USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 632 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 151:sc= -0.0471 (180deg=-0.759) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.106 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= -0.0652 (180deg=-0.0652) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.211 K(o=-0.21,f=-1.4!) USER MOD Single : A 23 LYS NZ :NH3+ -158:sc= -0.0411 (180deg=-0.278) USER MOD Single : A 24 SER OG : rot 180:sc= -0.0365 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.0648 K(o=-0.065,f=-1.6!) USER MOD Single : A 30 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0625) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.561 K(o=-0.56,f=-2.7!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 HIS : no HE2:sc= 0.371 K(o=0.37,f=-2.1!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0.08) USER MOD Single : A 70 GLN : amide:sc=-9.59e-05 X(o=-9.6e-05,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0.1 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 166:sc=-0.00505 (180deg=-0.0936) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.0532 X(o=-0.053,f=-0.23) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 54.329 -12.625 74.862 1.00 0.00 N ATOM 2 CA MET A 1 53.710 -11.519 75.585 1.00 0.00 C ATOM 3 C MET A 1 54.634 -11.003 76.684 1.00 0.00 C ATOM 4 O MET A 1 54.449 -11.317 77.861 1.00 0.00 O ATOM 5 CB MET A 1 52.376 -11.958 76.188 1.00 0.00 C ATOM 6 CG MET A 1 51.184 -11.702 75.280 1.00 0.00 C ATOM 7 SD MET A 1 49.875 -12.923 75.492 1.00 0.00 S ATOM 8 CE MET A 1 48.424 -11.873 75.453 1.00 0.00 C ATOM 0 H1 MET A 1 53.682 -12.960 74.119 1.00 0.00 H new ATOM 0 H2 MET A 1 55.217 -12.302 74.428 1.00 0.00 H new ATOM 0 H3 MET A 1 54.529 -13.403 75.523 1.00 0.00 H new ATOM 0 HA MET A 1 53.530 -10.710 74.877 1.00 0.00 H new ATOM 0 HB2 MET A 1 52.424 -13.022 76.419 1.00 0.00 H new ATOM 0 HB3 MET A 1 52.223 -11.433 77.131 1.00 0.00 H new ATOM 0 HG2 MET A 1 50.785 -10.708 75.482 1.00 0.00 H new ATOM 0 HG3 MET A 1 51.515 -11.707 74.242 1.00 0.00 H new ATOM 0 HE1 MET A 1 47.577 -12.437 75.062 1.00 0.00 H new ATOM 0 HE2 MET A 1 48.197 -11.529 76.462 1.00 0.00 H new ATOM 0 HE3 MET A 1 48.614 -11.013 74.811 1.00 0.00 H new ATOM 16 N SER A 2 55.630 -10.214 76.293 1.00 0.00 N ATOM 17 CA SER A 2 56.585 -9.660 77.246 1.00 0.00 C ATOM 18 C SER A 2 56.926 -8.215 76.895 1.00 0.00 C ATOM 19 O SER A 2 56.575 -7.288 77.625 1.00 0.00 O ATOM 20 CB SER A 2 57.860 -10.505 77.273 1.00 0.00 C ATOM 21 OG SER A 2 58.388 -10.672 75.969 1.00 0.00 O ATOM 0 H SER A 2 55.797 -9.944 75.324 1.00 0.00 H new ATOM 0 HA SER A 2 56.126 -9.677 78.234 1.00 0.00 H new ATOM 0 HB2 SER A 2 58.603 -10.027 77.911 1.00 0.00 H new ATOM 0 HB3 SER A 2 57.645 -11.480 77.709 1.00 0.00 H new ATOM 0 HG SER A 2 59.203 -11.214 76.013 1.00 0.00 H new ATOM 26 N ASP A 3 57.612 -8.032 75.772 1.00 0.00 N ATOM 27 CA ASP A 3 58.001 -6.700 75.321 1.00 0.00 C ATOM 28 C ASP A 3 58.262 -6.689 73.818 1.00 0.00 C ATOM 29 O ASP A 3 59.361 -7.010 73.368 1.00 0.00 O ATOM 30 CB ASP A 3 59.247 -6.228 76.072 1.00 0.00 C ATOM 31 CG ASP A 3 58.923 -5.686 77.450 1.00 0.00 C ATOM 32 OD1 ASP A 3 58.669 -4.469 77.563 1.00 0.00 O ATOM 33 OD2 ASP A 3 58.924 -6.479 78.416 1.00 0.00 O ATOM 0 H ASP A 3 57.910 -8.789 75.157 1.00 0.00 H new ATOM 0 HA ASP A 3 57.178 -6.017 75.533 1.00 0.00 H new ATOM 0 HB2 ASP A 3 59.947 -7.058 76.167 1.00 0.00 H new ATOM 0 HB3 ASP A 3 59.747 -5.455 75.489 1.00 0.00 H new ATOM 37 N ALA A 4 57.244 -6.322 73.048 1.00 0.00 N ATOM 38 CA ALA A 4 57.363 -6.269 71.598 1.00 0.00 C ATOM 39 C ALA A 4 56.074 -5.761 70.958 1.00 0.00 C ATOM 40 O ALA A 4 55.078 -5.536 71.643 1.00 0.00 O ATOM 41 CB ALA A 4 57.722 -7.641 71.047 1.00 0.00 C ATOM 0 H ALA A 4 56.326 -6.057 73.405 1.00 0.00 H new ATOM 0 HA ALA A 4 58.161 -5.569 71.350 1.00 0.00 H new ATOM 0 HB1 ALA A 4 57.808 -7.586 69.962 1.00 0.00 H new ATOM 0 HB2 ALA A 4 58.673 -7.966 71.470 1.00 0.00 H new ATOM 0 HB3 ALA A 4 56.943 -8.355 71.314 1.00 0.00 H new ATOM 47 N GLY A 5 56.104 -5.582 69.640 1.00 0.00 N ATOM 48 CA GLY A 5 54.933 -5.102 68.932 1.00 0.00 C ATOM 49 C GLY A 5 54.281 -6.180 68.088 1.00 0.00 C ATOM 50 O GLY A 5 54.864 -6.645 67.108 1.00 0.00 O ATOM 0 H GLY A 5 56.918 -5.761 69.052 1.00 0.00 H new ATOM 0 HA2 GLY A 5 54.208 -4.721 69.652 1.00 0.00 H new ATOM 0 HA3 GLY A 5 55.217 -4.266 68.292 1.00 0.00 H new ATOM 54 N ARG A 6 53.072 -6.578 68.470 1.00 0.00 N ATOM 55 CA ARG A 6 52.344 -7.611 67.743 1.00 0.00 C ATOM 56 C ARG A 6 50.929 -7.147 67.411 1.00 0.00 C ATOM 57 O ARG A 6 50.101 -7.928 66.944 1.00 0.00 O ATOM 58 CB ARG A 6 52.291 -8.901 68.564 1.00 0.00 C ATOM 59 CG ARG A 6 53.567 -9.723 68.492 1.00 0.00 C ATOM 60 CD ARG A 6 53.294 -11.199 68.732 1.00 0.00 C ATOM 61 NE ARG A 6 52.393 -11.760 67.729 1.00 0.00 N ATOM 62 CZ ARG A 6 51.750 -12.913 67.880 1.00 0.00 C ATOM 63 NH1 ARG A 6 51.906 -13.622 68.989 1.00 0.00 N ATOM 64 NH2 ARG A 6 50.949 -13.357 66.920 1.00 0.00 N ATOM 0 H ARG A 6 52.576 -6.201 69.278 1.00 0.00 H new ATOM 0 HA ARG A 6 52.872 -7.805 66.809 1.00 0.00 H new ATOM 0 HB2 ARG A 6 52.089 -8.651 69.605 1.00 0.00 H new ATOM 0 HB3 ARG A 6 51.457 -9.510 68.215 1.00 0.00 H new ATOM 0 HG2 ARG A 6 54.031 -9.592 67.514 1.00 0.00 H new ATOM 0 HG3 ARG A 6 54.278 -9.358 69.233 1.00 0.00 H new ATOM 0 HD2 ARG A 6 54.236 -11.748 68.721 1.00 0.00 H new ATOM 0 HD3 ARG A 6 52.860 -11.331 69.723 1.00 0.00 H new ATOM 0 HE ARG A 6 52.249 -11.238 66.865 1.00 0.00 H new ATOM 0 HH11 ARG A 6 52.521 -13.283 69.729 1.00 0.00 H new ATOM 0 HH12 ARG A 6 51.411 -14.507 69.103 1.00 0.00 H new ATOM 0 HH21 ARG A 6 50.827 -12.813 66.066 1.00 0.00 H new ATOM 0 HH22 ARG A 6 50.456 -14.242 67.036 1.00 0.00 H new ATOM 75 N LYS A 7 50.659 -5.869 67.655 1.00 0.00 N ATOM 76 CA LYS A 7 49.345 -5.299 67.383 1.00 0.00 C ATOM 77 C LYS A 7 48.275 -5.963 68.243 1.00 0.00 C ATOM 78 O LYS A 7 48.504 -7.018 68.834 1.00 0.00 O ATOM 79 CB LYS A 7 48.996 -5.458 65.902 1.00 0.00 C ATOM 80 CG LYS A 7 49.158 -4.179 65.098 1.00 0.00 C ATOM 81 CD LYS A 7 50.238 -4.320 64.038 1.00 0.00 C ATOM 82 CE LYS A 7 51.622 -4.420 64.664 1.00 0.00 C ATOM 83 NZ LYS A 7 52.392 -5.575 64.123 1.00 0.00 N ATOM 0 H LYS A 7 51.333 -5.208 68.041 1.00 0.00 H new ATOM 0 HA LYS A 7 49.378 -4.238 67.631 1.00 0.00 H new ATOM 0 HB2 LYS A 7 49.630 -6.232 65.469 1.00 0.00 H new ATOM 0 HB3 LYS A 7 47.966 -5.804 65.815 1.00 0.00 H new ATOM 0 HG2 LYS A 7 48.211 -3.925 64.622 1.00 0.00 H new ATOM 0 HG3 LYS A 7 49.409 -3.356 65.768 1.00 0.00 H new ATOM 0 HD2 LYS A 7 50.045 -5.208 63.435 1.00 0.00 H new ATOM 0 HD3 LYS A 7 50.203 -3.464 63.365 1.00 0.00 H new ATOM 0 HE2 LYS A 7 52.172 -3.498 64.479 1.00 0.00 H new ATOM 0 HE3 LYS A 7 51.525 -4.522 65.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 53.329 -5.609 64.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 51.879 -6.458 64.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 52.506 -5.465 63.095 1.00 0.00 H new ATOM 93 N GLY A 8 47.102 -5.339 68.308 1.00 0.00 N ATOM 94 CA GLY A 8 46.014 -5.885 69.097 1.00 0.00 C ATOM 95 C GLY A 8 46.202 -5.654 70.582 1.00 0.00 C ATOM 96 O GLY A 8 45.489 -4.855 71.189 1.00 0.00 O ATOM 0 H GLY A 8 46.887 -4.465 67.828 1.00 0.00 H new ATOM 0 HA2 GLY A 8 45.075 -5.432 68.778 1.00 0.00 H new ATOM 0 HA3 GLY A 8 45.933 -6.955 68.906 1.00 0.00 H new ATOM 100 N PHE A 9 47.163 -6.357 71.172 1.00 0.00 N ATOM 101 CA PHE A 9 47.442 -6.228 72.597 1.00 0.00 C ATOM 102 C PHE A 9 48.385 -5.058 72.863 1.00 0.00 C ATOM 103 O PHE A 9 48.405 -4.498 73.959 1.00 0.00 O ATOM 104 CB PHE A 9 48.052 -7.522 73.140 1.00 0.00 C ATOM 105 CG PHE A 9 47.304 -8.092 74.311 1.00 0.00 C ATOM 106 CD1 PHE A 9 45.961 -8.418 74.201 1.00 0.00 C ATOM 107 CD2 PHE A 9 47.943 -8.302 75.522 1.00 0.00 C ATOM 108 CE1 PHE A 9 45.271 -8.942 75.277 1.00 0.00 C ATOM 109 CE2 PHE A 9 47.258 -8.825 76.603 1.00 0.00 C ATOM 110 CZ PHE A 9 45.921 -9.147 76.479 1.00 0.00 C ATOM 0 H PHE A 9 47.762 -7.023 70.684 1.00 0.00 H new ATOM 0 HA PHE A 9 46.499 -6.037 73.109 1.00 0.00 H new ATOM 0 HB2 PHE A 9 48.081 -8.264 72.342 1.00 0.00 H new ATOM 0 HB3 PHE A 9 49.084 -7.332 73.436 1.00 0.00 H new ATOM 0 HD1 PHE A 9 45.448 -8.261 73.264 1.00 0.00 H new ATOM 0 HD2 PHE A 9 48.989 -8.054 75.623 1.00 0.00 H new ATOM 0 HE1 PHE A 9 44.225 -9.191 75.179 1.00 0.00 H new ATOM 0 HE2 PHE A 9 47.767 -8.981 77.542 1.00 0.00 H new ATOM 0 HZ PHE A 9 45.384 -9.559 77.321 1.00 0.00 H new ATOM 119 N GLY A 10 49.167 -4.694 71.851 1.00 0.00 N ATOM 120 CA GLY A 10 50.102 -3.594 71.994 1.00 0.00 C ATOM 121 C GLY A 10 49.420 -2.302 72.400 1.00 0.00 C ATOM 122 O GLY A 10 49.774 -1.698 73.413 1.00 0.00 O ATOM 0 H GLY A 10 49.169 -5.142 70.935 1.00 0.00 H new ATOM 0 HA2 GLY A 10 50.853 -3.854 72.740 1.00 0.00 H new ATOM 0 HA3 GLY A 10 50.628 -3.443 71.051 1.00 0.00 H new ATOM 126 N GLU A 11 48.441 -1.877 71.608 1.00 0.00 N ATOM 127 CA GLU A 11 47.710 -0.648 71.890 1.00 0.00 C ATOM 128 C GLU A 11 47.161 -0.656 73.313 1.00 0.00 C ATOM 129 O GLU A 11 47.370 0.286 74.079 1.00 0.00 O ATOM 130 CB GLU A 11 46.565 -0.467 70.891 1.00 0.00 C ATOM 131 CG GLU A 11 46.682 0.795 70.053 1.00 0.00 C ATOM 132 CD GLU A 11 45.385 1.577 69.993 1.00 0.00 C ATOM 133 OE1 GLU A 11 44.454 1.129 69.292 1.00 0.00 O ATOM 134 OE2 GLU A 11 45.299 2.638 70.648 1.00 0.00 O ATOM 0 H GLU A 11 48.136 -2.366 70.766 1.00 0.00 H new ATOM 0 HA GLU A 11 48.404 0.187 71.791 1.00 0.00 H new ATOM 0 HB2 GLU A 11 46.533 -1.332 70.228 1.00 0.00 H new ATOM 0 HB3 GLU A 11 45.620 -0.446 71.434 1.00 0.00 H new ATOM 0 HG2 GLU A 11 47.466 1.430 70.466 1.00 0.00 H new ATOM 0 HG3 GLU A 11 46.988 0.528 69.042 1.00 0.00 H new ATOM 139 N LYS A 12 46.454 -1.726 73.662 1.00 0.00 N ATOM 140 CA LYS A 12 45.873 -1.860 74.993 1.00 0.00 C ATOM 141 C LYS A 12 46.957 -1.823 76.066 1.00 0.00 C ATOM 142 O LYS A 12 46.813 -1.146 77.084 1.00 0.00 O ATOM 143 CB LYS A 12 45.082 -3.165 75.097 1.00 0.00 C ATOM 144 CG LYS A 12 44.107 -3.378 73.952 1.00 0.00 C ATOM 145 CD LYS A 12 43.152 -2.207 73.806 1.00 0.00 C ATOM 146 CE LYS A 12 43.348 -1.489 72.481 1.00 0.00 C ATOM 147 NZ LYS A 12 43.322 -0.009 72.642 1.00 0.00 N ATOM 0 H LYS A 12 46.269 -2.514 73.041 1.00 0.00 H new ATOM 0 HA LYS A 12 45.198 -1.019 75.154 1.00 0.00 H new ATOM 0 HB2 LYS A 12 45.780 -4.002 75.129 1.00 0.00 H new ATOM 0 HB3 LYS A 12 44.532 -3.173 76.038 1.00 0.00 H new ATOM 0 HG2 LYS A 12 44.660 -3.515 73.023 1.00 0.00 H new ATOM 0 HG3 LYS A 12 43.539 -4.292 74.122 1.00 0.00 H new ATOM 0 HD2 LYS A 12 42.124 -2.563 73.879 1.00 0.00 H new ATOM 0 HD3 LYS A 12 43.306 -1.506 74.627 1.00 0.00 H new ATOM 0 HE2 LYS A 12 44.299 -1.790 72.042 1.00 0.00 H new ATOM 0 HE3 LYS A 12 42.566 -1.792 71.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 43.459 0.443 71.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 42.405 0.281 73.