 1.00 0.00 H new ATOM 0 HB VAL A 60 -6.235 3.256 2.912 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -8.659 3.460 3.313 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -7.755 4.829 4.003 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.657 5.034 2.483 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.838 2.308 1.300 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.804 3.831 0.380 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.334 2.836 0.509 1.00 0.00 H new ATOM 915 N VAL A 61 -3.673 4.738 2.549 1.00 0.00 N ATOM 916 CA VAL A 61 -2.294 4.343 2.345 1.00 0.00 C ATOM 917 C VAL A 61 -2.005 3.040 3.067 1.00 0.00 C ATOM 918 O VAL A 61 -2.110 2.959 4.289 1.00 0.00 O ATOM 919 CB VAL A 61 -1.315 5.414 2.862 1.00 0.00 C ATOM 920 CG1 VAL A 61 0.104 5.080 2.431 1.00 0.00 C ATOM 921 CG2 VAL A 61 -1.721 6.800 2.378 1.00 0.00 C ATOM 0 H VAL A 61 -3.885 5.042 3.499 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.152 4.220 1.271 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.351 5.420 3.951 1.00 0.00 H new ATOM 0 HG11 VAL A 61 0.787 5.844 2.802 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.389 4.110 2.838 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.155 5.046 1.343 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -1.014 7.539 2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.718 6.820 1.288 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.721 7.034 2.743 1.00 0.00 H new ATOM 931 N ILE A 62 -1.649 2.019 2.311 1.00 0.00 N ATOM 932 CA ILE A 62 -1.337 0.726 2.892 1.00 0.00 C ATOM 933 C ILE A 62 0.170 0.533 2.962 1.00 0.00 C ATOM 934 O ILE A 62 0.869 0.617 1.952 1.00 0.00 O ATOM 935 CB ILE A 62 -1.985 -0.446 2.103 1.00 0.00 C ATOM 936 CG1 ILE A 62 -3.497 -0.518 2.361 1.00 0.00 C ATOM 937 CG2 ILE A 62 -1.333 -1.777 2.461 1.00 0.00 C ATOM 938 CD1 ILE A 62 -4.289 0.621 1.759 1.00 0.00 C ATOM 0 H ILE A 62 -1.569 2.059 1.295 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.756 0.714 3.898 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.822 -0.253 1.043 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.877 -1.459 1.963 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -3.669 -0.535 3.437 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.807 -2.578 1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.271 -1.739 2.218 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.454 -1.966 3.528 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -5.346 0.491 1.989 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.941 1.566 2.175 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.152 0.628 0.678 1.00 0.00 H new ATOM 950 N PHE A 63 0.672 0.296 4.159 1.00 0.00 N ATOM 951 CA PHE A 63 2.085 0.034 4.346 1.00 0.00 C ATOM 952 C PHE A 63 2.324 -1.424 4.674 1.00 0.00 C ATOM 953 O PHE A 63 2.022 -1.879 5.776 1.00 0.00 O ATOM 954 CB PHE A 63 2.675 0.908 5.450 1.00 0.00 C ATOM 955 CG PHE A 63 2.973 2.307 5.009 1.00 0.00 C ATOM 956 CD1 PHE A 63 4.027 2.561 4.147 1.00 0.00 C ATOM 957 CD2 PHE A 63 2.199 3.365 5.447 1.00 0.00 C ATOM 958 CE1 PHE A 63 4.304 3.847 3.734 1.00 0.00 C ATOM 959 CE2 PHE A 63 2.471 4.655 5.036 1.00 0.00 C ATOM 960 CZ PHE A 63 3.525 4.894 4.178 1.00 0.00 C ATOM 0 H PHE A 63 0.121 0.280 5.017 1.00 0.00 H new ATOM 0 HA PHE A 63 2.583 0.277 3.408 1.00 0.00 H new ATOM 0 HB2 PHE A 63 1.979 0.940 6.288 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.593 0.447 5.816 1.00 0.00 H new ATOM 0 HD1 PHE A 63 4.638 1.743 3.795 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.373 3.181 6.118 1.00 0.00 H new ATOM 0 HE1 PHE A 63 5.130 4.034 3.064 1.00 0.00 H new ATOM 0 HE2 PHE A 63 1.860 5.475 5.385 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.740 5.902 3.854 1.00 0.00 H new ATOM 970 N ALA A 64 2.843 -2.151 3.704 1.00 0.00 N ATOM 971 CA ALA A 64 3.288 -3.508 3.932 1.00 0.00 C ATOM 972 C ALA A 64 4.800 -3.518 3.925 1.00 0.00 C ATOM 973 O ALA A 64 5.431 -3.656 2.875 1.00 0.00 O ATOM 974 CB ALA A 64 2.736 -4.442 2.869 1.00 0.00 C ATOM 0 H ALA A 64 2.966 -1.821 2.747 1.00 0.00 H new ATOM 0 HA ALA A 64 2.921 -3.862 4.895 1.00 0.00 H new ATOM 0 HB1 ALA A 64 3.084 -5.457 3.061 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.647 -4.420 2.896 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.081 -4.120 1.887 1.00 0.00 H new ATOM 980 N VAL A 65 5.385 -3.335 5.093 1.00 0.00 N ATOM 981 CA VAL A 65 6.812 -3.098 5.187 1.00 0.00 C ATOM 982 C VAL A 65 7.448 -3.891 6.316 1.00 0.00 C ATOM 983 O VAL A 65 6.770 -4.369 7.226 1.00 0.00 O ATOM 984 CB VAL A 65 7.117 -1.596 5.403 1.00 0.00 C ATOM 985 CG1 VAL A 65 6.620 -0.768 4.229 1.00 0.00 C ATOM 986 CG2 VAL A 65 6.501 -1.099 6.705 1.00 0.00 C ATOM 0 H VAL A 65 4.895 -3.346 5.988 1.00 0.00 H new ATOM 0 HA VAL A 65 7.239 -3.428 4.240 1.00 0.00 H new ATOM 0 HB VAL A 65 8.199 -1.480 5.470 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.846 0.284 4.404 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.115 -1.098 3.316 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.543 -0.895 4.124 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.729 -0.041 6.835 1.00 0.00 H new ATOM 0 HG22 VAL A 65 5.420 -1.236 6.672 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.913 -1.664 7.541 1.00 0.00 H new ATOM 996 N ASP A 66 8.756 -4.038 6.222 1.00 0.00 N ATOM 997 CA ASP A 66 9.558 -4.615 7.287 1.00 0.00 C ATOM 998 C ASP A 66 10.590 -3.590 7.742 1.00 0.00 C ATOM 999 O ASP A 66 10.951 -3.522 8.917 1.00 0.00 O ATOM 1000 CB ASP A 66 10.245 -5.895 6.809 1.00 0.00 C ATOM 1001 CG ASP A 66 11.143 -6.504 7.866 1.00 0.00 C ATOM 