USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 960 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -132:sc= 0.0108 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0851 X(o=-0.085,f=-0.28) USER MOD Single : A 4 MET CE :methyl -160:sc= -0.0478 (180deg=-0.698) USER MOD Single : A 5 THR OG1 : rot 130:sc= 0.00221 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot -116:sc= 0.942 USER MOD Single : A 29 CYS SG : rot -26:sc= 0.0673 USER MOD Single : A 33 HIS : no HD1:sc= -4.58! K(o=-4.6!,f=-2.7) USER MOD Single : A 38 THR OG1 : rot 13:sc= -4.34! USER MOD Single : A 40 SER OG : rot -167:sc= -0.623 USER MOD Single : A 42 MET CE :methyl -169:sc= 0 (180deg=-0.139) USER MOD Single : A 43 GLN : amide:sc= -0.503 X(o=-0.5,f=-0.64) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -0.593 K(o=-0.59,f=-4.5!) USER MOD Single : A 62 ASN : amide:sc= -1.03 K(o=-1,f=-3.5!) USER MOD Single : A 68 SER OG : rot 80:sc= -2.38! USER MOD Single : A 69 TYR OH : rot 165:sc= -0.157 USER MOD Single : A 79 ASN : amide:sc= -7.86! C(o=-7.9!,f=-7.5!) USER MOD Single : A 86 THR OG1 : rot -150:sc= -3.21! USER MOD Single : A 88 TYR OH : rot 130:sc= -0.814 USER MOD Single : A 90 SER OG : rot -160:sc= -1.3! USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -139:sc= 0.595 USER MOD Single : A 97 TYR OH : rot 44:sc= 0.702 USER MOD Single : A 98 SER OG : rot 180:sc= -0.94! USER MOD Single : A 99 ASN : amide:sc= -6.68! C(o=-6.7!,f=-2.4!) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.0276 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.779 K(o=-0.78,f=0) USER MOD Single : A 120 SER OG : rot 171:sc= -1.15 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.187 27.029 -3.749 1.00 0.00 N ATOM 2 CA GLY A 1 13.114 27.170 -2.590 1.00 0.00 C ATOM 3 C GLY A 1 13.102 25.882 -1.763 1.00 0.00 C ATOM 4 O GLY A 1 13.086 24.790 -2.296 1.00 0.00 O ATOM 0 H1 GLY A 1 12.667 27.340 -4.618 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.903 26.033 -3.847 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.343 27.616 -3.592 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.124 27.378 -2.943 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.812 28.015 -1.971 1.00 0.00 H new ATOM 10 N SER A 2 13.108 26.001 -0.463 1.00 0.00 N ATOM 11 CA SER A 2 13.097 24.784 0.398 1.00 0.00 C ATOM 12 C SER A 2 12.843 25.169 1.858 1.00 0.00 C ATOM 13 O SER A 2 13.483 26.050 2.399 1.00 0.00 O ATOM 14 CB SER A 2 14.490 24.174 0.237 1.00 0.00 C ATOM 15 OG SER A 2 14.631 23.069 1.123 1.00 0.00 O ATOM 0 H SER A 2 13.120 26.888 0.040 1.00 0.00 H new ATOM 0 HA SER A 2 12.310 24.085 0.115 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.639 23.849 -0.793 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.253 24.923 0.449 1.00 0.00 H new ATOM 0 HG SER A 2 15.523 22.677 1.018 1.00 0.00 H new ATOM 21 N HIS A 3 11.912 24.516 2.499 1.00 0.00 N ATOM 22 CA HIS A 3 11.614 24.843 3.923 1.00 0.00 C ATOM 23 C HIS A 3 11.676 23.574 4.778 1.00 0.00 C ATOM 24 O HIS A 3 11.054 23.481 5.818 1.00 0.00 O ATOM 25 CB HIS A 3 10.198 25.417 3.908 1.00 0.00 C ATOM 26 CG HIS A 3 10.131 26.611 4.819 1.00 0.00 C ATOM 27 ND1 HIS A 3 10.799 26.652 6.033 1.00 0.00 N ATOM 28 CD2 HIS A 3 9.482 27.815 4.707 1.00 0.00 C ATOM 29 CE1 HIS A 3 10.540 27.846 6.597 1.00 0.00 C ATOM 30 NE2 HIS A 3 9.742 28.594 5.831 1.00 0.00 N ATOM 0 H HIS A 3 11.344 23.770 2.098 1.00 0.00 H new ATOM 0 HA HIS A 3 12.331 25.545 4.348 1.00 0.00 H new ATOM 0 HB2 HIS A 3 9.921 25.704 2.894 1.00 0.00 H new ATOM 0 HB3 HIS A 3 9.484 24.660 4.231 1.00 0.00 H new ATOM 0 HD2 HIS A 3 8.863 28.113 3.873 1.00 0.00 H new ATOM 0 HE1 HIS A 3 10.930 28.161 7.553 1.00 0.00 H new ATOM 0 HE2 HIS A 3 9.397 29.534 6.027 1.00 0.00 H new ATOM 38 N MET A 4 12.428 22.598 4.348 1.00 0.00 N ATOM 39 CA MET A 4 12.542 21.332 5.130 1.00 0.00 C ATOM 40 C MET A 4 11.217 20.555 5.085 1.00 0.00 C ATOM 41 O MET A 4 10.282 20.940 4.412 1.00 0.00 O ATOM 42 CB MET A 4 12.907 21.786 6.559 1.00 0.00 C ATOM 43 CG MET A 4 11.768 21.502 7.549 1.00 0.00 C ATOM 44 SD MET A 4 12.107 22.348 9.113 1.00 0.00 S ATOM 45 CE MET A 4 13.527 21.342 9.609 1.00 0.00 C ATOM 0 H MET A 4 12.971 22.622 3.485 1.00 0.00 H new ATOM 0 HA MET A 4 13.293 20.650 4.731 1.00 0.00 H new ATOM 0 HB2 MET A 4 13.811 21.271 6.885 1.00 0.00 H new ATOM 0 HB3 MET A 4 13.131 22.853 6.557 1.00 0.00 H new ATOM 0 HG2 MET A 4 10.819 21.844 7.136 1.00 0.00 H new ATOM 0 HG3 MET A 4 11.675 20.429 7.716 1.00 0.00 H new ATOM 0 HE1 MET A 4 13.685 21.440 10.683 1.00 0.00 H new ATOM 0 HE2 MET A 4 13.336 20.297 9.364 1.00 0.00 H new ATOM 0 HE3 MET A 4 14.417 21.682 9.079 1.00 0.00 H new ATOM 55 N THR A 5 11.138 19.465 5.799 1.00 0.00 N ATOM 56 CA THR A 5 9.881 18.661 5.804 1.00 0.00 C ATOM 57 C THR A 5 9.390 18.470 7.241 1.00 0.00 C ATOM 58 O THR A 5 10.124 18.670 8.188 1.00 0.00 O ATOM 59 CB THR A 5 10.266 17.316 5.183 1.00 0.00 C ATOM 60 OG1 THR A 5 11.538 16.917 5.675 1.00 0.00 O ATOM 61 CG2 THR A 5 10.326 17.449 3.660 1.00 0.00 C ATOM 0 H THR A 5 11.890 19.096 6.380 1.00 0.00 H new ATOM 0 HA THR A 5 9.075 19.145 5.252 1.00 0.00 H new ATOM 0 HB THR A 5 9.520 16.567 5.449 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.488 15.994 5.999 1.00 0.00 H new ATOM 0 HG21 THR A 5 10.600 16.490 