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 44.084 0.284 73.286 1.00 0.00 H new ATOM 157 N ALA A 13 48.043 -2.553 75.829 1.00 0.00 N ATOM 158 CA ALA A 13 49.151 -2.600 76.774 1.00 0.00 C ATOM 159 C ALA A 13 49.626 -1.197 77.135 1.00 0.00 C ATOM 160 O ALA A 13 49.727 -0.849 78.310 1.00 0.00 O ATOM 161 CB ALA A 13 50.300 -3.416 76.199 1.00 0.00 C ATOM 0 H ALA A 13 48.178 -3.119 74.991 1.00 0.00 H new ATOM 0 HA ALA A 13 48.798 -3.081 77.686 1.00 0.00 H new ATOM 0 HB1 ALA A 13 51.121 -3.443 76.915 1.00 0.00 H new ATOM 0 HB2 ALA A 13 49.960 -4.432 75.998 1.00 0.00 H new ATOM 0 HB3 ALA A 13 50.643 -2.958 75.271 1.00 0.00 H new ATOM 167 N SER A 14 49.917 -0.395 76.115 1.00 0.00 N ATOM 168 CA SER A 14 50.385 0.970 76.324 1.00 0.00 C ATOM 169 C SER A 14 49.331 1.801 77.048 1.00 0.00 C ATOM 170 O SER A 14 49.654 2.757 77.754 1.00 0.00 O ATOM 171 CB SER A 14 50.736 1.623 74.986 1.00 0.00 C ATOM 172 OG SER A 14 52.139 1.672 74.795 1.00 0.00 O ATOM 0 H SER A 14 49.837 -0.668 75.135 1.00 0.00 H new ATOM 0 HA SER A 14 51.280 0.929 76.945 1.00 0.00 H new ATOM 0 HB2 SER A 14 50.274 1.063 74.172 1.00 0.00 H new ATOM 0 HB3 SER A 14 50.326 2.632 74.952 1.00 0.00 H new ATOM 0 HG SER A 14 52.337 2.092 73.932 1.00 0.00 H new ATOM 177 N GLU A 15 48.067 1.431 76.867 1.00 0.00 N ATOM 178 CA GLU A 15 46.963 2.142 77.500 1.00 0.00 C ATOM 179 C GLU A 15 46.827 1.739 78.966 1.00 0.00 C ATOM 180 O GLU A 15 46.464 2.553 79.814 1.00 0.00 O ATOM 181 CB GLU A 15 45.655 1.865 76.759 1.00 0.00 C ATOM 182 CG GLU A 15 45.531 2.612 75.442 1.00 0.00 C ATOM 183 CD GLU A 15 44.266 3.443 75.358 1.00 0.00 C ATOM 184 OE1 GLU A 15 43.975 4.178 76.326 1.00 0.00 O ATOM 185 OE2 GLU A 15 43.567 3.358 74.327 1.00 0.00 O ATOM 0 H GLU A 15 47.782 0.642 76.287 1.00 0.00 H new ATOM 0 HA GLU A 15 47.177 3.210 77.453 1.00 0.00 H new ATOM 0 HB2 GLU A 15 45.575 0.795 76.569 1.00 0.00 H new ATOM 0 HB3 GLU A 15 44.818 2.138 77.402 1.00 0.00 H new ATOM 0 HG2 GLU A 15 46.397 3.262 75.315 1.00 0.00 H new ATOM 0 HG3 GLU A 15 45.546 1.896 74.620 1.00 0.00 H new ATOM 190 N ALA A 16 47.119 0.475 79.254 1.00 0.00 N ATOM 191 CA ALA A 16 47.029 -0.038 80.616 1.00 0.00 C ATOM 192 C ALA A 16 48.040 0.649 81.529 1.00 0.00 C ATOM 193 O ALA A 16 47.676 1.209 82.564 1.00 0.00 O ATOM 194 CB ALA A 16 47.243 -1.545 80.628 1.00 0.00 C ATOM 0 H ALA A 16 47.420 -0.212 78.563 1.00 0.00 H new ATOM 0 HA ALA A 16 46.030 0.179 80.994 1.00 0.00 H new ATOM 0 HB1 ALA A 16 47.173 -1.914 81.651 1.00 0.00 H new ATOM 0 HB2 ALA A 16 46.480 -2.026 80.016 1.00 0.00 H new ATOM 0 HB3 ALA A 16 48.229 -1.776 80.226 1.00 0.00 H new ATOM 200 N LEU A 17 49.309 0.602 81.139 1.00 0.00 N ATOM 201 CA LEU A 17 50.374 1.219 81.923 1.00 0.00 C ATOM 202 C LEU A 17 50.107 2.707 82.127 1.00 0.00 C ATOM 203 O LEU A 17 50.332 3.247 83.210 1.00 0.00 O ATOM 204 CB LEU A 17 51.724 1.021 81.231 1.00 0.00 C ATOM 205 CG LEU A 17 51.883 1.694 79.867 1.00 0.00 C ATOM 206 CD1 LEU A 17 52.416 3.109 80.028 1.00 0.00 C ATOM 207 CD2 LEU A 17 52.802 0.875 78.973 1.00 0.00 C ATOM 0 H LEU A 17 49.626 0.143 80.285 1.00 0.00 H new ATOM 0 HA LEU A 17 50.400 0.736 82.900 1.00 0.00 H new ATOM 0 HB2 LEU A 17 52.507 1.394 81.892 1.00 0.00 H new ATOM 0 HB3 LEU A 17 51.894 -0.049 81.108 1.00 0.00 H new ATOM 0 HG LEU A 17 50.902 1.749 79.394 1.00 0.00 H new ATOM 0 HD11 LEU A 17 52.522 3.572 79.047 1.00 0.00 H new ATOM 0 HD12 LEU A 17 51.721 3.693 80.631 1.00 0.00 H new ATOM 0 HD13 LEU A 17 53.387 3.078 80.522 1.00 0.00 H new ATOM 0 HD21 LEU A 17 52.904 1.368 78.006 1.00 0.00 H new ATOM 0 HD22 LEU A 17 53.782 0.788 79.441 1.00 0.00 H new ATOM 0 HD23 LEU A 17 52.379 -0.119 78.830 1.00 0.00 H new ATOM 218 N LYS A 18 49.621 3.364 81.079 1.00 0.00 N ATOM 219 CA LYS A 18 49.320 4.790 81.143 1.00 0.00 C ATOM 220 C LYS A 18 48.093 5.048 82.010 1.00 0.00 C ATOM 221 O LYS A 18 47.281 4.156 82.260 1.00 0.00 O ATOM 222 CB LYS A 18 49.090 5.347 79.736 1.00 0.00 C ATOM 223 CG LYS A 18 50.226 6.221 79.234 1.00 0.00 C ATOM 224 CD LYS A 18 49.706 7.493 78.586 1.00 0.00 C ATOM 225 CE LYS A 18 49.507 7.314 77.088 1.00 0.00 C ATOM 226 NZ LYS A 18 50.786 7.453 76.338 1.00 0.00 N ATOM 0 H LYS A 18 49.427 2.932 80.175 1.00 0.00 H new ATOM 0 HA LYS A 18 50.174 5.297 81.593 1.00 0.00 H new ATOM 0 HB2 LYS A 18 48.949 4.517 79.044 1.00 0.00 H new ATOM 0 HB3 LYS A 18 48.167 5.927 79.730 1.00 0.00 H new ATOM 0 HG2 LYS A 18 50.884 6.477 80.065 1.00 0.00 H new ATOM 0 HG3 LYS A 18 50.825 5.663 78.514 1.00 0.00 H new ATOM 0 HD2 LYS A 18 48.761 7.778 79.048 1.00 0.00 H new ATOM 0 HD3 LYS A 18 50.407 8.308 78.766 1.00 0.00 H new ATOM 0 HE2 LYS A 18 49.077 6.331 76.894 1.00 0.00 H new ATOM 0 HE3 LYS A 18 48.792 8.052 76.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 50.608 7.324 75.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 51.184 8.400 76.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 51.460 6.732 76.665 1.00 0.00 H new ATOM 236 N PRO A 19 47.950 6.296 82.481 1.00 0.00 N ATOM 237 CA PRO A 19 46.822 6.699 83.325 1.00 0.00 C ATOM 238 C PRO A 19 45.506 6.734 82.557 1.00 0.00 C ATOM 239 O PRO A 19 45.432 6.288 81.412 1.00 0.00 O ATOM 240 CB PRO A 19 47.210 8.108 83.785 1.00 0.00 C ATOM 241 CG PRO A 19 48.131 8.612 82.727 1.00 0.00 C ATOM 242 CD PRO A 19 48.879 7.409 82.222 1.00 0.00 C ATOM 0 HA PRO A 19 46.655 5.998 84.143 1.00 0.00 H new ATOM 0 HB2 PRO A 19 46.333 8.748 83.884 1.00 0.00 H new ATOM 0 HB3 PRO A 19 47.700 8.086 84.759 1.00 0.00 H new ATOM 0 HG2 PRO A 19 47.575 9.092 81.922 1.00 0.00 H new ATOM 0 HG3 PRO A 19 48.817 9.358 83.129 1.00 0.00 H new ATOM 0 HD2 PRO A 19 49.114 7.498 81.161 1.00 0.00 H new ATOM 0 HD3 PRO A 19 49.824 7.274 82.747 1.00 0.00 H new ATOM 247 N ASP A 20 44.469 7.267 83.194 1.00 0.00 N ATOM 248 CA ASP A 20 43.154 7.361 82.569 1.00 0.00 C ATOM 249 C ASP A 20 42.457 8.659 82.964 1.00 0.00 C ATOM 250 O ASP A 20 43.003 9.464 83.719 1.00 0.00 O ATOM 251 CB ASP A 20 42.291 6.163 82.967 1.00 0.00 C ATOM 252 CG ASP A 20 42.637 5.630 84.343 1.00 0.00 C ATOM 253 OD1 ASP A 20 42.734 6.442 85.287 1.00 0.00 O ATOM 254 OD2 ASP A 20 42.812 4.400 84.475 1.00 0.00 O ATOM 0 H ASP A 20 44.513 7.640 84.142 1.00 0.00 H new ATOM 0 HA ASP A 20 43.291 7.357 81.488 1.00 0.00 H new ATOM 0 HB2 ASP A 20 41.241 6.453 82.947 1.00 0.00 H new ATOM 0 HB3 ASP A 20 42.416 5.369 82.231 1.00 0.00 H new ATOM 258 N SER A 21 41.248 8.857 82.448 1.00 0.00 N ATOM 259 CA SER A 21 40.477 10.058 82.743 1.00 0.00 C ATOM 260 C SER A 21 40.378 10.284 84.248 1.00 0.00 C ATOM 261 O SER A 21 39.879 9.431 84.981 1.00 0.00 O ATOM 262 CB SER A 21 39.077 9.954 82.136 1.00 0.00 C ATOM 263 OG SER A 21 38.788 11.078 81.324 1.00 0.00 O ATOM 0 H SER A 21 40.781 8.200 81.823 1.00 0.00 H new ATOM 0 HA SER A 21 40.993 10.909 82.300 1.00 0.00 H new ATOM 0 HB2 SER A 21 39.002 9.043 81.542 1.00 0.00 H new ATOM 0 HB3 SER A 21 38.337 9.877 82.932 1.00 0.00 H new ATOM 0 HG SER A 21 37.888 10.986 80.947 1.00 0.00 H new ATOM 268 N GLN A 22 40.855 11.440 84.700 1.00 0.00 N ATOM 269 CA GLN A 22 40.819 11.777 86.119 1.00 0.00 C ATOM 270 C GLN A 22 39.940 12.998 86.365 1.00 0.00 C ATOM 271 O GLN A 22 39.598 13.311 87.506 1.00 0.00 O ATOM 272 CB GLN A 22 42.234 12.040 86.637 1.00 0.00 C ATOM 273 CG GLN A 22 42.443 11.608 88.079 1.00 0.00 C ATOM 274 CD GLN A 22 43.720 10.813 88.272 1.00 0.00 C ATOM 275 OE1 GLN A 22 44.639 10.885 87.455 1.00 0.00 O ATOM 276 NE2 GLN A 22 43.784 10.050 89.356 1.00 0.00 N ATOM 0 H GLN A 22 41.270 12.158 84.106 1.00 0.00 H new ATOM 0 HA GLN A 22 40.393 10.931 86.658 1.00 0.00 H new ATOM 0 HB2 GLN A 22 42.948 11.515 86.002 1.00 0.00 H new ATOM 0 HB3 GLN A 22 42.452 13.104 86.550 1.00 0.00 H new ATOM 0 HG2 GLN A 22 42.469 12.490 88.718 1.00 0.00 H new ATOM 0 HG3 GLN A 22 41.593 11.006 88.401 1.00 0.00 H new ATOM 0 HE21 GLN A 22 42.999 10.021 90.006 1.00 0.00 H new ATOM 0 HE22 GLN A 22 44.619 9.493 89.539 1.00 0.00 H new ATOM 283 N LYS A 23 39.576 13.687 85.288 1.00 0.00 N ATOM 284 CA LYS A 23 38.735 14.873 85.387 1.00 0.00 C ATOM 285 C LYS A 23 39.240 15.809 86.481 1.00 0.00 C ATOM 286 O LYS A 23 38.553 16.039 87.477 1.00 0.00 O ATOM 287 CB LYS A 23 37.284 14.474 85.670 1.00 0.00 C ATOM 288 CG LYS A 23 36.802 13.303 84.834 1.00 0.00 C ATOM 289 CD LYS A 23 36.913 11.992 85.593 1.00 0.00 C ATOM 290 CE LYS A 23 35.801 11.028 85.210 1.00 0.00 C ATOM 291 NZ LYS A 23 34.472 11.493 85.696 1.00 0.00 N ATOM 0 H LYS A 23 39.851 13.444 84.336 1.00 0.00 H new ATOM 0 HA LYS A 23 38.780 15.400 84.434 1.00 0.00 H new ATOM 0 HB2 LYS A 23 37.185 14.221 86.726 1.00 0.00 H new ATOM 0 HB3 LYS A 23 36.637 15.332 85.485 1.00 0.00 H new ATOM 0 HG2 LYS A 23 35.765 13.467 84.540 1.00 0.00 H new ATOM 0 HG3 LYS A 23 37.388 13.244 83.917 1.00 0.00 H new ATOM 0 HD2 LYS A 23 37.880 11.533 85.388 1.00 0.00 H new ATOM 0 HD3 LYS A 23 36.873 12.187 86.665 1.00 0.00 H new ATOM 0 HE2 LYS A 23 35.773 10.918 84.126 1.00 0.00 H new ATOM 0 HE3 LYS A 23 36.015 10.043 85.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 33.822 10.683 85.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 34.578 11.925 86.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 34.087 12.196 85.034 1.00 0.00 H new ATOM 301 N SER A 24 40.439 16.345 86.288 1.00 0.00 N ATOM 302 CA SER A 24 41.037 17.253 87.260 1.00 0.00 C ATOM 303 C SER A 24 42.375 17.784 86.757 1.00 0.00 C ATOM 304 O SER A 24 42.730 17.602 85.592 1.00 0.00 O ATOM 305 CB SER A 24 41.228 16.544 88.603 1.00 0.00 C ATOM 306 OG SER A 24 42.519 15.964 88.692 1.00 0.00 O ATOM 0 H SER A 24 41.017 16.167 85.467 1.00 0.00 H new ATOM 0 HA SER A 24 40.360 18.096 87.396 1.00 0.00 H new ATOM 0 HB2 SER A 24 41.088 17.255 89.417 1.00 0.00 H new ATOM 0 HB3 SER A 24 40.469 15.771 88.721 1.00 0.00 H new ATOM 0 HG SER A 24 42.618 15.518 89.559 1.00 0.00 H new ATOM 311 N TYR A 25 43.114 18.443 87.642 1.00 0.00 N ATOM 312 CA TYR A 25 44.412 19.005 87.289 1.00 0.00 C ATOM 313 C TYR A 25 45.277 17.970 86.577 1.00 0.00 C ATOM 314 O TYR A 25 46.064 18.304 85.692 1.00 0.00 O ATOM 315 CB TYR A 25 45.131 19.511 88.541 1.00 0.00 C ATOM 316 CG TYR A 25 45.484 20.980 88.484 1.00 0.00 C ATOM 317 CD1 TYR A 25 44.530 21.931 88.142 1.00 0.00 C ATOM 318 CD2 TYR A 25 46.770 21.418 88.772 1.00 0.00 C ATOM 319 CE1 TYR A 25 44.848 23.274 88.088 1.00 0.00 C ATOM 320 CE2 TYR A 25 47.098 22.759 88.721 1.00 0.00 C ATOM 321 CZ TYR A 25 46.133 23.683 88.379 1.00 0.00 C ATOM 322 OH TYR A 25 46.455 25.021 88.326 1.00 0.00 O ATOM 0 H TYR A 25 42.836 18.601 88.610 1.00 0.00 H new ATOM 0 HA TYR A 25 44.245 19.842 86.611 1.00 0.00 H new ATOM 0 HB2 TYR A 25 44.499 19.331 89.411 1.00 0.00 H new ATOM 0 HB3 TYR A 25 46.043 18.932 88.685 1.00 0.00 H new ATOM 0 HD1 TYR A 25 43.523 21.614 87.915 1.00 0.00 H new ATOM 0 HD2 TYR A 25 47.528 20.697 89.041 1.00 0.00 H new ATOM 0 HE1 TYR A 25 44.095 24.000 87.819 1.00 0.00 H new ATOM 0 HE2 TYR A 25 48.103 23.082 88.947 1.00 0.00 H new ATOM 0 HH TYR A 25 47.399 25.140 88.560 1.00 0.00 H new ATOM 331 N ALA A 26 45.125 16.709 86.970 1.00 0.00 N ATOM 332 CA ALA A 26 45.888 15.623 86.368 1.00 0.00 C ATOM 333 C ALA A 26 45.783 15.655 84.848 1.00 0.00 C ATOM 334 O ALA A 26 46.783 15.517 84.144 1.00 0.00 O ATOM 335 CB ALA A 26 45.411 14.281 86.905 1.00 0.00 C ATOM 0 H ALA A 26 44.480 16.415 87.703 1.00 0.00 H new ATOM 0 HA ALA A 26 46.936 15.757 86.636 1.00 0.00 H new ATOM 0 HB1 ALA A 26 45.990 13.479 86.447 1.00 0.00 H new ATOM 0 HB2 ALA A 26 45.546 14.253 87.986 1.00 0.00 H new ATOM 0 HB3 ALA A 26 44.356 14.148 86.667 1.00 0.00 H new ATOM 341 N GLU A 27 44.565 15.835 84.347 1.00 0.00 N ATOM 342 CA GLU A 27 44.330 15.883 82.909 1.00 0.00 C ATOM 343 C GLU A 27 44.740 17.237 82.334 1.00 0.00 C ATOM 344 O GLU A 27 45.263 17.319 81.224 1.00 0.00 O ATOM 345 CB GLU A 27 42.857 15.611 82.601 1.00 0.00 C ATOM 346 CG GLU A 27 42.614 14.278 81.914 1.00 0.00 C ATOM 347 CD GLU A 27 41.920 14.429 80.573 1.00 0.00 C ATOM 348 OE1 GLU A 27 41.070 15.335 80.446 1.00 0.00 O ATOM 349 OE2 GLU A 27 42.226 13.643 79.654 1.00 0.00 O ATOM 0 H GLU A 27 43.726 15.950 84.916 1.00 0.00 H new ATOM 0 HA GLU A 27 44.940 15.110 82.442 1.00 0.00 H new ATOM 0 HB2 GLU A 27 42.289 15.640 83.531 1.00 0.00 H new ATOM 0 HB3 GLU A 27 42.473 16.411 81.968 1.00 0.00 H new ATOM 0 HG2 GLU A 27 43.567 13.769 81.770 1.00 0.00 H new ATOM 0 HG3 GLU A 27 42.009 13.644 82.563 1.00 