USER MOD reduce.3.24.130724 H: found=0, std=0, add=857, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 702 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 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 97 GLN : amide:sc= -0.199 K(o=-0.2,f=-2!) USER MOD Set 2.1: A 75 MET CE :methyl -162:sc=-0.00886 (180deg=0) USER MOD Set 2.2: A 104 SER OG : rot 150:sc= 0.0197 USER MOD Single : A 3 CYS SG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 HIS : no HD1:sc= -1.19 X(o=-1.2,f=-1.3) USER MOD Single : A 10 HIS :FLIP no HD1:sc= -5.21! C(o=-6.1!,f=-5.2!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 80:sc= -4.29! USER MOD Single : A 21 THR OG1 : rot -153:sc= -0.741 USER MOD Single : A 24 MET CE :methyl -171:sc= -6.23! (180deg=-6.42!) USER MOD Single : A 27 MET CE :methyl -176:sc= -18.7! (180deg=-18.9!) USER MOD Single : A 28 LYS NZ :NH3+ 157:sc= 0.548 (180deg=0.36) USER MOD Single : A 30 THR OG1 : rot -132:sc= -1.64 USER MOD Single : A 31 SER OG : rot 176:sc= -4.08! USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 GLN : amide:sc= -12.2! C(o=-12!,f=-12!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 67:sc= -5.3! USER MOD Single : A 44 MET CE :methyl -118:sc= -3.27! (180deg=-10.5!) USER MOD Single : A 45 ASN :FLIP amide:sc= -4.32! C(o=-6.7!,f=-4.3!) USER MOD Single : A 53 GLN : amide:sc= -0.218 K(o=-0.22,f=-2.5!) USER MOD Single : A 55 TYR OH : rot -149:sc= -0.91 USER MOD Single : A 56 ASN : amide:sc= 0.0563 X(o=0.056,f=0) USER MOD Single : A 58 SER OG : rot -112:sc= -0.0788 USER MOD Single : A 66 GLN : amide:sc= -5.03! C(o=-5!,f=-6.2!) USER MOD Single : A 71 THR OG1 : rot -170:sc= -2.24 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.0367 X(o=-0.037,f=-0.51) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc=-0.000813 X(o=-0.00081,f=0) USER MOD Single : A 86 LYS NZ :NH3+ -142:sc= 0.125 (180deg=-2.42!) USER MOD Single : A 88 ASN : amide:sc= -11.6! C(o=-12!,f=-15!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.95! C(o=-1.9!,f=-2.6!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot -29:sc= 0.23 USER MOD Single : A 102 SER OG : rot 102:sc= 0.293 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 3 13.021 9.876 1.570 1.00 0.00 N ATOM 2 CA CYS A 3 13.267 9.097 2.771 1.00 0.00 C ATOM 3 C CYS A 3 14.779 8.932 2.936 1.00 0.00 C ATOM 4 O CYS A 3 15.242 8.371 3.927 1.00 0.00 O ATOM 5 CB CYS A 3 12.547 7.747 2.728 1.00 0.00 C ATOM 6 SG CYS A 3 13.302 6.677 1.450 1.00 0.00 S ATOM 0 HA CYS A 3 12.863 9.622 3.636 1.00 0.00 H new ATOM 0 HB2 CYS A 3 12.607 7.262 3.702 1.00 0.00 H new ATOM 0 HB3 CYS A 3 11.489 7.896 2.511 1.00 0.00 H new ATOM 0 HG CYS A 3 12.686 5.533 1.422 1.00 0.00 H new ATOM 11 N THR A 4 15.508 9.432 1.948 1.00 0.00 N ATOM 12 CA THR A 4 16.958 9.348 1.970 1.00 0.00 C ATOM 13 C THR A 4 17.536 10.359 2.963 1.00 0.00 C ATOM 14 O THR A 4 17.906 9.997 4.079 1.00 0.00 O ATOM 15 CB THR A 4 17.465 9.543 0.541 1.00 0.00 C ATOM 16 OG1 THR A 4 17.045 8.363 -0.141 1.00 0.00 O ATOM 17 CG2 THR A 4 18.992 9.501 0.450 1.00 0.00 C ATOM 0 H THR A 4 15.121 9.897 1.127 1.00 0.00 H new ATOM 0 HA THR A 4 17.292 8.370 2.318 1.00 0.00 H new ATOM 0 HB THR A 4 17.104 10.497 0.156 1.00 0.00 H new ATOM 0 HG1 THR A 4 17.331 8.407 -1.077 1.00 0.00 H new ATOM 0 HG21 THR A 4 19.299 9.645 -0.586 1.00 0.00 H new ATOM 0 HG22 THR A 4 19.415 10.294 1.067 1.00 0.00 H new ATOM 0 HG23 THR A 4 19.351 8.535 0.804 1.00 0.00 H new ATOM 25 N PHE A 5 17.595 11.607 2.521 1.00 0.00 N ATOM 26 CA PHE A 5 18.122 12.672 3.356 1.00 0.00 C ATOM 27 C PHE A 5 17.087 13.123 4.389 1.00 0.00 C ATOM 28 O PHE A 5 17.020 12.573 5.487 1.00 0.00 O ATOM 29 CB PHE A 5 18.446 13.847 2.431 1.00 0.00 C ATOM 30 CG PHE A 5 19.790 13.718 1.711 1.00 0.00 C ATOM 31 CD1 PHE A 5 20.932 14.130 2.324 1.00 0.00 C ATOM 32 CD2 PHE A 5 19.842 13.194 0.457 1.00 0.00 C ATOM 33 CE1 PHE A 5 22.180 14.012 1.655 1.00 0.00 C ATOM 34 CE2 PHE A 5 21.090 13.075 -0.211 1.00 0.00 C ATOM 35 CZ PHE A 5 22.232 13.486 0.402 1.00 0.00 C ATOM 0 H PHE A 5 17.286 11.904 1.595 1.00 0.00 H new ATOM 0 HA PHE A 5 19.003 12.321 3.893 1.00 0.00 H new ATOM 0 HB2 PHE A 5 17.654 13.940 1.688 1.00 0.00 H new ATOM 0 HB3 PHE A 5 18.445 14.767 3.015 1.00 0.00 H new ATOM 0 HD1 PHE A 5 20.890 14.547 3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 5 18.935 12.869 -0.031 1.00 0.00 H new ATOM 0 HE1 PHE A 5 23.087 14.340 2.141 1.00 0.00 H new ATOM 0 HE2 PHE A 5 21.132 12.658 -1.206 1.00 0.00 H new ATOM 0 HZ PHE A 5 23.181 13.395 -0.106 1.00 0.00 H new ATOM 44 N PHE A 6 16.304 14.118 3.999 1.00 0.00 N ATOM 45 CA PHE A 6 15.274 14.649 4.877 1.00 0.00 C ATOM 46 C PHE A 6 13.892 14.536 4.231 1.00 0.00 C ATOM 47 O PHE A 6 12.943 14.075 4.864 1.00 0.00 O ATOM 48 CB PHE A 6 15.599 16.126 5.105 1.00 0.00 C ATOM 49 CG PHE A 6 15.747 16.937 3.816 1.00 0.00 C ATOM 50 CD1 PHE A 6 14.659 17.536 3.261 1.00 0.00 C ATOM 51 CD2 PHE A 6 16.966 17.059 3.226 1.00 0.00 C ATOM 52 CE1 PHE A 6 14.796 18.289 2.065 1.00 0.00 C ATOM 53 CE2 PHE A 6 17.103 17.812 2.029 1.00 0.00 C ATOM 54 CZ PHE A 6 16.016 18.410 1.474 1.00 0.00 C ATOM 0 H PHE A 6 16.362 14.571 3.087 1.00 0.00 H new ATOM 0 HA PHE A 6 15.255 14.088 5.811 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.812 16.571 5.714 1.00 0.00 H new ATOM 0 HB3 PHE A 6 16.524 16.200 5.677 1.00 0.00 H new ATOM 0 HD1 PHE A 6 13.691 17.439 3.730 1.00 0.00 H new ATOM 0 HD2 PHE A 6 17.830 16.584 3.667 1.00 0.00 H new ATOM 0 HE1 PHE A 6 13.933 18.765 1.625 1.00 0.00 H new ATOM 0 HE2 PHE A 6 18.071 17.909 1.560 1.00 0.00 H new ATOM 0 HZ PHE A 6 16.120 18.981 0.564 1.00 0.00 H new ATOM 63 N GLU A 7 13.822 14.966 2.979 1.00 0.00 N ATOM 64 CA GLU A 7 12.571 14.920 2.241 1.00 0.00 C ATOM 65 C GLU A 7 11.444 15.542 3.067 1.00 0.00 C ATOM 66 O GLU A 7 11.691 16.124 4.122 1.00 0.00 O ATOM 67 CB GLU A 7 12.227 13.485 1.836 1.00 0.00 C ATOM 68 CG GLU A 7 12.229 13.330 0.314 1.00 0.00 C ATOM 69 CD GLU A 7 13.587 13.717 -0.275 1.00 0.00 C ATOM 70 OE1 GLU A 7 14.602 13.390 0.377 1.00 0.00 O ATOM 71 OE2 GLU A 7 13.579 14.332 -1.362 1.00 0.00 O ATOM 0 H GLU A 7 14.611 15.348 2.458 1.00 0.00 H new ATOM 0 HA GLU A 7 12.689 15.503 1.327 1.00 0.00 H new ATOM 0 HB2 GLU A 7 12.948 12.796 2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 7 11.247 13.217 2.231 1.00 0.00 H new ATOM 0 HG2 GLU A 7 11.995 12.299 0.050 1.00 0.00 H new ATOM 0 HG3 GLU A 7 11.449 13.956 -0.120 1.00 0.00 H new ATOM 76 N LYS A 8 10.230 15.397 2.556 1.00 0.00 N ATOM 77 CA LYS A 8 9.064 15.939 3.234 1.00 0.00 C ATOM 78 C LYS A 8 8.477 14.871 4.160 1.00 0.00 C ATOM 79 O LYS A 8 8.677 14.918 5.373 1.00 0.00 O ATOM 80 CB LYS A 8 8.061 16.489 2.217 1.00 0.00 C ATOM 81 CG LYS A 8 7.003 17.355 2.905 1.00 0.00 C ATOM 82 CD LYS A 8 7.604 18.679 3.381 1.00 0.00 C ATOM 83 CE LYS A 8 7.671 18.733 4.909 1.00 0.00 C ATOM 84 NZ LYS A 8 8.255 20.015 5.358 1.00 0.00 N ATOM 0 H LYS A 8 10.028 14.913 1.681 1.00 0.00 H new ATOM 0 HA LYS A 8 9.346 16.786 3.860 1.00 0.00 H new ATOM 0 HB2 LYS A 8 8.586 17.078 1.465 1.00 0.00 H new ATOM 0 HB3 LYS A 8 7.577 15.664 1.695 1.00 0.00 H new ATOM 0 HG2 LYS A 8 6.183 17.551 2.214 1.00 0.00 H new ATOM 0 HG3 LYS A 8 6.583 16.816 3.754 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.604 18.799 2.965 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.003 19.509 3.010 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.671 18.616 5.327 1.00 0.00 H new ATOM 0 HE3 LYS A 8 8.271 17.903 5.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 8.293 20.034 6.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 9.217 20.111 4.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.667 20.802 5.018 1.00 0.00 H new ATOM 94 N HIS A 9 7.763 13.934 3.553 1.00 0.00 N ATOM 95 CA HIS A 9 7.146 12.857 4.309 1.00 0.00 C ATOM 96 C HIS A 9 7.464 11.517 3.644 1.00 0.00 C ATOM 97 O HIS A 9 6.699 10.561 3.768 1.00 0.00 O ATOM 98 CB HIS A 9 5.644 13.098 4.470 1.00 0.00 C ATOM 99 CG HIS A 9 5.293 14.485 4.954 1.00 0.00 C ATOM 100 ND1 HIS A 9 5.744 14.994 6.160 1.00 0.00 N ATOM 101 CD2 HIS A 9 4.531 15.461 4.384 1.00 0.00 C ATOM 102 CE1 HIS A 9 5.268 16.223 6.298 1.00 0.00 C ATOM 103 NE2 HIS A 9 4.517 16.511 5.197 1.00 0.00 N ATOM 0 H HIS A 9 7.598 13.898 2.547 1.00 0.00 H new ATOM 0 HA HIS A 9 7.560 12.830 5.317 1.00 0.00 H new ATOM 0 HB2 HIS A 9 5.154 12.924 3.512 1.00 0.00 H new ATOM 0 HB3 HIS A 9 5.242 12.367 5.172 1.00 0.00 H new ATOM 0 HD2 HIS A 9 4.025 15.392 3.433 1.00 0.00 H new ATOM 0 HE1 HIS A 9 5.444 16.881 7.136 1.00 0.00 H new ATOM 0 HE2 HIS A 9 4.025 17.388 5.026 1.00 0.00 H new ATOM 110 N HIS A 10 8.593 11.488 2.952 1.00 0.00 N ATOM 111 CA HIS A 10 9.022 10.280 2.267 1.00 0.00 C ATOM 112 C HIS A 10 9.461 9.236 3.295 1.00 0.00 C ATOM 113 O HIS A 10 9.318 8.036 3.066 1.00 0.00 O ATOM 114 CB HIS A 10 10.110 10.595 1.239 1.00 0.00 C ATOM 115 CG HIS A 10 9.653 11.493 0.116 1.00 0.00 C ATOM 116 ND1 HIS A 10 9.073 12.728 0.141 1.00 0.00 N flip ATOM 117 CD2 HIS A 10 9.773 11.146 -1.219 1.00 0.00 C flip ATOM 118 CE1 HIS A 10 8.853 13.114 -1.110 1.00 0.00 C flip ATOM 119 NE2 HIS A 10 9.287 12.134 -1.955 1.00 0.00 N flip ATOM 0 H HIS A 10 9.225 12.282 2.851 1.00 0.00 H new ATOM 0 HA HIS A 10 8.187 9.859 1.707 1.00 0.00 H new ATOM 0 HB2 HIS A 10 10.951 11.066 1.748 1.00 0.00 H new ATOM 0 HB3 HIS A 10 10.477 9.660 0.816 1.00 0.00 H new ATOM 0 HD2 HIS A 10 10.192 10.225 -1.596 1.00 0.00 H new ATOM 0 HE1 HIS A 10 8.404 14.050 -1.410 1.00 0.00 H new ATOM 0 HE2 HIS A 10 9.245 12.158 -2.974 1.00 0.00 H new ATOM 126 N ARG A 11 9.988 9.730 4.406 1.00 0.00 N ATOM 127 CA ARG A 11 10.448 8.855 5.470 1.00 0.00 C ATOM 128 C ARG A 11 9.285 8.479 6.390 1.00 0.00 C ATOM 129 O ARG A 11 9.399 8.576 7.611 1.00 0.00 O ATOM 130 CB ARG A 11 11.548 9.525 6.297 1.00 0.00 C ATOM 131 CG ARG A 11 11.104 10.905 6.783 1.00 0.00 C ATOM 132 CD ARG A 11 11.967 11.377 7.955 1.00 0.00 C ATOM 133 NE ARG A 11 11.163 11.408 9.196 1.00 0.00 N ATOM 134 CZ ARG A 11 11.593 11.921 10.358 1.00 0.00 C ATOM 135 NH1 ARG A 11 12.821 12.449 10.443 1.00 0.00 N ATOM 136 NH2 ARG A 11 10.793 11.905 11.433 1.00 0.00 N ATOM 0 H ARG A 11 10.106 10.726 4.592 1.00 0.00 H new ATOM 0 HA ARG A 11 10.854 7.956 5.007 1.00 0.00 H new ATOM 0 HB2 ARG A 11 11.798 8.897 7.152 1.00 0.00 H new ATOM 0 HB3 ARG A 11 12.452 9.621 5.696 1.00 0.00 H new ATOM 0 HG2 ARG A 11 11.172 11.622 5.965 1.00 0.00 H new ATOM 0 HG3 ARG A 11 10.058 10.868 7.088 1.00 0.00 H new ATOM 0 HD2 ARG A 11 12.820 10.710 8.081 1.00 0.00 H new ATOM 0 HD3 ARG A 11 12.367 12.369 7.746 1.00 0.00 H new ATOM 0 HE ARG A 11 10.222 11.014 9.166 1.00 0.00 H new ATOM 0 HH11 ARG A 11 13.429 12.461 9.624 1.00 0.00 H new ATOM 0 HH12 ARG A 11 13.148 12.839 11.327 1.00 0.00 H new ATOM 0 HH21 ARG A 11 9.858 11.503 11.367 1.00 0.00 H new ATOM 0 HH22 ARG A 11 11.119 12.295 12.317 1.00 0.00 H new ATOM 147 N LYS A 12 8.193 8.060 5.769 1.00 0.00 N ATOM 148 CA LYS A 12 7.010 7.670 6.517 1.00 0.00 C ATOM 149 C LYS A 12 5.907 7.257 5.540 1.00 0.00 C ATOM 150 O LYS A 12 5.505 6.095 5.507 1.00 0.00 O ATOM 151 CB LYS A 12 6.593 8.784 7.480 1.00 0.00 C ATOM 152 CG LYS A 12 6.565 10.140 6.771 1.00 0.00 C ATOM 153 CD LYS A 12 6.947 11.268 7.730 1.00 0.00 C ATOM 154 CE LYS A 12 5.993 11.316 8.926 1.00 0.00 C ATOM 155 NZ LYS A 12 4.703 11.927 8.536 1.00 0.00 N ATOM 0 H LYS A 12 8.102 7.982 4.756 1.00 0.00 H new ATOM 0 HA LYS A 12 7.224 6.803 7.142 1.00 0.00 H new ATOM 0 HB2 LYS A 12 5.608 8.564 7.891 1.00 0.00 H new ATOM 0 HB3 LYS A 12 7.287 8.823 8.319 1.00 0.00 H new ATOM 0 HG2 LYS A 12 7.254 10.127 5.926 1.00 0.00 H new ATOM 0 HG3 LYS A 12 5.569 10.323 6.367 1.00 0.00 H new ATOM 0 HD2 LYS A 12 7.969 11.122 8.081 1.00 0.00 H new ATOM 0 HD3 LYS A 12 6.924 12.222 7.203 1.00 0.00 H new ATOM 0 HE2 LYS A 12 5.825 10.308 9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 12 6.444 11.890 9.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 4.068 11.952 9.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 4.867 12.896 8.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 4.267 11.363 7.779 1.00 0.00 H new ATOM 165 N TRP A 13 5.449 8.231 4.768 1.00 0.00 N ATOM 166 CA TRP A 13 4.401 7.984 3.792 1.00 0.00 C ATOM 167 C TRP A 13 4.995 7.140 2.663 1.00 0.00 C ATOM 168 O TRP A 13 4.485 6.065 2.353 1.00 0.00 O ATOM 169 CB TRP A 13 3.790 9.297 3.299 1.00 0.00 C ATOM 170 CG TRP A 13 2.898 9.144 2.065 1.00 0.00 C ATOM 171 CD1 TRP A 13 2.339 8.025 1.585 1.00 0.00 C ATOM 172 CD2 TRP A 13 2.481 10.196 1.169 1.00 0.00 C ATOM 173 NE1 TRP A 13 1.597 8.277 0.449 1.00 0.00 N ATOM 174 CE2 TRP A 13 1.687 9.639 0.189 1.00 0.00 C ATOM 175 CE3 TRP A 13 2.768 11.572 1.187 1.00 0.00 C ATOM 176 CZ2 TRP A 13 1.111 10.385 -0.847 1.00 0.00 C ATOM 177 CZ3 TRP A 13 2.186 12.304 0.145 1.00 0.00 C ATOM 178 CH2 TRP A 13 1.383 11.758 -0.850 1.00 0.00 C ATOM 0 H TRP A 13 5.785 9.194 4.798 1.00 0.00 H new ATOM 0 HA TRP A 13 3.577 7.431 4.243 1.00 0.00 H new ATOM 0 HB2 TRP A 13 3.204 9.739 4.105 1.00 0.00 H new ATOM 0 HB3 TRP A 13 4.594 9.996 3.069 1.00 0.00 H new ATOM 0 HD1 TRP A 13 2.455 7.048 2.031 1.00 0.00 H new ATOM 0 HE1 TRP A 13 1.078 7.590 -0.099 1.00 0.00 H new ATOM 0 HE3 TRP A 13 3.388 12.028 1.