1002 OD1 ASP A 66 10.627 -7.206 8.763 1.00 0.00 O ATOM 1003 OD2 ASP A 66 12.366 -6.285 7.806 1.00 0.00 O ATOM 0 H ASP A 66 9.295 -3.760 5.402 1.00 0.00 H new ATOM 0 HA ASP A 66 8.913 -4.876 8.126 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.487 -6.623 6.518 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.835 -5.676 5.919 1.00 0.00 H new ATOM 1008 N THR A 67 11.040 -2.778 6.796 1.00 0.00 N ATOM 1009 CA THR A 67 11.944 -1.680 7.086 1.00 0.00 C ATOM 1010 C THR A 67 11.176 -0.356 6.990 1.00 0.00 C ATOM 1011 O THR A 67 9.948 -0.359 6.905 1.00 0.00 O ATOM 1012 CB THR A 67 13.158 -1.688 6.122 1.00 0.00 C ATOM 1013 OG1 THR A 67 14.112 -0.688 6.506 1.00 0.00 O ATOM 1014 CG2 THR A 67 12.728 -1.454 4.680 1.00 0.00 C ATOM 0 H THR A 67 10.789 -2.863 5.811 1.00 0.00 H new ATOM 0 HA THR A 67 12.333 -1.796 8.097 1.00 0.00 H new ATOM 0 HB THR A 67 13.619 -2.674 6.188 1.00 0.00 H new ATOM 0 HG1 THR A 67 14.140 -0.621 7.483 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.605 -1.466 4.032 1.00 0.00 H new ATOM 0 HG22 THR A 67 12.039 -2.241 4.373 1.00 0.00 H new ATOM 0 HG23 THR A 67 12.232 -0.487 4.601 1.00 0.00 H new ATOM 1022 N LYS A 68 11.888 0.761 6.997 1.00 0.00 N ATOM 1023 CA LYS A 68 11.246 2.069 6.983 1.00 0.00 C ATOM 1024 C LYS A 68 11.096 2.591 5.556 1.00 0.00 C ATOM 1025 O LYS A 68 11.668 2.039 4.615 1.00 0.00 O ATOM 1026 CB LYS A 68 12.039 3.053 7.842 1.00 0.00 C ATOM 1027 CG LYS A 68 13.443 3.330 7.332 1.00 0.00 C ATOM 1028 CD LYS A 68 14.259 4.082 8.368 1.00 0.00 C ATOM 1029 CE LYS A 68 13.587 5.385 8.763 1.00 0.00 C ATOM 1030 NZ LYS A 68 14.246 6.008 9.937 1.00 0.00 N ATOM 0 H LYS A 68 12.907 0.789 7.012 1.00 0.00 H new ATOM 0 HA LYS A 68 10.246 1.967 7.404 1.00 0.00 H new ATOM 0 HB2 LYS A 68 11.492 3.994 7.897 1.00 0.00 H new ATOM 0 HB3 LYS A 68 12.103 2.662 8.858 1.00 0.00 H new ATOM 0 HG2 LYS A 68 13.937 2.390 7.087 1.00 0.00 H new ATOM 0 HG3 LYS A 68 13.391 3.912 6.412 1.00 0.00 H new ATOM 0 HD2 LYS A 68 14.393 3.458 9.251 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.253 4.289 7.971 1.00 0.00 H new ATOM 0 HE2 LYS A 68 13.612 6.077 7.921 1.00 0.00 H new ATOM 0 HE3 LYS A 68 12.538 5.199 8.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 13.760 6.895 10.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 14.200 5.357 10.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 15.241 6.209 9.711 1.00 0.00 H new ATOM 1044 N VAL A 69 10.335 3.667 5.403 1.00 0.00 N ATOM 1045 CA VAL A 69 9.983 4.177 4.086 1.00 0.00 C ATOM 1046 C VAL A 69 10.304 5.663 3.956 1.00 0.00 C ATOM 1047 O VAL A 69 10.272 6.407 4.937 1.00 0.00 O ATOM 1048 CB VAL A 69 8.483 3.967 3.790 1.00 0.00 C ATOM 1049 CG1 VAL A 69 8.160 2.495 3.641 1.00 0.00 C ATOM 1050 CG2 VAL A 69 7.636 4.571 4.892 1.00 0.00 C ATOM 0 H VAL A 69 9.949 4.205 6.179 1.00 0.00 H new ATOM 0 HA VAL A 69 10.580 3.618 3.365 1.00 0.00 H new ATOM 0 HB VAL A 69 8.254 4.468 2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 69 7.097 2.375 3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.740 2.077 2.819 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.410 1.972 4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.581 4.414 4.667 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.880 4.094 5.841 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.837 5.640 4.961 1.00 0.00 H new ATOM 1060 N ARG A 70 10.628 6.087 2.745 1.00 0.00 N ATOM 1061 CA ARG A 70 10.873 7.496 2.466 1.00 0.00 C ATOM 1062 C ARG A 70 9.600 8.169 1.950 1.00 0.00 C ATOM 1063 O ARG A 70 9.369 9.355 2.182 1.00 0.00 O ATOM 1064 CB ARG A 70 12.009 7.657 1.449 1.00 0.00 C ATOM 1065 CG ARG A 70 12.299 9.107 1.095 1.00 0.00 C ATOM 1066 CD ARG A 70 13.425 9.240 0.083 1.00 0.00 C ATOM 1067 NE ARG A 70 13.550 10.613 -0.400 1.00 0.00 N ATOM 1068 CZ ARG A 70 14.444 11.015 -1.297 1.00 0.00 C ATOM 1069 NH1 ARG A 70 15.354 10.171 -1.771 1.00 0.00 N ATOM 1070 NH2 ARG A 70 14.436 12.277 -1.705 1.00 0.00 N ATOM 0 H ARG A 70 10.728 5.474 1.936 1.00 0.00 H new ATOM 0 HA ARG A 70 11.171 7.981 3.396 1.00 0.00 H new ATOM 0 HB2 ARG A 70 12.914 7.200 1.850 1.00 0.00 H new ATOM 0 HB3 ARG A 70 11.753 7.113 0.540 1.00 0.00 H new ATOM 0 HG2 ARG A 70 11.397 9.568 0.694 1.00 0.00 H new ATOM 0 HG3 ARG A 70 12.561 9.654 2.001 1.00 0.00 H new ATOM 0 HD2 ARG A 70 14.364 8.926 0.539 1.00 0.00 H new ATOM 0 HD3 ARG A 70 13.240 8.572 -0.759 1.00 0.00 H new ATOM 0 HE ARG A 70 12.908 11.310 -0.023 1.00 0.00 H new ATOM 0 HH11 ARG A 70 15.371 9.204 -1.447 1.00 0.00 H new ATOM 0 HH12 ARG A 70 16.036 10.490 -2.459 1.00 0.00 H new ATOM 0 HH21 ARG A 70 13.747 12.930 -1.330 1.00 0.00 H new ATOM 0 HH22 ARG A 70 15.118 12.595 -2.393 1.00 0.00 H new ATOM 1084 N ASN A 71 8.764 7.392 1.263 1.00 0.00 N ATOM 1085 CA ASN A 71 7.545 7.927 0.651 1.00 0.00 C ATOM 1086 C ASN A 71 6.532 8.376 1.706 1.00 0.00 C ATOM 1087 O ASN A 71 5.583 9.086 1.389 1.00 0.00 O ATOM 1088 CB ASN A 71 6.881 6.896 -0.271 1.00 0.00 C ATOM 1089 CG ASN A 71 7.745 6.496 -1.455 1.00 0.00 C ATOM 1090 OD1 ASN A 71 7.739 7.159 -2.491 1.00 0.00 O ATOM 1091 ND2 ASN A 71 8.467 5.392 -1.324 1.00 0.00 N ATOM 0 H ASN A 71 8.906 6.393 1.116 1.00 0.00 H new ATOM 0 HA ASN A 71 7.851 8.792 0.062 1.00 0.00 H new ATOM 0 HB2 ASN A 71 6.638 6.005 0.309 1.00 0.00 H new ATOM 0 HB3 ASN A 71 5.939 7.303 -0.640 1.00 0.00 H new ATOM 0 HD21 ASN A 71 9.044 5.065 -2.099 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.445 4.869 -0.448 1.00 0.00 H new ATOM 1098 N LYS A 72 6.761 7.975 2.957 1.00 0.00 N ATOM 1099 CA LYS A 72 5.846 8.264 4.067 1.00 0.00 C ATOM 1100 C LYS A 72 5.489 9.748 4.145 1.00 0.00 