0.00 H new ATOM 354 N GLN A 28 44.496 18.296 83.102 1.00 0.00 N ATOM 355 CA GLN A 28 44.838 19.645 82.669 1.00 0.00 C ATOM 356 C GLN A 28 46.318 19.744 82.308 1.00 0.00 C ATOM 357 O GLN A 28 46.674 20.209 81.226 1.00 0.00 O ATOM 358 CB GLN A 28 44.500 20.655 83.765 1.00 0.00 C ATOM 359 CG GLN A 28 43.044 20.618 84.200 1.00 0.00 C ATOM 360 CD GLN A 28 42.632 21.856 84.971 1.00 0.00 C ATOM 361 OE1 GLN A 28 43.279 22.902 84.882 1.00 0.00 O ATOM 362 NE2 GLN A 28 41.552 21.748 85.735 1.00 0.00 N ATOM 0 H GLN A 28 44.064 18.245 84.025 1.00 0.00 H new ATOM 0 HA GLN A 28 44.251 19.873 81.780 1.00 0.00 H new ATOM 0 HB2 GLN A 28 45.134 20.464 84.631 1.00 0.00 H new ATOM 0 HB3 GLN A 28 44.739 21.657 83.410 1.00 0.00 H new ATOM 0 HG2 GLN A 28 42.409 20.515 83.320 1.00 0.00 H new ATOM 0 HG3 GLN A 28 42.876 19.737 84.819 1.00 0.00 H new ATOM 0 HE21 GLN A 28 41.046 20.864 85.780 1.00 0.00 H new ATOM 0 HE22 GLN A 28 41.229 22.549 86.277 1.00 0.00 H new ATOM 369 N GLY A 29 47.175 19.301 83.224 1.00 0.00 N ATOM 370 CA GLY A 29 48.606 19.349 82.984 1.00 0.00 C ATOM 371 C GLY A 29 49.017 18.535 81.774 1.00 0.00 C ATOM 372 O GLY A 29 49.709 19.032 80.887 1.00 0.00 O ATOM 0 H GLY A 29 46.904 18.910 84.126 1.00 0.00 H new ATOM 0 HA2 GLY A 29 48.913 20.385 82.843 1.00 0.00 H new ATOM 0 HA3 GLY A 29 49.132 18.978 83.864 1.00 0.00 H new ATOM 376 N LYS A 30 48.594 17.276 81.738 1.00 0.00 N ATOM 377 CA LYS A 30 48.922 16.388 80.630 1.00 0.00 C ATOM 378 C LYS A 30 48.588 17.041 79.292 1.00 0.00 C ATOM 379 O LYS A 30 49.450 17.181 78.427 1.00 0.00 O ATOM 380 CB LYS A 30 48.168 15.064 80.767 1.00 0.00 C ATOM 381 CG LYS A 30 48.493 14.308 82.043 1.00 0.00 C ATOM 382 CD LYS A 30 47.407 13.302 82.387 1.00 0.00 C ATOM 383 CE LYS A 30 47.811 11.888 81.998 1.00 0.00 C ATOM 384 NZ LYS A 30 47.795 11.693 80.522 1.00 0.00 N ATOM 0 H LYS A 30 48.022 16.847 82.466 1.00 0.00 H new ATOM 0 HA LYS A 30 49.994 16.191 80.661 1.00 0.00 H new ATOM 0 HB2 LYS A 30 47.096 15.261 80.734 1.00 0.00 H new ATOM 0 HB3 LYS A 30 48.402 14.432 79.910 1.00 0.00 H new ATOM 0 HG2 LYS A 30 49.446 13.791 81.928 1.00 0.00 H new ATOM 0 HG3 LYS A 30 48.610 15.014 82.865 1.00 0.00 H new ATOM 0 HD2 LYS A 30 47.200 13.341 83.456 1.00 0.00 H new ATOM 0 HD3 LYS A 30 46.484 13.572 81.873 1.00 0.00 H new ATOM 0 HE2 LYS A 30 48.809 11.677 82.381 1.00 0.00 H new ATOM 0 HE3 LYS A 30 47.133 11.175 82.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 47.976 10.693 80.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 46.865 11.967 80.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 48.532 12.283 80.086 1.00 0.00 H new ATOM 394 N GLU A 31 47.329 17.439 79.132 1.00 0.00 N ATOM 395 CA GLU A 31 46.881 18.077 77.900 1.00 0.00 C ATOM 396 C GLU A 31 47.650 19.372 77.648 1.00 0.00 C ATOM 397 O GLU A 31 47.814 19.796 76.504 1.00 0.00 O ATOM 398 CB GLU A 31 45.381 18.367 77.966 1.00 0.00 C ATOM 399 CG GLU A 31 44.522 17.115 78.023 1.00 0.00 C ATOM 400 CD GLU A 31 43.752 16.877 76.738 1.00 0.00 C ATOM 401 OE1 GLU A 31 44.265 17.249 75.662 1.00 0.00 O ATOM 402 OE2 GLU A 31 42.637 16.318 76.808 1.00 0.00 O ATOM 0 H GLU A 31 46.602 17.331 79.840 1.00 0.00 H new ATOM 0 HA GLU A 31 47.075 17.392 77.075 1.00 0.00 H new ATOM 0 HB2 GLU A 31 45.176 18.979 78.845 1.00 0.00 H new ATOM 0 HB3 GLU A 31 45.094 18.955 77.094 1.00 0.00 H new ATOM 0 HG2 GLU A 31 45.156 16.253 78.227 1.00 0.00 H new ATOM 0 HG3 GLU A 31 43.820 17.198 78.853 1.00 0.00 H new ATOM 407 N TYR A 32 48.117 19.994 78.724 1.00 0.00 N ATOM 408 CA TYR A 32 48.865 21.241 78.621 1.00 0.00 C ATOM 409 C TYR A 32 50.194 21.022 77.904 1.00 0.00 C ATOM 410 O TYR A 32 50.579 21.804 77.034 1.00 0.00 O ATOM 411 CB TYR A 32 49.115 21.828 80.012 1.00 0.00 C ATOM 412 CG TYR A 32 49.700 23.222 79.985 1.00 0.00 C ATOM 413 CD1 TYR A 32 51.075 23.418 79.965 1.00 0.00 C ATOM 414 CD2 TYR A 32 48.878 24.341 79.979 1.00 0.00 C ATOM 415 CE1 TYR A 32 51.615 24.689 79.942 1.00 0.00 C ATOM 416 CE2 TYR A 32 49.409 25.617 79.953 1.00 0.00 C ATOM 417 CZ TYR A 32 50.778 25.786 79.937 1.00 0.00 C ATOM 418 OH TYR A 32 51.311 27.054 79.912 1.00 0.00 O ATOM 0 H TYR A 32 47.991 19.655 79.678 1.00 0.00 H new ATOM 0 HA TYR A 32 48.269 21.944 78.039 1.00 0.00 H new ATOM 0 HB2 TYR A 32 48.175 21.848 80.563 1.00 0.00 H new ATOM 0 HB3 TYR A 32 49.791 21.170 80.559 1.00 0.00 H new ATOM 0 HD1 TYR A 32 51.733 22.562 79.967 1.00 0.00 H new ATOM 0 HD2 TYR A 32 47.806 24.212 79.995 1.00 0.00 H new ATOM 0 HE1 TYR A 32 52.686 24.824 79.928 1.00 0.00 H new ATOM 0 HE2 TYR A 32 48.756 26.477 79.945 1.00 0.00 H new ATOM 0 HH TYR A 32 50.586 27.714 79.911 1.00 0.00 H new ATOM 427 N ILE A 33 50.890 19.953 78.275 1.00 0.00 N ATOM 428 CA ILE A 33 52.174 19.629 77.667 1.00 0.00 C ATOM 429 C ILE A 33 51.994 19.111 76.244 1.00 0.00 C ATOM 430 O ILE A 33 52.791 19.412 75.356 1.00 0.00 O ATOM 431 CB ILE A 33 52.937 18.575 78.491 1.00 0.00 C ATOM 432 CG1 ILE A 33 52.766 18.845 79.988 1.00 0.00 C ATOM 433 CG2 ILE A 33 54.412 18.571 78.113 1.00 0.00 C ATOM 434 CD1 ILE A 33 53.856 18.232 80.841 1.00 0.00 C ATOM 0 H ILE A 33 50.586 19.296 78.994 1.00 0.00 H new ATOM 0 HA ILE A 33 52.754 20.552 77.645 1.00 0.00 H new ATOM 0 HB ILE A 33 52.523 17.592 78.268 1.00 0.00 H new ATOM 0 HG12 ILE A 33 52.748 19.922 80.155 1.00 0.00 H new ATOM 0 HG13 ILE A 33 51.801 18.456 80.311 1.00 0.00 H new ATOM 0 HG21 ILE A 33 54.937 17.821 78.704 1.00 0.00 H new ATOM 0 HG22 ILE A 33 54.515 18.336 77.054 1.00 0.00 H new ATOM 0 HG23 ILE A 33 54.841 19.554 78.310 1.00 0.00 H new ATOM 0 HD11 ILE A 33 53.671 18.464 81.890 1.00 0.00 H new ATOM 0 HD12 ILE A 33 53.861 17.151 80.703 1.00 0.00 H new ATOM 0 HD13 ILE A 33 54.822 18.640 80.545 1.00 0.00 H new ATOM 445 N THR A 34 50.938 18.331 76.033 1.00 0.00 N ATOM 446 CA THR A 34 50.651 17.771 74.718 1.00 0.00 C ATOM 447 C THR A 34 50.349 18.871 73.708 1.00 0.00 C ATOM 448 O THR A 34 50.672 18.749 72.525 1.00 0.00 O ATOM 449 CB THR A 34 49.461 16.796 74.770 1.00 0.00 C ATOM 450 OG1 THR A 34 49.882 15.487 74.368 1.00 0.00 O ATOM 451 CG2 THR A 34 48.332 17.270 73.868 1.00 0.00 C ATOM 0 H THR A 34 50.267 18.073 76.757 1.00 0.00 H new ATOM 0 HA THR A 34 51.542 17.227 74.404 1.00 0.00 H new ATOM 0 HB THR A 34 49.094 16.761 75.796 1.00 0.00 H new ATOM 0 HG1 THR A 34 49.120 14.872 74.405 1.00 0.00 H new ATOM 0 HG21 THR A 34 47.503 16.565 73.922 1.00 0.00 H new ATOM 0 HG22 THR A 34 47.994 18.253 74.195 1.00 0.00 H new ATOM 0 HG23 THR A 34 48.689 17.332 72.840 1.00 0.00 H new ATOM 459 N ASP A 35 49.726 19.946 74.179 1.00 0.00 N ATOM 460 CA ASP A 35 49.380 21.069 73.315 1.00 0.00 C ATOM 461 C ASP A 35 50.623 21.871 72.943 1.00 0.00 C ATOM 462 O ASP A 35 50.693 22.465 71.867 1.00 0.00 O ATOM 463 CB ASP A 35 48.360 21.977 74.006 1.00 0.00 C ATOM 464 CG ASP A 35 47.219 22.368 73.089 1.00 0.00 C ATOM 465 OD1 ASP A 35 47.485 22.671 71.906 1.00 0.00 O ATOM 466 OD2 ASP A 35 46.060 22.372 73.552 1.00 0.00 O ATOM 0 H ASP A 35 49.450 20.063 75.154 1.00 0.00 H new ATOM 0 HA ASP A 35 48.939 20.670 72.401 1.00 0.00 H new ATOM 0 HB2 ASP A 35 47.960 21.468 74.883 1.00 0.00 H new ATOM 0 HB3 ASP A 35 48.861 22.877 74.362 1.00 0.00 H new ATOM 470 N LYS A 36 51.602 21.886 73.842 1.00 0.00 N ATOM 471 CA LYS A 36 52.845 22.613 73.609 1.00 0.00 C ATOM 472 C LYS A 36 53.710 21.899 72.574 1.00 0.00 C ATOM 473 O LYS A 36 54.270 22.529 71.679 1.00 0.00 O ATOM 474 CB LYS A 36 53.621 22.769 74.918 1.00 0.00 C ATOM 475 CG LYS A 36 52.871 23.556 75.980 1.00 0.00 C ATOM 476 CD LYS A 36 53.360 24.993 76.060 1.00 0.00 C ATOM 477 CE LYS A 36 53.537 25.441 77.502 1.00 0.00 C ATOM 478 NZ LYS A 36 54.619 26.455 77.639 1.00 0.00 N ATOM 0 H LYS A 36 51.559 21.403 74.739 1.00 0.00 H new ATOM 0 HA LYS A 36 52.591 23.601 73.224 1.00 0.00 H new ATOM 0 HB2 LYS A 36 53.858 21.780 75.310 1.00 0.00 H new ATOM 0 HB3 LYS A 36 54.569 23.266 74.712 1.00 0.00 H new ATOM 0 HG2 LYS A 36 51.804 23.546 75.756 1.00 0.00 H new ATOM 0 HG3 LYS A 36 52.998 23.073 76.949 1.00 0.00 H new ATOM 0 HD2 LYS A 36 54.308 25.086 75.530 1.00 0.00 H new ATOM 0 HD3 LYS A 36 52.649 25.649 75.559 1.00 0.00 H new ATOM 0 HE2 LYS A 36 52.600 25.858 77.870 1.00 0.00 H new ATOM 0 HE3 LYS A 36 53.768 24.577 78.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 54.708 26.735 78.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 55.519 26.049 77.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 54.387 27.290 77.065 1.00 0.00 H new ATOM 488 N ALA A 37 53.811 20.581 72.705 1.00 0.00 N ATOM 489 CA ALA A 37 54.604 19.781 71.779 1.00 0.00 C ATOM 490 C ALA A 37 53.979 19.769 70.389 1.00 0.00 C ATOM 491 O ALA A 37 54.670 19.575 69.389 1.00 0.00 O ATOM 492 CB ALA A 37 54.753 18.361 72.304 1.00 0.00 C ATOM 0 H ALA A 37 53.354 20.044 73.442 1.00 0.00 H new ATOM 0 HA ALA A 37 55.592 20.234 71.700 1.00 0.00 H new ATOM 0 HB1 ALA A 37 55.347 17.774 71.603 1.00 0.00 H new ATOM 0 HB2 ALA A 37 55.251 18.382 73.273 1.00 0.00 H new ATOM 0 HB3 ALA A 37 53.768 17.908 72.412 1.00 0.00 H new ATOM 498 N ASP A 38 52.668 19.978 70.333 1.00 0.00 N ATOM 499 CA ASP A 38 51.950 19.993 69.063 1.00 0.00 C ATOM 500 C ASP A 38 52.111 21.338 68.363 1.00 0.00 C ATOM 501 O ASP A 38 52.297 21.401 67.147 1.00 0.00 O ATOM 502 CB ASP A 38 50.466 19.695 69.289 1.00 0.00 C ATOM 503 CG ASP A 38 49.921 18.686 68.299 1.00 0.00 C ATOM 504 OD1 ASP A 38 50.398 17.531 68.304 1.00 0.00 O ATOM 505 OD2 ASP A 38 49.019 19.049 67.515 1.00 0.00 O ATOM 0 H ASP A 38 52.081 20.139 71.151 1.00 0.00 H new ATOM 0 HA ASP A 38 52.375 19.219 68.424 1.00 0.00 H new ATOM 0 HB2 ASP A 38 50.324 19.319 70.302 1.00 0.00 H new ATOM 0 HB3 ASP A 38 49.896 20.621 69.210 1.00 0.00 H new ATOM 509 N LYS A 39 52.036 22.416 69.138 1.00 0.00 N ATOM 510 CA LYS A 39 52.173 23.761 68.594 1.00 0.00 C ATOM 511 C LYS A 39 53.595 24.005 68.098 1.00 0.00 C ATOM 512 O LYS A 39 53.801 24.503 66.992 1.00 0.00 O ATOM 513 CB LYS A 39 51.805 24.802 69.653 1.00 0.00 C ATOM 514 CG LYS A 39 50.392 25.341 69.511 1.00 0.00 C ATOM 515 CD LYS A 39 50.391 26.837 69.244 1.00 0.00 C ATOM 516 CE LYS A 39 50.637 27.631 70.518 1.00 0.00 C ATOM 517 NZ LYS A 39 50.655 29.098 70.261 1.00 0.00 N ATOM 0 H LYS A 39 51.881 22.383 70.146 1.00 0.00 H new ATOM 0 HA LYS A 39 51.491 23.855 67.749 1.00 0.00 H new ATOM 0 HB2 LYS A 39 51.918 24.357 70.642 1.00 0.00 H new ATOM 0 HB3 LYS A 39 52.509 25.632 69.595 1.00 0.00 H new ATOM 0 HG2 LYS A 39 49.885 24.825 68.696 1.00 0.00 H new ATOM 0 HG3 LYS A 39 49.829 25.132 70.420 1.00 0.00 H new ATOM 0 HD2 LYS A 39 51.160 27.077 68.510 1.00 0.00 H new ATOM 0 HD3 LYS A 39 49.435 27.130 68.811 1.00 0.00 H new ATOM 0 HE2 LYS A 39 49.860 27.399 71.246 1.00 0.00 H new ATOM 0 HE3 LYS A 39 51.587 27.327 70.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 50.825 29.605 71.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 51.413 29.323 69.