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 0.491 9.926 -1.602 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 2.374 13.367 0.112 1.00 0.00 H new ATOM 0 HH2 TRP A 13 0.971 12.391 -1.622 1.00 0.00 H new ATOM 188 N ASP A 14 6.066 7.660 2.079 1.00 0.00 N ATOM 189 CA ASP A 14 6.735 6.966 0.991 1.00 0.00 C ATOM 190 C ASP A 14 7.527 5.786 1.555 1.00 0.00 C ATOM 191 O ASP A 14 7.731 4.786 0.869 1.00 0.00 O ATOM 192 CB ASP A 14 7.716 7.893 0.270 1.00 0.00 C ATOM 193 CG ASP A 14 8.262 7.352 -1.053 1.00 0.00 C ATOM 194 OD1 ASP A 14 7.476 6.688 -1.763 1.00 0.00 O ATOM 195 OD2 ASP A 14 9.454 7.614 -1.324 1.00 0.00 O ATOM 0 H ASP A 14 6.486 8.552 2.339 1.00 0.00 H new ATOM 0 HA ASP A 14 5.974 6.627 0.288 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.220 8.845 0.079 1.00 0.00 H new ATOM 0 HB3 ASP A 14 8.555 8.098 0.935 1.00 0.00 H new ATOM 199 N ILE A 15 7.952 5.939 2.801 1.00 0.00 N ATOM 200 CA ILE A 15 8.716 4.898 3.465 1.00 0.00 C ATOM 201 C ILE A 15 7.816 3.684 3.704 1.00 0.00 C ATOM 202 O ILE A 15 8.274 2.544 3.637 1.00 0.00 O ATOM 203 CB ILE A 15 9.368 5.440 4.738 1.00 0.00 C ATOM 204 CG1 ILE A 15 10.816 4.963 4.859 1.00 0.00 C ATOM 205 CG2 ILE A 15 8.541 5.080 5.974 1.00 0.00 C ATOM 206 CD1 ILE A 15 11.514 5.626 6.050 1.00 0.00 C ATOM 0 H ILE A 15 7.781 6.769 3.368 1.00 0.00 H new ATOM 0 HA ILE A 15 9.538 4.566 2.831 1.00 0.00 H new ATOM 0 HB ILE A 15 9.392 6.528 4.672 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.837 3.880 4.977 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.357 5.194 3.941 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.027 5.477 6.865 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.544 5.510 5.882 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.463 3.996 6.056 1.00 0.00 H new ATOM 0 HD11 ILE A 15 12.542 5.270 6.114 1.00 0.00 H new ATOM 0 HD12 ILE A 15 11.512 6.708 5.917 1.00 0.00 H new ATOM 0 HD13 ILE A 15 10.985 5.373 6.969 1.00 0.00 H new ATOM 217 N LEU A 16 6.552 3.969 3.978 1.00 0.00 N ATOM 218 CA LEU A 16 5.584 2.915 4.228 1.00 0.00 C ATOM 219 C LEU A 16 5.105 2.341 2.893 1.00 0.00 C ATOM 220 O LEU A 16 4.823 1.149 2.790 1.00 0.00 O ATOM 221 CB LEU A 16 4.450 3.428 5.118 1.00 0.00 C ATOM 222 CG LEU A 16 3.608 2.358 5.815 1.00 0.00 C ATOM 223 CD1 LEU A 16 2.761 1.581 4.805 1.00 0.00 C ATOM 224 CD2 LEU A 16 4.488 1.432 6.659 1.00 0.00 C ATOM 0 H LEU A 16 6.175 4.915 4.032 1.00 0.00 H new ATOM 0 HA LEU A 16 6.047 2.097 4.780 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.879 4.078 5.880 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.788 4.044 4.510 1.00 0.00 H new ATOM 0 HG LEU A 16 2.918 2.856 6.496 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.172 0.827 5.328 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.092 2.268 4.286 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.414 1.094 4.081 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.865 0.680 7.144 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.218 0.939 6.017 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.008 2.016 7.418 1.00 0.00 H new ATOM 235 N LEU A 17 5.029 3.218 1.902 1.00 0.00 N ATOM 236 CA LEU A 17 4.590 2.814 0.577 1.00 0.00 C ATOM 237 C LEU A 17 5.790 2.298 -0.218 1.00 0.00 C ATOM 238 O LEU A 17 5.640 1.841 -1.351 1.00 0.00 O ATOM 239 CB LEU A 17 3.842 3.957 -0.112 1.00 0.00 C ATOM 240 CG LEU A 17 2.706 3.546 -1.052 1.00 0.00 C ATOM 241 CD1 LEU A 17 1.550 2.918 -0.272 1.00 0.00 C ATOM 242 CD2 LEU A 17 2.246 4.729 -1.906 1.00 0.00 C ATOM 0 H LEU A 17 5.264 4.207 1.990 1.00 0.00 H new ATOM 0 HA LEU A 17 3.876 1.993 0.647 1.00 0.00 H new ATOM 0 HB2 LEU A 17 3.432 4.612 0.657 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.562 4.545 -0.680 1.00 0.00 H new ATOM 0 HG LEU A 17 3.085 2.785 -1.734 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.756 2.635 -0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.905 2.032 0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.164 3.639 0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.438 4.410 -2.565 1.00 0.00 H new ATOM 0 HD22 LEU A 17 1.890 5.529 -1.257 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.081 5.092 -2.505 1.00 0.00 H new ATOM 253 N GLU A 18 6.956 2.386 0.406 1.00 0.00 N ATOM 254 CA GLU A 18 8.181 1.933 -0.229 1.00 0.00 C ATOM 255 C GLU A 18 8.784 0.764 0.552 1.00 0.00 C ATOM 256 O GLU A 18 9.628 0.036 0.033 1.00 0.00 O ATOM 257 CB GLU A 18 9.186 3.080 -0.363 1.00 0.00 C ATOM 258 CG GLU A 18 10.440 2.627 -1.112 1.00 0.00 C ATOM 259 CD GLU A 18 11.572 2.294 -0.138 1.00 0.00 C ATOM 260 OE1 GLU A 18 11.765 3.097 0.801 1.00 0.00 O ATOM 261 OE2 GLU A 18 12.218 1.246 -0.353 1.00 0.00 O ATOM 0 H GLU A 18 7.078 2.765 1.345 1.00 0.00 H new ATOM 0 HA GLU A 18 7.939 1.586 -1.234 1.00 0.00 H new ATOM 0 HB2 GLU A 18 8.723 3.913 -0.892 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.461 3.444 0.627 1.00 0.00 H new ATOM 0 HG2 GLU A 18 10.209 1.752 -1.719 1.00 0.00 H new ATOM 0 HG3 GLU A 18 10.763 3.412 -1.795 1.00 0.00 H new ATOM 266 N LYS A 19 8.327 0.622 1.787 1.00 0.00 N ATOM 267 CA LYS A 19 8.811 -0.446 2.646 1.00 0.00 C ATOM 268 C LYS A 19 7.663 -1.413 2.945 1.00 0.00 C ATOM 269 O LYS A 19 7.881 -2.484 3.510 1.00 0.00 O ATOM 270 CB LYS A 19 9.472 0.131 3.899 1.00 0.00 C ATOM 271 CG LYS A 19 10.662 1.019 3.531 1.00 0.00 C ATOM 272 CD LYS A 19 11.586 1.221 4.734 1.00 0.00 C ATOM 273 CE LYS A 19 12.689 0.160 4.761 1.00 0.00 C ATOM 274 NZ LYS A 19 14.017 0.788 4.581 1.00 0.00 N ATOM 0 H LYS A 19 7.627 1.228 2.214 1.00 0.00 H new ATOM 0 HA LYS A 19 9.588 -1.019 2.140 1.00 0.00 H new ATOM 0 HB2 LYS A 19 8.743 0.710 4.465 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.806 -0.681 4.545 1.00 0.00 H new ATOM 0 HG2 LYS A 19 11.219 0.565 2.711 1.00 0.00 H new ATOM 0 HG3 LYS A 19 10.304 1.985 3.176 1.00 0.00 H new ATOM 0 HD2 LYS A 19 12.033 2.214 4.692 1.00 0.00 H new ATOM 0 HD3 LYS A 19 11.006 1.171 5.655 1.00 0.00 H new ATOM 0 HE2 LYS A 19 12.660 -0.379 5.708 1.00 0.00 H new ATOM 0 HE3 LYS A 19 12.517 -0.572 3.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 14.754 0.054 4.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 14.046 1.282 3.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 14.186 1.470 5.348 1.00 0.00 H new ATOM 284 N SER A 20 6.467 -1.001 2.553 1.00 0.00 N ATOM 285 CA SER A 20 5.284 -1.816 2.772 1.00 0.00 C ATOM 286 C SER A 20 4.594 -2.107 1.438 1.00 0.00 C ATOM 287 O SER A 20 4.591 -3.245 0.972 1.00 0.00 O ATOM 288 CB SER A 20 4.313 -1.131 3.735 1.00 0.00 C ATOM 289 OG SER A 20 3.693 -2.060 4.620 1.00 0.00 O ATOM 0 H SER A 20 6.291 -0.112 2.084 1.00 0.00 H new ATOM 0 HA SER A 20 5.597 -2.757 3.224 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.848 -0.379 4.315 1.00 0.00 H new ATOM 0 HB3 SER A 20 3.546 -0.607 3.165 1.00 0.00 H new ATOM 0 HG SER A 20 4.309 -2.276 5.351 1.00 0.00 H new ATOM 294 N THR A 21 4.026 -1.058 0.863 1.00 0.00 N ATOM 295 CA THR A 21 3.334 -1.185 -0.409 1.00 0.00 C ATOM 296 C THR A 21 4.340 -1.275 -1.558 1.00 0.00 C ATOM 297 O THR A 21 4.237 -0.538 -2.536 1.00 0.00 O ATOM 298 CB THR A 21 2.365 -0.008 -0.540 1.00 0.00 C ATOM 299 OG1 THR A 21 1.574 -0.077 0.643 1.00 0.00 O ATOM 300 CG2 THR A 21 1.357 -0.204 -1.674 1.00 0.00 C ATOM 0 H THR A 21 4.030 -0.116 1.254 1.00 0.00 H new ATOM 0 HA THR A 21 2.755 -2.108 -0.453 1.00 0.00 H new ATOM 0 HB THR A 21 2.928 0.910 -0.709 1.00 0.00 H new ATOM 0 HG1 THR A 21 0.696 0.324 0.473 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.693 0.659 -1.724 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.889 -0.308 -2.620 1.00 0.00 H new ATOM 0 HG23 THR A 21 0.770 -1.103 -1.487 1.00 0.00 H new ATOM 308 N GLY A 22 5.291 -2.184 -1.400 1.00 0.00 N ATOM 309 CA GLY A 22 6.316 -2.380 -2.411 1.00 0.00 C ATOM 310 C GLY A 22 7.409 -3.326 -1.909 1.00 0.00 C ATOM 311 O GLY A 22 8.527 -3.316 -2.422 1.00 0.00 O ATOM 0 H GLY A 22 5.373 -2.793 -0.586 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.866 -2.787 -3.316 1.00 0.00 H new ATOM 0 HA3 GLY A 22 6.756 -1.419 -2.678 1.00 0.00 H new ATOM 315 N VAL A 23 7.047 -4.120 -0.913 1.00 0.00 N ATOM 316 CA VAL A 23 7.983 -5.070 -0.336 1.00 0.00 C ATOM 317 C VAL A 23 7.370 -6.471 -0.376 1.00 0.00 C ATOM 318 O VAL A 23 8.047 -7.439 -0.717 1.00 0.00 O ATOM 319 CB VAL A 23 8.374 -4.629 1.076 1.00 0.00 C ATOM 320 CG1 VAL A 23 9.385 -5.597 1.693 1.00 0.00 C ATOM 321 CG2 VAL A 23 8.918 -3.198 1.072 1.00 0.00 C ATOM 0 H VAL A 23 6.119 -4.125 -0.491 1.00 0.00 H new ATOM 0 HA VAL A 23 8.904 -5.101 -0.919 1.00 0.00 H new ATOM 0 HB VAL A 23 7.475 -4.645 1.693 1.00 0.00 H new ATOM 0 HG11 VAL A 23 9.646 -5.260 2.696 1.00 0.00 H new ATOM 0 HG12 VAL A 23 8.948 -6.594 1.747 1.00 0.00 H new ATOM 0 HG13 VAL A 23 10.283 -5.628 1.076 1.00 0.00 H new ATOM 0 HG21 VAL A 23 9.189 -2.909 2.088 1.00 0.00 H new ATOM 0 HG22 VAL A 23 9.799 -3.146 0.433 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.154 -2.519 0.693 1.00 0.00 H new ATOM 331 N MET A 24 6.095 -6.535 -0.022 1.00 0.00 N ATOM 332 CA MET A 24 5.382 -7.801 -0.013 1.00 0.00 C ATOM 333 C MET A 24 5.854 -8.686 1.143 1.00 0.00 C ATOM 334 O MET A 24 5.440 -9.839 1.255 1.00 0.00 O ATOM 335 CB MET A 24 5.614 -8.527 -1.340 1.00 0.00 C ATOM 336 CG MET A 24 4.735 -9.775 -1.443 1.00 0.00 C ATOM 337 SD MET A 24 5.737 -11.197 -1.842 1.00 0.00 S ATOM 338 CE MET A 24 6.800 -11.239 -0.410 1.00 0.00 C ATOM 0 H MET A 24 5.537 -5.730 0.261 1.00 0.00 H new ATOM 0 HA MET A 24 4.319 -7.598 0.119 1.00 0.00 H new ATOM 0 HB2 MET A 24 5.396 -7.855 -2.170 1.00 0.00 H new ATOM 0 HB3 MET A 24 6.663 -8.809 -1.426 1.00 0.00 H new ATOM 0 HG2 MET A 24 4.213 -9.941 -0.501 1.00 0.00 H new ATOM 0 HG3 MET A 24 3.973 -9.631 -2.209 1.00 0.00 H new ATOM 0 HE1 MET A 24 7.594 -11.969 -0.568 1.00 0.00 H new ATOM 0 HE2 MET A 24 7.239 -10.254 -0.254 1.00 0.00 H new ATOM 0 HE3 MET A 24 6.218 -11.520 0.467 1.00 0.00 H new ATOM 346 N GLU A 25 6.713 -8.114 1.972 1.00 0.00 N ATOM 347 CA GLU A 25 7.245 -8.837 3.116 1.00 0.00 C ATOM 348 C GLU A 25 6.746 -8.209 4.419 1.00 0.00 C ATOM 349 O GLU A 25 6.010 -8.842 5.175 1.00 0.00 O ATOM 350 CB GLU A 25 8.773 -8.878 3.076 1.00 0.00 C ATOM 351 CG GLU A 25 9.281 -10.314 2.946 1.00 0.00 C ATOM 352 CD GLU A 25 10.793 -10.384 3.167 1.00 0.00 C ATOM 353 OE1 GLU A 25 11.196 -10.361 4.350 1.00 0.00 O ATOM 354 OE2 GLU A 25 11.512 -10.459 2.148 1.00 0.00 O ATOM 0 H GLU A 25 7.055 -7.158 1.875 1.00 0.00 H new ATOM 0 HA GLU A 25 6.886 -9.865 3.071 1.00 0.00 H new ATOM 0 HB2 GLU A 25 9.134 -8.284 2.237 1.00 0.00 H new ATOM 0 HB3 GLU A 25 9.176 -8.427 3.983 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.774 -10.950 3.672 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.036 -10.702 1.957 1.00 0.00 H new ATOM 359 N ALA A 26 7.167 -6.973 4.642 1.00 0.00 N ATOM 360 CA ALA A 26 6.773 -6.253 5.841 1.00 0.00 C ATOM 361 C ALA A 26 5.352 -5.716 5.664 1.00 0.00 C ATOM 362 O ALA A 26 4.819 -5.053 6.553 1.00 0.00 O ATOM 363 CB ALA A 26 7.786 -5.142 6.126 1.00 0.00 C ATOM 0 H ALA A 26 7.777 -6.452 4.013 1.00 0.00 H new ATOM 0 HA ALA A 26 6.768 -6.918 6.704 1.00 0.00 H new ATOM 0 HB1 ALA A 26 7.490 -4.602 7.025 1.00 0.00 H new ATOM 0 HB2 ALA A 26 8.774 -5.579 6.273 1.00 0.00 H new ATOM 0 HB3 ALA A 26 7.817 -4.452 5.282 1.00 0.00 H new ATOM 369 N MET A 27 4.777 -6.022 4.509 1.00 0.00 N ATOM 370 CA MET A 27 3.428 -5.578 4.205 1.00 0.00 C ATOM 371 C MET A 27 2.498 -6.770 3.969 1.00 0.00 C ATOM 372 O MET A 27 1.281 -6.648 4.098 1.00 0.00 O ATOM 373 CB MET A 27 3.452 -4.694 2.955 1.00 0.00 C ATOM 374 CG MET A 27 2.032 -4.385 2.475 1.00 0.00 C ATOM 375 SD MET A 27 1.778 -5.065 0.844 1.00 0.00 S ATOM 376 CE MET A 27 2.123 -6.786 1.168 1.00 0.00 C ATOM 0 H MET A 27 5.221 -6.572 3.774 1.00 0.00 H new ATOM 0 HA MET A 27 3.051 -5.011 5.056 1.00 0.00 H new ATOM 0 HB2 MET A 27 3.977 -3.764 3.173 1.00 0.00 H new ATOM 0 HB3 MET A 27 4.007 -5.195 2.162 1.00 0.00 H new ATOM 0 HG2 MET A 27 1.305 -4.804 3.170 1.00 0.00 H new ATOM 0 HG3 MET A 27 1.871 -3.307 2.458 1.00 0.00 H new ATOM 0 HE1 MET A 27 2.079 -7.348 0.235 1.00 0.00 H new ATOM 0 HE2 MET A 27 3.118 -6.882 1.603 1.00 0.00 H new ATOM 0 HE3 MET A 27 1.383 -7.181 1.864 1.00 0.00 H new ATOM 384 N LYS A 28 3.107 -7.896 3.626 1.00 0.00 N ATOM 385 CA LYS A 28 2.350 -9.109 3.372 1.00 0.00 C ATOM 386 C LYS A 28 2.832 -10.214 4.314 1.00 0.00 C ATOM 387 O LYS A 28 2.027 -10.974 4.849 1.00 0.00 O ATOM 388 CB LYS A 28 2.424 -9.487 1.891 1.00 0.00 C ATOM 389 CG LYS A 28 2.718 -10.979 1.720 1.00 0.00 C ATOM 390 CD LYS A 28 1.508 -11.824 2.124 1.00 0.00 C ATOM 391 CE LYS A 28 1.934 -13.245 2.502 1.00 0.00 C ATOM 392 NZ LYS A 28 0.757 -14.054 2.888 1.00 0.00 N ATOM 0 H LYS A 28 4.117 -7.993 3.518 1.00 0.00 H new ATOM 0 HA LYS A 28 1.293 -8.949 3.584 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.482 -9.240 1.401 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.201 -8.901 1.401 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.981 -11.185 0.682 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.579 -11.256 2.328 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.999 -11.357 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.794 -11.861 1.301 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.445 -13.714 1.661 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.645 -13.210 3.