C ATOM 1101 O LYS A 72 4.378 10.104 4.532 1.00 0.00 O ATOM 1102 CB LYS A 72 6.486 7.813 5.382 1.00 0.00 C ATOM 1103 CG LYS A 72 5.645 8.069 6.620 1.00 0.00 C ATOM 1104 CD LYS A 72 4.349 7.278 6.600 1.00 0.00 C ATOM 1105 CE LYS A 72 3.499 7.577 7.823 1.00 0.00 C ATOM 1106 NZ LYS A 72 4.194 7.218 9.089 1.00 0.00 N ATOM 0 H LYS A 72 7.585 7.441 3.232 1.00 0.00 H new ATOM 0 HA LYS A 72 4.921 7.715 3.891 1.00 0.00 H new ATOM 0 HB2 LYS A 72 6.699 6.746 5.319 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.443 8.323 5.498 1.00 0.00 H new ATOM 0 HG2 LYS A 72 6.218 7.804 7.509 1.00 0.00 H new ATOM 0 HG3 LYS A 72 5.419 9.133 6.692 1.00 0.00 H new ATOM 0 HD2 LYS A 72 3.788 7.519 5.697 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.572 6.212 6.562 1.00 0.00 H new ATOM 0 HE2 LYS A 72 3.245 8.637 7.837 1.00 0.00 H new ATOM 0 HE3 LYS A 72 2.561 7.026 7.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 3.516 7.244 9.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 4.592 6.261 9.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 4.960 7.898 9.269 1.00 0.00 H new ATOM 1120 N GLU A 73 6.428 10.597 3.747 1.00 0.00 N ATOM 1121 CA GLU A 73 6.262 12.044 3.842 1.00 0.00 C ATOM 1122 C GLU A 73 4.966 12.529 3.187 1.00 0.00 C ATOM 1123 O GLU A 73 4.228 13.315 3.776 1.00 0.00 O ATOM 1124 CB GLU A 73 7.460 12.744 3.201 1.00 0.00 C ATOM 1125 CG GLU A 73 8.790 12.356 3.824 1.00 0.00 C ATOM 1126 CD GLU A 73 8.882 12.736 5.287 1.00 0.00 C ATOM 1127 OE1 GLU A 73 8.346 11.999 6.133 1.00 0.00 O ATOM 1128 OE2 GLU A 73 9.496 13.779 5.597 1.00 0.00 O ATOM 0 H GLU A 73 7.322 10.305 3.351 1.00 0.00 H new ATOM 0 HA GLU A 73 6.203 12.295 4.901 1.00 0.00 H new ATOM 0 HB2 GLU A 73 7.483 12.508 2.137 1.00 0.00 H new ATOM 0 HB3 GLU A 73 7.329 13.823 3.285 1.00 0.00 H new ATOM 0 HG2 GLU A 73 8.934 11.280 3.722 1.00 0.00 H new ATOM 0 HG3 GLU A 73 9.598 12.839 3.276 1.00 0.00 H new ATOM 1135 N ARG A 74 4.682 12.050 1.982 1.00 0.00 N ATOM 1136 CA ARG A 74 3.533 12.531 1.222 1.00 0.00 C ATOM 1137 C ARG A 74 2.215 11.972 1.752 1.00 0.00 C ATOM 1138 O ARG A 74 1.142 12.461 1.403 1.00 0.00 O ATOM 1139 CB ARG A 74 3.711 12.170 -0.250 1.00 0.00 C ATOM 1140 CG ARG A 74 3.832 10.675 -0.500 1.00 0.00 C ATOM 1141 CD ARG A 74 4.681 10.395 -1.724 1.00 0.00 C ATOM 1142 NE ARG A 74 6.049 10.893 -1.568 1.00 0.00 N ATOM 1143 CZ ARG A 74 6.817 11.282 -2.589 1.00 0.00 C ATOM 1144 NH1 ARG A 74 6.415 11.082 -3.839 1.00 0.00 N ATOM 1145 NH2 ARG A 74 7.999 11.841 -2.356 1.00 0.00 N ATOM 0 H ARG A 74 5.230 11.330 1.510 1.00 0.00 H new ATOM 0 HA ARG A 74 3.486 13.614 1.334 1.00 0.00 H new ATOM 0 HB2 ARG A 74 2.863 12.557 -0.815 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.603 12.667 -0.632 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.274 10.192 0.371 1.00 0.00 H new ATOM 0 HG3 ARG A 74 2.840 10.244 -0.635 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.705 9.321 -1.911 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.223 10.860 -2.597 1.00 0.00 H new ATOM 0 HE ARG A 74 6.437 10.946 -0.626 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.518 10.631 -4.020 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.003 11.380 -4.618 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.320 11.973 -1.397 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.585 12.138 -3.136 1.00 0.00 H new ATOM 1159 N PHE A 75 2.294 10.953 2.595 1.00 0.00 N ATOM 1160 CA PHE A 75 1.107 10.325 3.141 1.00 0.00 C ATOM 1161 C PHE A 75 0.699 10.960 4.468 1.00 0.00 C ATOM 1162 O PHE A 75 -0.278 10.539 5.091 1.00 0.00 O ATOM 1163 CB PHE A 75 1.361 8.837 3.343 1.00 0.00 C ATOM 1164 CG PHE A 75 1.858 8.140 2.112 1.00 0.00 C ATOM 1165 CD1 PHE A 75 1.165 8.226 0.919 1.00 0.00 C ATOM 1166 CD2 PHE A 75 3.018 7.391 2.153 1.00 0.00 C ATOM 1167 CE1 PHE A 75 1.624 7.581 -0.211 1.00 0.00 C ATOM 1168 CE2 PHE A 75 3.483 6.743 1.029 1.00 0.00 C ATOM 1169 CZ PHE A 75 2.785 6.837 -0.155 1.00 0.00 C ATOM 0 H PHE A 75 3.172 10.545 2.915 1.00 0.00 H new ATOM 0 HA PHE A 75 0.292 10.470 2.432 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.090 8.707 4.143 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.437 8.361 3.672 1.00 0.00 H new ATOM 0 HD1 PHE A 75 0.254 8.804 0.871 1.00 0.00 H new ATOM 0 HD2 PHE A 75 3.568 7.312 3.079 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.075 7.658 -1.138 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.393 6.163 1.076 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.146 6.330 -1.038 1.00 0.00 H new ATOM 1179 N ASP A 76 1.448 11.965 4.904 1.00 0.00 N ATOM 1180 CA ASP A 76 1.139 12.655 6.150 1.00 0.00 C ATOM 1181 C ASP A 76 -0.209 13.362 6.054 1.00 0.00 C ATOM 1182 O ASP A 76 -0.506 14.020 5.055 1.00 0.00 O ATOM 1183 CB ASP A 76 2.231 13.664 6.501 1.00 0.00 C ATOM 1184 CG ASP A 76 1.861 14.512 7.702 1.00 0.00 C ATOM 1185 OD1 ASP A 76 1.902 13.993 8.837 1.00 0.00 O ATOM 1186 OD2 ASP A 76 1.507 15.696 7.512 1.00 0.00 O ATOM 0 H ASP A 76 2.270 12.319 4.416 1.00 0.00 H new ATOM 0 HA ASP A 76 1.090 11.907 6.941 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.161 13.134 6.705 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.415 14.311 5.644 1.00 0.00 H new ATOM 1191 N GLY A 77 -1.024 13.206 7.090 1.00 0.00 N ATOM 1192 CA GLY A 77 -2.330 13.834 7.108 1.00 0.00 C ATOM 1193 C GLY A 77 -3.369 13.020 6.364 1.00 0.00 C ATOM 1194 O GLY A 77 -4.522 13.434 6.240 1.00 0.00 O ATOM 0 H GLY A 77 -0.803 12.655 7.919 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -2.650 13.972 8.141 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.260 14.826 