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 49.739 29.392 69.865 1.00 0.00 H new ATOM 527 N VAL A 40 54.574 23.651 68.925 1.00 0.00 N ATOM 528 CA VAL A 40 55.977 23.829 68.569 1.00 0.00 C ATOM 529 C VAL A 40 56.338 23.014 67.332 1.00 0.00 C ATOM 530 O VAL A 40 57.121 23.458 66.492 1.00 0.00 O ATOM 531 CB VAL A 40 56.906 23.421 69.728 1.00 0.00 C ATOM 532 CG1 VAL A 40 56.657 21.976 70.129 1.00 0.00 C ATOM 533 CG2 VAL A 40 58.362 23.633 69.343 1.00 0.00 C ATOM 0 H VAL A 40 54.421 23.239 69.846 1.00 0.00 H new ATOM 0 HA VAL A 40 56.118 24.889 68.356 1.00 0.00 H new ATOM 0 HB VAL A 40 56.685 24.054 70.587 1.00 0.00 H new ATOM 0 HG11 VAL A 40 57.323 21.706 70.949 1.00 0.00 H new ATOM 0 HG12 VAL A 40 55.621 21.860 70.449 1.00 0.00 H new ATOM 0 HG13 VAL A 40 56.848 21.324 69.277 1.00 0.00 H new ATOM 0 HG21 VAL A 40 59.004 23.340 70.173 1.00 0.00 H new ATOM 0 HG22 VAL A 40 58.599 23.027 68.469 1.00 0.00 H new ATOM 0 HG23 VAL A 40 58.527 24.685 69.110 1.00 0.00 H new ATOM 543 N ALA A 41 55.763 21.822 67.227 1.00 0.00 N ATOM 544 CA ALA A 41 56.023 20.945 66.092 1.00 0.00 C ATOM 545 C ALA A 41 55.269 21.415 64.853 1.00 0.00 C ATOM 546 O ALA A 41 55.809 21.416 63.748 1.00 0.00 O ATOM 547 CB ALA A 41 55.642 19.512 66.433 1.00 0.00 C ATOM 0 H ALA A 41 55.113 21.440 67.914 1.00 0.00 H new ATOM 0 HA ALA A 41 57.090 20.982 65.872 1.00 0.00 H new ATOM 0 HB1 ALA A 41 55.842 18.869 65.576 1.00 0.00 H new ATOM 0 HB2 ALA A 41 56.229 19.173 67.286 1.00 0.00 H new ATOM 0 HB3 ALA A 41 54.582 19.467 66.681 1.00 0.00 H new ATOM 553 N GLY A 42 54.014 21.812 65.046 1.00 0.00 N ATOM 554 CA GLY A 42 53.205 22.279 63.933 1.00 0.00 C ATOM 555 C GLY A 42 53.665 23.623 63.405 1.00 0.00 C ATOM 556 O GLY A 42 53.567 23.894 62.208 1.00 0.00 O ATOM 0 H GLY A 42 53.544 21.819 65.951 1.00 0.00 H new ATOM 0 HA2 GLY A 42 53.241 21.545 63.128 1.00 0.00 H new ATOM 0 HA3 GLY A 42 52.165 22.354 64.250 1.00 0.00 H new ATOM 560 N LYS A 43 54.166 24.468 64.299 1.00 0.00 N ATOM 561 CA LYS A 43 54.642 25.792 63.919 1.00 0.00 C ATOM 562 C LYS A 43 55.865 25.692 63.013 1.00 0.00 C ATOM 563 O LYS A 43 56.156 26.605 62.242 1.00 0.00 O ATOM 564 CB LYS A 43 54.983 26.612 65.165 1.00 0.00 C ATOM 565 CG LYS A 43 53.846 27.499 65.641 1.00 0.00 C ATOM 566 CD LYS A 43 53.477 28.540 64.597 1.00 0.00 C ATOM 567 CE LYS A 43 53.668 29.953 65.128 1.00 0.00 C ATOM 568 NZ LYS A 43 53.713 30.957 64.030 1.00 0.00 N ATOM 0 H LYS A 43 54.253 24.259 65.294 1.00 0.00 H new ATOM 0 HA LYS A 43 53.845 26.292 63.369 1.00 0.00 H new ATOM 0 HB2 LYS A 43 55.264 25.933 65.970 1.00 0.00 H new ATOM 0 HB3 LYS A 43 55.853 27.234 64.953 1.00 0.00 H new ATOM 0 HG2 LYS A 43 52.975 26.885 65.868 1.00 0.00 H new ATOM 0 HG3 LYS A 43 54.135 27.997 66.567 1.00 0.00 H new ATOM 0 HD2 LYS A 43 54.091 28.398 63.707 1.00 0.00 H new ATOM 0 HD3 LYS A 43 52.439 28.401 64.294 1.00 0.00 H new ATOM 0 HE2 LYS A 43 52.854 30.198 65.810 1.00 0.00 H new ATOM 0 HE3 LYS A 43 54.592 30.003 65.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 53.844 31.907 64.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 54.505 30.739 63.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 52.821 30.928 63.496 1.00 0.00 H new ATOM 578 N VAL A 44 56.577 24.573 63.111 1.00 0.00 N ATOM 579 CA VAL A 44 57.768 24.351 62.299 1.00 0.00 C ATOM 580 C VAL A 44 57.474 23.407 61.138 1.00 0.00 C ATOM 581 O VAL A 44 56.860 22.357 61.321 1.00 0.00 O ATOM 582 CB VAL A 44 58.921 23.769 63.139 1.00 0.00 C ATOM 583 CG1 VAL A 44 58.492 22.471 63.806 1.00 0.00 C ATOM 584 CG2 VAL A 44 60.153 23.552 62.274 1.00 0.00 C ATOM 0 H VAL A 44 56.350 23.807 63.744 1.00 0.00 H new ATOM 0 HA VAL A 44 58.068 25.323 61.907 1.00 0.00 H new ATOM 0 HB VAL A 44 59.176 24.485 63.921 1.00 0.00 H new ATOM 0 HG11 VAL A 44 59.319 22.074 64.395 1.00 0.00 H new ATOM 0 HG12 VAL A 44 57.640 22.662 64.459 1.00 0.00 H new ATOM 0 HG13 VAL A 44 58.209 21.746 63.043 1.00 0.00 H new ATOM 0 HG21 VAL A 44 60.958 23.141 62.883 1.00 0.00 H new ATOM 0 HG22 VAL A 44 59.915 22.856 61.470 1.00 0.00 H new ATOM 0 HG23 VAL A 44 60.471 24.504 61.848 1.00 0.00 H new ATOM 594 N GLN A 45 57.915 23.790 59.945 1.00 0.00 N ATOM 595 CA GLN A 45 57.699 22.978 58.753 1.00 0.00 C ATOM 596 C GLN A 45 59.020 22.447 58.209 1.00 0.00 C ATOM 597 O GLN A 45 59.527 22.905 57.185 1.00 0.00 O ATOM 598 CB GLN A 45 56.982 23.796 57.677 1.00 0.00 C ATOM 599 CG GLN A 45 55.472 23.610 57.677 1.00 0.00 C ATOM 600 CD GLN A 45 54.830 24.055 56.378 1.00 0.00 C ATOM 601 OE1 GLN A 45 54.550 23.240 55.499 1.00 0.00 O ATOM 602 NE2 GLN A 45 54.594 25.356 56.249 1.00 0.00 N ATOM 0 H GLN A 45 58.424 24.658 59.777 1.00 0.00 H new ATOM 0 HA GLN A 45 57.075 22.129 59.031 1.00 0.00 H new ATOM 0 HB2 GLN A 45 57.210 24.852 57.823 1.00 0.00 H new ATOM 0 HB3 GLN A 45 57.374 23.517 56.699 1.00 0.00 H new ATOM 0 HG2 GLN A 45 55.239 22.560 57.852 1.00 0.00 H new ATOM 0 HG3 GLN A 45 55.040 24.174 58.503 1.00 0.00 H new ATOM 0 HE21 GLN A 45 54.842 25.997 57.003 1.00 0.00 H new ATOM 0 HE22 GLN A 45 54.165 25.714 55.396 1.00 0.00 H new ATOM 609 N PRO A 46 59.593 21.457 58.909 1.00 0.00 N ATOM 610 CA PRO A 46 60.864 20.840 58.515 1.00 0.00 C ATOM 611 C PRO A 46 60.732 20.002 57.248 1.00 0.00 C ATOM 612 O PRO A 46 59.748 20.113 56.519 1.00 0.00 O ATOM 613 CB PRO A 46 61.214 19.953 59.711 1.00 0.00 C ATOM 614 CG PRO A 46 59.904 19.645 60.351 1.00 0.00 C ATOM 615 CD PRO A 46 59.046 20.862 60.140 1.00 0.00 C ATOM 0 HA PRO A 46 61.625 21.585 58.284 1.00 0.00 H new ATOM 0 HB2 PRO A 46 61.723 19.043 59.393 1.00 0.00 H new ATOM 0 HB3 PRO A 46 61.882 20.467 60.403 1.00 0.00 H new ATOM 0 HG2 PRO A 46 59.448 18.763 59.902 1.00 0.00 H new ATOM 0 HG3 PRO A 46 60.028 19.434 61.413 1.00 0.00 H new ATOM 0 HD2 PRO A 46 57.995 20.597 60.025 1.00 0.00 H new ATOM 0 HD3 PRO A 46 59.111 21.551 60.982 1.00 0.00 H new ATOM 620 N GLU A 47 61.731 19.161 56.994 1.00 0.00 N ATOM 621 CA GLU A 47 61.726 18.303 55.815 1.00 0.00 C ATOM 622 C GLU A 47 62.978 17.434 55.769 1.00 0.00 C ATOM 623 O GLU A 47 62.936 16.288 55.317 1.00 0.00 O ATOM 624 CB GLU A 47 61.633 19.148 54.543 1.00 0.00 C ATOM 625 CG GLU A 47 60.276 19.076 53.862 1.00 0.00 C ATOM 626 CD GLU A 47 59.788 20.430 53.386 1.00 0.00 C ATOM 627 OE1 GLU A 47 60.406 20.992 52.458 1.00 0.00 O ATOM 628 OE2 GLU A 47 58.788 20.928 53.944 1.00 0.00 O ATOM 0 H GLU A 47 62.553 19.056 57.589 1.00 0.00 H new ATOM 0 HA GLU A 47 60.854 17.652 55.876 1.00 0.00 H new ATOM 0 HB2 GLU A 47 61.851 20.187 54.790 1.00 0.00 H new ATOM 0 HB3 GLU A 47 62.400 18.819 53.842 1.00 0.00 H new ATOM 0 HG2 GLU A 47 60.336 18.397 53.012 1.00 0.00 H new ATOM 0 HG3 GLU A 47 59.548 18.655 54.555 1.00 0.00 H new ATOM 633 N ASP A 48 64.092 17.983 56.239 1.00 0.00 N ATOM 634 CA ASP A 48 65.356 17.259 56.254 1.00 0.00 C ATOM 635 C ASP A 48 65.676 16.696 54.873 1.00 0.00 C ATOM 636 O ASP A 48 65.014 17.024 53.889 1.00 0.00 O ATOM 637 CB ASP A 48 65.310 16.128 57.281 1.00 0.00 C ATOM 638 CG ASP A 48 64.888 16.610 58.655 1.00 0.00 C ATOM 639 OD1 ASP A 48 65.687 17.314 59.309 1.00 0.00 O ATOM 640 OD2 ASP A 48 63.758 16.285 59.076 1.00 0.00 O ATOM 0 H ASP A 48 64.145 18.930 56.615 1.00 0.00 H new ATOM 0 HA ASP A 48 66.143 17.959 56.533 1.00 0.00 H new ATOM 0 HB2 ASP A 48 64.616 15.360 56.940 1.00 0.00 H new ATOM 0 HB3 ASP A 48 66.293 15.662 57.349 1.00 0.00 H new ATOM 644 N ASN A 49 66.696 15.846 54.808 1.00 0.00 N ATOM 645 CA ASN A 49 67.102 15.237 53.546 1.00 0.00 C ATOM 646 C ASN A 49 67.334 16.302 52.478 1.00 0.00 C ATOM 647 O ASN A 49 67.352 17.498 52.771 1.00 0.00 O ATOM 648 CB ASN A 49 66.042 14.243 53.068 1.00 0.00 C ATOM 649 CG ASN A 49 66.652 13.019 52.413 1.00 0.00 C ATOM 650 OD1 ASN A 49 67.870 12.920 52.267 1.00 0.00 O ATOM 651 ND2 ASN A 49 65.803 12.079 52.011 1.00 0.00 N ATOM 0 H ASN A 49 67.256 15.564 55.613 1.00 0.00 H new ATOM 0 HA ASN A 49 68.038 14.705 53.714 1.00 0.00 H new ATOM 0 HB2 ASN A 49 65.431 13.932 53.915 1.00 0.00 H new ATOM 0 HB3 ASN A 49 65.377 14.737 52.360 1.00 0.00 H new ATOM 0 HD21 ASN A 49 66.154 11.234 51.561 1.00 0.00 H new ATOM 0 HD22 ASN A 49 64.800 12.203 52.152 1.00 0.00 H new ATOM 657 N LYS A 50 67.512 15.860 51.238 1.00 0.00 N ATOM 658 CA LYS A 50 67.740 16.773 50.125 1.00 0.00 C ATOM 659 C LYS A 50 67.181 16.200 48.827 1.00 0.00 C ATOM 660 O LYS A 50 66.451 15.209 48.838 1.00 0.00 O ATOM 661 CB LYS A 50 69.237 17.054 49.967 1.00 0.00 C ATOM 662 CG LYS A 50 69.573 18.532 49.875 1.00 0.00 C ATOM 663 CD LYS A 50 71.071 18.771 49.958 1.00 0.00 C ATOM 664 CE LYS A 50 71.395 19.987 50.813 1.00 0.00 C ATOM 665 NZ LYS A 50 72.671 19.814 51.561 1.00 0.00 N ATOM 0 H LYS A 50 67.503 14.874 50.978 1.00 0.00 H new ATOM 0 HA LYS A 50 67.221 17.707 50.343 1.00 0.00 H new ATOM 0 HB2 LYS A 50 69.770 16.621 50.813 1.00 0.00 H new ATOM 0 HB3 LYS A 50 69.600 16.551 49.070 1.00 0.00 H new ATOM 0 HG2 LYS A 50 69.191 18.935 48.937 1.00 0.00 H new ATOM 0 HG3 LYS A 50 69.073 19.070 50.680 1.00 0.00 H new ATOM 0 HD2 LYS A 50 71.558 17.890 50.376 1.00 0.00 H new ATOM 0 HD3 LYS A 50 71.474 18.912 48.955 1.00 0.00 H new ATOM 0 HE2 LYS A 50 71.463 20.870 50.178 1.00 0.00 H new ATOM 0 HE3 LYS A 50 70.582 20.163 51.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 72.857 20.663 52.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 72.597 18.986 52.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 73.451 19.671 50.888 1.00 0.00 H new ATOM 675 N GLY A 51 67.530 16.830 47.708 1.00 0.00 N ATOM 676 CA GLY A 51 67.054 16.367 46.418 1.00 0.00 C ATOM 677 C GLY A 51 65.824 17.117 45.949 1.00 0.00 C ATOM 678 O GLY A 51 65.163 16.707 44.996 1.00 0.00 O ATOM 0 H GLY A 51 68.133 17.652 47.673 1.00 0.00 H new ATOM 0 HA2 GLY A 51 67.848 16.480 45.680 1.00 0.00 H new ATOM 0 HA3 GLY A 51 66.825 15.303 46.479 1.00 0.00 H new ATOM 682 N VAL A 52 65.513 18.221 46.623 1.00 0.00 N ATOM 683 CA VAL A 52 64.353 19.030 46.271 1.00 0.00 C ATOM 684 C VAL A 52 64.498 19.619 44.873 1.00 0.00 C ATOM 685 O VAL A 52 63.507 19.938 44.215 1.00 0.00 O ATOM 686 CB VAL A 52 64.142 20.177 47.280 1.00 0.00 C ATOM 687 CG1 VAL A 52 62.878 20.954 46.946 1.00 0.00 C ATOM 688 CG2 VAL A 52 64.085 19.632 48.699 1.00 0.00 C ATOM 0 H VAL A 52 66.049 18.575 47.416 1.00 0.00 H new ATOM 0 HA VAL A 52 63.486 18.369 46.296 1.00 0.00 H new ATOM 0 HB VAL A 52 64.988 20.861 47.212 1.00 0.00 H new ATOM 0 HG11 VAL A 52 62.745 21.760 47.668 1.00 0.00 H new ATOM 0 HG12 VAL A 52 62.964 21.375 45.944 1.00 0.00 H new ATOM 0 HG13 VAL A 52 62.018 20.285 46.986 1.00 0.00 H new ATOM 0 HG21 VAL A 52 63.936 20.454 49.399 1.00 0.00 H new ATOM 0 HG22 VAL A 52 63.258 18.927 48.785 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.021 19.123 48.931 1.00 0.00 H new ATOM 698 N PHE A 53 65.741 19.762 44.422 1.00 0.00 N ATOM 699 CA PHE A 53 66.016 20.311 43.101 1.00 0.00 C ATOM 700 C PHE A 53 65.625 19.323 42.006 1.00 0.00 C ATOM 701 O PHE A 53 64.985 19.692 41.022 1.00 0.00 O ATOM 702 CB PHE A 53 67.497 20.671 42.973 1.00 0.00 C ATOM 703 CG PHE A 53 67.740 22.133 42.736 1.00 0.00 C ATOM 704 CD1 PHE A 53 67.137 23.089 43.538 1.00 0.00 C ATOM 705 CD2 PHE A 53 68.575 22.554 41.711 1.00 0.00 C ATOM 706 CE1 PHE A 53 67.360 24.436 43.321 1.00 0.00 C ATOM 707 CE2 PHE A 53 68.802 23.899 41.490 1.00 0.00 C ATOM 708 CZ PHE A 53 68.193 24.842 42.296 1.00 0.00 C ATOM 0 H PHE A 53 66.573 19.505 44.953 1.00 0.00 H new ATOM 0 HA PHE A 53 65.417 21.214 42.980 1.00 0.00 H new ATOM 0 HB2 PHE A 53 68.016 20.367 43.882 1.00 0.00 H new ATOM 0 HB3 PHE A 53 67.932 20.101 42.152 1.00 0.00 H new ATOM 0 HD1 PHE A 53 66.486 22.778 44.341 1.00 0.00 H new ATOM 0 HD2 PHE A 53 69.053 21.821 41.078 1.00 0.00 H new ATOM 0 HE1 PHE A 53 66.883 25.171 43.953 1.00 0.00 H new ATOM 0 HE2 PHE A 53 69.454 24.213 40.689 1.00 0.00 H new ATOM 0 HZ PHE A 53 68.368 25.894 42.125 1.00 0.00 H new ATOM 717 N GLN A 54 66.013 18.065 42.187 1.00 0.00 N ATOM 718 CA GLN A 54 65.705 17.023 41.215 1.00 0.00 C ATOM 719 C GLN A 54 64.200 16.905 41.003 1.00 0.00 C ATOM 720 O GLN A 54 63.737 16.651 39.893 1.00 0.00 O ATOM 721 CB GLN A 54 66.275 15.681 41.676 1.00 0.00 C ATOM 722 CG GLN A 54 67.493 15.231 40.884 1.00 0.00 C ATOM 723 CD GLN A 54 67.290 13.886 40.215 1.00 0.00 C ATOM 724 OE1 GLN A 54 67.321 12.844 40.869 1.00 0.00 O ATOM 725 NE2 GLN A 54 67.080 13.903 38.904 1.00 0.00 N ATOM 0 H GLN A 54 66.541 