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.974 -15.064 2.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 0.521 -13.870 3.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.053 -13.798 2.288 1.00 0.00 H new ATOM 402 N VAL A 29 4.145 -10.268 4.486 1.00 0.00 N ATOM 403 CA VAL A 29 4.745 -11.267 5.354 1.00 0.00 C ATOM 404 C VAL A 29 4.901 -10.688 6.761 1.00 0.00 C ATOM 405 O VAL A 29 6.017 -10.542 7.256 1.00 0.00 O ATOM 406 CB VAL A 29 6.068 -11.752 4.758 1.00 0.00 C ATOM 407 CG1 VAL A 29 6.751 -12.760 5.684 1.00 0.00 C ATOM 408 CG2 VAL A 29 5.857 -12.345 3.363 1.00 0.00 C ATOM 0 H VAL A 29 4.810 -9.636 4.039 1.00 0.00 H new ATOM 0 HA VAL A 29 4.099 -12.141 5.432 1.00 0.00 H new ATOM 0 HB VAL A 29 6.726 -10.889 4.659 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.689 -13.088 5.236 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.953 -12.291 6.647 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.098 -13.620 5.830 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.813 -12.682 2.962 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.172 -13.191 3.427 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.435 -11.585 2.705 1.00 0.00 H new ATOM 418 N THR A 30 3.764 -10.374 7.366 1.00 0.00 N ATOM 419 CA THR A 30 3.760 -9.813 8.706 1.00 0.00 C ATOM 420 C THR A 30 2.809 -10.599 9.610 1.00 0.00 C ATOM 421 O THR A 30 3.049 -10.727 10.809 1.00 0.00 O ATOM 422 CB THR A 30 3.406 -8.328 8.597 1.00 0.00 C ATOM 423 OG1 THR A 30 2.453 -8.275 7.539 1.00 0.00 O ATOM 424 CG2 THR A 30 4.576 -7.484 8.088 1.00 0.00 C ATOM 0 H THR A 30 2.840 -10.498 6.952 1.00 0.00 H new ATOM 0 HA THR A 30 4.742 -9.894 9.171 1.00 0.00 H new ATOM 0 HB THR A 30 3.088 -7.958 9.572 1.00 0.00 H new ATOM 0 HG1 THR A 30 2.698 -7.561 6.914 1.00 0.00 H new ATOM 0 HG21 THR A 30 4.272 -6.439 8.029 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.418 -7.579 8.773 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.872 -7.832 7.098 1.00 0.00 H new ATOM 432 N SER A 31 1.748 -11.106 8.999 1.00 0.00 N ATOM 433 CA SER A 31 0.758 -11.876 9.734 1.00 0.00 C ATOM 434 C SER A 31 -0.632 -11.646 9.139 1.00 0.00 C ATOM 435 O SER A 31 -1.638 -12.030 9.735 1.00 0.00 O ATOM 436 CB SER A 31 0.767 -11.510 11.220 1.00 0.00 C ATOM 437 OG SER A 31 0.878 -10.104 11.422 1.00 0.00 O ATOM 0 H SER A 31 1.552 -10.999 8.004 1.00 0.00 H new ATOM 0 HA SER A 31 1.013 -12.932 9.646 1.00 0.00 H new ATOM 0 HB2 SER A 31 -0.148 -11.873 11.688 1.00 0.00 H new ATOM 0 HB3 SER A 31 1.599 -12.014 11.713 1.00 0.00 H new ATOM 0 HG SER A 31 0.815 -9.905 12.380 1.00 0.00 H new ATOM 442 N GLU A 32 -0.645 -11.022 7.970 1.00 0.00 N ATOM 443 CA GLU A 32 -1.895 -10.736 7.288 1.00 0.00 C ATOM 444 C GLU A 32 -2.720 -9.729 8.091 1.00 0.00 C ATOM 445 O GLU A 32 -2.855 -8.573 7.693 1.00 0.00 O ATOM 446 CB GLU A 32 -2.689 -12.021 7.037 1.00 0.00 C ATOM 447 CG GLU A 32 -2.375 -12.599 5.655 1.00 0.00 C ATOM 448 CD GLU A 32 -1.872 -14.039 5.765 1.00 0.00 C ATOM 449 OE1 GLU A 32 -2.678 -14.890 6.200 1.00 0.00 O ATOM 450 OE2 GLU A 32 -0.693 -14.256 5.412 1.00 0.00 O ATOM 0 H GLU A 32 0.191 -10.707 7.478 1.00 0.00 H new ATOM 0 HA GLU A 32 -1.665 -10.295 6.318 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.450 -12.756 7.805 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -3.756 -11.814 7.115 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -3.269 -12.569 5.032 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -1.622 -11.984 5.162 1.00 0.00 H new ATOM 455 N GLU A 33 -3.251 -10.205 9.208 1.00 0.00 N ATOM 456 CA GLU A 33 -4.060 -9.361 10.071 1.00 0.00 C ATOM 457 C GLU A 33 -3.343 -8.036 10.340 1.00 0.00 C ATOM 458 O GLU A 33 -3.977 -6.984 10.396 1.00 0.00 O ATOM 459 CB GLU A 33 -4.396 -10.078 11.380 1.00 0.00 C ATOM 460 CG GLU A 33 -3.125 -10.437 12.151 1.00 0.00 C ATOM 461 CD GLU A 33 -3.461 -11.150 13.462 1.00 0.00 C ATOM 462 OE1 GLU A 33 -4.022 -12.264 13.375 1.00 0.00 O ATOM 463 OE2 GLU A 33 -3.151 -10.565 14.523 1.00 0.00 O ATOM 0 H GLU A 33 -3.137 -11.164 9.535 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.999 -9.147 9.561 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -5.031 -9.440 11.995 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.964 -10.983 11.167 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.492 -11.077 11.537 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.555 -9.532 12.361 1.00 0.00 H new ATOM 468 N LYS A 34 -2.032 -8.131 10.498 1.00 0.00 N ATOM 469 CA LYS A 34 -1.222 -6.952 10.759 1.00 0.00 C ATOM 470 C LYS A 34 -0.681 -6.407 9.436 1.00 0.00 C ATOM 471 O LYS A 34 -0.317 -5.236 9.347 1.00 0.00 O ATOM 472 CB LYS A 34 -0.132 -7.268 11.786 1.00 0.00 C ATOM 473 CG LYS A 34 1.246 -7.327 11.123 1.00 0.00 C ATOM 474 CD LYS A 34 2.308 -7.820 12.108 1.00 0.00 C ATOM 475 CE LYS A 34 3.344 -6.730 12.387 1.00 0.00 C ATOM 476 NZ LYS A 34 4.570 -7.318 12.971 1.00 0.00 N ATOM 0 H LYS A 34 -1.509 -9.006 10.451 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.829 -6.164 11.204 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -0.132 -6.507 12.567 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.348 -8.221 12.269 1.00 0.00 H new ATOM 0 HG2 LYS A 34 1.210 -7.991 10.259 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.518 -6.338 10.754 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.832 -8.122 13.041 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.803 -8.702 11.703 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.589 -6.208 11.462 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.927 -5.990 13.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.263 -6.565 13.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 4.334 -7.796 13.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.976 -8.007 12.306 1.00 0.00 H new ATOM 486 N GLU A 35 -0.646 -7.283 8.442 1.00 0.00 N ATOM 487 CA GLU A 35 -0.156 -6.903 7.128 1.00 0.00 C ATOM 488 C GLU A 35 -1.099 -5.886 6.483 1.00 0.00 C ATOM 489 O GLU A 35 -0.742 -5.241 5.498 1.00 0.00 O ATOM 490 CB GLU A 35 0.021 -8.131 6.233 1.00 0.00 C ATOM 491 CG GLU A 35 -1.106 -8.224 5.202 1.00 0.00 C ATOM 492 CD GLU A 35 -0.882 -9.402 4.250 1.00 0.00 C ATOM 493 OE1 GLU A 35 -0.221 -10.369 4.689 1.00 0.00 O ATOM 494 OE2 GLU A 35 -1.376 -9.309 3.107 1.00 0.00 O ATOM 0 H GLU A 35 -0.949 -8.254 8.520 1.00 0.00 H new ATOM 0 HA GLU A 35 0.822 -6.437 7.247 1.00 0.00 H new ATOM 0 HB2 GLU A 35 0.983 -8.078 5.722 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.034 -9.033 6.845 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.062 -8.341 5.712 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.160 -7.296 4.632 1.00 0.00 H new ATOM 499 N GLN A 36 -2.283 -5.773 7.066 1.00 0.00 N ATOM 500 CA GLN A 36 -3.280 -4.845 6.560 1.00 0.00 C ATOM 501 C GLN A 36 -3.656 -3.829 7.640 1.00 0.00 C ATOM 502 O GLN A 36 -3.882 -2.656 7.345 1.00 0.00 O ATOM 503 CB GLN A 36 -4.517 -5.590 6.053 1.00 0.00 C ATOM 504 CG GLN A 36 -4.119 -6.804 5.211 1.00 0.00 C ATOM 505 CD GLN A 36 -4.594 -8.103 5.862 1.00 0.00 C ATOM 506 OE1 GLN A 36 -5.379 -8.108 6.796 1.00 0.00 O ATOM 507 NE2 GLN A 36 -4.074 -9.201 5.321 1.00 0.00 N ATOM 0 H GLN A 36 -2.574 -6.308 7.884 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.850 -4.306 5.716 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -5.124 -5.913 6.899 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -5.133 -4.916 5.458 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -4.548 -6.715 4.213 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -3.036 -6.828 5.091 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -3.422 -9.125 4.540 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -4.327 -10.119 5.687 1.00 0.00 H new ATOM 514 N LEU A 37 -3.713 -4.316 8.871 1.00 0.00 N ATOM 515 CA LEU A 37 -4.059 -3.466 9.998 1.00 0.00 C ATOM 516 C LEU A 37 -2.834 -2.643 10.404 1.00 0.00 C ATOM 517 O LEU A 37 -2.866 -1.414 10.363 1.00 0.00 O ATOM 518 CB LEU A 37 -4.645 -4.299 11.139 1.00 0.00 C ATOM 519 CG LEU A 37 -5.987 -4.977 10.852 1.00 0.00 C ATOM 520 CD1 LEU A 37 -7.141 -4.198 11.488 1.00 0.00 C ATOM 521 CD2 LEU A 37 -6.190 -5.177 9.349 1.00 0.00 C ATOM 0 H LEU A 37 -3.525 -5.289 9.113 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.841 -2.760 9.717 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.922 -5.068 11.410 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.765 -3.654 12.009 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.975 -5.966 11.309 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.083 -4.700 11.269 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.997 -4.151 12.567 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.166 -3.187 11.081 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.151 -5.661 9.173 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.173 -4.209 8.848 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.391 -5.804 8.954 1.00 0.00 H new ATOM 532 N SER A 38 -1.784 -3.354 10.788 1.00 0.00 N ATOM 533 CA SER A 38 -0.551 -2.706 11.202 1.00 0.00 C ATOM 534 C SER A 38 0.143 -2.081 9.991 1.00 0.00 C ATOM 535 O SER A 38 1.048 -1.262 10.142 1.00 0.00 O ATOM 536 CB SER A 38 0.385 -3.695 11.899 1.00 0.00 C ATOM 537 OG SER A 38 -0.049 -3.997 13.223 1.00 0.00 O ATOM 0 H SER A 38 -1.762 -4.373 10.821 1.00 0.00 H new ATOM 0 HA SER A 38 -0.800 -1.921 11.915 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.440 -4.615 11.317 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.392 -3.279 11.933 1.00 0.00 H new ATOM 0 HG SER A 38 0.573 -4.633 13.634 1.00 0.00 H new ATOM 542 N THR A 39 -0.305 -2.493 8.813 1.00 0.00 N ATOM 543 CA THR A 39 0.263 -1.984 7.576 1.00 0.00 C ATOM 544 C THR A 39 -0.540 -0.781 7.076 1.00 0.00 C ATOM 545 O THR A 39 -0.021 0.049 6.331 1.00 0.00 O ATOM 546 CB THR A 39 0.318 -3.138 6.572 1.00 0.00 C ATOM 547 OG1 THR A 39 0.649 -4.274 7.366 1.00 0.00 O ATOM 548 CG2 THR A 39 1.490 -3.010 5.598 1.00 0.00 C ATOM 0 H THR A 39 -1.055 -3.173 8.690 1.00 0.00 H new ATOM 0 HA THR A 39 1.278 -1.617 7.728 1.00 0.00 H new ATOM 0 HB THR A 39 -0.617 -3.177 6.013 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.090 -4.472 7.978 1.00 0.00 H new ATOM 0 HG21 THR A 39 1.483 -3.853 4.908 1.00 0.00 H new ATOM 0 HG22 THR A 39 1.396 -2.081 5.036 1.00 0.00 H new ATOM 0 HG23 THR A 39 2.427 -3.005 6.155 1.00 0.00 H new ATOM 556 N ALA A 40 -1.791 -0.725 7.507 1.00 0.00 N ATOM 557 CA ALA A 40 -2.671 0.362 7.113 1.00 0.00 C ATOM 558 C ALA A 40 -2.936 1.262 8.321 1.00 0.00 C ATOM 559 O ALA A 40 -3.685 2.233 8.225 1.00 0.00 O ATOM 560 CB ALA A 40 -3.959 -0.212 6.519 1.00 0.00 C ATOM 0 H ALA A 40 -2.217 -1.415 8.126 1.00 0.00 H new ATOM 0 HA ALA A 40 -2.202 0.974 6.343 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -4.619 0.604 6.224 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -3.718 -0.818 5.646 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.459 -0.831 7.264 1.00 0.00 H new ATOM 566 N ILE A 41 -2.306 0.908 9.432 1.00 0.00 N ATOM 567 CA ILE A 41 -2.465 1.670 10.659 1.00 0.00 C ATOM 568 C ILE A 41 -1.095 2.160 11.130 1.00 0.00 C ATOM 569 O ILE A 41 -0.957 3.301 11.572 1.00 0.00 O ATOM 570 CB ILE A 41 -3.219 0.849 11.707 1.00 0.00 C ATOM 571 CG1 ILE A 41 -4.551 0.341 11.151 1.00 0.00 C ATOM 572 CG2 ILE A 41 -3.404 1.648 12.999 1.00 0.00 C ATOM 573 CD1 ILE A 41 -5.031 -0.892 11.919 1.00 0.00 C ATOM 0 H ILE A 41 -1.684 0.103 9.508 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.077 2.554 10.482 1.00 0.00 H new ATOM 0 HB ILE A 41 -2.618 -0.027 11.953 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.301 1.129 11.216 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -4.438 0.095 10.095 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.943 1.042 13.728 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -2.428 1.918 13.402 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.973 2.553 12.789 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.979 -1.233 11.504 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.290 -1.687 11.831 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -5.166 -0.636 12.970 1.00 0.00 H new ATOM 584 N ASP A 42 -0.116 1.275 11.021 1.00 0.00 N ATOM 585 CA ASP A 42 1.239 1.603 11.431 1.00 0.00 C ATOM 586 C ASP A 42 1.413 3.123 11.435 1.00 0.00 C ATOM 587 O ASP A 42 1.451 3.745 12.495 1.00 0.00 O ATOM 588 CB ASP A 42 2.266 