6.661 1.00 0.00 H new ATOM 1198 N LYS A 78 -2.962 11.864 5.864 1.00 0.00 N ATOM 1199 CA LYS A 78 -3.854 10.992 5.121 1.00 0.00 C ATOM 1200 C LYS A 78 -4.196 9.760 5.949 1.00 0.00 C ATOM 1201 O LYS A 78 -3.722 9.611 7.075 1.00 0.00 O ATOM 1202 CB LYS A 78 -3.202 10.589 3.797 1.00 0.00 C ATOM 1203 CG LYS A 78 -2.925 11.773 2.881 1.00 0.00 C ATOM 1204 CD LYS A 78 -2.077 11.383 1.681 1.00 0.00 C ATOM 1205 CE LYS A 78 -2.734 10.295 0.848 1.00 0.00 C ATOM 1206 NZ LYS A 78 -4.097 10.683 0.394 1.00 0.00 N ATOM 0 H LYS A 78 -2.011 11.507 5.961 1.00 0.00 H new ATOM 0 HA LYS A 78 -4.779 11.527 4.906 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -2.266 10.071 4.003 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -3.851 9.882 3.280 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -3.870 12.192 2.535 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.417 12.555 3.445 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -1.904 12.261 1.059 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.101 11.038 2.023 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.111 10.078 -0.020 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -2.795 9.378 1.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -4.453 9.975 -0.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -4.735 10.733 1.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.057 11.613 -0.071 1.00 0.00 H new ATOM 1220 N VAL A 79 -5.008 8.877 5.389 1.00 0.00 N ATOM 1221 CA VAL A 79 -5.446 7.687 6.106 1.00 0.00 C ATOM 1222 C VAL A 79 -4.444 6.562 5.904 1.00 0.00 C ATOM 1223 O VAL A 79 -4.135 6.198 4.772 1.00 0.00 O ATOM 1224 CB VAL A 79 -6.837 7.222 5.639 1.00 0.00 C ATOM 1225 CG1 VAL A 79 -7.326 6.051 6.476 1.00 0.00 C ATOM 1226 CG2 VAL A 79 -7.829 8.371 5.695 1.00 0.00 C ATOM 0 H VAL A 79 -5.377 8.960 4.442 1.00 0.00 H new ATOM 0 HA VAL A 79 -5.510 7.944 7.163 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.755 6.887 4.605 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.311 5.740 6.127 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.628 5.219 6.381 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.390 6.353 7.521 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.807 8.024 5.361 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.904 8.737 6.719 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.489 9.177 5.045 1.00 0.00 H new ATOM 1236 N VAL A 80 -3.941 6.011 6.996 1.00 0.00 N ATOM 1237 CA VAL A 80 -2.863 5.041 6.917 1.00 0.00 C ATOM 1238 C VAL A 80 -3.261 3.695 7.521 1.00 0.00 C ATOM 1239 O VAL A 80 -3.909 3.629 8.566 1.00 0.00 O ATOM 1240 CB VAL A 80 -1.595 5.565 7.627 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -0.449 4.576 7.503 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -1.185 6.921 7.070 1.00 0.00 C ATOM 0 H VAL A 80 -4.260 6.218 7.943 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.651 4.894 5.858 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.832 5.681 8.685 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.430 4.972 8.012 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.736 3.628 7.958 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.217 4.418 6.450 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -0.290 7.270 7.585 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.978 6.829 6.004 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.993 7.636 7.222 1.00 0.00 H new ATOM 1252 N LEU A 81 -2.876 2.627 6.837 1.00 0.00 N ATOM 1253 CA LEU A 81 -3.075 1.272 7.318 1.00 0.00 C ATOM 1254 C LEU A 81 -1.736 0.536 7.262 1.00 0.00 C ATOM 1255 O LEU A 81 -1.222 0.244 6.183 1.00 0.00 O ATOM 1256 CB LEU A 81 -4.140 0.573 6.454 1.00 0.00 C ATOM 1257 CG LEU A 81 -4.735 -0.732 7.009 1.00 0.00 C ATOM 1258 CD1 LEU A 81 -3.760 -1.890 6.875 1.00 0.00 C ATOM 1259 CD2 LEU A 81 -5.147 -0.558 8.464 1.00 0.00 C ATOM 0 H LEU A 81 -2.415 2.679 5.929 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.431 1.274 8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.957 1.275 6.288 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.700 0.359 5.480 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.620 -0.967 6.417 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.214 -2.796 7.277 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.518 -2.042 5.823 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.849 -1.664 7.428 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.566 -1.492 8.838 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.275 -0.287 9.059 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.896 0.230 8.538 1.00 0.00 H new ATOM 1271 N GLU A 82 -1.165 0.263 8.427 1.00 0.00 N ATOM 1272 CA GLU A 82 0.170 -0.319 8.510 1.00 0.00 C ATOM 1273 C GLU A 82 0.094 -1.790 8.914 1.00 0.00 C ATOM 1274 O GLU A 82 -0.506 -2.125 9.937 1.00 0.00 O ATOM 1275 CB GLU A 82 1.004 0.471 9.526 1.00 0.00 C ATOM 1276 CG GLU A 82 2.491 0.155 9.506 1.00 0.00 C ATOM 1277 CD GLU A 82 3.271 1.004 10.493 1.00 0.00 C ATOM 1278 OE1 GLU A 82 3.191 2.247 10.410 1.00 0.00 O ATOM 1279 OE2 GLU A 82 3.956 0.436 11.369 1.00 0.00 O ATOM 0 H GLU A 82 -1.606 0.435 9.331 1.00 0.00 H new ATOM 0 HA GLU A 82 0.644 -0.264 7.530 1.00 0.00 H new ATOM 0 HB2 GLU A 82 0.870 1.536 9.337 1.00 0.00 H new ATOM 0 HB3 GLU A 82 0.617 0.273 10.526 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.640 -0.899 9.739 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.882 0.317 8.501 1.00 0.00 H new ATOM 1286 N VAL A 83 0.697 -2.660 8.111 1.00 0.00 N ATOM 1287 CA VAL A 83 0.709 -4.096 8.390 1.00 0.00 C ATOM 1288 C VAL A 83 2.074 -4.703 8.065 