17.743 42.998 1.00 0.00 H new ATOM 0 HA GLN A 54 66.166 17.298 40.266 1.00 0.00 H new ATOM 0 HB2 GLN A 54 66.544 15.753 42.730 1.00 0.00 H new ATOM 0 HB3 GLN A 54 65.499 14.920 41.596 1.00 0.00 H new ATOM 0 HG2 GLN A 54 67.725 15.979 40.125 1.00 0.00 H new ATOM 0 HG3 GLN A 54 68.354 15.175 41.550 1.00 0.00 H new ATOM 0 HE21 GLN A 54 67.062 14.791 38.402 1.00 0.00 H new ATOM 0 HE22 GLN A 54 66.936 13.028 38.399 1.00 0.00 H new ATOM 732 N GLY A 55 63.440 17.088 42.079 1.00 0.00 N ATOM 733 CA GLY A 55 61.994 16.997 41.990 1.00 0.00 C ATOM 734 C GLY A 55 61.425 17.873 40.892 1.00 0.00 C ATOM 735 O GLY A 55 60.386 17.556 40.311 1.00 0.00 O ATOM 0 H GLY A 55 63.800 17.298 43.010 1.00 0.00 H new ATOM 0 HA2 GLY A 55 61.709 15.961 41.808 1.00 0.00 H new ATOM 0 HA3 GLY A 55 61.555 17.286 42.945 1.00 0.00 H new ATOM 739 N VAL A 56 62.103 18.981 40.609 1.00 0.00 N ATOM 740 CA VAL A 56 61.658 19.907 39.575 1.00 0.00 C ATOM 741 C VAL A 56 61.491 19.195 38.236 1.00 0.00 C ATOM 742 O VAL A 56 60.717 19.630 37.381 1.00 0.00 O ATOM 743 CB VAL A 56 62.647 21.074 39.402 1.00 0.00 C ATOM 744 CG1 VAL A 56 62.181 22.011 38.299 1.00 0.00 C ATOM 745 CG2 VAL A 56 62.819 21.825 40.714 1.00 0.00 C ATOM 0 H VAL A 56 62.963 19.259 41.082 1.00 0.00 H new ATOM 0 HA VAL A 56 60.695 20.302 39.897 1.00 0.00 H new ATOM 0 HB VAL A 56 63.616 20.666 39.113 1.00 0.00 H new ATOM 0 HG11 VAL A 56 62.893 22.829 38.192 1.00 0.00 H new ATOM 0 HG12 VAL A 56 62.115 21.462 37.359 1.00 0.00 H new ATOM 0 HG13 VAL A 56 61.201 22.414 38.554 1.00 0.00 H new ATOM 0 HG21 VAL A 56 63.521 22.647 40.574 1.00 0.00 H new ATOM 0 HG22 VAL A 56 61.856 22.222 41.035 1.00 0.00 H new ATOM 0 HG23 VAL A 56 63.203 21.145 41.475 1.00 0.00 H new ATOM 755 N HIS A 57 62.220 18.097 38.060 1.00 0.00 N ATOM 756 CA HIS A 57 62.151 17.325 36.825 1.00 0.00 C ATOM 757 C HIS A 57 60.945 16.389 36.836 1.00 0.00 C ATOM 758 O HIS A 57 60.292 16.192 35.810 1.00 0.00 O ATOM 759 CB HIS A 57 63.435 16.516 36.633 1.00 0.00 C ATOM 760 CG HIS A 57 63.669 16.093 35.216 1.00 0.00 C ATOM 761 ND1 HIS A 57 62.675 16.076 34.261 1.00 0.00 N ATOM 762 CD2 HIS A 57 64.795 15.672 34.592 1.00 0.00 C ATOM 763 CE1 HIS A 57 63.177 15.660 33.112 1.00 0.00 C ATOM 764 NE2 HIS A 57 64.462 15.408 33.286 1.00 0.00 N ATOM 0 H HIS A 57 62.864 17.723 38.756 1.00 0.00 H new ATOM 0 HA HIS A 57 62.041 18.023 35.995 1.00 0.00 H new ATOM 0 HB2 HIS A 57 64.284 17.111 36.971 1.00 0.00 H new ATOM 0 HB3 HIS A 57 63.395 15.630 37.266 1.00 0.00 H new ATOM 0 HD1 HIS A 57 61.703 16.343 34.417 1.00 0.00 H new ATOM 0 HD2 HIS A 57 65.773 15.564 35.038 1.00 0.00 H new ATOM 0 HE1 HIS A 57 62.630 15.545 32.188 1.00 0.00 H new ATOM 771 N ASP A 58 60.657 15.818 38.000 1.00 0.00 N ATOM 772 CA ASP A 58 59.528 14.903 38.143 1.00 0.00 C ATOM 773 C ASP A 58 58.204 15.646 37.990 1.00 0.00 C ATOM 774 O ASP A 58 57.188 15.056 37.621 1.00 0.00 O ATOM 775 CB ASP A 58 59.581 14.205 39.501 1.00 0.00 C ATOM 776 CG ASP A 58 58.987 12.810 39.460 1.00 0.00 C ATOM 777 OD1 ASP A 58 59.740 11.853 39.185 1.00 0.00 O ATOM 778 OD2 ASP A 58 57.769 12.677 39.701 1.00 0.00 O ATOM 0 H ASP A 58 61.188 15.971 38.857 1.00 0.00 H new ATOM 0 HA ASP A 58 59.596 14.153 37.355 1.00 0.00 H new ATOM 0 HB2 ASP A 58 60.617 14.146 39.835 1.00 0.00 H new ATOM 0 HB3 ASP A 58 59.043 14.804 40.235 1.00 0.00 H new ATOM 782 N SER A 59 58.224 16.944 38.275 1.00 0.00 N ATOM 783 CA SER A 59 57.024 17.767 38.175 1.00 0.00 C ATOM 784 C SER A 59 56.405 17.656 36.785 1.00 0.00 C ATOM 785 O SER A 59 55.200 17.833 36.614 1.00 0.00 O ATOM 786 CB SER A 59 57.354 19.228 38.485 1.00 0.00 C ATOM 787 OG SER A 59 56.767 19.635 39.707 1.00 0.00 O ATOM 0 H SER A 59 59.058 17.448 38.577 1.00 0.00 H new ATOM 0 HA SER A 59 56.301 17.404 38.906 1.00 0.00 H new ATOM 0 HB2 SER A 59 58.435 19.357 38.537 1.00 0.00 H new ATOM 0 HB3 SER A 59 56.996 19.865 37.676 1.00 0.00 H new ATOM 0 HG SER A 59 56.994 20.572 39.883 1.00 0.00 H new ATOM 792 N ALA A 60 57.241 17.365 35.793 1.00 0.00 N ATOM 793 CA ALA A 60 56.778 17.229 34.418 1.00 0.00 C ATOM 794 C ALA A 60 55.601 16.263 34.328 1.00 0.00 C ATOM 795 O ALA A 60 54.728 16.412 33.472 1.00 0.00 O ATOM 796 CB ALA A 60 57.915 16.764 33.521 1.00 0.00 C ATOM 0 H ALA A 60 58.243 17.219 35.917 1.00 0.00 H new ATOM 0 HA ALA A 60 56.438 18.207 34.077 1.00 0.00 H new ATOM 0 HB1 ALA A 60 57.554 16.667 32.497 1.00 0.00 H new ATOM 0 HB2 ALA A 60 58.725 17.493 33.553 1.00 0.00 H new ATOM 0 HB3 ALA A 60 58.282 15.799 33.870 1.00 0.00 H new ATOM 802 N GLU A 61 55.586 15.272 35.214 1.00 0.00 N ATOM 803 CA GLU A 61 54.516 14.282 35.232 1.00 0.00 C ATOM 804 C GLU A 61 53.148 14.958 35.285 1.00 0.00 C ATOM 805 O GLU A 61 52.166 14.439 34.756 1.00 0.00 O ATOM 806 CB GLU A 61 54.680 13.344 36.430 1.00 0.00 C ATOM 807 CG GLU A 61 54.384 14.004 37.766 1.00 0.00 C ATOM 808 CD GLU A 61 52.947 13.808 38.209 1.00 0.00 C ATOM 809 OE1 GLU A 61 52.137 13.318 37.393 1.00 0.00 O ATOM 810 OE2 GLU A 61 52.632 14.143 39.369 1.00 0.00 O ATOM 0 H GLU A 61 56.302 15.134 35.928 1.00 0.00 H new ATOM 0 HA GLU A 61 54.579 13.701 34.312 1.00 0.00 H new ATOM 0 HB2 GLU A 61 54.018 12.487 36.303 1.00 0.00 H new ATOM 0 HB3 GLU A 61 55.700 12.960 36.442 1.00 0.00 H new ATOM 0 HG2 GLU A 61 55.053 13.596 38.524 1.00 0.00 H new ATOM 0 HG3 GLU A 61 54.596 15.071 37.695 1.00 0.00 H new ATOM 815 N LYS A 62 53.094 16.119 35.929 1.00 0.00 N ATOM 816 CA LYS A 62 51.849 16.869 36.052 1.00 0.00 C ATOM 817 C LYS A 62 51.406 17.414 34.698 1.00 0.00 C ATOM 818 O LYS A 62 52.212 17.950 33.941 1.00 0.00 O ATOM 819 CB LYS A 62 52.018 18.019 37.046 1.00 0.00 C ATOM 820 CG LYS A 62 50.782 18.281 37.890 1.00 0.00 C ATOM 821 CD LYS A 62 49.820 19.228 37.191 1.00 0.00 C ATOM 822 CE LYS A 62 48.548 19.429 38.000 1.00 0.00 C ATOM 823 NZ LYS A 62 48.720 20.463 39.057 1.00 0.00 N ATOM 0 H LYS A 62 53.898 16.561 36.374 1.00 0.00 H new ATOM 0 HA LYS A 62 51.080 16.190 36.420 1.00 0.00 H new ATOM 0 HB2 LYS A 62 52.857 17.798 37.705 1.00 0.00 H new ATOM 0 HB3 LYS A 62 52.273 18.927 36.499 1.00 0.00 H new ATOM 0 HG2 LYS A 62 50.277 17.338 38.100 1.00 0.00 H new ATOM 0 HG3 LYS A 62 51.079 18.705 38.849 1.00 0.00 H new ATOM 0 HD2 LYS A 62 50.307 20.190 37.032 1.00 0.00 H new ATOM 0 HD3 LYS A 62 49.568 18.831 36.207 1.00 0.00 H new ATOM 0 HE2 LYS A 62 47.737 19.722 37.334 1.00 0.00 H new ATOM 0 HE3 LYS A 62 48.257 18.485 38.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 47.831 20.570 39.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 49.477 20.172 39.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 48.972 21.371 38.617 1.00 0.00 H new ATOM 833 N GLY A 63 50.117 17.274 34.401 1.00 0.00 N ATOM 834 CA GLY A 63 49.591 17.760 33.139 1.00 0.00 C ATOM 835 C GLY A 63 48.129 17.403 32.945 1.00 0.00 C ATOM 836 O GLY A 63 47.807 16.421 32.276 1.00 0.00 O ATOM 0 H GLY A 63 49.429 16.833 35.011 1.00 0.00 H new ATOM 0 HA2 GLY A 63 49.707 18.843 33.093 1.00 0.00 H new ATOM 0 HA3 GLY A 63 50.176 17.342 32.320 1.00 0.00 H new ATOM 840 N LYS A 64 47.243 18.200 33.533 1.00 0.00 N ATOM 841 CA LYS A 64 45.809 17.965 33.423 1.00 0.00 C ATOM 842 C LYS A 64 45.275 18.477 32.089 1.00 0.00 C ATOM 843 O LYS A 64 45.954 19.221 31.382 1.00 0.00 O ATOM 844 CB LYS A 64 45.070 18.643 34.576 1.00 0.00 C ATOM 845 CG LYS A 64 45.418 18.075 35.941 1.00 0.00 C ATOM 846 CD LYS A 64 44.328 17.148 36.453 1.00 0.00 C ATOM 847 CE LYS A 64 44.533 15.721 35.965 1.00 0.00 C ATOM 848 NZ LYS A 64 45.110 14.851 37.026 1.00 0.00 N ATOM 0 H LYS A 64 47.494 19.016 34.092 1.00 0.00 H new ATOM 0 HA LYS A 64 45.637 16.890 33.474 1.00 0.00 H new ATOM 0 HB2 LYS A 64 45.299 19.709 34.566 1.00 0.00 H new ATOM 0 HB3 LYS A 64 43.996 18.546 34.415 1.00 0.00 H new ATOM 0 HG2 LYS A 64 46.361 17.531 35.880 1.00 0.00 H new ATOM 0 HG3 LYS A 64 45.566 18.891 36.649 1.00 0.00 H new ATOM 0 HD2 LYS A 64 44.319 17.163 37.543 1.00 0.00 H new ATOM 0 HD3 LYS A 64 43.355 17.511 36.121 1.00 0.00 H new ATOM 0 HE2 LYS A 64 43.579 15.309 35.636 1.00 0.00 H new ATOM 0 HE3 LYS A 64 45.194 15.725 35.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 45.235 13.887 36.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 46.032 15.230 37.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 44.467 14.827 37.843 1.00 0.00 H new ATOM 858 N ASP A 65 44.053 18.076 31.752 1.00 0.00 N ATOM 859 CA ASP A 65 43.426 18.497 30.505 1.00 0.00 C ATOM 860 C ASP A 65 44.236 18.021 29.303 1.00 0.00 C ATOM 861 O ASP A 65 45.362 17.550 29.448 1.00 0.00 O ATOM 862 CB ASP A 65 43.285 20.020 30.469 1.00 0.00 C ATOM 863 CG ASP A 65 41.837 20.467 30.512 1.00 0.00 C ATOM 864 OD1 ASP A 65 41.009 19.868 29.794 1.00 0.00 O ATOM 865 OD2 ASP A 65 41.533 21.417 31.263 1.00 0.00 O ATOM 0 H ASP A 65 43.477 17.460 32.326 1.00 0.00 H new ATOM 0 HA ASP A 65 42.435 18.047 30.455 1.00 0.00 H new ATOM 0 HB2 ASP A 65 43.821 20.452 31.314 1.00 0.00 H new ATOM 0 HB3 ASP A 65 43.754 20.404 29.564 1.00 0.00 H new ATOM 869 N ASN A 66 43.651 18.146 28.116 1.00 0.00 N ATOM 870 CA ASN A 66 44.317 17.727 26.887 1.00 0.00 C ATOM 871 C ASN A 66 44.714 16.256 26.960 1.00 0.00 C ATOM 872 O ASN A 66 45.695 15.837 26.346 1.00 0.00 O ATOM 873 CB ASN A 66 45.555 18.589 26.634 1.00 0.00 C ATOM 874 CG ASN A 66 45.790 18.843 25.157 1.00 0.00 C ATOM 875 OD1 ASN A 66 46.403 18.030 24.467 1.00 0.00 O ATOM 876 ND2 ASN A 66 45.301 19.976 24.667 1.00 0.00 N ATOM 0 H ASN A 66 42.718 18.534 27.979 1.00 0.00 H new ATOM 0 HA ASN A 66 43.618 17.857 26.061 1.00 0.00 H new ATOM 0 HB2 ASN A 66 45.443 19.542 27.151 1.00 0.00 H new ATOM 0 HB3 ASN A 66 46.430 18.097 27.059 1.00 0.00 H new ATOM 0 HD21 ASN A 66 45.427 20.201 23.680 1.00 0.00 H new ATOM 0 HD22 ASN A 66 44.799 20.621 25.277 1.00 0.00 H new ATOM 882 N ALA A 67 43.946 15.477 27.713 1.00 0.00 N ATOM 883 CA ALA A 67 44.216 14.052 27.863 1.00 0.00 C ATOM 884 C ALA A 67 43.021 13.328 28.476 1.00 0.00 C ATOM 885 O ALA A 67 43.178 12.307 29.144 1.00 0.00 O ATOM 886 CB ALA A 67 45.458 13.837 28.713 1.00 0.00 C ATOM 0 H ALA A 67 43.131 15.808 28.229 1.00 0.00 H new ATOM 0 HA ALA A 67 44.391 13.634 26.871 1.00 0.00 H new ATOM 0 HB1 ALA A 67 45.648 12.769 28.817 1.00 0.00 H new ATOM 0 HB2 ALA A 67 46.314 14.313 28.234 1.00 0.00 H new ATOM 0 HB3 ALA A 67 45.304 14.276 29.699 1.00 0.00 H new ATOM 892 N GLU A 68 41.827 13.865 28.244 1.00 0.00 N ATOM 893 CA GLU A 68 40.607 13.271 28.776 1.00 0.00 C ATOM 894 C GLU A 68 40.083 12.179 27.845 1.00 0.00 C ATOM 895 O GLU A 68 40.086 12.336 26.624 1.00 0.00 O ATOM 896 CB GLU A 68 39.535 14.343 28.976 1.00 0.00 C ATOM 897 CG GLU A 68 39.133 14.539 30.428 1.00 0.00 C ATOM 898 CD GLU A 68 40.266 15.080 31.279 1.00 0.00 C ATOM 899 OE1 GLU A 68 40.734 16.204 31.001 1.00 0.00 O ATOM 900 OE2 GLU A 68 40.686 14.378 32.223 1.00 0.00 O ATOM 0 H GLU A 68 41.679 14.710 27.692 1.00 0.00 H new ATOM 0 HA GLU A 68 40.844 12.821 29.740 1.00 0.00 H new ATOM 0 HB2 GLU A 68 39.901 15.290 28.578 1.00 0.00 H new ATOM 0 HB3 GLU A 68 38.652 14.074 28.396 1.00 0.00 H new ATOM 0 HG2 GLU A 68 38.287 15.225 30.478 1.00 0.00 H new ATOM 0 HG3 GLU A 68 38.797 13.587 30.840 1.00 0.00 H new ATOM 905 N GLY A 69 39.633 11.075 28.432 1.00 0.00 N ATOM 906 CA GLY A 69 39.113 9.974 27.641 1.00 0.00 C ATOM 907 C GLY A 69 37.773 10.296 27.009 1.00 0.00 C ATOM 908 O GLY A 69 37.607 11.351 26.397 1.00 0.00 O ATOM 0 H GLY A 69 39.619 10.923 29.440 1.00 0.00 H new ATOM 0 HA2 GLY A 69 39.829 9.723 26.859 1.00 0.00 H new ATOM 0 HA3 GLY A 69 39.010 9.093 28.274 1.00 0.00 H new ATOM 912 N GLN A 70 36.817 9.385 27.156 1.00 0.00 N ATOM 913 CA GLN A 70 35.486 9.578 26.592 1.00 