3.222 1.00 0.00 H new ATOM 0 HG22 THR A 5 9.350 17.755 3.283 1.00 0.00 H new ATOM 0 HG23 THR A 5 11.070 18.198 3.389 1.00 0.00 H new ATOM 69 N GLU A 6 8.155 18.088 7.415 1.00 0.00 N ATOM 70 CA GLU A 6 7.631 17.892 8.796 1.00 0.00 C ATOM 71 C GLU A 6 6.573 16.785 8.817 1.00 0.00 C ATOM 72 O GLU A 6 5.757 16.711 9.713 1.00 0.00 O ATOM 73 CB GLU A 6 7.012 19.239 9.178 1.00 0.00 C ATOM 74 CG GLU A 6 5.668 19.410 8.465 1.00 0.00 C ATOM 75 CD GLU A 6 5.352 20.900 8.317 1.00 0.00 C ATOM 76 OE1 GLU A 6 6.251 21.644 7.963 1.00 0.00 O ATOM 77 OE2 GLU A 6 4.215 21.271 8.562 1.00 0.00 O ATOM 0 H GLU A 6 7.489 17.904 6.665 1.00 0.00 H new ATOM 0 HA GLU A 6 8.412 17.589 9.493 1.00 0.00 H new ATOM 0 HB2 GLU A 6 6.871 19.292 10.258 1.00 0.00 H new ATOM 0 HB3 GLU A 6 7.686 20.051 8.904 1.00 0.00 H new ATOM 0 HG2 GLU A 6 5.702 18.936 7.484 1.00 0.00 H new ATOM 0 HG3 GLU A 6 4.879 18.915 9.031 1.00 0.00 H new ATOM 84 N ARG A 7 6.582 15.920 7.841 1.00 0.00 N ATOM 85 CA ARG A 7 5.576 14.820 7.815 1.00 0.00 C ATOM 86 C ARG A 7 5.982 13.750 6.799 1.00 0.00 C ATOM 87 O ARG A 7 5.476 13.703 5.696 1.00 0.00 O ATOM 88 CB ARG A 7 4.264 15.485 7.400 1.00 0.00 C ATOM 89 CG ARG A 7 3.153 15.063 8.363 1.00 0.00 C ATOM 90 CD ARG A 7 2.139 16.200 8.502 1.00 0.00 C ATOM 91 NE ARG A 7 0.819 15.525 8.621 1.00 0.00 N ATOM 92 CZ ARG A 7 0.136 15.615 9.729 1.00 0.00 C ATOM 93 NH1 ARG A 7 0.757 15.709 10.873 1.00 0.00 N ATOM 94 NH2 ARG A 7 -1.168 15.610 9.694 1.00 0.00 N ATOM 0 H ARG A 7 7.240 15.926 7.062 1.00 0.00 H new ATOM 0 HA ARG A 7 5.490 14.322 8.781 1.00 0.00 H new ATOM 0 HB2 ARG A 7 4.375 16.569 7.408 1.00 0.00 H new ATOM 0 HB3 ARG A 7 4.005 15.199 6.381 1.00 0.00 H new ATOM 0 HG2 ARG A 7 2.659 14.164 7.994 1.00 0.00 H new ATOM 0 HG3 ARG A 7 3.576 14.817 9.337 1.00 0.00 H new ATOM 0 HD2 ARG A 7 2.350 16.812 9.379 1.00 0.00 H new ATOM 0 HD3 ARG A 7 2.167 16.862 7.637 1.00 0.00 H new ATOM 0 HE ARG A 7 0.447 14.991 7.835 1.00 0.00 H new ATOM 0 HH11 ARG A 7 1.777 15.712 10.901 1.00 0.00 H new ATOM 0 HH12 ARG A 7 0.223 15.779 11.739 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -1.654 15.536 8.800 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -1.702 15.680 10.560 1.00 0.00 H new ATOM 108 N ARG A 8 6.889 12.888 7.166 1.00 0.00 N ATOM 109 CA ARG A 8 7.324 11.816 6.227 1.00 0.00 C ATOM 110 C ARG A 8 6.560 10.526 6.532 1.00 0.00 C ATOM 111 O ARG A 8 6.796 9.878 7.532 1.00 0.00 O ATOM 112 CB ARG A 8 8.820 11.631 6.494 1.00 0.00 C ATOM 113 CG ARG A 8 9.526 12.989 6.459 1.00 0.00 C ATOM 114 CD ARG A 8 9.940 13.317 5.022 1.00 0.00 C ATOM 115 NE ARG A 8 11.405 13.576 5.097 1.00 0.00 N ATOM 116 CZ ARG A 8 12.065 13.920 4.025 1.00 0.00 C ATOM 117 NH1 ARG A 8 11.790 13.359 2.880 1.00 0.00 N ATOM 118 NH2 ARG A 8 13.004 14.824 4.100 1.00 0.00 N ATOM 0 H ARG A 8 7.348 12.879 8.077 1.00 0.00 H new ATOM 0 HA ARG A 8 7.131 12.070 5.185 1.00 0.00 H new ATOM 0 HB2 ARG A 8 8.970 11.158 7.465 1.00 0.00 H new ATOM 0 HB3 ARG A 8 9.253 10.967 5.746 1.00 0.00 H new ATOM 0 HG2 ARG A 8 8.863 13.765 6.843 1.00 0.00 H new ATOM 0 HG3 ARG A 8 10.403 12.971 7.106 1.00 0.00 H new ATOM 0 HD2 ARG A 8 9.719 12.489 4.348 1.00 0.00 H new ATOM 0 HD3 ARG A 8 9.403 14.187 4.645 1.00 0.00 H new ATOM 0 HE ARG A 8 11.893 13.484 5.988 1.00 0.00 H new ATOM 0 HH11 ARG A 8 11.058 12.651 2.822 1.00 0.00 H new ATOM 0 HH12 ARG A 8 12.307 13.629 2.043 1.00 0.00 H new ATOM 0 HH21 ARG A 8 13.221 15.261 4.996 1.00 0.00 H new ATOM 0 HH22 ARG A 8 13.520 15.094 3.263 1.00 0.00 H new ATOM 132 N LEU A 9 5.646 10.147 5.683 1.00 0.00 N ATOM 133 CA LEU A 9 4.874 8.907 5.929 1.00 0.00 C ATOM 134 C LEU A 9 5.542 7.739 5.210 1.00 0.00 C ATOM 135 O LEU A 9 6.434 7.926 4.406 1.00 0.00 O ATOM 136 CB LEU A 9 3.486 9.177 5.347 1.00 0.00 C ATOM 137 CG LEU A 9 2.593 9.803 6.420 1.00 0.00 C ATOM 138 CD1 LEU A 9 1.587 10.750 5.764 1.00 0.00 C ATOM 139 CD2 LEU A 9 1.840 8.699 7.165 1.00 0.00 C ATOM 0 H LEU A 9 5.403 10.647 4.828 1.00 0.00 H new ATOM 0 HA LEU A 9 4.821 8.649 6.987 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.564 9.845 4.489 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.044 8.248 4.988 1.00 0.00 H new ATOM 0 HG LEU A 9 3.211 10.362 7.123 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.952 11.194 6.531 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.122 11.538 5.234 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.969 10.193 5.059 1.00 0.00 H new ATOM 0 HD21 LEU A 9 1.204 9.145 7.930 1.00 0.00 H new ATOM 0 HD22 LEU A 9 1.224 8.140 6.461 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.555 8.025 7.636 1.00 0.00 H new ATOM 151 N ARG A 10 5.127 6.536 5.486 1.00 0.00 N ATOM 152 CA ARG A 10 5.758 5.379 4.801 1.00 0.00 C ATOM 153 C ARG A 10 4.688 4.485 4.171 1.00 0.00 C ATOM 154 O ARG A 10 3.822 3.959 4.846 1.00 0.00 O ATOM 155 CB ARG A 10 6.509 4.622 5.895 1.00 0.00 C ATOM 156 CG ARG A 10 8.007 4.647 5.596 1.00 0.00 C ATOM 157 CD ARG A 10 8.549 6.057 5.840 1.00 0.00 C ATOM 158 NE ARG A 10 9.185 5.994 7.185 1.00 0.00 N ATOM 159 CZ ARG A 10 10.259 5.276 7.368 1.00 0.00 C ATOM 160 NH1 ARG A 10 11.100 5.100 6.388 1.00 0.00 N ATOM 161 NH2 ARG A 10 10.492 4.733 8.531 1.00 0.00 N ATOM 0 H ARG A 10 4.387 6.306 6.149 1.00 0.00 H new ATOM 0 HA ARG A 10 6.422 5.695 3.997 1.00 