1.013 10.463 1.00 0.00 C ATOM 589 CG ASP A 42 3.132 -0.108 11.041 1.00 0.00 C ATOM 590 OD1 ASP A 42 2.947 -0.406 12.241 1.00 0.00 O ATOM 591 OD2 ASP A 42 3.960 -0.642 10.271 1.00 0.00 O ATOM 0 H ASP A 42 -0.234 0.330 10.655 1.00 0.00 H new ATOM 0 HA ASP A 42 1.400 1.187 12.425 1.00 0.00 H new ATOM 0 HB2 ASP A 42 1.740 0.631 9.588 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.919 1.814 10.117 1.00 0.00 H new ATOM 595 N ARG A 43 1.512 3.678 10.236 1.00 0.00 N ATOM 596 CA ARG A 43 1.681 5.114 10.087 1.00 0.00 C ATOM 597 C ARG A 43 0.691 5.660 9.056 1.00 0.00 C ATOM 598 O ARG A 43 0.554 6.874 8.903 1.00 0.00 O ATOM 599 CB ARG A 43 3.105 5.460 9.651 1.00 0.00 C ATOM 600 CG ARG A 43 4.094 5.264 10.802 1.00 0.00 C ATOM 601 CD ARG A 43 4.550 6.611 11.368 1.00 0.00 C ATOM 602 NE ARG A 43 4.625 6.539 12.845 1.00 0.00 N ATOM 603 CZ ARG A 43 5.334 7.387 13.602 1.00 0.00 C ATOM 604 NH1 ARG A 43 6.033 8.375 13.027 1.00 0.00 N ATOM 605 NH2 ARG A 43 5.344 7.246 14.935 1.00 0.00 N ATOM 0 H ARG A 43 1.478 3.159 9.358 1.00 0.00 H new ATOM 0 HA ARG A 43 1.491 5.573 11.057 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.394 4.832 8.808 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.143 6.493 9.306 1.00 0.00 H new ATOM 0 HG2 ARG A 43 3.628 4.673 11.590 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.959 4.701 10.451 1.00 0.00 H new ATOM 0 HD2 ARG A 43 5.525 6.876 10.958 1.00 0.00 H new ATOM 0 HD3 ARG A 43 3.855 7.395 11.068 1.00 0.00 H new ATOM 0 HE ARG A 43 4.105 5.798 13.315 1.00 0.00 H new ATOM 0 HH11 ARG A 43 6.025 8.482 12.013 1.00 0.00 H new ATOM 0 HH12 ARG A 43 6.573 9.020 13.604 1.00 0.00 H new ATOM 0 HH21 ARG A 43 4.812 6.493 15.372 1.00 0.00 H new ATOM 0 HH22 ARG A 43 5.884 7.891 15.512 1.00 0.00 H new ATOM 616 N MET A 44 0.027 4.739 8.374 1.00 0.00 N ATOM 617 CA MET A 44 -0.946 5.113 7.362 1.00 0.00 C ATOM 618 C MET A 44 -2.213 5.682 8.002 1.00 0.00 C ATOM 619 O MET A 44 -2.973 6.398 7.352 1.00 0.00 O ATOM 620 CB MET A 44 -1.304 3.887 6.520 1.00 0.00 C ATOM 621 CG MET A 44 -0.093 3.392 5.727 1.00 0.00 C ATOM 622 SD MET A 44 -0.633 2.571 4.236 1.00 0.00 S ATOM 623 CE MET A 44 0.456 3.339 3.048 1.00 0.00 C ATOM 0 H MET A 44 0.144 3.734 8.502 1.00 0.00 H new ATOM 0 HA MET A 44 -0.506 5.883 6.729 1.00 0.00 H new ATOM 0 HB2 MET A 44 -1.669 3.090 7.168 1.00 0.00 H new ATOM 0 HB3 MET A 44 -2.114 4.136 5.835 1.00 0.00 H new ATOM 0 HG2 MET A 44 0.555 4.232 5.475 1.00 0.00 H new ATOM 0 HG3 MET A 44 0.496 2.706 6.337 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.135 3.888 2.315 1.00 0.00 H new ATOM 0 HE2 MET A 44 1.128 4.027 3.562 1.00 0.00 H new ATOM 0 HE3 MET A 44 1.041 2.571 2.541 1.00 0.00 H new ATOM 631 N ASN A 45 -2.401 5.341 9.268 1.00 0.00 N ATOM 632 CA ASN A 45 -3.564 5.810 10.004 1.00 0.00 C ATOM 633 C ASN A 45 -3.584 7.339 9.998 1.00 0.00 C ATOM 634 O ASN A 45 -4.253 7.952 9.168 1.00 0.00 O ATOM 635 CB ASN A 45 -3.519 5.343 11.460 1.00 0.00 C ATOM 636 CG ASN A 45 -4.720 4.451 11.788 1.00 0.00 C ATOM 637 OD1 ASN A 45 -5.055 3.615 10.810 1.00 0.00 O flip ATOM 638 ND2 ASN A 45 -5.302 4.520 12.857 1.00 0.00 N flip ATOM 0 H ASN A 45 -1.769 4.746 9.803 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.454 5.404 9.522 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -2.594 4.795 11.641 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.512 6.208 12.123 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -4.991 5.186 13.565 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -6.099 3.912 13.044 1.00 0.00 H new ATOM 644 N GLU A 46 -2.842 7.912 10.934 1.00 0.00 N ATOM 645 CA GLU A 46 -2.766 9.359 11.047 1.00 0.00 C ATOM 646 C GLU A 46 -1.688 9.908 10.112 1.00 0.00 C ATOM 647 O GLU A 46 -1.764 11.057 9.678 1.00 0.00 O ATOM 648 CB GLU A 46 -2.503 9.782 12.494 1.00 0.00 C ATOM 649 CG GLU A 46 -3.664 10.615 13.041 1.00 0.00 C ATOM 650 CD GLU A 46 -3.572 12.065 12.562 1.00 0.00 C ATOM 651 OE1 GLU A 46 -2.580 12.726 12.942 1.00 0.00 O ATOM 652 OE2 GLU A 46 -4.494 12.481 11.828 1.00 0.00 O ATOM 0 H GLU A 46 -2.288 7.401 11.621 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.727 9.779 10.748 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.361 8.898 13.115 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -1.580 10.360 12.546 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.611 10.181 12.719 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -3.655 10.587 14.131 1.00 0.00 H new ATOM 657 N GLY A 47 -0.709 9.062 9.826 1.00 0.00 N ATOM 658 CA GLY A 47 0.383 9.450 8.950 1.00 0.00 C ATOM 659 C GLY A 47 -0.119 9.701 7.527 1.00 0.00 C ATOM 660 O GLY A 47 0.276 10.675 6.888 1.00 0.00 O ATOM 0 H GLY A 47 -0.649 8.109 10.186 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.861 10.351 9.335 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.141 8.667 8.939 1.00 0.00 H new ATOM 664 N LEU A 48 -0.983 8.806 7.071 1.00 0.00 N ATOM 665 CA LEU A 48 -1.544 8.918 5.736 1.00 0.00 C ATOM 666 C LEU A 48 -2.518 10.097 5.693 1.00 0.00 C ATOM 667 O LEU A 48 -2.492 10.897 4.759 1.00 0.00 O ATOM 668 CB LEU A 48 -2.167 7.590 5.302 1.00 0.00 C ATOM 669 CG LEU A 48 -1.915 7.171 3.852 1.00 0.00 C ATOM 670 CD1 LEU A 48 -0.547 6.501 3.706 1.00 0.00 C ATOM 671 CD2 LEU A 48 -3.046 6.284 3.333 1.00 0.00 C ATOM 0 H LEU A 48 -1.308 7.999 7.603 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.758 9.127 5.010 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.791 6.804 5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -3.244 7.648 5.460 1.00 0.00 H new ATOM 0 HG LEU A 48 -1.902 8.069 3.234 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -0.392 6.213 2.666 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.234 7.198 4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.507 5.614 4.338 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -2.842 6.001 2.300 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.116 5.387 3.948 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.988 6.831 3.380 1.00 0.00 H new ATOM 682 N ASP A 49 -3.355 10.169 6.719 1.00 0.00 N ATOM 683 CA ASP A 49 -4.335 11.237 6.811 1.00 0.00 C ATOM 684 C ASP A 49 -3.625 12.547 7.154 1.00 0.00 C ATOM 685 O ASP A 49 -4.160 13.629 6.915 1.00 0.00 O ATOM 686 CB ASP A 49 -5.359 10.952 7.912 1.00 0.00 C ATOM 687 CG ASP A 49 -6.793 11.372 7.585 1.00 0.00 C ATOM 688 OD1 ASP A 49 -7.058 12.592 7.658 1.00 0.00 O ATOM 689 OD2 ASP A 49 -7.594 10.465 7.272 1.00 0.00 O ATOM 0 H ASP A 49 -3.374 9.505 7.493 1.00 0.00 H new ATOM 0 HA ASP A 49 -4.847 11.308 5.851 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.350 9.884 8.128 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.045 11.464 8.821 1.00 0.00 H new ATOM 693 N ALA A 50 -2.430 12.408 7.709 1.00 0.00 N ATOM 694 CA ALA A 50 -1.641 13.568 8.088 1.00 0.00 C ATOM 695 C ALA A 50 -0.920 14.113 6.854 1.00 0.00 C ATOM 696 O ALA A 50 -1.343 15.112 6.273 1.00 0.00 O ATOM 697 CB ALA A 50 -0.672 13.182 9.207 1.00 0.00 C ATOM 0 H ALA A 50 -1.989 11.510 7.905 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.283 14.361 8.472 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.080 14.052 9.492 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.236 12.828 10.070 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.009 12.391 8.857 1.00 0.00 H new ATOM 703 N PHE A 51 0.159 13.434 6.490 1.00 0.00 N ATOM 704 CA PHE A 51 0.943 13.839 5.335 1.00 0.00 C ATOM 705 C PHE A 51 0.037 14.290 4.188 1.00 0.00 C ATOM 706 O PHE A 51 0.315 15.292 3.530 1.00 0.00 O ATOM 707 CB PHE A 51 1.742 12.614 4.887 1.00 0.00 C ATOM 708 CG PHE A 51 1.053 11.784 3.802 1.00 0.00 C ATOM 709 CD1 PHE A 51 0.715 12.358 2.617 1.00 0.00 C ATOM 710 CD2 PHE A 51 0.777 10.470 4.024 1.00 0.00 C ATOM 711 CE1 PHE A 51 0.075 11.588 1.611 1.00 0.00 C ATOM 712 CE2 PHE A 51 0.137 9.699 3.018 1.00 0.00 C ATOM 713 CZ PHE A 51 -0.200 10.275 1.833 1.00 0.00 C ATOM 0 H PHE A 51 0.508 12.607 6.974 1.00 0.00 H new ATOM 0 HA PHE A 51 1.592 14.674 5.599 1.00 0.00 H new ATOM 0 HB2 PHE A 51 2.713 12.942 4.517 1.00 0.00 H new ATOM 0 HB3 PHE A 51 1.929 11.978 5.753 1.00 0.00 H new ATOM 0 HD1 PHE A 51 0.934 13.401 2.441 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.045 10.014 4.965 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -0.193 12.045 0.670 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -0.082 8.656 3.194 1.00 0.00 H new ATOM 0 HZ PHE A 51 -0.687 9.689 1.067 1.00 0.00 H new ATOM 722 N ILE A 52 -1.027 13.528 3.982 1.00 0.00 N ATOM 723 CA ILE A 52 -1.976 13.838 2.925 1.00 0.00 C ATOM 724 C ILE A 52 -2.719 15.129 3.274 1.00 0.00 C ATOM 725 O ILE A 52 -2.859 16.015 2.433 1.00 0.00 O ATOM 726 CB ILE A 52 -2.900 12.646 2.670 1.00 0.00 C ATOM 727 CG1 ILE A 52 -3.374 12.621 1.215 1.00 0.00 C ATOM 728 CG2 ILE A 52 -4.072 12.639 3.655 1.00 0.00 C ATOM 729 CD1 ILE A 52 -3.259 11.215 0.625 1.00 0.00 C ATOM 0 H ILE A 52 -1.253 12.697 4.528 1.00 0.00 H new ATOM 0 HA ILE A 52 -1.455 14.015 1.984 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.332 11.731 2.840 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -4.409 12.959 1.160 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.780 13.317 0.623 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -4.713 11.781 3.452 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.691 12.573 4.674 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.648 13.557 3.542 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.602 11.225 -0.409 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.219 10.890 0.659 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -3.874 10.526 1.204 1.00 0.00 H new ATOM 740 N GLN A 53 -3.176 15.193 4.517 1.00 0.00 N ATOM 741 CA GLN A 53 -3.901 16.361 4.988 1.00 0.00 C ATOM 742 C GLN A 53 -2.940 17.534 5.198 1.00 0.00 C ATOM 743 O GLN A 53 -3.366 18.634 5.545 1.00 0.00 O ATOM 744 CB GLN A 53 -4.672 16.047 6.271 1.00 0.00 C ATOM 745 CG GLN A 53 -5.475 17.263 6.739 1.00 0.00 C ATOM 746 CD GLN A 53 -6.796 16.832 7.382 1.00 0.00 C ATOM 747 OE1 GLN A 53 -7.281 15.731 7.187 1.00 0.00 O ATOM 748 NE2 GLN A 53 -7.347 17.762 8.158 1.00 0.00 N ATOM 0 H GLN A 53 -3.058 14.455 5.211 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.628 16.645 4.227 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -5.345 15.207 6.099 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -3.976 15.743 7.053 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -4.888 17.838 7.455 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -5.675 17.919 5.892 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -6.887 18.664 8.278 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -8.230 17.573 8.633 1.00 0.00 H new ATOM 755 N LEU A 54 -1.663 17.258 4.978 1.00 0.00 N ATOM 756 CA LEU A 54 -0.639 18.275 5.139 1.00 0.00 C ATOM 757 C LEU A 54 0.077 18.488 3.803 1.00 0.00 C ATOM 758 O LEU A 54 0.772 19.486 3.620 1.00 0.00 O ATOM 759 CB LEU A 54 0.301 17.912 6.289 1.00 0.00 C ATOM 760 CG LEU A 54 -0.179 18.287 7.693 1.00 0.00 C ATOM 761 CD1 LEU A 54 -0.216 17.061 8.607 1.00 0.00 C ATOM 762 CD2 LEU A 54 0.672 19.416 8.280 1.00 0.00 C ATOM 0 H LEU A 54 -1.314 16.344 4.689 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.089 19.228 5.415 1.00 0.00 H new ATOM 0 HB2 LEU A 54 0.477 16.837 6.262 1.00 0.00 H new ATOM 0 HB3 LEU A 54 1.261 18.397 6.114 1.00 0.00 H new ATOM 0 HG LEU A 54 -1.200 18.660 7.616 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.561 17.356 9.598 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.898 16.318 8.192 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.784 16.633 8.683 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.310 19.663 9.278 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.712 19.094 8.341 1.00 0.00 H new ATOM 0 HD23 LEU A 54 0.601 20.296 7.640 1.00 0.00 H new ATOM 773 N TYR A 55 -0.119 17.533 2.905 1.00 0.00 N ATOM 774 CA TYR A 55 0.500 17.604 1.593 1.00 0.00 C ATOM 775 C TYR A 55 -0.547 17.466 0.485 1.00 0.00 C ATOM 776 O TYR A 55 -0.817 18.421 -0.242 1.00 0.00 O ATOM 777 CB TYR A 55 1.464 16.419 1.516 1.00 0.00 C ATOM 778 CG TYR A 55 2.461 16.502 0.358 1.00 0.00 C ATOM 779 CD1 TYR A 55 2.292 17.447 -0.632 1.00 0.00 C ATOM 780 CD2 TYR A 55 3.529 15.630 0.304 1.00 0.00 C ATOM 781 CE1 TYR A 55 3.230 17.525 -1.722 1.00 0.00 C ATOM 782 CE2 TYR A 55 4.467 15.707 -0.785 1.00 0.00 C ATOM 783 CZ TYR A 55 4.272 16.651 -1.745 1.00 0.00 C ATOM 784 OH TYR A 55 5.158 16.724 -2.774 1.00 0.00 O ATOM 0 H TYR A 55 -0.697 16.707 3.060 1.00 0.00 H new ATOM 0 HA TYR A 55 1.003 18.562 1.458 1.00 0.00 H new ATOM 0 HB2 TYR A 55 2.016 16.352 2.453 1.00 0.00 H new ATOM 0 HB3 TYR A 55 0.886 15.500 1.420 1.00 0.00 H new ATOM 0 HD1 TYR A 55 1.456 18.129 -0.590 1.00 0.00 H new ATOM 0 HD2 TYR A 55 3.661 14.890 1.079 1.00 0.00 H new ATOM 0 HE1 TYR A 55 3.109 18.261 -2.503 1.00 0.00 H new ATOM 0 HE2 TYR A 55 5.307 15.030 -0.839 1.00 0.00 H new ATOM 0 HH TYR A 55 5.512 15.830 -2.965 1.00 0.00 H new