0.00 C ATOM 914 C GLN A 70 34.560 8.429 26.979 1.00 0.00 C ATOM 915 O GLN A 70 34.945 7.262 26.922 1.00 0.00 O ATOM 916 CB GLN A 70 35.567 9.694 25.069 1.00 0.00 C ATOM 917 CG GLN A 70 34.208 9.698 24.387 1.00 0.00 C ATOM 918 CD GLN A 70 34.308 9.906 22.889 1.00 0.00 C ATOM 919 OE1 GLN A 70 33.926 9.039 22.103 1.00 0.00 O ATOM 920 NE2 GLN A 70 34.824 11.062 22.485 1.00 0.00 N ATOM 0 H GLN A 70 36.939 8.507 27.660 1.00 0.00 H new ATOM 0 HA GLN A 70 35.076 10.503 26.998 1.00 0.00 H new ATOM 0 HB2 GLN A 70 36.097 10.611 24.810 1.00 0.00 H new ATOM 0 HB3 GLN A 70 36.157 8.864 24.680 1.00 0.00 H new ATOM 0 HG2 GLN A 70 33.703 8.753 24.586 1.00 0.00 H new ATOM 0 HG3 GLN A 70 33.591 10.486 24.819 1.00 0.00 H new ATOM 0 HE21 GLN A 70 35.128 11.752 23.171 1.00 0.00 H new ATOM 0 HE22 GLN A 70 34.916 11.259 21.488 1.00 0.00 H new ATOM 927 N GLY A 71 33.336 8.769 27.373 1.00 0.00 N ATOM 928 CA GLY A 71 32.375 7.754 27.763 1.00 0.00 C ATOM 929 C GLY A 71 31.705 7.101 26.570 1.00 0.00 C ATOM 930 O GLY A 71 30.480 7.113 26.455 1.00 0.00 O ATOM 0 H GLY A 71 32.993 9.728 27.429 1.00 0.00 H new ATOM 0 HA2 GLY A 71 32.878 6.990 28.356 1.00 0.00 H new ATOM 0 HA3 GLY A 71 31.615 8.204 28.401 1.00 0.00 H new ATOM 934 N GLU A 72 32.510 6.531 25.679 1.00 0.00 N ATOM 935 CA GLU A 72 31.988 5.873 24.489 1.00 0.00 C ATOM 936 C GLU A 72 31.265 6.869 23.588 1.00 0.00 C ATOM 937 O GLU A 72 31.043 8.019 23.970 1.00 0.00 O ATOM 938 CB GLU A 72 31.034 4.741 24.881 1.00 0.00 C ATOM 939 CG GLU A 72 31.220 3.477 24.060 1.00 0.00 C ATOM 940 CD GLU A 72 31.043 2.215 24.883 1.00 0.00 C ATOM 941 OE1 GLU A 72 29.910 1.954 25.335 1.00 0.00 O ATOM 942 OE2 GLU A 72 32.041 1.489 25.074 1.00 0.00 O ATOM 0 H GLU A 72 33.527 6.512 25.760 1.00 0.00 H new ATOM 0 HA GLU A 72 32.831 5.456 23.938 1.00 0.00 H new ATOM 0 HB2 GLU A 72 31.179 4.504 25.935 1.00 0.00 H new ATOM 0 HB3 GLU A 72 30.007 5.088 24.770 1.00 0.00 H new ATOM 0 HG2 GLU A 72 30.504 3.474 23.238 1.00 0.00 H new ATOM 0 HG3 GLU A 72 32.215 3.480 23.616 1.00 0.00 H new ATOM 947 N SER A 73 30.902 6.422 22.390 1.00 0.00 N ATOM 948 CA SER A 73 30.209 7.277 21.433 1.00 0.00 C ATOM 949 C SER A 73 28.739 7.437 21.811 1.00 0.00 C ATOM 950 O SER A 73 27.913 6.570 21.524 1.00 0.00 O ATOM 951 CB SER A 73 30.323 6.694 20.023 1.00 0.00 C ATOM 952 OG SER A 73 30.486 5.287 20.064 1.00 0.00 O ATOM 0 H SER A 73 31.076 5.473 22.059 1.00 0.00 H new ATOM 0 HA SER A 73 30.680 8.260 21.453 1.00 0.00 H new ATOM 0 HB2 SER A 73 29.430 6.943 19.450 1.00 0.00 H new ATOM 0 HB3 SER A 73 31.170 7.146 19.507 1.00 0.00 H new ATOM 0 HG SER A 73 30.555 4.939 19.150 1.00 0.00 H new ATOM 957 N LEU A 74 28.422 8.553 22.458 1.00 0.00 N ATOM 958 CA LEU A 74 27.052 8.830 22.878 1.00 0.00 C ATOM 959 C LEU A 74 26.092 8.739 21.697 1.00 0.00 C ATOM 960 O LEU A 74 24.910 8.440 21.866 1.00 0.00 O ATOM 961 CB LEU A 74 26.964 10.217 23.517 1.00 0.00 C ATOM 962 CG LEU A 74 25.565 10.679 23.929 1.00 0.00 C ATOM 963 CD1 LEU A 74 24.977 9.735 24.967 1.00 0.00 C ATOM 964 CD2 LEU A 74 25.610 12.102 24.464 1.00 0.00 C ATOM 0 H LEU A 74 29.094 9.280 22.703 1.00 0.00 H new ATOM 0 HA LEU A 74 26.765 8.079 23.614 1.00 0.00 H new ATOM 0 HB2 LEU A 74 27.604 10.230 24.400 1.00 0.00 H new ATOM 0 HB3 LEU A 74 27.373 10.945 22.816 1.00 0.00 H new ATOM 0 HG LEU A 74 24.923 10.664 23.048 1.00 0.00 H new ATOM 0 HD11 LEU A 74 23.982 10.079 25.249 1.00 0.00 H new ATOM 0 HD12 LEU A 74 24.909 8.731 24.549 1.00 0.00 H new ATOM 0 HD13 LEU A 74 25.618 9.718 25.848 1.00 0.00 H new ATOM 0 HD21 LEU A 74 24.606 12.414 24.752 1.00 0.00 H new ATOM 0 HD22 LEU A 74 26.267 12.143 25.333 1.00 0.00 H new ATOM 0 HD23 LEU A 74 25.990 12.770 23.691 1.00 0.00 H new ATOM 975 N ALA A 75 26.608 8.996 20.500 1.00 0.00 N ATOM 976 CA ALA A 75 25.798 8.939 19.290 1.00 0.00 C ATOM 977 C ALA A 75 25.052 7.613 19.191 1.00 0.00 C ATOM 978 O ALA A 75 23.963 7.543 18.621 1.00 0.00 O ATOM 979 CB ALA A 75 26.669 9.149 18.060 1.00 0.00 C ATOM 0 H ALA A 75 27.584 9.246 20.342 1.00 0.00 H new ATOM 0 HA ALA A 75 25.060 9.739 19.340 1.00 0.00 H new ATOM 0 HB1 ALA A 75 26.050 9.104 17.164 1.00 0.00 H new ATOM 0 HB2 ALA A 75 27.152 10.124 18.118 1.00 0.00 H new ATOM 0 HB3 ALA A 75 27.430 8.369 18.015 1.00 0.00 H new ATOM 985 N ASP A 76 25.646 6.562 19.747 1.00 0.00 N ATOM 986 CA ASP A 76 25.037 5.237 19.722 1.00 0.00 C ATOM 987 C ASP A 76 23.898 5.144 20.732 1.00 0.00 C ATOM 988 O ASP A 76 22.896 4.472 20.491 1.00 0.00 O ATOM 989 CB ASP A 76 26.087 4.165 20.016 1.00 0.00 C ATOM 990 CG ASP A 76 25.835 2.882 19.247 1.00 0.00 C ATOM 991 OD1 ASP A 76 25.771 2.940 18.002 1.00 0.00 O ATOM 992 OD2 ASP A 76 25.702 1.821 19.891 1.00 0.00 O ATOM 0 H ASP A 76 26.549 6.602 20.220 1.00 0.00 H new ATOM 0 HA ASP A 76 24.628 5.070 18.725 1.00 0.00 H new ATOM 0 HB2 ASP A 76 27.075 4.549 19.763 1.00 0.00 H new ATOM 0 HB3 ASP A 76 26.093 3.950 21.085 1.00 0.00 H new ATOM 996 N GLN A 77 24.061 5.820 21.865 1.00 0.00 N ATOM 997 CA GLN A 77 23.047 5.811 22.911 1.00 0.00 C ATOM 998 C GLN A 77 21.865 6.698 22.534 1.00 0.00 C ATOM 999 O GLN A 77 20.739 6.467 22.971 1.00 0.00 O ATOM 1000 CB GLN A 77 23.649 6.280 24.238 1.00 0.00 C ATOM 1001 CG GLN A 77 23.917 5.149 25.218 1.00 0.00 C ATOM 1002 CD GLN A 77 22.788 4.957 26.210 1.00 0.00 C ATOM 1003 OE1 GLN A 77 22.822 5.493 27.319 1.00 0.00 O ATOM 1004 NE2 GLN A 77 21.779 4.189 25.818 1.00 0.00 N ATOM 0 H GLN A 77 24.885 6.380 22.081 1.00 0.00 H new ATOM 0 HA GLN A 77 22.687 4.788 23.023 1.00 0.00 H new ATOM 0 HB2 GLN A 77 24.583 6.805 24.038 1.00 0.00 H new ATOM 0 HB3 GLN A 77 22.972 6.998 24.701 1.00 0.00 H new ATOM 0 HG2 GLN A 77 24.071 4.223 24.665 1.00 0.00 H new ATOM 0 HG3 GLN A 77 24.841 5.354 25.760 1.00 0.00 H new ATOM 0 HE21 GLN A 77 21.792 3.765 24.891 1.00 0.00 H new ATOM 0 HE22 GLN A 77 20.991 4.023 26.444 1.00 0.00 H new ATOM 1011 N ALA A 78 22.131 7.713 21.718 1.00 0.00 N ATOM 1012 CA ALA A 78 21.089 8.634 21.281 1.00 0.00 C ATOM 1013 C ALA A 78 20.153 7.966 20.278 1.00 0.00 C ATOM 1014 O ALA A 78 18.932 8.035 20.414 1.00 0.00 O ATOM 1015 CB ALA A 78 21.710 9.883 20.675 1.00 0.00 C ATOM 0 H ALA A 78 23.059 7.918 21.347 1.00 0.00 H new ATOM 0 HA ALA A 78 20.501 8.920 22.153 1.00 0.00 H new ATOM 0 HB1 ALA A 78 20.921 10.562 20.353 1.00 0.00 H new ATOM 0 HB2 ALA A 78 22.333 10.378 21.420 1.00 0.00 H new ATOM 0 HB3 ALA A 78 22.322 9.605 19.817 1.00 0.00 H new ATOM 1021 N ARG A 79 20.734 7.323 19.271 1.00 0.00 N ATOM 1022 CA ARG A 79 19.951 6.647 18.243 1.00 0.00 C ATOM 1023 C ARG A 79 19.011 5.619 18.866 1.00 0.00 C ATOM 1024 O ARG A 79 17.965 5.298 18.302 1.00 0.00 O ATOM 1025 CB ARG A 79 20.876 5.961 17.236 1.00 0.00 C ATOM 1026 CG ARG A 79 21.178 6.811 16.013 1.00 0.00 C ATOM 1027 CD ARG A 79 20.078 6.696 14.969 1.00 0.00 C ATOM 1028 NE ARG A 79 20.162 5.443 14.222 1.00 0.00 N ATOM 1029 CZ ARG A 79 19.356 5.137 13.211 1.00 0.00 C ATOM 1030 NH1 ARG A 79 18.413 5.987 12.828 1.00 0.00 N ATOM 1031 NH2 ARG A 79 19.493 3.977 12.580 1.00 0.00 N ATOM 0 H ARG A 79 21.744 7.256 19.145 1.00 0.00 H new ATOM 0 HA ARG A 79 19.353 7.397 17.725 1.00 0.00 H new ATOM 0 HB2 ARG A 79 21.813 5.705 17.731 1.00 0.00 H new ATOM 0 HB3 ARG A 79 20.419 5.025 16.914 1.00 0.00 H new ATOM 0 HG2 ARG A 79 21.290 7.853 16.312 1.00 0.00 H new ATOM 0 HG3 ARG A 79 22.128 6.500 15.578 1.00 0.00 H new ATOM 0 HD2 ARG A 79 19.106 6.762 15.458 1.00 0.00 H new ATOM 0 HD3 ARG A 79 20.145 7.536 14.277 1.00 0.00 H new ATOM 0 HE ARG A 79 20.877 4.767 14.491 1.00 0.00 H new ATOM 0 HH11 ARG A 79 18.304 6.879 13.310 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.796 5.748 12.051 1.00 0.00 H new ATOM 0 HH21 ARG A 79 20.217 3.320 12.871 1.00 0.00 H new ATOM 0 HH22 ARG A 79 18.874 3.742 11.804 1.00 0.00 H new ATOM 1042 N ASP A 80 19.391 5.106 20.031 1.00 0.00 N ATOM 1043 CA ASP A 80 18.582 4.116 20.732 1.00 0.00 C ATOM 1044 C ASP A 80 17.378 4.772 21.401 1.00 0.00 C ATOM 1045 O ASP A 80 16.261 4.258 21.333 1.00 0.00 O ATOM 1046 CB ASP A 80 19.426 3.384 21.777 1.00 0.00 C ATOM 1047 CG ASP A 80 19.149 1.892 21.802 1.00 0.00 C ATOM 1048 OD1 ASP A 80 19.204 1.260 20.725 1.00 0.00 O ATOM 1049 OD2 ASP A 80 18.880 1.358 22.897 1.00 0.00 O ATOM 0 H ASP A 80 20.255 5.360 20.510 1.00 0.00 H new ATOM 0 HA ASP A 80 18.219 3.395 19.999 1.00 0.00 H new ATOM 0 HB2 ASP A 80 20.483 3.551 21.569 1.00 0.00 H new ATOM 0 HB3 ASP A 80 19.225 3.805 22.762 1.00 0.00 H new ATOM 1053 N TYR A 81 17.613 5.908 22.046 1.00 0.00 N ATOM 1054 CA TYR A 81 16.549 6.633 22.731 1.00 0.00 C ATOM 1055 C TYR A 81 15.604 7.288 21.728 1.00 0.00 C ATOM 1056 O TYR A 81 14.385 7.267 21.902 1.00 0.00 O ATOM 1057 CB TYR A 81 17.142 7.696 23.658 1.00 0.00 C ATOM 1058 CG TYR A 81 16.103 8.446 24.461 1.00 0.00 C ATOM 1059 CD1 TYR A 81 15.040 7.777 25.057 1.00 0.00 C ATOM 1060 CD2 TYR A 81 16.185 9.824 24.624 1.00 0.00 C ATOM 1061 CE1 TYR A 81 14.089 8.458 25.791 1.00 0.00 C ATOM 1062 CE2 TYR A 81 15.238 10.512 25.358 1.00 0.00 C ATOM 1063 CZ TYR A 81 14.193 9.826 25.938 1.00 0.00 C ATOM 1064 OH TYR A 81 13.247 10.509 26.669 1.00 0.00 O ATOM 0 H TYR A 81 18.531 6.348 22.109 1.00 0.00 H new ATOM 0 HA TYR A 81 15.981 5.918 23.326 1.00 0.00 H new ATOM 0 HB2 TYR A 81 17.843 7.219 24.342 1.00 0.00 H new ATOM 0 HB3 TYR A 81 17.713 8.408 23.062 1.00 0.00 H new ATOM 0 HD1 TYR A 81 14.957 6.706 24.944 1.00 0.00 H new ATOM 0 HD2 TYR A 81 17.002 10.365 24.170 1.00 0.00 H new ATOM 0 HE1 TYR A 81 13.269 7.923 26.247 1.00 0.00 H new ATOM 0 HE2 TYR A 81 15.316 11.583 25.477 1.00 0.00 H new ATOM 0 HH TYR A 81 13.466 11.464 26.676 1.00 0.00 H new ATOM 1073 N MET A 82 16.176 7.870 20.678 1.00 0.00 N ATOM 1074 CA MET A 82 15.384 8.529 19.647 1.00 0.00 C ATOM 1075 C MET A 82 14.466 7.533 18.945 1.00 0.00 C ATOM 1076 O MET A 82 13.253 7.726 18.890 1.00 0.00 O ATOM 1077 CB MET A 82 16.302 9.202 18.623 1.00 0.00 C ATOM 1078 CG MET A 82 16.611 10.655 18.949 1.00 0.00 C ATOM 1079 SD MET A 82 15.297 11.777 18.434 1.00 0.00 S ATOM 1080 CE MET A 82 15.251 12.904 19.826 1.00 0.00 C ATOM 0 H MET A 82 17.183 7.898 20.520 1.00 0.00 H new ATOM 0 HA MET A 82 14.767 9.288 20.128 1.00 0.00 H new ATOM 0 HB2 MET A 82 17.237 8.645 18.563 1.00 0.00 H new ATOM 0 HB3 MET A 82 15.836 9.150 17.639 1.00 0.00 H new ATOM 0 HG2 MET A 82 16.770 10.757 20.023 1.00 0.00 H new ATOM 0 HG3 MET A 82 17.542 10.943 18.460 1.00 0.00 H new ATOM 0 HE1 MET A 82 14.484 13.660 19.657 1.00 0.00 H new ATOM 0 HE2 MET A 82 15.020 12.350 20.736 1.00 0.00 H new ATOM 0 HE3 MET A 82 16.221 13.389 19.934 1.00 0.00 H new ATOM 1088 N GLY A 83 15.055 6.468 18.410 1.00 0.00 N ATOM 1089 CA GLY A 83 14.274 5.457 17.719 1.00 0.00 C ATOM 1090 C GLY A 83 13.171 4.883 18.587 1.00 0.00 C ATOM 1091 O GLY A 83 12.098 4.540 18.092 1.00 0.00 O ATOM 0 H GLY A 83 16.058 6.287 18.442 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.836 5.892 16.821 1.00 0.00 H new ATOM 0 HA3 GLY A 83 14.933 4.652 17.395 1.00 0.00 H new ATOM 1095 N ALA A 84 13.438 4.775 19.884 1.00 0.00 N ATOM 1096 CA ALA A 84 12.460 4.238 20.823 1.00 0.00 C ATOM 1097 C ALA A 84 11.161 5.036 20.779 1.00 0.00 C ATOM 1098 O ALA A 84 10.075 4.466 20.676 1.00 0.00 O ATOM 1099 CB ALA A 84 13.031 4.233 22.234 1.00 0.00 C ATOM 0 H ALA A 84 14.323 5.052 20.309 1.00 0.00 H new ATOM 0 HA ALA A 84 12.236 3.212 20.529 1.00 0.00 H new ATOM 0 HB1 ALA A 84 12.290 3.830 22.925 1.00 0.00 H new ATOM 0 HB2 ALA A 84 13.928 3.614 22.261 1.00 0.00 H new ATOM 0 HB3 ALA A 84 13.284 5.252 22.528 1.00 0.00 H new ATOM 1105 N ALA A 85 11.281 6.357 20.858 1.00 0.00 N ATOM 1106 CA ALA A 85 10.116 7.233 20.827 1.00 0.00 C ATOM 1107 C ALA A 85 9.304 7.019 19.555 1.00 0.00 C ATOM 1108 O ALA A 85 8.081 7.167 19.554 1.00 0.00 O ATOM 1109 CB ALA A 85 10.546 8.688 20.941 1.00 0.00 C ATOM 0 H ALA A 85 12.173 6.844 20.944 1.00 0.00 H new ATOM 0 HA ALA A 85 9.483 6.985 21.679 1.00 0.00 H new ATOM 0 HB1 ALA A 85 9.666 9.331 20.916 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.078 8.838 21.880 1.00 0.00 H new ATOM 0 HB3 ALA A 85 11.202 8.940 20.108 1.00 0.00 H new ATOM 1115 N LYS A 86 9.989 6.671 18.471 1.00 0.00 N ATOM 1116 CA LYS A 86 9.332 6.434 17.191 1.00 0.00 C ATOM 1117 C LYS A 86 8.388 5.240 17.277 1.00 0.00 C ATOM 1118 O LYS A 86 7.201 5.351 16.968 1.00 0.00 O ATOM 1119 CB LYS A 86 10.373 6.199 16.096 1.00 0.00 C ATOM 1120 CG LYS A 86 11.461 7.256 16.053 1.00 0.00 C ATOM 1121 CD LYS A 86 10.880 8.649 15.888 1.00 0.00 C ATOM 1122 CE LYS A 86 11.824 9.561 15.117 1.00 0.00 C ATOM 1123 NZ LYS A 86 11.866 9.220 13.669 1.00 0.00 N ATOM 0 H LYS A 86 11.001 6.547 18.454 1.00 0.00 H new ATOM 0 HA LYS A 86 8.747 7.319 16.942 1.00 0.00 H new ATOM 0 HB2 LYS A 86 10.833 5.222 16.248 1.00 0.00 H new ATOM 0 HB3 LYS A 86 9.870 6.168 15.129 1.00 0.00 H new ATOM 0 HG2 LYS A 86 12.048 7.212 16.970 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.142 7.045 15.228 1.00 0.00 H new ATOM 0 HD2 LYS A 86 9.926 8.586 15.365 1.00 0.00 H new ATOM 0 HD3 LYS A 86 10.678 9.079 16.869 1.00 0.00 H new ATOM 0 HE2 LYS A 86 11.507 10.597 15.237 1.00 0.00 H new ATOM 0 HE3 LYS A 86 12.827 9.484 15.