0.00 H new ATOM 0 HB2 ARG A 10 6.314 5.077 6.866 1.00 0.00 H new ATOM 0 HB3 ARG A 10 6.155 3.592 5.948 1.00 0.00 H new ATOM 0 HG2 ARG A 10 8.528 3.930 6.231 1.00 0.00 H new ATOM 0 HG3 ARG A 10 8.188 4.349 4.563 1.00 0.00 H new ATOM 0 HD2 ARG A 10 9.271 6.341 5.074 1.00 0.00 H new ATOM 0 HD3 ARG A 10 7.750 6.798 5.815 1.00 0.00 H new ATOM 0 HE ARG A 10 8.780 6.513 7.964 1.00 0.00 H new ATOM 0 HH11 ARG A 10 10.919 5.524 5.478 1.00 0.00 H new ATOM 0 HH12 ARG A 10 11.940 4.539 6.531 1.00 0.00 H new ATOM 0 HH21 ARG A 10 9.834 4.869 9.299 1.00 0.00 H new ATOM 0 HH22 ARG A 10 11.332 4.172 8.673 1.00 0.00 H new ATOM 175 N VAL A 11 4.738 4.311 2.881 1.00 0.00 N ATOM 176 CA VAL A 11 3.722 3.455 2.205 1.00 0.00 C ATOM 177 C VAL A 11 4.363 2.156 1.701 1.00 0.00 C ATOM 178 O VAL A 11 4.866 2.088 0.595 1.00 0.00 O ATOM 179 CB VAL A 11 3.221 4.299 1.031 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.015 3.614 0.388 1.00 0.00 C ATOM 181 CG2 VAL A 11 2.809 5.686 1.535 1.00 0.00 C ATOM 0 H VAL A 11 5.438 4.724 2.264 1.00 0.00 H new ATOM 0 HA VAL A 11 2.915 3.163 2.877 1.00 0.00 H new ATOM 0 HB VAL A 11 4.018 4.402 0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.658 4.215 -0.448 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.306 2.628 0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.219 3.510 1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.452 6.286 0.698 1.00 0.00 H new ATOM 0 HG22 VAL A 11 2.013 5.583 2.273 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.668 6.177 1.993 1.00 0.00 H new ATOM 191 N LEU A 12 4.351 1.117 2.498 1.00 0.00 N ATOM 192 CA LEU A 12 4.960 -0.166 2.044 1.00 0.00 C ATOM 193 C LEU A 12 4.057 -0.829 1.008 1.00 0.00 C ATOM 194 O LEU A 12 3.019 -1.367 1.326 1.00 0.00 O ATOM 195 CB LEU A 12 5.067 -1.034 3.297 1.00 0.00 C ATOM 196 CG LEU A 12 6.283 -0.608 4.126 1.00 0.00 C ATOM 197 CD1 LEU A 12 7.565 -0.821 3.318 1.00 0.00 C ATOM 198 CD2 LEU A 12 6.151 0.872 4.495 1.00 0.00 C ATOM 0 H LEU A 12 3.949 1.103 3.435 1.00 0.00 H new ATOM 0 HA LEU A 12 5.934 -0.017 1.578 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.159 -0.941 3.893 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.157 -2.083 3.016 1.00 0.00 H new ATOM 0 HG LEU A 12 6.329 -1.210 5.033 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.425 -0.516 3.914 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.660 -1.875 3.057 1.00 0.00 H new ATOM 0 HD13 LEU A 12 7.524 -0.224 2.407 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.015 1.178 5.085 1.00 0.00 H new ATOM 0 HD22 LEU A 12 6.102 1.471 3.586 1.00 0.00 H new ATOM 0 HD23 LEU A 12 5.242 1.022 5.078 1.00 0.00 H new ATOM 210 N VAL A 13 4.439 -0.791 -0.232 1.00 0.00 N ATOM 211 CA VAL A 13 3.597 -1.421 -1.278 1.00 0.00 C ATOM 212 C VAL A 13 4.447 -2.343 -2.146 1.00 0.00 C ATOM 213 O VAL A 13 5.563 -2.024 -2.506 1.00 0.00 O ATOM 214 CB VAL A 13 3.036 -0.260 -2.102 1.00 0.00 C ATOM 215 CG1 VAL A 13 1.927 0.447 -1.329 1.00 0.00 C ATOM 216 CG2 VAL A 13 4.151 0.737 -2.385 1.00 0.00 C ATOM 0 H VAL A 13 5.297 -0.352 -0.567 1.00 0.00 H new ATOM 0 HA VAL A 13 2.799 -2.030 -0.854 1.00 0.00 H new ATOM 0 HB VAL A 13 2.632 -0.651 -3.036 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.536 1.271 -1.926 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.125 -0.259 -1.116 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.327 0.835 -0.392 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.757 1.567 -2.972 1.00 0.00 H new ATOM 0 HG22 VAL A 13 4.548 1.115 -1.443 1.00 0.00 H new ATOM 0 HG23 VAL A 13 4.947 0.244 -2.943 1.00 0.00 H new ATOM 226 N VAL A 14 3.930 -3.489 -2.477 1.00 0.00 N ATOM 227 CA VAL A 14 4.710 -4.441 -3.309 1.00 0.00 C ATOM 228 C VAL A 14 3.756 -5.358 -4.101 1.00 0.00 C ATOM 229 O VAL A 14 2.720 -5.765 -3.610 1.00 0.00 O ATOM 230 CB VAL A 14 5.548 -5.233 -2.295 1.00 0.00 C ATOM 231 CG1 VAL A 14 6.741 -4.388 -1.832 1.00 0.00 C ATOM 232 CG2 VAL A 14 4.701 -5.603 -1.083 1.00 0.00 C ATOM 0 H VAL A 14 3.000 -3.808 -2.207 1.00 0.00 H new ATOM 0 HA VAL A 14 5.338 -3.948 -4.051 1.00 0.00 H new ATOM 0 HB VAL A 14 5.905 -6.143 -2.777 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.332 -4.956 -1.113 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.362 -4.134 -2.691 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.379 -3.473 -1.363 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.308 -6.164 -0.373 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.331 -4.695 -0.607 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.857 -6.215 -1.402 1.00 0.00 H new ATOM 242 N GLU A 15 4.090 -5.680 -5.329 1.00 0.00 N ATOM 243 CA GLU A 15 3.187 -6.566 -6.140 1.00 0.00 C ATOM 244 C GLU A 15 3.984 -7.507 -7.059 1.00 0.00 C ATOM 245 O GLU A 15 3.980 -8.703 -6.860 1.00 0.00 O ATOM 246 CB GLU A 15 2.301 -5.631 -6.967 1.00 0.00 C ATOM 247 CG GLU A 15 3.121 -4.465 -7.529 1.00 0.00 C ATOM 248 CD GLU A 15 3.109 -4.522 -9.059 1.00 0.00 C ATOM 249 OE1 GLU A 15 2.029 -4.577 -9.622 1.00 0.00 O ATOM 250 OE2 GLU A 15 4.182 -4.510 -9.640 1.00 0.00 O ATOM 0 H GLU A 15 4.939 -5.372 -5.803 1.00 0.00 H new ATOM 0 HA GLU A 15 2.597 -7.209 -5.487 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.841 -6.186 -7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.491 -5.247 -6.347 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.706 -3.517 -7.187 1.00 0.00 H new ATOM 0 HG3 GLU A 15 4.146 -4.516 -7.161 1.00 0.00 H new ATOM 257 N ASP A 16 4.668 -6.991 -8.050 1.00 0.00 N ATOM 258 CA ASP A 16 5.463 -7.879 -8.959 1.00 0.00 C ATOM 259 C ASP A 16 5.906 -7.117 -10.211 1.00 0.00 C ATOM 260 O ASP A 16 5.796 -7.614 -11.314 1.00 0.00 O ATOM 261 CB ASP A 16 4.531 -9.030 -9.363 1.00 0.00 C ATOM 262 CG ASP A 16 3.164 -8.482 -9.786 1.00 0.00 C ATOM 263 OD1 ASP A 16 2.978 -7.278 -9.724 1.00 0.00 O ATOM 264 OD2 ASP A 16 2.327 -9.280 -10.172 1.00 0.00 O ATOM 0 H ASP A 16 4.711 -5.996 -8.270 1.00 0.00 H new ATOM 0 HA ASP A 16 6.361 -8.239 -8.457 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.974 -9.595 -10.183 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.411 -9.721 -8.528 1.00 0.00 H new ATOM 269 N GLU A 17 6.406 -5.920 -10.065 1.00 0.00 N ATOM 270 CA GLU A 17 6.844 -5.162 -11.273 1.00 0.00 C ATOM 271 C GLU A 17 7.270 -3.739 -10.909 1.00 0.00 C ATOM 272 O GLU A 17 7.357 -3.375 -9.753 1.00 0.00 O ATOM 273 CB GLU A 17 5.615 -5.126 -12.180 1.00 0.00 C ATOM 274 CG GLU A 17 5.990 -5.638 -13.570 1.00 0.00 C ATOM 275 CD GLU A 17 6.135 -4.456 -14.531 1.00 0.00 C ATOM 276 OE1 GLU A 17 5.846 -3.344 -14.119 1.00 0.00 O ATOM 277 OE2 GLU A 17 6.531 -4.683 -15.662 1.00 0.00 O ATOM 0 H GLU A 17 6.529 -5.439 -9.174 1.00 0.00 H new ATOM 0 HA GLU A 17 7.705 -5.630 -11.750 1.00 0.00 H new ATOM 0 HB2 GLU A 17 4.820 -5.740 -11.757 1.00 0.00 H new ATOM 0 HB3 GLU A 17 5.230 -4.109 -12.248 1.00 0.00 H new ATOM 0 HG2 GLU A 17 6.924 -6.198 -13.523 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.225 -6.324 -13.934 1.00 0.00 H new ATOM 284 N SER A 18 7.533 -2.930 -11.901 1.00 0.00 N ATOM 285 CA SER A 18 7.950 -1.527 -11.634 1.00 0.00 C ATOM 286 C SER A 18 6.740 -0.593 -11.726 1.00 0.00 C ATOM 287 O SER A 18 6.838 0.588 -11.458 1.00 0.00 O ATOM 288 CB SER A 18 8.970 -1.200 -12.725 1.00 0.00 C ATOM 289 OG SER A 18 10.194 -0.807 -12.117 1.00 0.00 O ATOM 0 H SER A 18 7.476 -3.184 -12.887 1.00 0.00 H new ATOM 0 HA SER A 18 8.372 -1.402 -10.637 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.129 -2.069 -13.363 1.00 0.00 H new ATOM 0 HB3 SER A 18 8.594 -0.401 -13.364 1.00 0.00 H new ATOM 0 HG SER A 18 10.852 -0.598 -12.812 1.00 0.00 H new ATOM 295 N MET A 19 5.596 -1.113 -12.090 1.00 0.00 N ATOM 296 CA MET A 19 4.385 -0.246 -12.179 1.00 0.00 C ATOM 297 C MET A 19 4.019 0.245 -10.779 1.00 0.00 C ATOM 298 O MET A 19 3.286 1.198 -10.608 1.00 0.00 O ATOM 299 CB MET A 19 3.283 -1.142 -12.747 1.00 0.00 C ATOM 300 CG MET A 19 2.461 -0.349 -13.764 1.00 0.00 C ATOM 301 SD MET A 19 3.248 -0.459 -15.390 1.00 0.00 S ATOM 302 CE MET A 19 1.801 0.003 -16.373 1.00 0.00 C ATOM 0 H MET A 19 5.449 -2.094 -12.328 1.00 0.00 H new ATOM 0 HA MET A 19 4.539 0.632 -12.807 1.00 0.00 H new ATOM 0 HB2 MET A 19 3.721 -2.020 -13.222 1.00 0.00 H new ATOM 0 HB3 MET A 19 2.640 -1.501 -11.943 1.00 0.00 H new ATOM 0 HG2 MET A 19 1.445 -0.741 -13.812 1.00 0.00 H new ATOM 0 HG3 MET A 19 2.386 0.693 -13.454 1.00 0.00 H new ATOM 0 HE1 MET A 19 2.064 -0.000 -17.431 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.998 -0.712 -16.197 1.00 0.00 H new ATOM 0 HE3 MET A 19 1.469 1.000 -16.085 1.00 0.00 H new ATOM 312 N ILE A 20 4.552 -0.400 -9.779 1.00 0.00 N ATOM 313 CA ILE A 20 4.277 0.015 -8.374 1.00 0.00 C ATOM 314 C ILE A 20 5.479 0.780 -7.828 1.00 0.00 C ATOM 315 O ILE A 20 5.528 1.143 -6.670 1.00 0.00 O ATOM 316 CB ILE A 20 4.087 -1.289 -7.600 1.00 0.00 C ATOM 317 CG1 ILE A 20 4.110 -0.997 -6.096 1.00 0.00 C ATOM 318 CG2 ILE A 20 5.215 -2.260 -7.942 1.00 0.00 C ATOM 319 CD1 ILE A 20 3.169 -1.963 -5.361 1.00 0.00 C ATOM 0 H ILE A 20 5.172 -1.204 -9.876 1.00 0.00 H new ATOM 0 HA ILE A 20 3.405 0.663 -8.293 1.00 0.00 H new ATOM 0 HB ILE A 20 3.130 -1.734 -7.874 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.125 -1.102 -5.712 1.00 0.00 H new ATOM 0 HG13 ILE A 20 3.804 0.033 -5.912 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.076 -3.189 -7.388 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.203 -2.470 -9.012 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.173 -1.815 -7.671 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.191 -1.749 -4.292 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.153 -1.837 -5.736 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.494 -2.989 -5.533 1.00 0.00 H new ATOM 331 N ALA A 21 6.455 1.017 -8.659 1.00 0.00 N ATOM 332 CA ALA A 21 7.666 1.747 -8.209 1.00 0.00 C ATOM 333 C ALA A 21 7.576 3.217 -8.634 1.00 0.00 C ATOM 334 O ALA A 21 7.426 4.098 -7.812 1.00 0.00 O ATOM 335 CB ALA A 21 8.812 1.031 -8.916 1.00 0.00 C ATOM 0 H ALA A 21 6.463 0.733 -9.639 1.00 0.00 H new ATOM 0 HA ALA A 21 7.794 1.750 -7.127 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.757 1.501 -8.645 1.00 0.00 H new ATOM 0 HB2 ALA A 21 8.828 -0.016 -8.614 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.671 1.096 -9.995 1.00 0.00 H new ATOM 341 N MET A 22 7.642 3.494 -9.908 1.00 0.00 N ATOM 342 CA MET A 22 7.532 4.912 -10.353 1.00 0.00 C ATOM 343 C MET A 22 6.202 5.480 -9.847 1.00 0.00 C ATOM 344 O MET A 22 6.011 6.676 -9.758 1.00 0.00 O ATOM 345 CB MET A 22 7.604 4.855 -11.893 1.00 0.00 C ATOM 