ATOM 793 N ASN A 56 -1.108 16.270 0.392 1.00 0.00 N ATOM 794 CA ASN A 56 -2.120 15.993 -0.614 1.00 0.00 C ATOM 795 C ASN A 56 -1.452 15.884 -1.987 1.00 0.00 C ATOM 796 O ASN A 56 -1.961 16.413 -2.973 1.00 0.00 O ATOM 797 CB ASN A 56 -3.154 17.120 -0.680 1.00 0.00 C ATOM 798 CG ASN A 56 -4.568 16.558 -0.825 1.00 0.00 C ATOM 799 OD1 ASN A 56 -5.071 16.344 -1.916 1.00 0.00 O ATOM 800 ND2 ASN A 56 -5.181 16.330 0.333 1.00 0.00 N ATOM 0 H ASN A 56 -0.881 15.481 0.997 1.00 0.00 H new ATOM 0 HA ASN A 56 -2.618 15.062 -0.344 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.092 17.729 0.222 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -2.931 17.774 -1.523 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -6.129 15.954 0.343 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -4.703 16.531 1.211 1.00 0.00 H new ATOM 806 N GLU A 57 -0.321 15.195 -2.005 1.00 0.00 N ATOM 807 CA GLU A 57 0.423 15.011 -3.240 1.00 0.00 C ATOM 808 C GLU A 57 -0.073 13.764 -3.976 1.00 0.00 C ATOM 809 O GLU A 57 0.076 13.657 -5.193 1.00 0.00 O ATOM 810 CB GLU A 57 1.926 14.924 -2.968 1.00 0.00 C ATOM 811 CG GLU A 57 2.731 15.304 -4.212 1.00 0.00 C ATOM 812 CD GLU A 57 2.794 16.823 -4.381 1.00 0.00 C ATOM 813 OE1 GLU A 57 1.751 17.466 -4.132 1.00 0.00 O ATOM 814 OE2 GLU A 57 3.883 17.308 -4.757 1.00 0.00 O ATOM 0 H GLU A 57 0.099 14.757 -1.185 1.00 0.00 H new ATOM 0 HA GLU A 57 0.252 15.879 -3.877 1.00 0.00 H new ATOM 0 HB2 GLU A 57 2.189 15.587 -2.144 1.00 0.00 H new ATOM 0 HB3 GLU A 57 2.185 13.912 -2.658 1.00 0.00 H new ATOM 0 HG2 GLU A 57 3.741 14.901 -4.133 1.00 0.00 H new ATOM 0 HG3 GLU A 57 2.276 14.855 -5.095 1.00 0.00 H new ATOM 819 N SER A 58 -0.652 12.854 -3.208 1.00 0.00 N ATOM 820 CA SER A 58 -1.171 11.619 -3.772 1.00 0.00 C ATOM 821 C SER A 58 -0.092 10.534 -3.739 1.00 0.00 C ATOM 822 O SER A 58 -0.388 9.354 -3.915 1.00 0.00 O ATOM 823 CB SER A 58 -1.666 11.832 -5.204 1.00 0.00 C ATOM 824 OG SER A 58 -2.366 13.065 -5.349 1.00 0.00 O ATOM 0 H SER A 58 -0.774 12.947 -2.200 1.00 0.00 H new ATOM 0 HA SER A 58 -2.019 11.297 -3.168 1.00 0.00 H new ATOM 0 HB2 SER A 58 -0.817 11.815 -5.887 1.00 0.00 H new ATOM 0 HB3 SER A 58 -2.321 11.008 -5.488 1.00 0.00 H new ATOM 0 HG SER A 58 -3.314 12.885 -5.519 1.00 0.00 H new ATOM 829 N GLU A 59 1.138 10.975 -3.514 1.00 0.00 N ATOM 830 CA GLU A 59 2.262 10.057 -3.457 1.00 0.00 C ATOM 831 C GLU A 59 3.352 10.610 -2.536 1.00 0.00 C ATOM 832 O GLU A 59 3.551 10.108 -1.432 1.00 0.00 O ATOM 833 CB GLU A 59 2.815 9.778 -4.855 1.00 0.00 C ATOM 834 CG GLU A 59 2.858 8.276 -5.138 1.00 0.00 C ATOM 835 CD GLU A 59 1.567 7.807 -5.812 1.00 0.00 C ATOM 836 OE1 GLU A 59 0.952 8.646 -6.506 1.00 0.00 O ATOM 837 OE2 GLU A 59 1.224 6.621 -5.618 1.00 0.00 O ATOM 0 H GLU A 59 1.380 11.955 -3.369 1.00 0.00 H new ATOM 0 HA GLU A 59 1.912 9.110 -3.046 1.00 0.00 H new ATOM 0 HB2 GLU A 59 2.195 10.275 -5.601 1.00 0.00 H new ATOM 0 HB3 GLU A 59 3.817 10.197 -4.944 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.710 8.047 -5.778 1.00 0.00 H new ATOM 0 HG3 GLU A 59 3.004 7.731 -4.206 1.00 0.00 H new ATOM 842 N ILE A 60 4.030 11.638 -3.026 1.00 0.00 N ATOM 843 CA ILE A 60 5.095 12.265 -2.261 1.00 0.00 C ATOM 844 C ILE A 60 5.807 13.296 -3.139 1.00 0.00 C ATOM 845 O ILE A 60 5.754 14.494 -2.863 1.00 0.00 O ATOM 846 CB ILE A 60 6.030 11.205 -1.676 1.00 0.00 C ATOM 847 CG1 ILE A 60 6.068 9.958 -2.562 1.00 0.00 C ATOM 848 CG2 ILE A 60 5.645 10.871 -0.234 1.00 0.00 C ATOM 849 CD1 ILE A 60 7.506 9.483 -2.778 1.00 0.00 C ATOM 0 H ILE A 60 3.863 12.052 -3.943 1.00 0.00 H new ATOM 0 HA ILE A 60 4.685 12.802 -1.405 1.00 0.00 H new ATOM 0 HB ILE A 60 7.040 11.615 -1.654 1.00 0.00 H new ATOM 0 HG12 ILE A 60 5.484 9.162 -2.101 1.00 0.00 H new ATOM 0 HG13 ILE A 60 5.605 10.177 -3.524 1.00 0.00 H new ATOM 0 HG21 ILE A 60 6.325 10.115 0.158 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.711 11.771 0.378 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.624 10.489 -0.209 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.505 8.596 -3.411 1.00 0.00 H new ATOM 0 HD12 ILE A 60 8.081 10.273 -3.261 1.00 0.00 H new ATOM 0 HD13 ILE A 60 7.958 9.242 -1.816 1.00 0.00 H new ATOM 860 N ASP A 61 6.457 12.794 -4.178 1.00 0.00 N ATOM 861 CA ASP A 61 7.179 13.657 -5.097 1.00 0.00 C ATOM 862 C ASP A 61 6.231 14.733 -5.632 1.00 0.00 C ATOM 863 O ASP A 61 6.346 15.902 -5.267 1.00 0.00 O ATOM 864 CB ASP A 61 7.716 12.864 -6.291 1.00 0.00 C ATOM 865 CG ASP A 61 9.142 13.220 -6.716 1.00 0.00 C ATOM 866 OD1 ASP A 61 9.270 14.127 -7.567 1.00 0.00 O ATOM 867 OD2 ASP A 61 10.071 12.578 -6.180 1.00 0.00 O ATOM 0 H ASP A 61 6.499 11.800 -4.404 1.00 0.00 H new ATOM 0 HA ASP A 61 8.013 14.103 -4.555 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.680 11.802 -6.048 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.050 13.020 -7.140 1.00 0.00 H new ATOM 871 N GLU A 62 5.317 14.298 -6.487 1.00 0.00 N ATOM 872 CA GLU A 62 4.350 15.210 -7.075 1.00 0.00 C ATOM 873 C GLU A 62 3.525 14.491 -8.144 1.00 0.00 C ATOM 874 O GLU A 62 3.945 13.461 -8.670 1.00 0.00 O ATOM 875 CB GLU A 62 5.042 16.444 -7.655 1.00 0.00 C ATOM 876 CG GLU A 62 6.334 16.059 -8.378 1.00 0.00 C ATOM 877 CD GLU A 62 6.818 17.196 -9.280 1.00 0.00 C ATOM 878 OE1 GLU A 62 5.942 17.881 -9.850 1.00 0.00 O ATOM 879 OE2 GLU A 62 8.054 17.357 -9.379 1.00 0.00 O ATOM 0 H GLU A 62 5.226 13.327 -6.786 1.00 0.00 H new ATOM 0 HA GLU A 62 3.675 15.549 -6.289 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.370 16.950 -8.348 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.265 17.150 -6.855 1.00 0.00 H new ATOM 0 HG2 GLU A 62 7.105 15.817 -7.647 1.00 0.00 H new ATOM 0 HG3 GLU A 62 6.167 15.162 -8.975 1.00 0.00 H new ATOM 884 N PRO A 63 2.334 15.076 -8.442 1.00 0.00 N ATOM 885 CA PRO A 63 1.446 14.502 -9.438 1.00 0.00 C ATOM 886 C PRO A 63 1.967 14.763 -10.852 1.00 0.00 C ATOM 887 O PRO A 63 1.198 15.108 -11.748 1.00 0.00 O ATOM 888 CB PRO A 63 0.093 15.144 -9.176 1.00 0.00 C ATOM 889 CG PRO A 63 0.376 16.389 -8.351 1.00 0.00 C ATOM 890 CD PRO A 63 1.803 16.296 -7.839 1.00 0.00 C ATOM 0 HA PRO A 63 1.378 13.417 -9.365 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -0.406 15.400 -10.111 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.566 14.461 -8.640 1.00 0.00 H new ATOM 0 HG2 PRO A 63 0.246 17.286 -8.957 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.324 16.462 -7.519 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.387 17.169 -8.132 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.831 16.244 -6.751 1.00 0.00 H new ATOM 895 N LEU A 64 3.272 14.589 -11.010 1.00 0.00 N ATOM 896 CA LEU A 64 3.905 14.801 -12.300 1.00 0.00 C ATOM 897 C LEU A 64 3.838 13.509 -13.115 1.00 0.00 C ATOM 898 O LEU A 64 4.010 13.528 -14.333 1.00 0.00 O ATOM 899 CB LEU A 64 5.325 15.342 -12.117 1.00 0.00 C ATOM 900 CG LEU A 64 6.095 15.654 -13.402 1.00 0.00 C ATOM 901 CD1 LEU A 64 5.479 16.847 -14.135 1.00 0.00 C ATOM 902 CD2 LEU A 64 7.582 15.863 -13.113 1.00 0.00 C ATOM 0 H LEU A 64 3.908 14.303 -10.265 1.00 0.00 H new ATOM 0 HA LEU A 64 3.370 15.563 -12.867 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.272 16.252 -11.519 1.00 0.00 H new ATOM 0 HB3 LEU A 64 5.898 14.615 -11.541 1.00 0.00 H new ATOM 0 HG LEU A 64 6.015 14.793 -14.066 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.045 17.047 -15.044 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.445 16.620 -14.394 1.00 0.00 H new ATOM 0 HD13 LEU A 64 5.507 17.725 -13.489 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.106 16.083 -14.043 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.705 16.696 -12.421 1.00 0.00 H new ATOM 0 HD23 LEU A 64 7.997 14.958 -12.668 1.00 0.00 H new ATOM 913 N ILE A 65 3.589 12.415 -12.410 1.00 0.00 N ATOM 914 CA ILE A 65 3.498 11.115 -13.053 1.00 0.00 C ATOM 915 C ILE A 65 4.891 10.484 -13.118 1.00 0.00 C ATOM 916 O ILE A 65 5.135 9.593 -13.930 1.00 0.00 O ATOM 917 CB ILE A 65 2.815 11.238 -14.417 1.00 0.00 C ATOM 918 CG1 ILE A 65 1.774 10.134 -14.611 1.00 0.00 C ATOM 919 CG2 ILE A 65 3.847 11.259 -15.547 1.00 0.00 C ATOM 920 CD1 ILE A 65 0.402 10.578 -14.102 1.00 0.00 C ATOM 0 H ILE A 65 3.447 12.402 -11.400 1.00 0.00 H new ATOM 0 HA ILE A 65 2.870 10.444 -12.467 1.00 0.00 H new ATOM 0 HB ILE A 65 2.284 12.189 -14.449 1.00 0.00 H new ATOM 0 HG12 ILE A 65 1.707 9.874 -15.667 1.00 0.00 H new ATOM 0 HG13 ILE A 65 2.089 9.235 -14.081 1.00 0.00 H new ATOM 0 HG21 ILE A 65 3.335 11.347 -16.505 1.00 0.00 H new ATOM 0 HG22 ILE A 65 4.516 12.109 -15.413 1.00 0.00 H new ATOM 0 HG23 ILE A 65 4.426 10.336 -15.528 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -0.319 9.775 -14.252 1.00 0.00 H new ATOM 0 HD12 ILE A 65 0.467 10.814 -13.040 1.00 0.00 H new ATOM 0 HD13 ILE A 65 0.079 11.463 -14.651 1.00 0.00 H new ATOM 931 N GLN A 66 5.767 10.970 -12.250 1.00 0.00 N ATOM 932 CA GLN A 66 7.128 10.465 -12.199 1.00 0.00 C ATOM 933 C GLN A 66 7.327 9.607 -10.948 1.00 0.00 C ATOM 934 O GLN A 66 8.115 8.662 -10.959 1.00 0.00 O ATOM 935 CB GLN A 66 8.140 11.611 -12.246 1.00 0.00 C ATOM 936 CG GLN A 66 8.030 12.492 -10.999 1.00 0.00 C ATOM 937 CD GLN A 66 9.341 13.234 -10.734 1.00 0.00 C ATOM 938 OE1 GLN A 66 9.630 14.264 -11.321 1.00 0.00 O ATOM 939 NE2 GLN A 66 10.115 12.656 -9.820 1.00 0.00 N ATOM 0 H GLN A 66 5.560 11.708 -11.577 1.00 0.00 H new ATOM 0 HA GLN A 66 7.297 9.840 -13.076 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.149 11.207 -12.322 1.00 0.00 H new ATOM 0 HB3 GLN A 66 7.970 12.214 -13.138 1.00 0.00 H new ATOM 0 HG2 GLN A 66 7.221 13.211 -11.128 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.776 11.877 -10.136 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.812 11.794 -9.367 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.011 13.075 -9.572 1.00 0.00 H new ATOM 946 N LEU A 67 6.602 9.967 -9.900 1.00 0.00 N ATOM 947 CA LEU A 67 6.691 9.242 -8.643 1.00 0.00 C ATOM 948 C LEU A 67 5.286 8.833 -8.197 1.00 0.00 C ATOM 949 O LEU A 67 5.120 7.836 -7.494 1.00 0.00 O ATOM 950 CB LEU A 67 7.452 10.065 -7.603 1.00 0.00 C ATOM 951 CG LEU A 67 8.849 9.559 -7.238 1.00 0.00 C ATOM 952 CD1 LEU A 67 8.771 8.237 -6.471 1.00 0.00 C ATOM 953 CD2 LEU A 67 9.734 9.448 -8.482 1.00 0.00 C ATOM 0 H LEU A 67 5.950 10.751 -9.895 1.00 0.00 H new ATOM 0 HA LEU A 67 7.266 8.325 -8.771 1.00 0.00 H new ATOM 0 HB2 LEU A 67 7.542 11.086 -7.973 1.00 0.00 H new ATOM 0 HB3 LEU A 67 6.853 10.107 -6.693 1.00 0.00 H new ATOM 0 HG LEU A 67 9.314 10.289 -6.575 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.778 7.900 -6.224 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.201 8.382 -5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.278 7.486 -7.089 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.721 9.086 -8.195 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.283 8.751 -9.188 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.828 10.428 -8.950 1.00 0.00 H new ATOM 964 N ASP A 68 4.311 9.621 -8.622 1.00 0.00 N ATOM 965 CA ASP A 68 2.926 9.353 -8.274 1.00 0.00 C ATOM 966 C ASP A 68 2.483 8.045 -8.933 1.00 0.00 C ATOM 967 O ASP A 68 1.684 7.300 -8.368 1.00 0.00 O ATOM 968 CB ASP A 68 2.006 10.470 -8.774 1.00 0.00 C ATOM 969 CG ASP A 68 1.010 10.997 -7.741 1.00 0.00 C ATOM 970 OD1 ASP A 68 1.407 11.910 -6.984 1.00 0.00 O ATOM 971 OD2 ASP A 68 -0.126 10.477 -7.730 1.00 0.00 O ATOM 0 H ASP A 68 4.452 10.446 -9.205 1.00 0.00 H new ATOM 0 HA ASP A 68 2.858 9.288 -7.188 1.00 0.00 H new ATOM 0 HB2 ASP A 68 2.622 11.300 -9.119 1.00 0.00 H new ATOM 0 HB3 ASP A 68 1.451 10.104 -9.638 1.00 0.00 H new ATOM 975 N ASP A 69 3.020 7.806 -10.121 1.00 0.00 N ATOM 976 CA ASP A 69 2.691 6.602 -10.863 1.00 0.00 C ATOM 977 C ASP A 69 3.639 5.475 -10.446 1.00 0.00 C ATOM 978 O ASP A 69 3.328 4.299 -10.624 1.00 0.00 O ATOM 979 CB ASP A 69 2.852 6.820 -12.368 1.00 0.00 C ATOM 980 CG ASP A 69 1.684 6.322 -13.222 1.00 0.00 C ATOM 981 OD1 ASP A 69 0.539 6.421 -12.730 1.00 0.00 O ATOM 982 OD2 ASP A 69 1.963 5.854 -14.347 1.00 0.00 O ATOM 0 H ASP A 69 3.681 8.427 -10.588 1.00 0.00 H new ATOM 0 HA ASP A 69 1.654 6.345 -10.644 1.00 0.00 H new ATOM 0 HB2 ASP A 69 2.989 7.885 -12.553 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.763 6.319 -12.697 1.00 0.00 H new ATOM 986 N ASP A 70 4.776 5.876 -9.896 1.00 0.00 N ATOM 987 CA ASP A 70 5.772 4.914 -9.452 1.00 0.00 C ATOM 988 C ASP A 70 5.238 4.160 -8.233 1.00 0.00 C ATOM 989 O ASP A 70 5.432 2.951 -8.113 1.00 0.00 O ATOM 990 CB ASP A 70 7.069 5.615 -9.043 1.00 0.00 C ATOM 991 CG ASP A 70 8.312 4.723 -9.039 1.00 0.00 C ATOM 992 OD1 ASP A 70 8.196 3.585 -9.542 1.00 0.00 O ATOM 993 OD2 ASP A 70 9.351 5.199 -8.533 1.00 0.00 O ATOM 0 H ASP A 70 5.030 6.853 -9.748 1.00 0.00 H new ATOM 0 HA ASP A 70 5.975 4.232 -10.278 1.00 0.00 H new ATOM 0 HB2 ASP A 70 7.242 6.451 -9.721 1.00 0.00 H new ATOM 0 HB3 ASP A 70 6.938 6.035 -8.046 1.00 0.00 H new ATOM 997 N THR A 71 4.575 4.904 -7.360 1.00 