1.00 0.00 C ATOM 1289 O VAL A 83 2.874 -4.099 7.348 1.00 0.00 O ATOM 1290 CB VAL A 83 -0.376 -4.854 7.584 1.00 0.00 C ATOM 1291 CG1 VAL A 83 -1.768 -4.525 8.097 1.00 0.00 C ATOM 1292 CG2 VAL A 83 -0.268 -4.543 6.097 1.00 0.00 C ATOM 0 H VAL A 83 1.187 -2.396 7.256 1.00 0.00 H new ATOM 0 HA VAL A 83 0.497 -4.206 9.453 1.00 0.00 H new ATOM 0 HB VAL A 83 -0.206 -5.922 7.723 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -2.509 -5.071 7.513 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.847 -4.814 9.145 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.947 -3.454 8.001 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.041 -5.088 5.554 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.399 -3.473 5.939 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.713 -4.846 5.732 1.00 0.00 H new ATOM 1302 N PRO A 84 2.366 -5.900 8.604 1.00 0.00 N ATOM 1303 CA PRO A 84 3.592 -6.635 8.274 1.00 0.00 C ATOM 1304 C PRO A 84 3.652 -6.975 6.788 1.00 0.00 C ATOM 1305 O PRO A 84 2.622 -7.243 6.166 1.00 0.00 O ATOM 1306 CB PRO A 84 3.488 -7.915 9.110 1.00 0.00 C ATOM 1307 CG PRO A 84 2.511 -7.596 10.189 1.00 0.00 C ATOM 1308 CD PRO A 84 1.541 -6.623 9.586 1.00 0.00 C ATOM 0 HA PRO A 84 4.491 -6.056 8.486 1.00 0.00 H new ATOM 0 HB2 PRO A 84 3.146 -8.755 8.505 1.00 0.00 H new ATOM 0 HB3 PRO A 84 4.456 -8.194 9.525 1.00 0.00 H new ATOM 0 HG2 PRO A 84 2.000 -8.495 10.533 1.00 0.00 H new ATOM 0 HG3 PRO A 84 3.012 -7.163 11.055 1.00 0.00 H new ATOM 0 HD2 PRO A 84 0.701 -7.131 9.112 1.00 0.00 H new ATOM 0 HD3 PRO A 84 1.124 -5.951 10.336 1.00 0.00 H new ATOM 1316 N VAL A 85 4.853 -6.979 6.228 1.00 0.00 N ATOM 1317 CA VAL A 85 5.038 -7.203 4.797 1.00 0.00 C ATOM 1318 C VAL A 85 4.589 -8.614 4.388 1.00 0.00 C ATOM 1319 O VAL A 85 4.267 -8.869 3.228 1.00 0.00 O ATOM 1320 CB VAL A 85 6.515 -6.967 4.388 1.00 0.00 C ATOM 1321 CG1 VAL A 85 7.438 -7.995 5.026 1.00 0.00 C ATOM 1322 CG2 VAL A 85 6.671 -6.964 2.874 1.00 0.00 C ATOM 0 H VAL A 85 5.720 -6.829 6.744 1.00 0.00 H new ATOM 0 HA VAL A 85 4.412 -6.484 4.269 1.00 0.00 H new ATOM 0 HB VAL A 85 6.805 -5.984 4.759 1.00 0.00 H new ATOM 0 HG11 VAL A 85 8.466 -7.801 4.719 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.364 -7.926 6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.146 -8.995 4.705 1.00 0.00 H new ATOM 0 HG21 VAL A 85 7.717 -6.796 2.616 1.00 0.00 H new ATOM 0 HG22 VAL A 85 6.348 -7.925 2.473 1.00 0.00 H new ATOM 0 HG23 VAL A 85 6.060 -6.169 2.447 1.00 0.00 H new ATOM 1332 N SER A 86 4.575 -9.526 5.350 1.00 0.00 N ATOM 1333 CA SER A 86 4.152 -10.900 5.112 1.00 0.00 C ATOM 1334 C SER A 86 2.631 -11.030 4.973 1.00 0.00 C ATOM 1335 O SER A 86 2.137 -11.954 4.326 1.00 0.00 O ATOM 1336 CB SER A 86 4.669 -11.774 6.253 1.00 0.00 C ATOM 1337 OG SER A 86 4.693 -11.042 7.472 1.00 0.00 O ATOM 0 H SER A 86 4.855 -9.337 6.312 1.00 0.00 H new ATOM 0 HA SER A 86 4.573 -11.231 4.163 1.00 0.00 H new ATOM 0 HB2 SER A 86 4.033 -12.653 6.362 1.00 0.00 H new ATOM 0 HB3 SER A 86 5.671 -12.133 6.018 1.00 0.00 H new ATOM 0 HG SER A 86 5.025 -11.617 8.193 1.00 0.00 H new ATOM 1343 N ALA A 87 1.898 -10.090 5.558 1.00 0.00 N ATOM 1344 CA ALA A 87 0.438 -10.179 5.638 1.00 0.00 C ATOM 1345 C ALA A 87 -0.255 -10.131 4.263 1.00 0.00 C ATOM 1346 O ALA A 87 -1.051 -11.020 3.948 1.00 0.00 O ATOM 1347 CB ALA A 87 -0.117 -9.092 6.554 1.00 0.00 C ATOM 0 H ALA A 87 2.290 -9.252 5.987 1.00 0.00 H new ATOM 0 HA ALA A 87 0.215 -11.159 6.061 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -1.203 -9.175 6.600 1.00 0.00 H new ATOM 0 HB2 ALA A 87 0.299 -9.212 7.554 1.00 0.00 H new ATOM 0 HB3 ALA A 87 0.156 -8.112 6.162 1.00 0.00 H new ATOM 1353 N PRO A 88 0.026 -9.113 3.411 1.00 0.00 N ATOM 1354 CA PRO A 88 -0.708 -8.919 2.151 1.00 0.00 C ATOM 1355 C PRO A 88 -0.378 -9.962 1.085 1.00 0.00 C ATOM 1356 O PRO A 88 -0.888 -9.896 -0.031 1.00 0.00 O ATOM 1357 CB PRO A 88 -0.261 -7.531 1.692 1.00 0.00 C ATOM 1358 CG PRO A 88 1.102 -7.382 2.259 1.00 0.00 C ATOM 1359 CD PRO A 88 1.062 -8.074 3.591 1.00 0.00 C ATOM 0 HA PRO A 88 -1.783 -9.018 2.302 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -0.251 -7.455 0.605 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -0.932 -6.755 2.059 1.00 0.00 H new ATOM 0 HG2 PRO A 88 1.850 -7.832 1.606 1.00 0.00 H new ATOM 0 HG3 PRO A 88 1.367 -6.331 2.371 1.00 0.00 H new ATOM 0 HD2 PRO A 88 2.028 -8.511 3.845 1.00 0.00 H new ATOM 0 HD3 PRO A 88 0.803 -7.384 4.394 1.00 0.00 H new ATOM 1367 N ILE A 89 0.478 -10.916 1.419 1.00 0.00 N ATOM 1368 CA ILE A 89 0.792 -11.995 0.496 1.00 0.00 C ATOM 1369 C ILE A 89 -0.389 -12.960 0.408 1.00 0.00 C ATOM 1370 O ILE A 89 -0.788 -13.385 -0.681 1.00 0.00 O ATOM 1371 CB ILE A 89 2.078 -12.745 0.914 1.00 0.00 C ATOM 1372 CG1 ILE A 89 3.290 -11.821 0.769 1.00 0.00 C ATOM 1373 CG2 ILE A 89 2.264 -14.010 0.082 1.00 0.00 C ATOM 1374 CD1 ILE A 89 4.597 -12.462 1.191 1.00 0.00 C ATOM 0 H ILE A 89 0.964 -10.965 2.315 1.00 0.00 H new ATOM 0 HA ILE A 89 0.974 -11.560 -0.487 1.00 0.00 H new ATOM 0 HB ILE A 89 1.984 -13.042 1.958 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.371 -11.502 -0.270 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.126 -10.924 1.366 1.00 0.00 H new ATOM 0 HG21 ILE A 89 3.175 -14.520 0.394 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.410 -14.671 0.229 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.340 -13.744 -0.972 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.411 -11.749 1.061 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.536 -12.756 2.239 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.785 -13.343 0.577 1.00 0.00 H new ATOM 1386 N LYS A 90 -0.957 -13.291 1.558 1.00 0.00 N ATOM 1387 CA LYS A 90 -2.152 -14.117 1.599 1.00 0.00 C ATOM 1388 C LYS A 90 -3.400 -13.250 1.720 1.00 0.00 C ATOM 1389 O LYS A 90 -4.316 -13.337 0.902 1.00 0.00 O ATOM 1390 CB LYS A 90 -2.098 -15.100 2.770 1.00 0.00 C ATOM 1391 CG LYS A 90 -3.294 -16.037 2.810 1.00 0.00 C ATOM 1392 CD LYS A 90 -3.370 -16.806 4.117 1.00 0.00 C ATOM 1393 CE LYS A 90 -4.617 -17.672 4.165 1.00 0.00 C ATOM 1394 NZ LYS A 90 -4.845 -18.254 5.513 1.00 0.00 N ATOM 0 H LYS A 90 -0.610 -13.001 2.472 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.196 -14.681 0.667 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.183 -15.689 2.702 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.049 -14.542 3.705 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -4.210 -15.462 2.674 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.232 -16.740 1.979 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.484 -17.431 4.228 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.375 -16.108 4.954 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.483 -17.075 3.878 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.527 -18.476 3.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.706 -18.837 5.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.031 -18.845 5.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.957 -17.488 6.207 1.00 0.00 H new ATOM 1408 N ASP A 91 -3.407 -12.385 2.727 1.00 0.00 N ATOM 1409 CA ASP A 91 -4.601 -11.631 3.095 1.00 0.00 C ATOM 1410 C ASP A 91 -4.623 -10.257 2.439 1.00 0.00 C ATOM 1411 O ASP A 91 -5.000 -9.275 3.069 1.00 0.00 O ATOM 1412 CB ASP A 91 -4.685 -11.473 4.616 1.00 0.00 C ATOM 1413 CG ASP A 91 -5.055 -12.761 5.323 1.00 0.00 C ATOM 1414 OD1 ASP A 91 -6.227 -13.190 5.214 1.00 0.00 O ATOM 1415 OD2 ASP A 91 -4.179 -13.353 5.993 1.00 0.00 O ATOM 0 H ASP A 91 -2.592 -12.187 3.308 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.463 -12.194 2.738 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.725 -11.120 4.993 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.423 -10.708 4.857 1.00 0.00 H new ATOM 1420 N ALA A 92 -4.258 -10.195 1.165 1.00 0.00 N ATOM 1421 CA ALA A 92 -4.133 -8.921 0.461 1.00 0.00 C ATOM 1422 C ALA A 92 -5.448 -8.164 0.483 1.00 0.00 C ATOM 1423 O ALA A 92 -5.497 -6.978 0.805 1.00 0.00 O ATOM 1424 CB ALA A 92 -3.691 -9.153 -0.973 1.00 0.00 C ATOM 0 H ALA A 92 -4.042 -11.013 0.595 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.379 -8.321 0.972 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -3.602 -8.195 -1.486 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.726 -9.659 -0.979 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.428 -9.772 -1.485 1.00 0.00 H new ATOM 1430 N GLU A 93 -6.516 -8.872 0.161 1.00 0.00 N ATOM 1431 CA GLU A 93 -7.841 -8.287 0.129 1.00 0.00 C ATOM 1432 C GLU A 93 -8.336 -7.976 1.539 1.00 0.00 C ATOM 1433 O GLU A 93 -9.143 -7.068 1.741 1.00 0.00 O ATOM 1434 CB GLU A 93 -8.797 -9.234 -0.583 1.00 0.00 C ATOM 1435 CG GLU A 93 -8.784 -10.652 -0.043 1.00 0.00 C ATOM 1436 CD GLU A 93 -9.721 -11.561 -0.802 1.00 0.00 C ATOM 1437 OE1 GLU A 93 -10.947 -11.376 -0.694 1.00 0.00 O ATOM 1438 OE2 GLU A 93 -9.236 -12.461 -1.515 1.00 0.00 O ATOM 0 H GLU A 93 -6.488 -9.862 -0.084 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.798 -7.346 -0.419 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -9.809 -8.837 -0.506 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -8.544 -9.258 -1.643 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.771 -11.050 -0.098 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.066 -10.640 1.010 1.00 0.00 H new ATOM 1445 N LYS A 94 -7.828 -8.723 2.511 1.00 0.00 N ATOM 1446 CA LYS A 94 -8.190 -8.523 3.908 1.00 0.00 C ATOM 1447 C LYS A 94 -7.548 -7.237 4.420 1.00 0.00 C ATOM 1448 O LYS A 94 -8.136 -6.503 5.213 1.00 0.00 O ATOM 1449 CB LYS A 94 -7.737 -9.729 4.741 1.00 0.00 C ATOM 1450 CG LYS A 94 -8.173 -9.692 6.198 1.00 0.00 C ATOM 1451 CD LYS A 94 -9.686 -9.630 6.328 1.00 0.00 C ATOM 1452 CE LYS A 94 -10.138 -9.865 7.761 1.00 0.00 C ATOM 1453 NZ LYS A 94 -9.502 -8.922 8.720 1.00 0.00 N ATOM 0 H LYS A 94 -7.160 -9.478 2.356 1.00 0.00 H new ATOM 0 HA LYS A 94 -9.272 -8.433 3.998 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -8.126 -10.638 4.282 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -6.650 -9.793 4.702 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -7.799 -10.577 6.713 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -7.729 -8.826 6.689 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.041 -8.656 5.990 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -10.138 -10.378 5.677 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -11.222 -9.761 7.819 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -9.900 -10.889 8.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.929 -9.043 9.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -8.482 -9.118 8.