346 CG MET A 22 6.269 5.260 -12.535 1.00 0.00 C ATOM 347 SD MET A 22 6.136 7.064 -12.567 1.00 0.00 S ATOM 348 CE MET A 22 6.835 7.313 -14.217 1.00 0.00 C ATOM 0 H MET A 22 7.766 2.808 -10.653 1.00 0.00 H new ATOM 0 HA MET A 22 8.317 5.561 -9.965 1.00 0.00 H new ATOM 0 HB2 MET A 22 8.394 5.518 -12.246 1.00 0.00 H new ATOM 0 HB3 MET A 22 7.869 3.846 -12.209 1.00 0.00 H new ATOM 0 HG2 MET A 22 6.205 4.862 -13.548 1.00 0.00 H new ATOM 0 HG3 MET A 22 5.439 4.834 -11.972 1.00 0.00 H new ATOM 0 HE1 MET A 22 6.849 8.378 -14.449 1.00 0.00 H new ATOM 0 HE2 MET A 22 7.852 6.922 -14.244 1.00 0.00 H new ATOM 0 HE3 MET A 22 6.225 6.789 -14.953 1.00 0.00 H new ATOM 358 N LEU A 23 5.287 4.611 -9.512 1.00 0.00 N ATOM 359 CA LEU A 23 3.962 5.061 -9.003 1.00 0.00 C ATOM 360 C LEU A 23 4.068 5.394 -7.510 1.00 0.00 C ATOM 361 O LEU A 23 3.189 6.003 -6.935 1.00 0.00 O ATOM 362 CB LEU A 23 3.038 3.858 -9.245 1.00 0.00 C ATOM 363 CG LEU A 23 1.752 3.970 -8.413 1.00 0.00 C ATOM 364 CD1 LEU A 23 2.036 3.581 -6.961 1.00 0.00 C ATOM 365 CD2 LEU A 23 1.210 5.401 -8.467 1.00 0.00 C ATOM 0 H LEU A 23 5.403 3.599 -9.570 1.00 0.00 H new ATOM 0 HA LEU A 23 3.592 5.961 -9.494 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.785 3.797 -10.304 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.561 2.937 -8.989 1.00 0.00 H new ATOM 0 HG LEU A 23 1.006 3.293 -8.828 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.120 3.663 -6.377 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.400 2.554 -6.924 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.791 4.249 -6.547 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.298 5.467 -7.873 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.955 6.088 -8.066 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.990 5.668 -9.501 1.00 0.00 H new ATOM 377 N ILE A 24 5.143 5.004 -6.878 1.00 0.00 N ATOM 378 CA ILE A 24 5.294 5.308 -5.425 1.00 0.00 C ATOM 379 C ILE A 24 6.175 6.547 -5.236 1.00 0.00 C ATOM 380 O ILE A 24 6.004 7.311 -4.304 1.00 0.00 O ATOM 381 CB ILE A 24 5.933 4.058 -4.804 1.00 0.00 C ATOM 382 CG1 ILE A 24 5.900 4.182 -3.280 1.00 0.00 C ATOM 383 CG2 ILE A 24 7.384 3.884 -5.264 1.00 0.00 C ATOM 384 CD1 ILE A 24 6.134 2.808 -2.653 1.00 0.00 C ATOM 0 H ILE A 24 5.917 4.492 -7.301 1.00 0.00 H new ATOM 0 HA ILE A 24 4.340 5.532 -4.947 1.00 0.00 H new ATOM 0 HB ILE A 24 5.365 3.186 -5.129 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.665 4.882 -2.945 1.00 0.00 H new ATOM 0 HG13 ILE A 24 4.939 4.582 -2.958 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.806 2.990 -4.806 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.412 3.784 -6.349 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.967 4.755 -4.965 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.111 2.895 -1.567 1.00 0.00 H new ATOM 0 HD12 ILE A 24 5.353 2.122 -2.979 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.106 2.426 -2.966 1.00 0.00 H new ATOM 396 N GLU A 25 7.103 6.756 -6.123 1.00 0.00 N ATOM 397 CA GLU A 25 7.992 7.945 -6.013 1.00 0.00 C ATOM 398 C GLU A 25 7.279 9.171 -6.580 1.00 0.00 C ATOM 399 O GLU A 25 7.360 10.259 -6.045 1.00 0.00 O ATOM 400 CB GLU A 25 9.216 7.596 -6.857 1.00 0.00 C ATOM 401 CG GLU A 25 10.168 6.727 -6.035 1.00 0.00 C ATOM 402 CD GLU A 25 11.613 7.098 -6.368 1.00 0.00 C ATOM 403 OE1 GLU A 25 11.828 8.213 -6.814 1.00 0.00 O ATOM 404 OE2 GLU A 25 12.479 6.262 -6.173 1.00 0.00 O ATOM 0 H GLU A 25 7.286 6.152 -6.924 1.00 0.00 H new ATOM 0 HA GLU A 25 8.263 8.177 -4.983 1.00 0.00 H new ATOM 0 HB2 GLU A 25 8.910 7.067 -7.759 1.00 0.00 H new ATOM 0 HB3 GLU A 25 9.722 8.507 -7.178 1.00 0.00 H new ATOM 0 HG2 GLU A 25 9.981 6.870 -4.971 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.993 5.673 -6.251 1.00 0.00 H new ATOM 411 N ASP A 26 6.575 8.995 -7.661 1.00 0.00 N ATOM 412 CA ASP A 26 5.845 10.135 -8.273 1.00 0.00 C ATOM 413 C ASP A 26 4.756 10.626 -7.313 1.00 0.00 C ATOM 414 O ASP A 26 4.559 11.811 -7.131 1.00 0.00 O ATOM 415 CB ASP A 26 5.243 9.556 -9.562 1.00 0.00 C ATOM 416 CG ASP A 26 3.920 8.848 -9.256 1.00 0.00 C ATOM 417 OD1 ASP A 26 3.963 7.799 -8.636 1.00 0.00 O ATOM 418 OD2 ASP A 26 2.889 9.368 -9.648 1.00 0.00 O ATOM 0 H ASP A 26 6.474 8.105 -8.149 1.00 0.00 H new ATOM 0 HA ASP A 26 6.482 10.994 -8.481 1.00 0.00 H new ATOM 0 HB2 ASP A 26 5.078 10.354 -10.285 1.00 0.00 H new ATOM 0 HB3 ASP A 26 5.943 8.854 -10.016 1.00 0.00 H new ATOM 423 N THR A 27 4.055 9.717 -6.691 1.00 0.00 N ATOM 424 CA THR A 27 2.988 10.123 -5.737 1.00 0.00 C ATOM 425 C THR A 27 3.591 10.982 -4.623 1.00 0.00 C ATOM 426 O THR A 27 3.065 12.019 -4.271 1.00 0.00 O ATOM 427 CB THR A 27 2.443 8.810 -5.173 1.00 0.00 C ATOM 428 OG1 THR A 27 3.472 7.830 -5.179 1.00 0.00 O ATOM 429 CG2 THR A 27 1.272 8.329 -6.032 1.00 0.00 C ATOM 0 H THR A 27 4.177 8.711 -6.804 1.00 0.00 H new ATOM 0 HA THR A 27 2.204 10.715 -6.210 1.00 0.00 H new ATOM 0 HB THR A 27 2.099 8.969 -4.151 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.226 7.101 -5.787 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.885 7.393 -5.629 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.483 9.081 -6.025 1.00 0.00 H new ATOM 0 HG23 THR A 27 1.613 8.170 -7.055 1.00 0.00 H new ATOM 437 N LEU A 28 4.695 10.558 -4.068 1.00 0.00 N