0.00 N ATOM 998 CA THR A 71 4.011 4.320 -6.155 1.00 0.00 C ATOM 999 C THR A 71 2.599 3.796 -6.427 1.00 0.00 C ATOM 1000 O THR A 71 2.215 2.744 -5.917 1.00 0.00 O ATOM 1001 CB THR A 71 4.065 5.375 -5.048 1.00 0.00 C ATOM 1002 OG1 THR A 71 5.017 6.324 -5.520 1.00 0.00 O ATOM 1003 CG2 THR A 71 4.684 4.838 -3.757 1.00 0.00 C ATOM 0 H THR A 71 4.416 5.906 -7.463 1.00 0.00 H new ATOM 0 HA THR A 71 4.588 3.455 -5.827 1.00 0.00 H new ATOM 0 HB THR A 71 3.058 5.738 -4.844 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.232 6.956 -4.803 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.698 5.627 -3.005 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.092 3.999 -3.392 1.00 0.00 H new ATOM 0 HG23 THR A 71 5.703 4.505 -3.953 1.00 0.00 H new ATOM 1011 N ALA A 72 1.865 4.555 -7.227 1.00 0.00 N ATOM 1012 CA ALA A 72 0.504 4.181 -7.571 1.00 0.00 C ATOM 1013 C ALA A 72 0.516 2.825 -8.280 1.00 0.00 C ATOM 1014 O ALA A 72 -0.432 2.050 -8.163 1.00 0.00 O ATOM 1015 CB ALA A 72 -0.127 5.281 -8.428 1.00 0.00 C ATOM 0 H ALA A 72 2.187 5.427 -7.647 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.104 4.078 -6.672 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.148 5.000 -8.686 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.138 6.217 -7.869 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.455 5.411 -9.340 1.00 0.00 H new ATOM 1021 N GLU A 73 1.602 2.580 -9.000 1.00 0.00 N ATOM 1022 CA GLU A 73 1.750 1.331 -9.727 1.00 0.00 C ATOM 1023 C GLU A 73 1.936 0.167 -8.752 1.00 0.00 C ATOM 1024 O GLU A 73 1.646 -0.981 -9.088 1.00 0.00 O ATOM 1025 CB GLU A 73 2.914 1.408 -10.717 1.00 0.00 C ATOM 1026 CG GLU A 73 2.405 1.518 -12.156 1.00 0.00 C ATOM 1027 CD GLU A 73 2.451 2.967 -12.645 1.00 0.00 C ATOM 1028 OE1 GLU A 73 3.548 3.386 -13.074 1.00 0.00 O ATOM 1029 OE2 GLU A 73 1.388 3.623 -12.578 1.00 0.00 O ATOM 0 H GLU A 73 2.387 3.225 -9.095 1.00 0.00 H new ATOM 0 HA GLU A 73 0.839 1.157 -10.300 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.539 2.269 -10.482 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.541 0.522 -10.616 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.012 0.891 -12.809 1.00 0.00 H new ATOM 0 HG3 GLU A 73 1.383 1.143 -12.214 1.00 0.00 H new ATOM 1034 N LEU A 74 2.418 0.503 -7.565 1.00 0.00 N ATOM 1035 CA LEU A 74 2.646 -0.500 -6.538 1.00 0.00 C ATOM 1036 C LEU A 74 1.299 -0.991 -6.004 1.00 0.00 C ATOM 1037 O LEU A 74 1.009 -2.186 -6.048 1.00 0.00 O ATOM 1038 CB LEU A 74 3.576 0.046 -5.453 1.00 0.00 C ATOM 1039 CG LEU A 74 5.004 0.373 -5.896 1.00 0.00 C ATOM 1040 CD1 LEU A 74 5.652 1.387 -4.951 1.00 0.00 C ATOM 1041 CD2 LEU A 74 5.841 -0.900 -6.033 1.00 0.00 C ATOM 0 H LEU A 74 2.657 1.456 -7.291 1.00 0.00 H new ATOM 0 HA LEU A 74 3.158 -1.366 -6.958 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.129 0.950 -5.040 1.00 0.00 H new ATOM 0 HB3 LEU A 74 3.626 -0.683 -4.644 1.00 0.00 H new ATOM 0 HG LEU A 74 4.959 0.835 -6.882 1.00 0.00 H new ATOM 0 HD11 LEU A 74 6.666 1.602 -5.288 1.00 0.00 H new ATOM 0 HD12 LEU A 74 5.068 2.307 -4.948 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.685 0.975 -3.942 1.00 0.00 H new ATOM 0 HD21 LEU A 74 6.851 -0.639 -6.349 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.882 -1.413 -5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 74 5.387 -1.556 -6.776 1.00 0.00 H new ATOM 1052 N MET A 75 0.513 -0.046 -5.511 1.00 0.00 N ATOM 1053 CA MET A 75 -0.796 -0.368 -4.968 1.00 0.00 C ATOM 1054 C MET A 75 -1.737 -0.867 -6.066 1.00 0.00 C ATOM 1055 O MET A 75 -2.538 -1.772 -5.839 1.00 0.00 O ATOM 1056 CB MET A 75 -1.395 0.875 -4.307 1.00 0.00 C ATOM 1057 CG MET A 75 -1.460 2.043 -5.294 1.00 0.00 C ATOM 1058 SD MET A 75 -2.343 3.411 -4.563 1.00 0.00 S ATOM 1059 CE MET A 75 -3.755 3.486 -5.654 1.00 0.00 C ATOM 0 H MET A 75 0.757 0.944 -5.476 1.00 0.00 H new ATOM 0 HA MET A 75 -0.677 -1.161 -4.229 1.00 0.00 H new ATOM 0 HB2 MET A 75 -2.396 0.649 -3.939 1.00 0.00 H new ATOM 0 HB3 MET A 75 -0.794 1.157 -3.443 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.452 2.355 -5.568 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.957 1.727 -6.212 1.00 0.00 H new ATOM 0 HE1 MET A 75 -4.241 4.456 -5.554 1.00 0.00 H new ATOM 0 HE2 MET A 75 -3.426 3.350 -6.684 1.00 0.00 H new ATOM 0 HE3 MET A 75 -4.460 2.698 -5.391 1.00 0.00 H new ATOM 1067 N LYS A 76 -1.609 -0.253 -7.234 1.00 0.00 N ATOM 1068 CA LYS A 76 -2.439 -0.623 -8.368 1.00 0.00 C ATOM 1069 C LYS A 76 -2.043 -2.020 -8.849 1.00 0.00 C ATOM 1070 O LYS A 76 -2.895 -2.897 -8.991 1.00 0.00 O ATOM 1071 CB LYS A 76 -2.363 0.447 -9.459 1.00 0.00 C ATOM 1072 CG LYS A 76 -3.180 1.682 -9.074 1.00 0.00 C ATOM 1073 CD LYS A 76 -4.066 2.137 -10.235 1.00 0.00 C ATOM 1074 CE LYS A 76 -3.680 3.543 -10.702 1.00 0.00 C ATOM 1075 NZ LYS A 76 -4.737 4.515 -10.348 1.00 0.00 N ATOM 0 H LYS A 76 -0.943 0.498 -7.419 1.00 0.00 H new ATOM 0 HA LYS A 76 -3.487 -0.671 -8.073 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -1.323 0.731 -9.623 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -2.734 0.040 -10.399 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -3.799 1.457 -8.206 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.509 2.491 -8.785 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.973 1.436 -11.065 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -5.111 2.127 -9.925 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -2.737 3.839 -10.243 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -3.523 3.544 -11.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -4.459 5.463 -10.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -5.629 4.240 -10.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -4.867 4.526 -9.316 1.00 0.00 H new ATOM 1085 N GLN A 77 -0.750 -2.186 -9.086 1.00 0.00 N ATOM 1086 CA GLN A 77 -0.232 -3.462 -9.548 1.00 0.00 C ATOM 1087 C GLN A 77 -0.654 -4.583 -8.596 1.00 0.00 C ATOM 1088 O GLN A 77 -0.764 -5.739 -9.002 1.00 0.00 O ATOM 1089 CB GLN A 77 1.290 -3.414 -9.698 1.00 0.00 C ATOM 1090 CG GLN A 77 1.843 -4.777 -10.120 1.00 0.00 C ATOM 1091 CD GLN A 77 3.190 -4.626 -10.831 1.00 0.00 C ATOM 1092 OE1 GLN A 77 3.376 -3.781 -11.691 1.00 0.00 O ATOM 1093 NE2 GLN A 77 4.116 -5.489 -10.422 1.00 0.00 N ATOM 0 H GLN A 77 -0.046 -1.458 -8.967 1.00 0.00 H new ATOM 0 HA GLN A 77 -0.655 -3.669 -10.531 1.00 0.00 H new ATOM 0 HB2 GLN A 77 1.562 -2.662 -10.439 1.00 0.00 H new ATOM 0 HB3 GLN A 77 1.743 -3.110 -8.754 1.00 0.00 H new ATOM 0 HG2 GLN A 77 1.960 -5.413 -9.243 1.00 0.00 H new ATOM 0 HG3 GLN A 77 1.132 -5.273 -10.781 1.00 0.00 H new ATOM 0 HE21 GLN A 77 3.893 -6.171 -9.697 1.00 0.00 H new ATOM 0 HE22 GLN A 77 5.049 -5.469 -10.833 1.00 0.00 H new ATOM 1100 N ALA A 78 -0.879 -4.202 -7.347 1.00 0.00 N ATOM 1101 CA ALA A 78 -1.287 -5.160 -6.334 1.00 0.00 C ATOM 1102 C ALA A 78 -2.720 -5.613 -6.615 1.00 0.00 C ATOM 1103 O ALA A 78 -2.940 -6.711 -7.122 1.00 0.00 O ATOM 1104 CB ALA A 78 -1.134 -4.532 -4.947 1.00 0.00 C ATOM 0 H ALA A 78 -0.786 -3.242 -7.014 1.00 0.00 H new ATOM 0 HA ALA A 78 -0.651 -6.045 -6.363 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -1.440 -5.250 -4.187 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -0.092 -4.255 -4.786 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -1.761 -3.643 -4.879 1.00 0.00 H new ATOM 1110 N ARG A 79 -3.660 -4.744 -6.271 1.00 0.00 N ATOM 1111 CA ARG A 79 -5.066 -5.041 -6.479 1.00 0.00 C ATOM 1112 C ARG A 79 -5.343 -5.286 -7.964 1.00 0.00 C ATOM 1113 O ARG A 79 -6.446 -5.685 -8.336 1.00 0.00 O ATOM 1114 CB ARG A 79 -5.951 -3.894 -5.986 1.00 0.00 C ATOM 1115 CG ARG A 79 -7.418 -4.323 -5.915 1.00 0.00 C ATOM 1116 CD ARG A 79 -8.350 -3.126 -6.110 1.00 0.00 C ATOM 1117 NE ARG A 79 -9.492 -3.508 -6.970 1.00 0.00 N ATOM 1118 CZ ARG A 79 -9.379 -3.855 -8.259 1.00 0.00 C ATOM 1119 NH1 ARG A 79 -8.174 -3.869 -8.846 1.00 0.00 N ATOM 1120 NH2 ARG A 79 -10.470 -4.187 -8.962 1.00 0.00 N ATOM 0 H ARG A 79 -3.474 -3.834 -5.849 1.00 0.00 H new ATOM 0 HA ARG A 79 -5.302 -5.939 -5.908 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -5.616 -3.569 -5.001 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -5.851 -3.039 -6.655 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -7.619 -5.073 -6.680 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -7.618 -4.790 -4.951 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -8.713 -2.776 -5.144 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.803 -2.299 -6.563 1.00 0.00 H new ATOM 0 HE ARG A 79 -10.424 -3.507 -6.555 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -7.343 -3.615 -8.311 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -8.088 -4.133 -9.827 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -11.387 -4.176 -8.516 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -10.383 -4.451 -9.943 1.00 0.00 H new ATOM 1131 N ASP A 80 -4.323 -5.039 -8.772 1.00 0.00 N ATOM 1132 CA ASP A 80 -4.442 -5.229 -10.208 1.00 0.00 C ATOM 1133 C ASP A 80 -4.282 -6.714 -10.537 1.00 0.00 C ATOM 1134 O ASP A 80 -5.133 -7.301 -11.203 1.00 0.00 O ATOM 1135 CB ASP A 80 -3.353 -4.458 -10.957 1.00 0.00 C ATOM 1136 CG ASP A 80 -3.063 -4.961 -12.372 1.00 0.00 C ATOM 1137 OD1 ASP A 80 -3.896 -5.745 -12.878 1.00 0.00 O ATOM 1138 OD2 ASP A 80 -2.016 -4.550 -12.918 1.00 0.00 O ATOM 0 H ASP A 80 -3.410 -4.709 -8.460 1.00 0.00 H new ATOM 0 HA ASP A 80 -5.421 -4.862 -10.517 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.644 -3.409 -11.013 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.432 -4.502 -10.376 1.00 0.00 H new ATOM 1142 N MET A 81 -3.186 -7.280 -10.054 1.00 0.00 N ATOM 1143 CA MET A 81 -2.903 -8.685 -10.288 1.00 0.00 C ATOM 1144 C MET A 81 -3.763 -9.576 -9.387 1.00 0.00 C ATOM 1145 O MET A 81 -4.096 -10.700 -9.756 1.00 0.00 O ATOM 1146 CB MET A 81 -1.423 -8.962 -10.016 1.00 0.00 C ATOM 1147 CG MET A 81 -0.535 -7.957 -10.752 1.00 0.00 C ATOM 1148 SD MET A 81 0.469 -8.801 -11.963 1.00 0.00 S ATOM 1149 CE MET A 81 -0.652 -8.795 -13.352 1.00 0.00 C ATOM 0 H MET A 81 -2.483 -6.790 -9.501 1.00 0.00 H new ATOM 0 HA MET A 81 -3.139 -8.914 -11.327 1.00 0.00 H new ATOM 0 HB2 MET A 81 -1.230 -8.908 -8.945 1.00 0.00 H new ATOM 0 HB3 MET A 81 -1.174 -9.974 -10.334 1.00 0.00 H new ATOM 0 HG2 MET A 81 -1.153 -7.204 -11.241 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.103 -7.433 -10.040 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.180 -9.288 -14.202 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.565 -9.327 -13.085 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.896 -7.767 -13.618 1.00 0.00 H new ATOM 1157 N TYR A 82 -4.095 -9.037 -8.223 1.00 0.00 N ATOM 1158 CA TYR A 82 -4.909 -9.768 -7.267 1.00 0.00 C ATOM 1159 C TYR A 82 -5.116 -8.954 -5.987 1.00 0.00 C ATOM 1160 O TYR A 82 -6.142 -9.087 -5.321 1.00 0.00 O ATOM 1161 CB TYR A 82 -4.124 -11.037 -6.927 1.00 0.00 C ATOM 1162 CG TYR A 82 -5.002 -12.267 -6.693 1.00 0.00 C ATOM 1163 CD1 TYR A 82 -6.126 -12.172 -5.897 1.00 0.00 C ATOM 1164 CD2 TYR A 82 -4.671 -13.474 -7.276 1.00 0.00 C ATOM 1165 CE1 TYR A 82 -6.953 -13.331 -5.676 1.00 0.00 C ATOM 1166 CE2 TYR A 82 -5.497 -14.632 -7.056 1.00 0.00 C ATOM 1167 CZ TYR A 82 -6.597 -14.504 -6.266 1.00 0.00 C ATOM 1168 OH TYR A 82 -7.378 -15.597 -6.058 1.00 0.00 O ATOM 0 H TYR A 82 -3.815 -8.104 -7.921 1.00 0.00 H new ATOM 0 HA TYR A 82 -5.892 -9.983 -7.686 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -3.427 -11.249 -7.738 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -3.527 -10.854 -6.034 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -6.385 -11.229 -5.440 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.791 -13.549 -7.898 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -7.835 -13.270 -5.056 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -5.249 -15.581 -7.508 1.00 0.00 H new ATOM 0 HH TYR A 82 -7.004 -16.363 -6.541 1.00 0.00 H new ATOM 1177 N GLY A 83 -4.125 -8.129 -5.683 1.00 0.00 N ATOM 1178 CA GLY A 83 -4.186 -7.293 -4.496 1.00 0.00 C ATOM 1179 C GLY A 83 -3.537 -7.992 -3.299 1.00 0.00 C ATOM 1180 O GLY A 83 -3.422 -7.409 -2.223 1.00 0.00 O ATOM 0 H GLY A 83 -3.276 -8.022 -6.238 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.680 -6.347 -4.687 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.225 -7.058 -4.265 1.00 0.00 H new ATOM 1184 N GLN A 84 -3.128 -9.231 -3.528 1.00 0.00 N ATOM 1185 CA GLN A 84 -2.492 -10.016 -2.484 1.00 0.00 C ATOM 1186 C GLN A 84 -1.590 -9.126 -1.628 1.00 0.00 C ATOM 1187 O GLN A 84 -1.373 -9.406 -0.449 1.00 0.00 O ATOM 1188 CB GLN A 84 -1.706 -11.186 -3.078 1.00 0.00 C ATOM 1189 CG GLN A 84 -0.608 -10.687 -4.020 1.00 0.00 C ATOM 1190 CD GLN A 84 -0.131 -11.807 -4.947 1.00 0.00 C ATOM 1191 OE1 GLN A 84 0.715 -12.614 -4.601 1.00 0.00 O ATOM 1192 NE2 GLN A 84 -0.719 -11.810 -6.139 1.00 0.00 N ATOM 0 H GLN A 84 -3.225 -9.711 -4.423 1.00 0.00 H new ATOM 0 HA GLN A 84 -3.270 -10.434 -1.845 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.262 -11.775 -2.276 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -2.383 -11.846 -3.620 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -0.984 -9.854 -4.614 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.232 -10.309 -3.437 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -1.420 -11.104 -6.364 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -0.469 -12.518 -6.829 1.00 0.00 H new ATOM 1199 N GLU A 85 -1.086 -8.072 -2.253 1.00 0.00 N ATOM 1200 CA GLU A 85 -0.211 -7.140 -1.563 1.00 0.00 C ATOM 1201 C GLU A 85 -0.834 -6.713 -0.232 1.00 0.00 C ATOM 1202 O GLU A 85 -0.468 -7.230 0.823 1.00 0.00 O ATOM 1203 CB GLU A 85 0.096 -5.924 -2.439 1.00 0.00 C ATOM 1204 CG GLU A 85 1.519 -5.418 -2.197 1.00 0.00 C ATOM 1205 CD GLU A 85 2.295 -5.313 -3.512 1.00 0.00 C ATOM 1206 OE1 GLU A 85 2.219 -6.284 -4.295 1.00 0.00 O ATOM 1207 OE2 GLU A 85 2.947 -4.263 -3.703 1.00 0.00 O ATOM 0 H GLU A 85 -1.267 -7.843 -3.230 1.00 0.00 H new ATOM 0 HA GLU A 85 0.733 -7.644 -1.355 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.026 -6.188 -3.489 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.618 -5.128 -2.226 1.00 0.00 H new ATOM 0 HG2 GLU A 85 1.484 -4.442 -1.712 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.038 -6.093 -1.517 1.00 0.00 H new ATOM 1212 N LYS A 86 -1.763 -5.774 -0.324 1.00 0.00 N ATOM 1213 CA LYS A 86 -2.441 -5.272 0.859 1.00 0.00 C ATOM 1214 C LYS A 86 -3.874 -4.881 0.495 1.00 0.00 C ATOM 1215 O LYS A 86 -4.635 -4.432 1.350 1.00 0.00 O ATOM 1216 CB LYS A 86 -1.636 -4.136 1.495 1.00 0.00 C ATOM 1217 CG LYS A 86 -1.762 -4.161 3.020 1.00 0.00 C ATOM 1218 CD LYS A 86 -2.190 -2.794 3.558 1.00 0.00 C ATOM 1219 CE LYS A 86 -1.231 -1.698 3.090 1.00 0.00 C ATOM 1220 NZ LYS A 86 -1.166 -0.606 4.088 1.00 0.00 N ATOM 0 H LYS A 86 -2.063 -5.347 -1.200 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.507 -6.051 1.619 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.587 -4.226 1.212 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -1.988 -3.178 1.113 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.490 -4.916 3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -0.808 -4.447 3.463 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.201 -2.566 3.221 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.216 -2.819 4.647 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -0.237 -2.118 2.936 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.562 -1.302 2.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -1.103 0.309 3.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -2.022 -0.624 4.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -0.327 -0.735 4.690 1.00 0.00 H new ATOM 1230 N LEU A 87 -4.199 -5.067 -0.777 1.00 0.00 N ATOM 1231 CA LEU A 87 -5.528 -4.740 -1.265 1.00 0.00 C ATOM 1232 C LEU A 87 -6.049 -5.893 -2.125 1.00 0.00 C ATOM 1233 O LEU A 87 -6.311 -5.715 -3.314 1.00 0.00 O ATOM 1234 CB LEU A 87 -5.516 -3.390 -1.986 1.00 0.00 C ATOM 1235 CG LEU A 87 -4.330 -3.138 -2.919 1.00 0.00 C ATOM 1236 CD1 LEU A 87 -4.559 -1.891 -3.773 1.00 0.00 C ATOM 1237 CD2 LEU A 87 -3.020 -3.061 -2.130 1.00 0.00 C ATOM 0 H LEU A 87 -3.565 -5.440 -1.484 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.222 -4.625 -0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.434 -3.303 -2.567 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.537 -2.600 -1.236 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.246 -3.983 -3.602 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.701 -1.735 -4.427 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.456 -2.024 -4.377 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.683 -1.024 -3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.192 -2.881 -2.816 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.077 -2.246 -1.409 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.857 -4.001 -1.603 1.00 0.00 H new ATOM 1248 N ASN A 88 -6.182 -7.049 -1.491 1.00 0.00 N ATOM 1249 CA ASN A 88 -6.667 -8.230 -2.184 1.00 0.00 C ATOM 1250 C ASN A 88 -8.061 -8.586 -1.663 1.00 0.00 C ATOM 1251 O ASN A 88 -9.016 -7.838 -1.871 1.00 0.00 O ATOM 1252 CB ASN A 88 -5.750 -9.429 -1.936 1.00 0.00 C ATOM 1253 CG ASN A 88 -5.931 -10.491 -3.023 1.00 0.00 C ATOM 1254 OD1 ASN A 88 -5.003 -10.867 -3.720 1.00 0.00 O ATOM 1255 ND2 ASN A 88 -7.173 -10.953 -3.126 1.00 0.00 N ATOM 0 H ASN A 88 -5.962 -7.193 -0.505 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.691 -8.008 -3.251 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.711 -9.099 -1.914 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -5.967 -9.862 -0.960 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -7.396 -11.666 -3.821 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -7.903 -10.595 -2.510 1.00 0.00 H new ATOM 1261 N GLU A 89 -8.134 -9.727 -0.994 1.00 0.00 N ATOM 1262 CA GLU A 89 -9.395 -10.191 -0.441 1.00 0.00 C ATOM 1263 C GLU A 89 -9.765 -9.373 0.798 1.00 0.00 C ATOM 1264 O GLU A 89 -10.619 -8.491 0.731 1.00 0.00 O ATOM 1265 CB GLU A 89 -9.334 -11.685 -0.114 1.00 0.00 C ATOM 1266 CG GLU A 89 -10.674 -12.181 0.433 1.00 0.00 C ATOM 1267 CD GLU A 89 -10.507 -12.779 1.832 1.00 0.00 C ATOM 1268 OE1 GLU A 89 -9.888 -13.862 1.917 1.00 0.00 O ATOM 1269 OE2 GLU A 89 -11.002 -12.140 2.785 1.00 0.00 O ATOM 0 H GLU A 89 -7.340 -10.344 -0.822 1.00 0.00 H new ATOM 0 HA GLU A 89 -10.172 -10.048 -1.192 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -9.073 -12.247 -1.011 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.548 -11.869 0.618 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.384 -11.355 0.469 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -11.091 -12.931 -0.240 1.00 0.00 H new ATOM 1274 N LYS A 90 -9.102 -9.696 1.900 1.00 0.00 N ATOM 1275 CA LYS A 90 -9.350 -9.001 3.151 1.00 0.00 C ATOM 1276 C LYS A 90 -8.538 -7.705 3.180 1.00 0.00 C ATOM 1277 O LYS A 90 -8.859 -6.784 3.931 1.00 0.00 O ATOM 1278 CB LYS A 90 -9.076 -9.925 4.340 1.00 0.00 C ATOM 1279 CG LYS A 90 -10.383 -10.379 4.995 1.00 0.00 C ATOM 1280 CD LYS A 90 -10.620 -9.639 6.314 1.00 0.00 C ATOM 1281 CE LYS A 90 -11.767 -8.635 6.180 1.00 0.00 C ATOM 1282 NZ LYS A 90 -13.055 -9.270 6.538 1.00 0.00 N ATOM 0 H LYS A 90 -8.394 -10.429 1.952 1.00 0.00 H new ATOM 0 HA LYS A 90 -10.400 -8.721 3.229 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.511 -10.795 4.006 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.459 -9.406 5.073 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.217 -10.197 4.317 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.349 -11.453 5.177 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -10.850 -10.357 7.102 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.710 -9.119 6.612 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -11.585 -7.777 6.828 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.812 -8.259 5.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.823 -8.575 6.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.234 -10.074 5.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.014 -9.607 7.521 1.00 0.00 H new ATOM 1292 N LEU A 91 -7.504 -7.674 2.354 1.00 0.00 N ATOM 1293 CA LEU A 91 -6.643 -6.506 2.275 1.00 0.00 C ATOM 1294 C LEU A 91 -7.369 -5.393 1.517 1.00 0.00 C ATOM 1295 O LEU A 91 -7.218 -4.215 1.839 1.00 0.00 O ATOM 1296 CB LEU A 91 -5.287 -6.877 1.672 1.00 0.00 C ATOM 1297 CG LEU A 91 -4.993 -8.375 1.558 1.00 0.00 C ATOM 1298 CD1 LEU A 91 -3.548 -8.617 1.116 1.00 0.00 C ATOM 1299 CD2 LEU A 91 -5.320 -9.099 2.866 1.00 0.00 C ATOM 0 H LEU A 91 -7.242 -8.439 1.733 1.00 0.00 H new ATOM 0 HA LEU A 91 -6.427 -6.125 3.273 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -5.221 -6.437 0.677 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -4.505 -6.418 2.276 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.641 -8.793 0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.365 -9.689 1.043 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -3.382 -8.153 0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.866 -8.181 1.847 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.102 -10.162 2.758 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -4.715 -8.685 3.672 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.376 -8.967 3.101 1.00 0.00 H new ATOM 1310 N ASN A 92 -8.142 -5.805 0.522 1.00 0.00 N ATOM 1311 CA ASN A 92 -8.893 -4.858 -0.284 1.00 0.00 C ATOM 1312 C ASN A 92 -9.765 -3.995 0.629 1.00 0.00 C ATOM 1313 O ASN A 92 -9.922 -2.798 0.394 1.00 0.00 O ATOM 1314 CB ASN A 92 -9.811 -5.582 -1.271 1.00 0.00 C ATOM 1315 CG ASN A 92 -10.995 -4.698 -1.667 1.00 0.00 C ATOM 1316 OD1 ASN A 92 -10.923 -3.480 -1.663 1.00 0.00 O ATOM 1317 ND2 ASN A 92 -12.087 -5.376 -2.009 1.00 0.00 N ATOM 0 H ASN A 92 -8.264 -6.782 0.256 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.180 -4.246 -0.837 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -9.247 -5.861 -2.161 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -10.176 -6.506 -0.823 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -12.931 -4.876 -2.289 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -12.081 -6.396 -1.991 1.00 0.00 H new ATOM 1323 N THR A 93 -10.310 -4.637 1.653 1.00 0.00 N ATOM 1324 CA THR A 93 -11.163 -3.942 2.602 1.00 0.00 C ATOM 1325 C THR A 93 -10.329 -3.018 3.491 1.00 0.00 C ATOM 1326 O THR A 93 -10.730 -1.889 3.769 1.00 0.00 O ATOM 1327 CB THR A 93 -11.950 -4.994 3.387 1.00 0.00 C ATOM 1328 OG1 THR A 93 -12.796 -5.595 2.410 1.00 0.00 O ATOM 1329 CG2 THR A 93 -12.924 -4.370 4.388 1.00 0.00 C ATOM 0 H THR A 93 -10.177 -5.630 1.846 1.00 0.00 H new ATOM 0 HA THR A 93 -11.876 -3.294 2.093 1.00 0.00 H new ATOM 0 HB THR A 93 -11.255 -5.647 3.915 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.341 -6.291 2.833 1.00 0.00 H new ATOM 0 HG21 THR A 93 -13.457 -5.160 4.918 1.00 0.00 H new ATOM 0 HG22 THR A 93 -12.370 -3.762 5.104 1.00 0.00 H new ATOM 0 HG23 THR A 93 -13.640 -3.743 3.857 1.00 0.00 H new ATOM 1337 N ILE A 94 -9.183 -3.532 3.914 1.00 0.00 N ATOM 1338 CA ILE A 94 -8.290 -2.768 4.767 1.00 0.00 C ATOM 1339 C ILE A 94 -7.740 -1.575 3.982 1.00 0.00 C ATOM 1340 O ILE A 94 -7.569 -0.489 4.536 1.00 0.00 O ATOM 1341 CB ILE A 94 -7.203 -3.673 5.352 1.00 0.00 C ATOM 1342 CG1 ILE A 94 -7.813 -4.756 6.244 1.00 0.00 C ATOM 1343 CG2 ILE A 94 -6.145 -2.851 6.091 1.00 0.00 C ATOM 1344 CD1 ILE A 94 -8.507 -4.139 7.460 1.00 0.00 C ATOM 0 H ILE A 94 -8.853 -4.469 3.681 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.832 -2.365 5.623 1.00 0.00 H new ATOM 0 HB ILE A 94 -6.700 -4.180 4.528 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.530 -5.343 5.670 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -7.033 -5.441 6.575 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.384 -3.518 6.497 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -5.680 -2.149 5.398 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -6.616 -2.299 6.905 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -8.932 -4.931 8.077 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -7.782 -3.573 8.045 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -9.303 -3.473 7.126 1.00 0.00 H new ATOM 1355 N ILE A 95 -7.479 -1.816 2.707 1.00 0.00 N ATOM 1356 CA ILE A 95 -6.952 -0.775 1.840 1.00 0.00 C ATOM 1357 C ILE A 95 -8.105 0.101 1.345 1.00 0.00 C ATOM 1358 O ILE A 95 -7.916 1.287 1.081 1.00 0.00 O ATOM 1359 CB ILE A 95 -6.116 -1.387 0.714 1.00 0.00 C ATOM 1360 CG1 ILE A 95 -4.740 -1.818 1.225 1.00 0.00 C ATOM 1361 CG2 ILE A 95 -6.012 -0.428 -0.474 1.00 0.00 C ATOM 1362 CD1 ILE A 95 -3.842 -0.605 1.474 1.00 0.00 C ATOM 0 H ILE A 95 -7.622 -2.718 2.252 1.00 0.00 H new ATOM 0 HA ILE A 95 -6.272 -0.126 2.392 1.00 0.00 H new ATOM 0 HB ILE A 95 -6.623 -2.285 0.360 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.853 -2.387 2.148 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.269 -2.480 0.498 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -5.413 -0.887 -1.261 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -7.010 -0.213 -0.857 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -5.539 0.500 -0.152 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -2.870 -0.940 1.837 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.711 -0.052 0.544 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -4.304 0.043 2.219 1.00 0.00 H new ATOM 1373 N LYS A 96 -9.270 -0.518 1.234 1.00 0.00 N ATOM 1374 CA LYS A 96 -10.453 0.190 0.775 1.00 0.00 C ATOM 1375 C LYS A 96 -10.781 1.316 1.758 1.00 0.00 C ATOM 1376 O LYS A 96 -11.265 2.374 1.357 1.00 0.00 O ATOM 1377 CB LYS A 96 -11.609 -0.785 0.549 1.00 0.00 C ATOM 1378 CG LYS A 96 -12.958 -0.105 0.795 1.00 0.00 C ATOM 1379 CD LYS A 96 -14.103 -1.116 0.723 1.00 0.00 C ATOM 1380 CE LYS A 96 -14.639 -1.438 2.119 1.00 0.00 C ATOM 1381 NZ LYS A 96 -15.800 -0.578 2.439 1.00 0.00 N ATOM 0 H LYS A 96 -9.421 -1.503 1.454 1.00 0.00 H new ATOM 0 HA LYS A 96 -10.266 0.655 -0.193 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.572 -1.168 -0.471 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.503 -1.641 1.215 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -12.954 0.376 1.773 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.114 0.680 0.055 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.907 -0.717 0.104 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -13.755 -2.031 0.243 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.931 -2.487 2.170 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.853 -1.289 2.