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -9.650 -7.945 8.396 1.00 0.00 H new ATOM 1467 N VAL A 95 -6.340 -6.974 3.939 1.00 0.00 N ATOM 1468 CA VAL A 95 -5.628 -5.741 4.253 1.00 0.00 C ATOM 1469 C VAL A 95 -6.373 -4.536 3.682 1.00 0.00 C ATOM 1470 O VAL A 95 -6.496 -3.496 4.332 1.00 0.00 O ATOM 1471 CB VAL A 95 -4.190 -5.784 3.685 1.00 0.00 C ATOM 1472 CG1 VAL A 95 -3.450 -4.482 3.938 1.00 0.00 C ATOM 1473 CG2 VAL A 95 -3.418 -6.954 4.273 1.00 0.00 C ATOM 0 H VAL A 95 -5.828 -7.605 3.323 1.00 0.00 H new ATOM 0 HA VAL A 95 -5.575 -5.645 5.338 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.267 -5.919 2.606 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.443 -4.549 3.525 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -3.984 -3.661 3.460 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.391 -4.300 5.011 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.409 -6.968 3.861 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.367 -6.848 5.357 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -3.924 -7.886 4.023 1.00 0.00 H new ATOM 1483 N ILE A 96 -6.888 -4.698 2.469 1.00 0.00 N ATOM 1484 CA ILE A 96 -7.653 -3.647 1.810 1.00 0.00 C ATOM 1485 C ILE A 96 -8.932 -3.335 2.580 1.00 0.00 C ATOM 1486 O ILE A 96 -9.269 -2.171 2.793 1.00 0.00 O ATOM 1487 CB ILE A 96 -7.999 -4.042 0.361 1.00 0.00 C ATOM 1488 CG1 ILE A 96 -6.713 -4.238 -0.443 1.00 0.00 C ATOM 1489 CG2 ILE A 96 -8.889 -2.992 -0.292 1.00 0.00 C ATOM 1490 CD1 ILE A 96 -6.947 -4.700 -1.861 1.00 0.00 C ATOM 0 H ILE A 96 -6.789 -5.552 1.920 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.030 -2.753 1.790 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.552 -4.981 0.377 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -6.161 -3.298 -0.463 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.083 -4.967 0.068 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.119 -3.294 -1.314 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -9.815 -2.896 0.275 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.371 -2.033 -0.305 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.989 -4.817 -2.368 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.471 -5.656 -1.850 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.550 -3.961 -2.389 1.00 0.00 H new ATOM 1502 N ASN A 97 -9.633 -4.379 3.012 1.00 0.00 N ATOM 1503 CA ASN A 97 -10.854 -4.205 3.798 1.00 0.00 C ATOM 1504 C ASN A 97 -10.556 -3.482 5.105 1.00 0.00 C ATOM 1505 O ASN A 97 -11.375 -2.706 5.595 1.00 0.00 O ATOM 1506 CB ASN A 97 -11.528 -5.551 4.088 1.00 0.00 C ATOM 1507 CG ASN A 97 -12.426 -6.021 2.958 1.00 0.00 C ATOM 1508 OD1 ASN A 97 -13.608 -5.679 2.908 1.00 0.00 O ATOM 1509 ND2 ASN A 97 -11.883 -6.811 2.043 1.00 0.00 N ATOM 0 H ASN A 97 -9.380 -5.351 2.833 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.540 -3.599 3.206 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -10.761 -6.303 4.272 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.117 -5.467 5.001 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -12.448 -7.155 1.267 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -10.900 -7.075 2.115 1.00 0.00 H new ATOM 1516 N ALA A 98 -9.373 -3.727 5.657 1.00 0.00 N ATOM 1517 CA ALA A 98 -8.940 -3.049 6.869 1.00 0.00 C ATOM 1518 C ALA A 98 -8.754 -1.558 6.610 1.00 0.00 C ATOM 1519 O ALA A 98 -9.131 -0.726 7.430 1.00 0.00 O ATOM 1520 CB ALA A 98 -7.652 -3.666 7.393 1.00 0.00 C ATOM 0 H ALA A 98 -8.697 -4.392 5.282 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.713 -3.171 7.628 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -7.342 -3.147 8.300 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.818 -4.720 7.617 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.871 -3.574 6.638 1.00 0.00 H new ATOM 1526 N ALA A 99 -8.190 -1.227 5.454 1.00 0.00 N ATOM 1527 CA ALA A 99 -8.007 0.167 5.067 1.00 0.00 C ATOM 1528 C ALA A 99 -9.356 0.853 4.894 1.00 0.00 C ATOM 1529 O ALA A 99 -9.552 1.985 5.336 1.00 0.00 O ATOM 1530 CB ALA A 99 -7.195 0.260 3.786 1.00 0.00 C ATOM 0 H ALA A 99 -7.852 -1.903 4.769 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.460 0.677 5.860 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.068 1.307 3.511 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.217 -0.196 3.941 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.717 -0.264 2.986 1.00 0.00 H new ATOM 1536 N LEU A 100 -10.286 0.155 4.253 1.00 0.00 N ATOM 1537 CA LEU A 100 -11.646 0.649 4.091 1.00 0.00 C ATOM 1538 C LEU A 100 -12.318 0.838 5.446 1.00 0.00 C ATOM 1539 O LEU A 100 -13.146 1.729 5.620 1.00 0.00 O ATOM 1540 CB LEU A 100 -12.460 -0.322 3.234 1.00 0.00 C ATOM 1541 CG LEU A 100 -12.405 -0.086 1.720 1.00 0.00 C ATOM 1542 CD1 LEU A 100 -13.137 1.194 1.355 1.00 0.00 C ATOM 1543 CD2 LEU A 100 -10.970 -0.036 1.215 1.00 0.00 C ATOM 0 H LEU A 100 -10.120 -0.761 3.835 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.602 1.616 3.590 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.112 -1.335 3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -13.501 -0.272 3.552 1.00 0.00 H new ATOM 0 HG LEU A 100 -12.901 -0.927 1.236 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -13.088 1.346 0.277 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -14.180 1.118 1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -12.669 2.038 1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.969 0.133 0.138 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -10.438 0.777 1.710 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.474 -0.981 1.435 1.00 0.00 H new ATOM 1555 N ALA A 101 -11.945 0.004 6.407 1.00 0.00 N ATOM 1556 CA ALA A 101 -12.497 0.082 7.753 1.00 0.00 C ATOM 1557 C ALA A 101 -12.037 1.349 8.473 1.00 0.00 C ATOM 1558 O ALA A 101 -12.632 1.759 9.468 1.00 0.00 O ATOM 1559 CB ALA A 101 -12.114 -1.153 8.554 1.00 0.00 C ATOM 0 H ALA A 101 -11.258 -0.739 6.278 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.583 0.124 7.667 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -12.533 -1.080 9.557 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -12.505 -2.043 8.061 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.028 -1.222 8.619 1.00 0.00 H new ATOM 1565 N LEU A 102 -10.978 1.968 7.967 1.00 0.00 N ATOM 1566 CA LEU A 102 -10.448 3.190 8.563 1.00 0.00 C ATOM 1567 C LEU A 102 -11.163 4.430 8.031 1.00 0.00 C ATOM 1568 O LEU A 102 -11.055 5.510 8.612 1.00 0.00 O ATOM 1569 CB LEU A 102 -8.943 3.306 8.301 1.00 0.00 C ATOM 1570 CG LEU A 102 -8.030 2.781 9.416 1.00 0.00 C ATOM 1571 CD1 LEU A 102 -8.229 3.591 10.686 1.00 0.00 C ATOM 1572 CD2 LEU A 102 -8.282 1.304 9.681 1.00 0.00 C ATOM 0 H LEU A 102 -10.468 1.645 7.145 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.623 3.132 9.637 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.710 2.767 7.383 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.704 4.355 8.125 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.996 2.891 9.088 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -7.575 3.207 11.469 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -7.989 4.636 10.492 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -9.267 3.511 11.009 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.621 0.959 10.476 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -9.319 1.160 9.984 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -8.087 0.733 8.773 1.00 0.00 H new ATOM 1584 N ILE A 103 -11.892 4.279 6.929 1.00 0.00 N ATOM 1585 CA ILE A 103 -12.588 5.414 6.323 1.00 0.00 C ATOM 1586 C ILE A 103 -14.099 5.204 6.271 1.00 0.00 C ATOM 1587 O ILE A 103 -14.857 6.162 6.110 1.00 0.00 O ATOM 1588 CB ILE A 103 -12.081 5.705 4.893 1.00 0.00 C ATOM 1589 CG1 ILE A 103 -12.188 4.456 4.012 1.00 0.00 C ATOM 1590 CG2 ILE A 103 -10.652 6.217 4.932 1.00 0.00 C ATOM 1591 CD1 ILE A 103 -11.792 4.694 2.570 1.00 0.00 C ATOM 0 H ILE A 103 -12.017 3.392 6.440 1.00 0.00 H new ATOM 0 HA ILE A 103 -12.369 6.267 6.965 1.00 0.00 H new ATOM 0 HB ILE A 103 -12.712 6.479 4.456 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -11.555 3.673 4.429 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -13.213 4.087 4.042 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -10.309 6.417 3.917 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -10.611 7.136 5.517 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -10.009 5.466 5.390 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -11.893 3.766 2.007 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -12.441 5.454 2.135 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -10.757 5.033 2.528 1.00 0.00 H new ATOM 1603 N ASP A 104 -14.536 3.959 6.405 1.00 0.00 N ATOM 1604 CA ASP A 104 -15.954 3.635 6.284 1.00 0.00 C ATOM 1605 C ASP A 104 -16.312 2.431 7.149 1.00 0.00 C ATOM 1606 O ASP A 104 -17.148 2.534 8.044 1.00 0.00 O ATOM 1607 CB ASP A 104 -16.296 3.348 4.821 1.00 0.00 C ATOM 1608 CG ASP A 104 -17.786 3.249 4.573 1.00 0.00 C ATOM 1609 OD1 ASP A 104 -18.370 2.187 4.852 1.00 0.00 O ATOM 1610 OD2 ASP A 104 -18.374 4.237 4.078 1.00 0.00 O ATOM 0 H ASP A 104 -13.933 3.159 6.597 1.00 0.00 H new ATOM 0 HA ASP A 104 -16.535 4.490 6.631 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -15.880 4.137 4.194 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -15.820 2.416 4.518 1.00 0.00 H new ATOM 1615 N GLU A 105 -15.653 1.306 6.869 1.00 0.00 N ATOM 1616 CA GLU A 105 -15.860 0.042 7.587 1.00 0.00 C ATOM 1617 C GLU A 105 -17.215 -0.582 7.268 1.00 0.00 C ATOM 1618 O GLU A 105 -18.230 -0.239 7.876 1.00 0.00 O ATOM 1619 CB GLU A 105 -15.703 0.218 9.103 1.00 0.00 C ATOM 1620 CG GLU A 105 -15.872 -1.080 9.881 1.00 0.00 C ATOM 1621 CD GLU A 105 -15.743 -0.898 11.378 1.00 0.00 C ATOM 1622 OE1 GLU A 105 -16.726 -0.467 12.022 1.00 0.00 O ATOM 1623 OE2 GLU A 105 -14.664 -1.199 11.926 1.00 0.00 O ATOM 0 H GLU A 105 -14.953 1.243 6.130 1.00 0.00 H new ATOM 0 HA GLU A 105 -15.084 -0.639 7.238 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -14.718 0.634 9.313 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -16.437 0.943 9.455 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -16.850 -1.506 9.656 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -15.125 -1.799 9.543 1.00 0.00 H new ATOM 1630 N LYS A 106 -17.204 -1.501 6.300 1.00 0.00 N ATOM 1631 CA LYS A 106 -18.374 -2.303 5.946 1.00 0.00 C ATOM 1632 C LYS A 106 -19.501 -1.433 5.394 1.00 0.00 C ATOM 1633 O LYS A 106 -19.525 -1.204 4.165 1.00 0.00 O ATOM 1634 CB LYS A 106 -18.862 -3.113 7.153 1.00 0.00 C ATOM 1635 CG LYS A 106 -17.824 -4.086 7.689 1.00 0.00 C ATOM 1636 CD LYS A 106 -18.346 -4.855 8.893 1.00 0.00 C ATOM 1637 CE LYS A 106 -17.296 -5.812 9.435 1.00 0.00 C ATOM 1638 NZ LYS A 106 -17.813 -6.636 10.561 1.00 0.00 N ATOM 1639 OXT LYS A 106 -20.368 -1.000 6.181 1.00 0.00 O ATOM 0 H LYS A 106 -16.379 -1.710 5.738 1.00 0.00 H new ATOM 0 HA LYS A 106 -18.073 -2.997 5.161 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -19.150 -2.426 7.949 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -19.757 -3.668 6.871 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -17.542 -4.787 6.903 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -16.923 -3.540 7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -18.641 -4.155 9.675 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -19.239 -5.413 8.612 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -16.956 -6.468 8.633 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -16.428 -5.244 9.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -17.063 -7.273 10.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -18.113 -6.013 11.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -18.625 -7.199 10.235 1.00 0.00 H new TER 1653 LYS A 106