ATOM 438 CA LEU A 28 5.336 11.352 -2.981 1.00 0.00 C ATOM 439 C LEU A 28 5.761 12.721 -3.517 1.00 0.00 C ATOM 440 O LEU A 28 5.692 13.719 -2.827 1.00 0.00 O ATOM 441 CB LEU A 28 6.544 10.509 -2.548 1.00 0.00 C ATOM 442 CG LEU A 28 7.842 11.021 -3.194 1.00 0.00 C ATOM 443 CD1 LEU A 28 8.318 12.277 -2.460 1.00 0.00 C ATOM 444 CD2 LEU A 28 8.922 9.943 -3.098 1.00 0.00 C ATOM 0 H LEU A 28 5.180 9.697 -4.320 1.00 0.00 H new ATOM 0 HA LEU A 28 4.668 11.549 -2.142 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.640 10.537 -1.463 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.382 9.468 -2.827 1.00 0.00 H new ATOM 0 HG LEU A 28 7.654 11.258 -4.241 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.238 12.640 -2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.551 13.049 -2.525 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.504 12.038 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.841 10.307 -3.556 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.108 9.706 -2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.588 9.046 -3.619 1.00 0.00 H new ATOM 456 N CYS A 29 6.198 12.773 -4.745 1.00 0.00 N ATOM 457 CA CYS A 29 6.622 14.074 -5.325 1.00 0.00 C ATOM 458 C CYS A 29 5.573 15.136 -5.007 1.00 0.00 C ATOM 459 O CYS A 29 5.854 16.319 -4.983 1.00 0.00 O ATOM 460 CB CYS A 29 6.705 13.830 -6.831 1.00 0.00 C ATOM 461 SG CYS A 29 7.295 15.331 -7.654 1.00 0.00 S ATOM 0 H CYS A 29 6.279 11.971 -5.370 1.00 0.00 H new ATOM 0 HA CYS A 29 7.573 14.425 -4.924 1.00 0.00 H new ATOM 0 HB2 CYS A 29 7.379 12.999 -7.039 1.00 0.00 H new ATOM 0 HB3 CYS A 29 5.726 13.550 -7.219 1.00 0.00 H new ATOM 0 HG CYS A 29 6.991 16.369 -6.933 1.00 0.00 H new ATOM 467 N GLU A 30 4.359 14.720 -4.764 1.00 0.00 N ATOM 468 CA GLU A 30 3.287 15.699 -4.449 1.00 0.00 C ATOM 469 C GLU A 30 3.099 15.830 -2.933 1.00 0.00 C ATOM 470 O GLU A 30 3.210 16.904 -2.378 1.00 0.00 O ATOM 471 CB GLU A 30 2.026 15.136 -5.102 1.00 0.00 C ATOM 472 CG GLU A 30 1.004 16.261 -5.289 1.00 0.00 C ATOM 473 CD GLU A 30 1.252 16.964 -6.625 1.00 0.00 C ATOM 474 OE1 GLU A 30 2.402 17.043 -7.026 1.00 0.00 O ATOM 475 OE2 GLU A 30 0.289 17.413 -7.224 1.00 0.00 O ATOM 0 H GLU A 30 4.066 13.743 -4.771 1.00 0.00 H new ATOM 0 HA GLU A 30 3.527 16.696 -4.819 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.271 14.688 -6.065 1.00 0.00 H new ATOM 0 HB3 GLU A 30 1.604 14.346 -4.481 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -0.007 15.855 -5.263 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.082 16.976 -4.470 1.00 0.00 H new ATOM 482 N LEU A 31 2.814 14.747 -2.259 1.00 0.00 N ATOM 483 CA LEU A 31 2.617 14.820 -0.780 1.00 0.00 C ATOM 484 C LEU A 31 3.964 14.993 -0.073 1.00 0.00 C ATOM 485 O LEU A 31 4.167 15.929 0.674 1.00 0.00 O ATOM 486 CB LEU A 31 1.973 13.488 -0.392 1.00 0.00 C ATOM 487 CG LEU A 31 0.593 13.381 -1.043 1.00 0.00 C ATOM 488 CD1 LEU A 31 0.516 12.103 -1.881 1.00 0.00 C ATOM 489 CD2 LEU A 31 -0.481 13.338 0.047 1.00 0.00 C ATOM 0 H LEU A 31 2.709 13.818 -2.666 1.00 0.00 H new ATOM 0 HA LEU A 31 1.996 15.668 -0.491 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.604 12.659 -0.713 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.882 13.418 0.692 1.00 0.00 H new ATOM 0 HG LEU A 31 0.429 14.246 -1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.468 12.030 -2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.280 12.130 -2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.681 11.237 -1.240 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.465 13.262 -0.415 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.313 12.473 0.689 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.430 14.248 0.644 1.00 0.00 H new ATOM 501 N GLY A 32 4.887 14.101 -0.304 1.00 0.00 N ATOM 502 CA GLY A 32 6.218 14.225 0.354 1.00 0.00 C ATOM 503 C GLY A 32 6.596 12.909 1.038 1.00 0.00 C ATOM 504 O GLY A 32 7.570 12.841 1.761 1.00 0.00 O ATOM 0 H GLY A 32 4.778 13.294 -0.918 1.00 0.00 H new ATOM 0 HA2 GLY A 32 6.974 14.489 -0.386 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.195 15.031 1.088 1.00 0.00 H new ATOM 508 N HIS A 33 5.843 11.861 0.815 1.00 0.00 N ATOM 509 CA HIS A 33 6.181 10.553 1.454 1.00 0.00 C ATOM 510 C HIS A 33 7.692 10.321 1.382 1.00 0.00 C ATOM 511 O HIS A 33 8.362 10.812 0.495 1.00 0.00 O ATOM 512 CB HIS A 33 5.429 9.500 0.638 1.00 0.00 C ATOM 513 CG HIS A 33 4.057 9.300 1.223 1.00 0.00 C ATOM 514 ND1 HIS A 33 2.913 9.797 0.616 1.00 0.00 N ATOM 515 CD2 HIS A 33 3.630 8.659 2.360 1.00 0.00 C ATOM 516 CE1 HIS A 33 1.863 9.449 1.384 1.00 0.00 C ATOM 517 NE2 HIS A 33 2.244 8.754 2.460 1.00 0.00 N ATOM 0 H HIS A 33 5.013 11.854 0.222 1.00 0.00 H new ATOM 0 HA HIS A 33 5.900 10.516 2.506 1.00 0.00 H new ATOM 0 HB2 HIS A 33 5.350 9.818 -0.402 1.00 0.00 H new ATOM 0 HB3 HIS A 33 5.979 8.559 0.643 1.00 0.00 H new ATOM 0 HD2 HIS A 33 4.272 8.157 3.069 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.837 9.701 1.158 1.00 0.00 H new ATOM 0 HE2 HIS A 33 1.648 8.375 3.196 1.00 0.00 H new ATOM 525 N GLU A 34 8.237 9.590 2.312 1.00 0.00 N ATOM 526 CA GLU A 34 9.707 9.345 2.300 1.00 0.00 C ATOM 527 C GLU A 34 10.048 8.182 1.367 1.00 0.00 C ATOM 528 O GLU A 34 10.615 8.363 0.308 1.00 0.00 O ATOM 529 CB GLU A 34 10.050 8.984 