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.152 -0.809 3.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.511 0.421 2.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.555 -0.740 1.742 1.00 0.00 H new ATOM 1391 N GLN A 97 -10.506 1.051 3.026 1.00 0.00 N ATOM 1392 CA GLN A 97 -10.765 2.028 4.069 1.00 0.00 C ATOM 1393 C GLN A 97 -9.607 3.023 4.164 1.00 0.00 C ATOM 1394 O GLN A 97 -9.828 4.230 4.247 1.00 0.00 O ATOM 1395 CB GLN A 97 -11.012 1.342 5.414 1.00 0.00 C ATOM 1396 CG GLN A 97 -12.285 1.871 6.075 1.00 0.00 C ATOM 1397 CD GLN A 97 -13.533 1.310 5.390 1.00 0.00 C ATOM 1398 OE1 GLN A 97 -13.879 1.676 4.278 1.00 0.00 O ATOM 1399 NE2 GLN A 97 -14.186 0.404 6.112 1.00 0.00 N ATOM 0 H GLN A 97 -10.106 0.172 3.355 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.669 2.578 3.808 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -11.095 0.265 5.267 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -10.160 1.509 6.073 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -12.291 1.598 7.130 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.298 2.960 6.027 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -13.841 0.143 7.036 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.031 -0.030 5.742 1.00 0.00 H new ATOM 1406 N ILE A 98 -8.400 2.480 4.150 1.00 0.00 N ATOM 1407 CA ILE A 98 -7.206 3.305 4.234 1.00 0.00 C ATOM 1408 C ILE A 98 -7.031 4.075 2.925 1.00 0.00 C ATOM 1409 O ILE A 98 -6.256 5.028 2.859 1.00 0.00 O ATOM 1410 CB ILE A 98 -5.993 2.455 4.614 1.00 0.00 C ATOM 1411 CG1 ILE A 98 -5.003 3.259 5.461 1.00 0.00 C ATOM 1412 CG2 ILE A 98 -5.331 1.857 3.372 1.00 0.00 C ATOM 1413 CD1 ILE A 98 -5.669 3.783 6.734 1.00 0.00 C ATOM 0 H ILE A 98 -8.222 1.478 4.082 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.309 4.044 5.028 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.339 1.622 5.227 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.151 2.632 5.724 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -4.616 4.095 4.878 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -4.471 1.257 3.671 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.048 1.227 2.846 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.002 2.660 2.713 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -4.944 4.350 7.317 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.505 4.429 6.468 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -6.033 2.943 7.326 1.00 0.00 H new ATOM 1424 N LEU A 99 -7.766 3.635 1.913 1.00 0.00 N ATOM 1425 CA LEU A 99 -7.701 4.272 0.609 1.00 0.00 C ATOM 1426 C LEU A 99 -8.933 5.158 0.418 1.00 0.00 C ATOM 1427 O LEU A 99 -8.872 6.169 -0.282 1.00 0.00 O ATOM 1428 CB LEU A 99 -7.522 3.223 -0.491 1.00 0.00 C ATOM 1429 CG LEU A 99 -7.271 3.764 -1.899 1.00 0.00 C ATOM 1430 CD1 LEU A 99 -5.916 3.297 -2.434 1.00 0.00 C ATOM 1431 CD2 LEU A 99 -8.417 3.393 -2.842 1.00 0.00 C ATOM 0 H LEU A 99 -8.409 2.845 1.970 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.827 4.921 0.545 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.688 2.577 -0.217 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.414 2.597 -0.517 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.238 4.852 -1.844 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -5.764 3.696 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.123 3.654 -1.777 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.895 2.208 -2.470 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -8.213 3.790 -3.836 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -8.507 2.308 -2.896 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -9.349 3.816 -2.467 1.00 0.00 H new ATOM 1442 N SER A 100 -10.021 4.749 1.052 1.00 0.00 N ATOM 1443 CA SER A 100 -11.266 5.496 0.961 1.00 0.00 C ATOM 1444 C SER A 100 -11.302 6.585 2.034 1.00 0.00 C ATOM 1445 O SER A 100 -12.176 7.450 2.015 1.00 0.00 O ATOM 1446 CB SER A 100 -12.475 4.568 1.103 1.00 0.00 C ATOM 1447 OG SER A 100 -13.705 5.283 1.036 1.00 0.00 O ATOM 0 H SER A 100 -10.068 3.911 1.631 1.00 0.00 H new ATOM 0 HA SER A 100 -11.315 5.964 -0.022 1.00 0.00 H new ATOM 0 HB2 SER A 100 -12.449 3.815 0.315 1.00 0.00 H new ATOM 0 HB3 SER A 100 -12.415 4.037 2.053 1.00 0.00 H new ATOM 0 HG SER A 100 -13.572 6.195 1.369 1.00 0.00 H new ATOM 1452 N ILE A 101 -10.343 6.507 2.945 1.00 0.00 N ATOM 1453 CA ILE A 101 -10.256 7.475 4.025 1.00 0.00 C ATOM 1454 C ILE A 101 -9.936 8.854 3.442 1.00 0.00 C ATOM 1455 O ILE A 101 -9.930 9.850 4.163 1.00 0.00 O ATOM 1456 CB ILE A 101 -9.256 7.008 5.084 1.00 0.00 C ATOM 1457 CG1 ILE A 101 -9.314 7.901 6.325 1.00 0.00 C ATOM 1458 CG2 ILE A 101 -7.842 6.924 4.505 1.00 0.00 C ATOM 1459 CD1 ILE A 101 -10.751 8.045 6.829 1.00 0.00 C ATOM 0 H ILE A 101 -9.619 5.788 2.957 1.00 0.00 H new ATOM 0 HA ILE A 101 -11.213 7.559 4.540 1.00 0.00 H new ATOM 0 HB ILE A 101 -9.536 6.002 5.397 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -8.689 7.478 7.112 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.907 8.884 6.089 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -7.151 6.590 5.279 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -7.829 6.216 3.677 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.537 7.907 4.146 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -10.765 8.684 7.712 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -11.367 8.491 6.048 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -11.146 7.062 7.087 1.00 0.00 H new ATOM 1470 N SER A 102 -9.676 8.865 2.143 1.00 0.00 N ATOM 1471 CA SER A 102 -9.355 10.105 1.455 1.00 0.00 C ATOM 1472 C SER A 102 -7.838 10.256 1.328 1.00 0.00 C ATOM 1473 O SER A 102 -7.279 11.288 1.697 1.00 0.00 O ATOM 1474 CB SER A 102 -9.948 11.310 2.188 1.00 0.00 C ATOM 1475 OG SER A 102 -11.279 11.063 2.632 1.00 0.00 O ATOM 0 H SER A 102 -9.681 8.036 1.549 1.00 0.00 H new ATOM 0 HA SER A 102 -9.795 10.067 0.458 1.00 0.00 H new ATOM 0 HB2 SER A 102 -9.321 11.558 3.044 1.00 0.00 H new ATOM 0 HB3 SER A 102 -9.942 12.176 1.526 1.00 0.00 H new ATOM 0 HG SER A 102 -11.271 10.857 3.590 1.00 0.00 H new ATOM 1480 N VAL A 103 -7.214 9.211 0.804 1.00 0.00 N ATOM 1481 CA VAL A 103 -5.772 9.214 0.623 1.00 0.00 C ATOM 1482 C VAL A 103 -5.445 8.909 -0.840 1.00 0.00 C ATOM 1483 O VAL A 103 -4.529 9.498 -1.411 1.00 0.00 O ATOM 1484 CB VAL A 103 -5.120 8.232 1.598 1.00 0.00 C ATOM 1485 CG1 VAL A 103 -5.911 8.150 2.905 1.00 0.00 C ATOM 1486 CG2 VAL A 103 -4.968 6.848 0.963 1.00 0.00 C ATOM 0 H VAL A 103 -7.680 8.357 0.499 1.00 0.00 H new ATOM 0 HA VAL A 103 -5.361 10.198 0.850 1.00 0.00 H new ATOM 0 HB VAL A 103 -4.123 8.605 1.832 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.426 7.445 3.580 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.946 9.134 3.372 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.926 7.812 2.695 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.502 6.169 1.677 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.950 6.465 0.686 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.343 6.923 0.073 1.00 0.00 H new ATOM 1496 N SER A 104 -6.212 7.988 -1.405 1.00 0.00 N ATOM 1497 CA SER A 104 -6.016 7.598 -2.791 1.00 0.00 C ATOM 1498 C SER A 104 -7.313 7.792 -3.579 1.00 0.00 C ATOM 1499 O SER A 104 -7.284 8.201 -4.738 1.00 0.00 O ATOM 1500 CB SER A 104 -5.546 6.146 -2.893 1.00 0.00 C ATOM 1501 OG SER A 104 -4.282 6.038 -3.543 1.00 0.00 O ATOM 0 H SER A 104 -6.970 7.501 -0.928 1.00 0.00 H new ATOM 0 HA SER A 104 -5.241 8.234 -3.218 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.478 5.716 -1.894 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.286 5.563 -3.441 1.00 0.00 H new ATOM 0 HG SER A 104 -3.800 5.260 -3.193 1.00 0.00 H new ATOM 1506 N GLU A 105 -8.421 7.491 -2.916 1.00 0.00 N ATOM 1507 CA GLU A 105 -9.726 7.627 -3.539 1.00 0.00 C ATOM 1508 C GLU A 105 -10.064 9.104 -3.745 1.00 0.00 C ATOM 1509 O GLU A 105 -10.964 9.438 -4.515 1.00 0.00 O ATOM 1510 CB GLU A 105 -10.805 6.927 -2.711 1.00 0.00 C ATOM 1511 CG GLU A 105 -11.510 5.844 -3.531 1.00 0.00 C ATOM 1512 CD GLU A 105 -12.713 6.421 -4.279 1.00 0.00 C ATOM 1513 OE1 GLU A 105 -13.222 7.466 -3.819 1.00 0.00 O ATOM 1514 OE2 GLU A 105 -13.099 5.803 -5.296 1.00 0.00 O ATOM 0 H GLU A 105 -8.441 7.154 -1.954 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.693 7.143 -4.515 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.355 6.481 -1.824 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.535 7.659 -2.365 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.809 5.408 -4.243 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.838 5.040 -2.873 1.00 0.00 H new ATOM 1519 N GLU A 106 -9.325 9.951 -3.043 1.00 0.00 N ATOM 1520 CA GLU A 106 -9.536 11.386 -3.139 1.00 0.00 C ATOM 1521 C GLU A 106 -8.225 12.092 -3.491 1.00 0.00 C ATOM 1522 O GLU A 106 -8.122 13.312 -3.372 1.00 0.00 O ATOM 1523 CB GLU A 106 -10.125 11.941 -1.841 1.00 0.00 C ATOM 1524 CG GLU A 106 -11.114 13.074 -2.127 1.00 0.00 C ATOM 1525 CD GLU A 106 -10.413 14.433 -2.100 1.00 0.00 C ATOM 1526 OE1 GLU A 106 -10.018 14.845 -0.988 1.00 0.00 O ATOM 1527 OE2 GLU A 106 -10.288 15.029 -3.191 1.00 0.00 O ATOM 0 H GLU A 106 -8.580 9.671 -2.406 1.00 0.00 H new ATOM 0 HA GLU A 106 -10.255 11.576 -3.936 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -10.629 11.143 -1.296 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -9.322 12.307 -1.201 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -11.578 12.919 -3.101 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -11.914 13.059 -1.387 1.00 0.00 H new ATOM 1532 N GLY A 107 -7.257 11.296 -3.919 1.00 0.00 N ATOM 1533 CA GLY A 107 -5.958 11.829 -4.291 1.00 0.00 C ATOM 1534 C GLY A 107 -6.074 12.766 -5.495 1.00 0.00 C ATOM 1535 O GLY A 107 -5.114 13.448 -5.851 1.00 0.00 O ATOM 0 H GLY A 107 -7.346 10.285 -4.017 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -5.527 12.367 -3.447 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.279 11.010 -4.527 1.00 0.00 H new ATOM 1539 N GLU A 108 -7.258 12.769 -6.090 1.00 0.00 N ATOM 1540 CA GLU A 108 -7.511 13.610 -7.248 1.00 0.00 C ATOM 1541 C GLU A 108 -8.997 13.574 -7.614 1.00 0.00 C ATOM 1542 O GLU A 108 -9.582 14.603 -7.947 1.00 0.00 O ATOM 1543 CB GLU A 108 -6.643 13.187 -8.435 1.00 0.00 C ATOM 1544 CG GLU A 108 -6.020 14.404 -9.120 1.00 0.00 C ATOM 1545 CD GLU A 108 -4.900 13.984 -10.074 1.00 0.00 C ATOM 1546 OE1 GLU A 108 -5.035 12.886 -10.658 1.00 0.00 O ATOM 1547 OE2 GLU A 108 -3.935 14.768 -10.197 1.00 0.00 O ATOM 0 H GLU A 108 -8.052 12.203 -5.792 1.00 0.00 H new ATOM 0 HA GLU A 108 -7.243 14.636 -6.993 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -5.856 12.515 -8.093 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -7.247 12.631 -9.152 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.787 14.948 -9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -5.625 15.086 -8.368 1.00 0.00 H new ATOM 1552 N LYS A 109 -9.563 12.379 -7.542 1.00 0.00 N ATOM 1553 CA LYS A 109 -10.968 12.196 -7.863 1.00 0.00 C ATOM 1554 C LYS A 109 -11.315 10.707 -7.783 1.00 0.00 C ATOM 1555 O LYS A 109 -11.832 10.240 -6.769 1.00 0.00 O ATOM 1556 CB LYS A 109 -11.296 12.831 -9.215 1.00 0.00 C ATOM 1557 CG LYS A 109 -12.715 12.469 -9.661 1.00 0.00 C ATOM 1558 CD LYS A 109 -13.737 13.456 -9.094 1.00 0.00 C ATOM 1559 CE LYS A 109 -14.440 12.872 -7.867 1.00 0.00 C ATOM 1560 NZ LYS A 109 -14.771 13.943 -6.901 1.00 0.00 N ATOM 0 H LYS A 109 -9.074 11.527 -7.266 1.00 0.00 H new ATOM 0 HA LYS A 109 -11.595 12.710 -7.135 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -11.198 13.914 -9.145 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -10.579 12.494 -9.963 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -12.769 12.470 -10.750 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -12.957 11.459 -9.330 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -13.238 14.386 -8.823 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -14.475 13.701 -9.858 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -15.350 12.356 -8.173 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -13.798 12.131 -7.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -15.248 13.530 -6.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -13.897 14.417 -6.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -15.401 14.636 -7.353 1.00 0.00 H new