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 12.322 9.993 13.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 12.408 8.343 13.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.897 9.086 13.316 1.00 0.00 H new ATOM 1133 N SER A 87 8.921 4.098 17.698 1.00 0.00 N ATOM 1134 CA SER A 87 8.127 2.881 17.821 1.00 0.00 C ATOM 1135 C SER A 87 6.986 3.076 18.815 1.00 0.00 C ATOM 1136 O SER A 87 5.848 2.689 18.554 1.00 0.00 O ATOM 1137 CB SER A 87 9.010 1.713 18.263 1.00 0.00 C ATOM 1138 OG SER A 87 8.480 0.476 17.818 1.00 0.00 O ATOM 0 H SER A 87 9.901 3.990 17.960 1.00 0.00 H new ATOM 0 HA SER A 87 7.700 2.654 16.844 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.017 1.844 17.867 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.093 1.707 19.350 1.00 0.00 H new ATOM 0 HG SER A 87 9.063 -0.255 18.112 1.00 0.00 H new ATOM 1143 N LYS A 88 7.301 3.679 19.956 1.00 0.00 N ATOM 1144 CA LYS A 88 6.305 3.927 20.991 1.00 0.00 C ATOM 1145 C LYS A 88 5.223 4.879 20.488 1.00 0.00 C ATOM 1146 O LYS A 88 4.030 4.591 20.593 1.00 0.00 O ATOM 1147 CB LYS A 88 6.971 4.511 22.240 1.00 0.00 C ATOM 1148 CG LYS A 88 7.754 3.489 23.045 1.00 0.00 C ATOM 1149 CD LYS A 88 6.841 2.440 23.656 1.00 0.00 C ATOM 1150 CE LYS A 88 6.678 2.648 25.153 1.00 0.00 C ATOM 1151 NZ LYS A 88 5.599 1.790 25.717 1.00 0.00 N ATOM 0 H LYS A 88 8.239 4.005 20.187 1.00 0.00 H new ATOM 0 HA LYS A 88 5.838 2.976 21.246 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.641 5.317 21.941 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.205 4.953 22.877 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.488 3.003 22.402 1.00 0.00 H new ATOM 0 HG3 LYS A 88 8.308 3.995 23.836 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.864 2.480 23.173 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.249 1.447 23.468 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.619 2.425 25.655 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.451 3.695 25.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 5.519 1.961 26.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.696 2.020 25.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.828 0.789 25.550 1.00 0.00 H new ATOM 1161 N LEU A 89 5.647 6.012 19.941 1.00 0.00 N ATOM 1162 CA LEU A 89 4.714 7.006 19.419 1.00 0.00 C ATOM 1163 C LEU A 89 3.728 6.368 18.446 1.00 0.00 C ATOM 1164 O LEU A 89 2.514 6.488 18.610 1.00 0.00 O ATOM 1165 CB LEU A 89 5.476 8.134 18.723 1.00 0.00 C ATOM 1166 CG LEU A 89 4.623 9.264 18.146 1.00 0.00 C ATOM 1167 CD1 LEU A 89 3.589 9.724 19.159 1.00 0.00 C ATOM 1168 CD2 LEU A 89 5.504 10.428 17.712 1.00 0.00 C ATOM 0 H LEU A 89 6.630 6.266 19.847 1.00 0.00 H new ATOM 0 HA LEU A 89 4.154 7.418 20.258 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.179 8.564 19.436 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.066 7.702 17.915 1.00 0.00 H new ATOM 0 HG LEU A 89 4.097 8.885 17.270 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.992 10.529 18.730 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.939 8.889 19.420 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.093 10.085 20.055 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.881 11.224 17.304 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.057 10.806 18.572 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.205 10.089 16.950 1.00 0.00 H new ATOM 1179 N ASN A 90 4.257 5.688 17.435 1.00 0.00 N ATOM 1180 CA ASN A 90 3.422 5.028 16.436 1.00 0.00 C ATOM 1181 C ASN A 90 2.488 4.017 17.092 1.00 0.00 C ATOM 1182 O ASN A 90 1.407 3.730 16.576 1.00 0.00 O ATOM 1183 CB ASN A 90 4.296 4.330 15.392 1.00 0.00 C ATOM 1184 CG ASN A 90 3.939 4.736 13.974 1.00 0.00 C ATOM 1185 OD1 ASN A 90 3.754 5.919 13.684 1.00 0.00 O ATOM 1186 ND2 ASN A 90 3.840 3.755 13.086 1.00 0.00 N ATOM 0 H ASN A 90 5.260 5.579 17.285 1.00 0.00 H new ATOM 0 HA ASN A 90 2.817 5.789 15.943 1.00 0.00 H new ATOM 0 HB2 ASN A 90 5.343 4.566 15.582 1.00 0.00 H new ATOM 0 HB3 ASN A 90 4.189 3.250 15.496 1.00 0.00 H new ATOM 0 HD21 ASN A 90 3.602 3.966 12.117 1.00 0.00 H new ATOM 0 HD22 ASN A 90 4.002 2.790 13.372 1.00 0.00 H new ATOM 1192 N ASP A 91 2.910 3.478 18.231 1.00 0.00 N ATOM 1193 CA ASP A 91 2.110 2.500 18.957 1.00 0.00 C ATOM 1194 C ASP A 91 0.894 3.161 19.597 1.00 0.00 C ATOM 1195 O ASP A 91 -0.181 2.565 19.673 1.00 0.00 O ATOM 1196 CB ASP A 91 2.957 1.813 20.030 1.00 0.00 C ATOM 1197 CG ASP A 91 3.147 0.334 19.758 1.00 0.00 C ATOM 1198 OD1 ASP A 91 3.561 -0.014 18.631 1.00 0.00 O ATOM 1199 OD2 ASP A 91 2.884 -0.476 20.671 1.00 0.00 O ATOM 0 H ASP A 91 3.802 3.703 18.671 1.00 0.00 H new ATOM 0 HA ASP A 91 1.761 1.751 18.246 1.00 0.00 H new ATOM 0 HB2 ASP A 91 3.932 2.298 20.085 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.482 1.943 21.002 1.00 0.00 H new ATOM 1203 N ALA A 92 1.071 4.395 20.059 1.00 0.00 N ATOM 1204 CA ALA A 92 -0.012 5.136 20.693 1.00 0.00 C ATOM 1205 C ALA A 92 -0.925 5.771 19.649 1.00 0.00 C ATOM 1206 O ALA A 92 -2.150 5.687 19.749 1.00 0.00 O ATOM 1207 CB ALA A 92 0.551 6.201 21.622 1.00 0.00 C ATOM 0 H ALA A 92 1.954 4.902 20.006 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.606 4.435 21.280 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -0.269 6.747 22.089 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.157 5.727 22.394 1.00 0.00 H new ATOM 0 HB3 ALA A 92 1.169 6.893 21.050 1.00 0.00 H new ATOM 1213 N VAL A 93 -0.323 6.407 18.650 1.00 0.00 N ATOM 1214 CA VAL A 93 -1.083 7.055 17.589 1.00 0.00 C ATOM 1215 C VAL A 93 -2.081 6.091 16.958 1.00 0.00 C ATOM 1216 O VAL A 93 -3.277 6.367 16.904 1.00 0.00 O ATOM 1217 CB VAL A 93 -0.154 7.608 16.491 1.00 0.00 C ATOM 1218 CG1 VAL A 93 -0.945 8.438 15.490 1.00 0.00 C ATOM 1219 CG2 VAL A 93 0.970 8.427 17.106 1.00 0.00 C ATOM 0 H VAL A 93 0.689 6.487 18.553 1.00 0.00 H new ATOM 0 HA VAL A 93 -1.624 7.882 18.048 1.00 0.00 H new ATOM 0 HB VAL A 93 0.291 6.767 15.958 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -0.272 8.820 14.722 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -1.710 7.816 15.025 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -1.420 9.273 16.005 1.00 0.00 H new ATOM 0 HG21 VAL A 93 1.616 8.809 16.316 1.00 0.00 H new ATOM 0 HG22 VAL A 93 0.548 9.262 17.665 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.553 7.798 17.778 1.00 0.00 H new ATOM 1229 N GLU A 94 -1.578 4.955 16.482 1.00 0.00 N ATOM 1230 CA GLU A 94 -2.426 3.949 15.854 1.00 0.00 C ATOM 1231 C GLU A 94 -3.632 3.630 16.732 1.00 0.00 C ATOM 1232 O GLU A 94 -4.732 3.392 16.231 1.00 0.00 O ATOM 1233 CB GLU A 94 -1.626 2.673 15.584 1.00 0.00 C ATOM 1234 CG GLU A 94 -1.574 2.286 14.116 1.00 0.00 C ATOM 1235 CD GLU A 94 -2.232 0.949 13.840 1.00 0.00 C ATOM 1236 OE1 GLU A 94 -3.436 0.807 14.144 1.00 0.00 O ATOM 1237 OE2 GLU A 94 -1.545 0.044 13.324 1.00 0.00 O ATOM 0 H GLU A 94 -0.589 4.709 16.520 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.784 4.352 14.907 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.609 2.807 15.952 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -2.064 1.852 16.152 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.066 3.058 13.523 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -0.534 2.249 13.791 1.00 0.00 H new ATOM 1242 N TYR A 95 -3.418 3.627 18.043 1.00 0.00 N ATOM 1243 CA TYR A 95 -4.486 3.334 18.991 1.00 0.00 C ATOM 1244 C TYR A 95 -5.420 4.531 19.146 1.00 0.00 C ATOM 1245 O TYR A 95 -6.639 4.376 19.225 1.00 0.00 O ATOM 1246 CB TYR A 95 -3.900 2.952 20.350 1.00 0.00 C ATOM 1247 CG TYR A 95 -4.930 2.450 21.336 1.00 0.00 C ATOM 1248 CD1 TYR A 95 -5.781 3.333 21.990 1.00 0.00 C ATOM 1249 CD2 TYR A 95 -5.055 1.094 21.615 1.00 0.00 C ATOM 1250 CE1 TYR A 95 -6.725 2.881 22.892 1.00 0.00 C ATOM 1251 CE2 TYR A 95 -5.996 0.633 22.513 1.00 0.00 C ATOM 1252 CZ TYR A 95 -6.829 1.530 23.150 1.00 0.00 C ATOM 1253 OH TYR A 95 -7.767 1.074 24.047 1.00 0.00 O ATOM 0 H TYR A 95 -2.514 3.824 18.473 1.00 0.00 H new ATOM 0 HA TYR A 95 -5.062 2.494 18.602 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -3.142 2.182 20.206 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.395 3.820 20.775 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.703 4.391 21.790 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.404 0.389 21.120 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -7.378 3.581 23.392 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -6.080 -0.424 22.716 1.00 0.00 H new ATOM 0 HH TYR A 95 -7.709 0.098 24.113 1.00 0.00 H new ATOM 1262 N VAL A 96 -4.839 5.725 19.188 1.00 0.00 N ATOM 1263 CA VAL A 96 -5.617 6.950 19.331 1.00 0.00 C ATOM 1264 C VAL A 96 -6.511 7.179 18.117 1.00 0.00 C ATOM 1265 O VAL A 96 -7.712 7.402 18.253 1.00 0.00 O ATOM 1266 CB VAL A 96 -4.704 8.175 19.521 1.00 0.00 C ATOM 1267 CG1 VAL A 96 -5.533 9.425 19.777 1.00 0.00 C ATOM 1268 CG2 VAL A 96 -3.720 7.936 20.657 1.00 0.00 C ATOM 0 H VAL A 96 -3.831 5.871 19.125 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.239 6.828 20.218 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.135 8.327 18.604 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.870 10.280 19.909 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.193 9.604 18.928 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.131 9.287 20.678 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.083 8.812 20.777 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.268 7.757 21.582 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.103 7.067 20.427 1.00 0.00 H new ATOM 1278 N SER A 97 -5.915 7.121 16.932 1.00 0.00 N ATOM 1279 CA SER A 97 -6.656 7.325 15.693 1.00 0.00 C ATOM 1280 C SER A 97 -7.778 6.301 15.556 1.00 0.00 C ATOM 1281 O SER A 97 -8.824 6.583 14.972 1.00 0.00 O ATOM 1282 CB SER A 97 -5.715 7.231 14.489 1.00 0.00 C ATOM 1283 OG SER A 97 -5.800 8.393 13.683 1.00 0.00 O ATOM 0 H SER A 97 -4.921 6.934 16.803 1.00 0.00 H new ATOM 0 HA SER A 97 -7.098 8.321 15.723 1.00 0.00 H new ATOM 0 HB2 SER A 97 -4.690 7.099 14.834 1.00 0.00 H new ATOM 0 HB3 SER A 97 -5.967 6.353 13.894 1.00 0.00 H new ATOM 0 HG SER A 97 -5.188 8.309 