3.744 1.00 0.00 C ATOM 530 CG GLU A 34 11.058 9.990 4.302 1.00 0.00 C ATOM 531 CD GLU A 34 12.471 9.583 3.883 1.00 0.00 C ATOM 532 OE1 GLU A 34 12.754 8.396 3.902 1.00 0.00 O ATOM 533 OE2 GLU A 34 13.247 10.464 3.553 1.00 0.00 O ATOM 0 H GLU A 34 7.729 9.151 3.080 1.00 0.00 H new ATOM 0 HA GLU A 34 10.267 10.210 1.943 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.146 8.984 4.353 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.464 7.977 3.789 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.832 10.990 3.933 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.986 10.028 5.389 1.00 0.00 H new ATOM 540 N VAL A 35 9.710 6.989 1.764 1.00 0.00 N ATOM 541 CA VAL A 35 10.010 5.793 0.926 1.00 0.00 C ATOM 542 C VAL A 35 9.489 4.547 1.638 1.00 0.00 C ATOM 543 O VAL A 35 9.386 4.519 2.849 1.00 0.00 O ATOM 544 CB VAL A 35 11.534 5.750 0.810 1.00 0.00 C ATOM 545 CG1 VAL A 35 12.135 5.314 2.148 1.00 0.00 C ATOM 546 CG2 VAL A 35 11.935 4.748 -0.276 1.00 0.00 C ATOM 0 H VAL A 35 9.233 6.788 2.643 1.00 0.00 H new ATOM 0 HA VAL A 35 9.541 5.836 -0.057 1.00 0.00 H new ATOM 0 HB VAL A 35 11.906 6.741 0.548 1.00 0.00 H new ATOM 0 HG11 VAL A 35 13.221 5.283 2.066 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.850 6.025 2.924 1.00 0.00 H new ATOM 0 HG13 VAL A 35 11.763 4.323 2.409 1.00 0.00 H new ATOM 0 HG21 VAL A 35 13.021 4.717 -0.359 1.00 0.00 H new ATOM 0 HG22 VAL A 35 11.563 3.758 -0.013 1.00 0.00 H new ATOM 0 HG23 VAL A 35 11.507 5.055 -1.230 1.00 0.00 H new ATOM 556 N ALA A 36 9.148 3.521 0.915 1.00 0.00 N ATOM 557 CA ALA A 36 8.626 2.307 1.585 1.00 0.00 C ATOM 558 C ALA A 36 8.936 1.048 0.766 1.00 0.00 C ATOM 559 O ALA A 36 10.065 0.601 0.723 1.00 0.00 O ATOM 560 CB ALA A 36 7.128 2.547 1.692 1.00 0.00 C ATOM 0 H ALA A 36 9.208 3.472 -0.102 1.00 0.00 H new ATOM 0 HA ALA A 36 9.084 2.141 2.560 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.657 1.693 2.179 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.945 3.447 2.280 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.708 2.673 0.694 1.00 0.00 H new ATOM 566 N ALA A 37 7.958 0.455 0.121 1.00 0.00 N ATOM 567 CA ALA A 37 8.256 -0.776 -0.666 1.00 0.00 C ATOM 568 C ALA A 37 7.815 -0.609 -2.120 1.00 0.00 C ATOM 569 O ALA A 37 6.873 0.094 -2.416 1.00 0.00 O ATOM 570 CB ALA A 37 7.454 -1.886 0.011 1.00 0.00 C ATOM 0 H ALA A 37 6.986 0.765 0.107 1.00 0.00 H new ATOM 0 HA ALA A 37 9.324 -0.995 -0.687 1.00 0.00 H new ATOM 0 HB1 ALA A 37 7.622 -2.827 -0.513 1.00 0.00 H new ATOM 0 HB2 ALA A 37 7.774 -1.986 1.048 1.00 0.00 H new ATOM 0 HB3 ALA A 37 6.393 -1.638 -0.019 1.00 0.00 H new ATOM 576 N THR A 38 8.497 -1.261 -3.024 1.00 0.00 N ATOM 577 CA THR A 38 8.135 -1.162 -4.467 1.00 0.00 C ATOM 578 C THR A 38 8.240 -2.547 -5.112 1.00 0.00 C ATOM 579 O THR A 38 9.202 -3.261 -4.912 1.00 0.00 O ATOM 580 CB THR A 38 9.164 -0.203 -5.072 1.00 0.00 C ATOM 581 OG1 THR A 38 8.878 -0.009 -6.450 1.00 0.00 O ATOM 582 CG2 THR A 38 10.567 -0.790 -4.916 1.00 0.00 C ATOM 0 H THR A 38 9.296 -1.863 -2.822 1.00 0.00 H new ATOM 0 HA THR A 38 7.117 -0.805 -4.624 1.00 0.00 H new ATOM 0 HB THR A 38 9.115 0.755 -4.554 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.985 -0.359 -6.651 1.00 0.00 H new ATOM 0 HG21 THR A 38 11.298 -0.106 -5.347 1.00 0.00 H new ATOM 0 HG22 THR A 38 10.785 -0.934 -3.858 1.00 0.00 H new ATOM 0 HG23 THR A 38 10.620 -1.749 -5.431 1.00 0.00 H new ATOM 590 N ALA A 39 7.252 -2.942 -5.868 1.00 0.00 N ATOM 591 CA ALA A 39 7.293 -4.294 -6.503 1.00 0.00 C ATOM 592 C ALA A 39 7.170 -5.350 -5.413 1.00 0.00 C ATOM 593 O ALA A 39 7.112 -5.025 -4.259 1.00 0.00 O ATOM 594 CB ALA A 39 8.651 -4.379 -7.182 1.00 0.00 C ATOM 0 H ALA A 39 6.419 -2.390 -6.074 1.00 0.00 H new ATOM 0 HA ALA A 39 6.485 -4.454 -7.217 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.753 -5.348 -7.671 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.736 -3.586 -7.925 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.438 -4.264 -6.437 1.00 0.00 H new ATOM 600 N SER A 40 7.108 -6.606 -5.745 1.00 0.00 N ATOM 601 CA SER A 40 6.967 -7.611 -4.655 1.00 0.00 C ATOM 602 C SER A 40 8.282 -8.316 -4.361 1.00 0.00 C ATOM 603 O SER A 40 8.935 -8.860 -5.230 1.00 0.00 O ATOM 604 CB SER A 40 5.888 -8.579 -5.112 1.00 0.00 C ATOM 605 OG SER A 40 6.223 -9.103 -6.390 1.00 0.00 O ATOM 0 H SER A 40 7.147 -6.975 -6.695 1.00 0.00 H new ATOM 0 HA SER A 40 6.688 -7.134 -3.715 1.00 0.00 H new ATOM 0 HB2 SER A 40 5.785 -9.390 -4.391 1.00 0.00 H new ATOM 0 HB3 SER A 40 4.925 -8.070 -5.158 1.00 0.00 H new ATOM 0 HG SER A 40 5.443 -9.557 -6.772 1.00 0.00 H new ATOM 611 N ARG A 41 8.665 -8.290 -3.115 1.00 0.00 N ATOM 612 CA ARG A 41 9.927 -8.928 -2.689 1.00 0.00 C ATOM 613 C ARG A 41 9.746 -9.540 -1.297 1.00 0.00 C ATOM 614 O ARG A 41 9.482 -8.849 -0.333 1.00 0.00 O ATOM 615 CB ARG A 41 10.934 -7.781 -2.652 1.00 0.00 C ATOM 616 CG ARG A 41 12.345 -8.351 -2.515 1.00 0.00 C ATOM 617 CD ARG A 41 12.697 -9.119 -3.790 1.00 0.00 C ATOM 618 NE ARG A 41 14.180 -9.257 -3.760 1.00 0.00 N ATOM 619 CZ ARG A 41 14.879 -9.036 -4.840 1.00 0.00 C ATOM 620 NH1 ARG A 41 14.427 -9.425 -6.001 1.00 0.00 N ATOM 621 NH2 ARG A 41 16.029 -8.426 -4.759 1.00 0.00 N ATOM 0 H ARG A 41 8.140 -7.842 -2.364 1.00 0.00 H new ATOM 0 HA ARG A 41 