12.922 1.00 0.00 H new ATOM 1288 N GLY A 98 -7.554 5.109 16.101 1.00 0.00 N ATOM 1289 CA GLY A 98 -8.555 4.061 16.031 1.00 0.00 C ATOM 1290 C GLY A 98 -9.667 4.253 17.042 1.00 0.00 C ATOM 1291 O GLY A 98 -10.770 3.733 16.866 1.00 0.00 O ATOM 0 H GLY A 98 -6.697 4.851 16.590 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -8.981 4.036 15.028 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -8.078 3.095 16.199 1.00 0.00 H new ATOM 1295 N ARG A 99 -9.379 4.998 18.103 1.00 0.00 N ATOM 1296 CA ARG A 99 -10.363 5.255 19.147 1.00 0.00 C ATOM 1297 C ARG A 99 -11.197 6.489 18.818 1.00 0.00 C ATOM 1298 O ARG A 99 -12.425 6.460 18.888 1.00 0.00 O ATOM 1299 CB ARG A 99 -9.669 5.440 20.498 1.00 0.00 C ATOM 1300 CG ARG A 99 -9.728 4.210 21.388 1.00 0.00 C ATOM 1301 CD ARG A 99 -10.856 4.309 22.401 1.00 0.00 C ATOM 1302 NE ARG A 99 -10.438 3.867 23.730 1.00 0.00 N ATOM 1303 CZ ARG A 99 -11.203 3.966 24.811 1.00 0.00 C ATOM 1304 NH1 ARG A 99 -12.419 4.486 24.722 1.00 0.00 N ATOM 1305 NH2 ARG A 99 -10.752 3.543 25.985 1.00 0.00 N ATOM 0 H ARG A 99 -8.471 5.435 18.263 1.00 0.00 H new ATOM 0 HA ARG A 99 -11.028 4.393 19.203 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.625 5.704 20.327 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -10.129 6.279 21.021 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.867 3.321 20.773 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -8.778 4.091 21.910 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -11.205 5.340 22.455 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.698 3.704 22.066 1.00 0.00 H new ATOM 0 HE ARG A 99 -9.508 3.460 23.833 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.770 4.812 23.821 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -13.004 4.561 25.554 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -9.817 3.141 26.058 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.340 3.619 26.815 1.00 0.00 H new ATOM 1316 N VAL A 100 -10.520 7.576 18.458 1.00 0.00 N ATOM 1317 CA VAL A 100 -11.197 8.821 18.118 1.00 0.00 C ATOM 1318 C VAL A 100 -12.284 8.588 17.076 1.00 0.00 C ATOM 1319 O VAL A 100 -13.407 9.075 17.215 1.00 0.00 O ATOM 1320 CB VAL A 100 -10.206 9.871 17.582 1.00 0.00 C ATOM 1321 CG1 VAL A 100 -10.944 11.126 17.142 1.00 0.00 C ATOM 1322 CG2 VAL A 100 -9.157 10.198 18.634 1.00 0.00 C ATOM 0 H VAL A 100 -9.503 7.618 18.395 1.00 0.00 H new ATOM 0 HA VAL A 100 -11.651 9.195 19.036 1.00 0.00 H new ATOM 0 HB VAL A 100 -9.697 9.456 16.712 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -10.228 11.857 16.766 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -11.653 10.874 16.353 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -11.482 11.548 17.991 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.465 10.941 18.239 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -9.646 10.594 19.524 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -8.608 9.293 18.894 1.00 0.00 H new ATOM 1332 N HIS A 101 -11.946 7.838 16.033 1.00 0.00 N ATOM 1333 CA HIS A 101 -12.895 7.537 14.966 1.00 0.00 C ATOM 1334 C HIS A 101 -12.852 6.057 14.601 1.00 0.00 C ATOM 1335 O HIS A 101 -12.027 5.304 15.117 1.00 0.00 O ATOM 1336 CB HIS A 101 -12.594 8.388 13.733 1.00 0.00 C ATOM 1337 CG HIS A 101 -13.775 9.165 13.237 1.00 0.00 C ATOM 1338 ND1 HIS A 101 -14.363 10.182 13.959 1.00 0.00 N ATOM 1339 CD2 HIS A 101 -14.477 9.069 12.083 1.00 0.00 C ATOM 1340 CE1 HIS A 101 -15.377 10.678 13.271 1.00 0.00 C ATOM 1341 NE2 HIS A 101 -15.466 10.020 12.130 1.00 0.00 N ATOM 0 H HIS A 101 -11.022 7.427 15.903 1.00 0.00 H new ATOM 0 HA HIS A 101 -13.896 7.774 15.326 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -11.787 9.081 13.969 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -12.234 7.740 12.934 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -14.293 8.374 11.277 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -16.022 11.484 13.588 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -16.158 10.191 11.401 1.00 0.00 H new ATOM 1348 N GLY A 102 -13.747 5.645 13.707 1.00 0.00 N ATOM 1349 CA GLY A 102 -13.794 4.257 13.289 1.00 0.00 C ATOM 1350 C GLY A 102 -12.664 3.897 12.344 1.00 0.00 C ATOM 1351 O GLY A 102 -11.862 4.753 11.973 1.00 0.00 O ATOM 0 H GLY A 102 -14.440 6.249 13.265 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.747 3.614 14.168 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.748 4.060 12.801 1.00 0.00 H new ATOM 1355 N GLU A 103 -12.603 2.628 11.953 1.00 0.00 N ATOM 1356 CA GLU A 103 -11.562 2.158 11.046 1.00 0.00 C ATOM 1357 C GLU A 103 -11.966 2.381 9.592 1.00 0.00 C ATOM 1358 O GLU A 103 -12.971 3.033 9.309 1.00 0.00 O ATOM 1359 CB GLU A 103 -11.279 0.673 11.287 1.00 0.00 C ATOM 1360 CG GLU A 103 -9.802 0.320 11.236 1.00 0.00 C ATOM 1361 CD GLU A 103 -9.308 -0.301 12.529 1.00 0.00 C ATOM 1362 OE1 GLU A 103 -9.919 -1.293 12.979 1.00 0.00 O ATOM 1363 OE2 GLU A 103 -8.311 0.202 13.087 1.00 0.00 O ATOM 0 H GLU A 103 -13.261 1.908 12.250 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.656 2.731 11.244 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -11.679 0.389 12.260 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -11.811 0.084 10.540 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.626 -0.373 10.413 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.224 1.220 11.025 1.00 0.00 H new ATOM 1368 N GLU A 104 -11.175 1.836 8.674 1.00 0.00 N ATOM 1369 CA GLU A 104 -11.449 1.979 7.249 1.00 0.00 C ATOM 1370 C GLU A 104 -12.862 1.507 6.917 1.00 0.00 C ATOM 1371 O GLU A 104 -13.438 0.687 7.632 1.00 0.00 O ATOM 1372 CB GLU A 104 -10.429 1.185 6.429 1.00 0.00 C ATOM 1373 CG GLU A 104 -10.580 -0.322 6.561 1.00 0.00 C ATOM 1374 CD GLU A 104 -9.358 -1.075 6.074 1.00 0.00 C ATOM 1375 OE1 GLU A 104 -8.232 -0.586 6.294 1.00 0.00 O ATOM 1376 OE2 GLU A 104 -9.531 -2.157 5.472 1.00 0.00 O ATOM 0 H GLU A 104 -10.340 1.292 8.891 1.00 0.00 H new ATOM 0 HA GLU A 104 -11.367 3.035 6.993 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -10.526 1.461 5.379 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.424 1.469 6.741 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -10.766 -0.575 7.605 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.452 -0.647 5.994 1.00 0.00 H new ATOM 1381 N ASP A 105 -13.413 2.030 5.827 1.00 0.00 N ATOM 1382 CA ASP A 105 -14.758 1.662 5.400 1.00 0.00 C ATOM 1383 C ASP A 105 -15.086 2.283 4.046 1.00 0.00 C ATOM 1384 O ASP A 105 -15.869 3.228 3.943 1.00 0.00 O ATOM 1385 CB ASP A 105 -15.786 2.104 6.441 1.00 0.00 C ATOM 1386 CG ASP A 105 -15.672 3.578 6.779 1.00 0.00 C ATOM 1387 OD1 ASP A 105 -14.739 3.945 7.524 1.00 0.00 O ATOM 1388 OD2 ASP A 105 -16.514 4.364 6.297 1.00 0.00 O ATOM 0 H ASP A 105 -12.950 2.709 5.224 1.00 0.00 H new ATOM 0 HA ASP A 105 -14.798 0.577 5.301 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -16.789 1.896 6.068 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -15.656 1.515 7.349 1.00 0.00 H new ATOM 1392 N PRO A 106 -14.474 1.743 2.982 1.00 0.00 N ATOM 1393 CA PRO A 106 -14.686 2.230 1.615 1.00 0.00 C ATOM 1394 C PRO A 106 -16.083 1.912 1.096 1.00 0.00 C ATOM 1395 O PRO A 106 -16.896 1.308 1.798 1.00 0.00 O ATOM 1396 CB PRO A 106 -13.629 1.476 0.803 1.00 0.00 C ATOM 1397 CG PRO A 106 -13.364 0.237 1.585 1.00 0.00 C ATOM 1398 CD PRO A 106 -13.530 0.615 3.030 1.00 0.00 C ATOM 0 HA PRO A 106 -14.600 3.315 1.551 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -13.991 1.242 -0.198 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -12.723 2.070 0.684 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -14.058 -0.556 1.307 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -12.359 -0.138 1.393 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -13.924 -0.213 3.619 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -12.581 0.904 3.481 1.00 0.00 H new ATOM 1403 N THR A 107 -16.360 2.322 -0.137 1.00 0.00 N ATOM 1404 CA THR A 107 -17.660 2.081 -0.751 1.00 0.00 C ATOM 1405 C THR A 107 -17.519 1.287 -2.043 1.00 0.00 C ATOM 1406 O THR A 107 -18.358 1.384 -2.940 1.00 0.00 O ATOM 1407 CB THR A 107 -18.392 3.403 -1.051 1.00 0.00 C ATOM 1408 OG1 THR A 107 -17.710 4.116 -2.088 1.00 0.00 O ATOM 1409 CG2 THR A 107 -18.479 4.269 0.196 1.00 0.00 C ATOM 0 H THR A 107 -15.700 2.824 -0.732 1.00 0.00 H new ATOM 0 HA THR A 107 -18.246 1.504 -0.036 1.00 0.00 H new ATOM 0 HB THR A 107 -19.404 3.166 -1.379 1.00 0.00 H new ATOM 0 HG1 THR A 107 -18.182 4.954 -2.274 1.00 0.00 H new ATOM 0 HG21 THR A 107 -19.000 5.197 -0.041 1.00 0.00 H new ATOM 0 HG22 THR A 107 -19.025 3.734 0.973 1.00 0.00 H new ATOM 0 HG23 THR A 107 -17.474 4.498 0.551 1.00 0.00 H new ATOM 1417 N LYS A 108 -16.455 0.496 -2.134 1.00 0.00 N ATOM 1418 CA LYS A 108 -16.205 -0.320 -3.316 1.00 0.00 C ATOM 1419 C LYS A 108 -15.224 -1.445 -3.004 1.00 0.00 C ATOM 1420 O LYS A 108 -14.310 -1.278 -2.196 1.00 0.00 O ATOM 1421 CB LYS A 108 -15.660 0.547 -4.452 1.00 0.00 C ATOM 1422 CG LYS A 108 -16.169 0.142 -5.826 1.00 0.00 C ATOM 1423 CD LYS A 108 -15.633 1.060 -6.912 1.00 0.00 C ATOM 1424 CE LYS A 108 -16.756 1.613 -7.778 1.00 0.00 C ATOM 1425 NZ LYS A 108 -17.046 3.038 -7.467 1.00 0.00 N ATOM 0 H LYS A 108 -15.751 0.403 -1.402 1.00 0.00 H new ATOM 0 HA LYS A 108 -17.151 -0.764 -3.627 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -15.930 1.587 -4.266 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -14.571 0.495 -4.447 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.871 -0.885 -6.037 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -17.259 0.166 -5.833 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -15.084 1.884 -6.456 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -14.926 0.513 -7.536 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -16.484 1.519 -8.829 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -17.657 1.018 -7.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -17.816 3.377 -8.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -17.331 3.125 -6.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -16.194 3.610 -7.635 1.00 0.00 H new ATOM 1435 N LYS A 109 -15.419 -2.590 -3.649 1.00 0.00 N ATOM 1436 CA LYS A 109 -14.549 -3.743 -3.442 1.00 0.00 C ATOM 1437 C LYS A 109 -13.098 -3.390 -3.748 1.00 0.00 C ATOM 1438 O LYS A 109 -12.174 -4.062 -3.287 1.00 0.00 O ATOM 1439 CB LYS A 109 -14.999 -4.910 -4.324 1.00 0.00 C ATOM 1440 CG LYS A 109 -14.214 -6.189 -4.085 1.00 0.00 C ATOM 1441 CD LYS A 109 -15.134 -7.383 -3.907 1.00 0.00 C ATOM 1442 CE LYS A 109 -14.354 -8.689 -3.869 1.00 0.00 C ATOM 1443 NZ LYS A 109 -15.201 -9.853 -4.247 1.00 0.00 N ATOM 0 H LYS A 109 -16.172 -2.745 -4.320 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.619 -4.038 -2.395 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -16.057 -5.104 -4.145 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.900 -4.623 -5.371 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -13.543 -6.368 -4.925 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -13.590 -6.074 -3.198 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.702 -7.271 -2.984 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -15.855 -7.413 -4.724 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -13.503 -8.624 -4.547 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -13.952 -8.843 -2.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -14.633 -10.723 -4.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.999 -9.931 -3.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -15.564 -9.719 -5.212 1.00 0.00 H new TER 1453 LYS A 109