10.248 -9.732 -3.351 1.00 0.00 H new ATOM 0 HB2 ARG A 41 10.857 -7.185 -3.561 1.00 0.00 H new ATOM 0 HB3 ARG A 41 10.715 -7.117 -1.816 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.062 -7.547 -2.350 1.00 0.00 H new ATOM 0 HG3 ARG A 41 12.402 -9.011 -1.650 1.00 0.00 H new ATOM 0 HD2 ARG A 41 12.210 -10.094 -3.810 1.00 0.00 H new ATOM 0 HD3 ARG A 41 12.369 -8.580 -4.679 1.00 0.00 H new ATOM 0 HE ARG A 41 14.650 -9.524 -2.895 1.00 0.00 H new ATOM 0 HH11 ARG A 41 13.527 -9.902 -6.064 1.00 0.00 H new ATOM 0 HH12 ARG A 41 14.973 -9.252 -6.845 1.00 0.00 H new ATOM 0 HH21 ARG A 41 16.382 -8.122 -3.852 1.00 0.00 H new ATOM 0 HH22 ARG A 41 16.575 -8.253 -5.603 1.00 0.00 H new ATOM 635 N MET A 42 9.878 -10.831 -1.185 1.00 0.00 N ATOM 636 CA MET A 42 9.705 -11.487 0.142 1.00 0.00 C ATOM 637 C MET A 42 10.427 -10.693 1.236 1.00 0.00 C ATOM 638 O MET A 42 9.909 -10.497 2.317 1.00 0.00 O ATOM 639 CB MET A 42 10.332 -12.871 -0.019 1.00 0.00 C ATOM 640 CG MET A 42 9.645 -13.615 -1.166 1.00 0.00 C ATOM 641 SD MET A 42 9.654 -15.391 -0.822 1.00 0.00 S ATOM 642 CE MET A 42 11.433 -15.643 -1.030 1.00 0.00 C ATOM 0 H MET A 42 10.098 -11.462 -1.955 1.00 0.00 H new ATOM 0 HA MET A 42 8.657 -11.542 0.438 1.00 0.00 H new ATOM 0 HB2 MET A 42 11.399 -12.777 -0.221 1.00 0.00 H new ATOM 0 HB3 MET A 42 10.231 -13.437 0.907 1.00 0.00 H new ATOM 0 HG2 MET A 42 8.621 -13.261 -1.282 1.00 0.00 H new ATOM 0 HG3 MET A 42 10.160 -13.413 -2.105 1.00 0.00 H new ATOM 0 HE1 MET A 42 11.649 -16.711 -1.055 1.00 0.00 H new ATOM 0 HE2 MET A 42 11.759 -15.185 -1.964 1.00 0.00 H new ATOM 0 HE3 MET A 42 11.965 -15.185 -0.196 1.00 0.00 H new ATOM 652 N GLN A 43 11.623 -10.245 0.970 1.00 0.00 N ATOM 653 CA GLN A 43 12.380 -9.475 2.000 1.00 0.00 C ATOM 654 C GLN A 43 11.650 -8.174 2.349 1.00 0.00 C ATOM 655 O GLN A 43 11.584 -7.781 3.497 1.00 0.00 O ATOM 656 CB GLN A 43 13.732 -9.174 1.352 1.00 0.00 C ATOM 657 CG GLN A 43 14.688 -8.602 2.402 1.00 0.00 C ATOM 658 CD GLN A 43 15.532 -7.491 1.772 1.00 0.00 C ATOM 659 OE1 GLN A 43 15.162 -6.335 1.812 1.00 0.00 O ATOM 660 NE2 GLN A 43 16.658 -7.795 1.186 1.00 0.00 N ATOM 0 H GLN A 43 12.110 -10.378 0.084 1.00 0.00 H new ATOM 0 HA GLN A 43 12.485 -10.032 2.931 1.00 0.00 H new ATOM 0 HB2 GLN A 43 14.151 -10.083 0.921 1.00 0.00 H new ATOM 0 HB3 GLN A 43 13.605 -8.463 0.535 1.00 0.00 H new ATOM 0 HG2 GLN A 43 14.124 -8.209 3.248 1.00 0.00 H new ATOM 0 HG3 GLN A 43 15.335 -9.390 2.788 1.00 0.00 H new ATOM 0 HE21 GLN A 43 16.969 -8.766 1.152 1.00 0.00 H new ATOM 0 HE22 GLN A 43 17.227 -7.062 0.762 1.00 0.00 H new ATOM 669 N GLU A 44 11.106 -7.497 1.373 1.00 0.00 N ATOM 670 CA GLU A 44 10.390 -6.222 1.660 1.00 0.00 C ATOM 671 C GLU A 44 9.175 -6.484 2.547 1.00 0.00 C ATOM 672 O GLU A 44 8.992 -5.851 3.566 1.00 0.00 O ATOM 673 CB GLU A 44 9.945 -5.691 0.298 1.00 0.00 C ATOM 674 CG GLU A 44 11.035 -4.785 -0.288 1.00 0.00 C ATOM 675 CD GLU A 44 12.413 -5.419 -0.076 1.00 0.00 C ATOM 676 OE1 GLU A 44 12.898 -5.374 1.043 1.00 0.00 O ATOM 677 OE2 GLU A 44 12.958 -5.937 -1.036 1.00 0.00 O ATOM 0 H GLU A 44 11.127 -7.772 0.391 1.00 0.00 H new ATOM 0 HA GLU A 44 11.025 -5.510 2.187 1.00 0.00 H new ATOM 0 HB2 GLU A 44 9.747 -6.522 -0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 44 9.013 -5.135 0.401 1.00 0.00 H new ATOM 0 HG2 GLU A 44 10.857 -4.630 -1.352 1.00 0.00 H new ATOM 0 HG3 GLU A 44 10.999 -3.805 0.188 1.00 0.00 H new ATOM 684 N ALA A 45 8.351 -7.425 2.176 1.00 0.00 N ATOM 685 CA ALA A 45 7.156 -7.732 3.008 1.00 0.00 C ATOM 686 C ALA A 45 7.615 -7.945 4.440 1.00 0.00 C ATOM 687 O ALA A 45 6.932 -7.622 5.391 1.00 0.00 O ATOM 688 CB ALA A 45 6.581 -9.020 2.424 1.00 0.00 C ATOM 0 H ALA A 45 8.454 -7.993 1.335 1.00 0.00 H new ATOM 0 HA ALA A 45 6.411 -6.937 3.007 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.694 -9.311 2.987 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.311 -8.858 1.380 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.327 -9.813 2.487 1.00 0.00 H new ATOM 694 N LEU A 46 8.794 -8.467 4.584 1.00 0.00 N ATOM 695 CA LEU A 46 9.356 -8.690 5.931 1.00 0.00 C ATOM 696 C LEU A 46 9.469 -7.348 6.644 1.00 0.00 C ATOM 697 O LEU A 46 8.908 -7.149 7.697 1.00 0.00 O ATOM 698 CB LEU A 46 10.737 -9.288 5.655 1.00 0.00 C ATOM 699 CG LEU A 46 11.146 -10.233 6.789 1.00 0.00 C ATOM 700 CD1 LEU A 46 10.735 -9.643 8.139 1.00 0.00 C ATOM 701 CD2 LEU A 46 10.455 -11.584 6.590 1.00 0.00 C ATOM 0 H LEU A 46 9.398 -8.752 3.813 1.00 0.00 H new ATOM 0 HA LEU A 46 8.752 -9.340 6.564 1.00 0.00 H new ATOM 0 HB2 LEU A 46 10.723 -9.829 4.709 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.473 -8.490 5.555 1.00 0.00 H new ATOM 0 HG LEU A 46 12.228 -10.364 6.776 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.030 -10.323 8.938 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.227 -8.681 8.281 1.00 0.00 H new ATOM 0 HD13 LEU A 46 9.654 -9.504 8.162 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.742 -12.261 7.394 1.00 0.00 H new ATOM 0 HD22 LEU A 46 9.374 -11.445 6.601 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.756 -12.009 5.633 1.00 0.00 H new ATOM 713 N ASP A 47 10.175 -6.421 6.061 1.00 0.00 N ATOM 714 CA ASP A 47 10.321 -5.081 6.695 1.00 0.00 C ATOM 715 C ASP A 47 8.958 -4.541 7.125 1.00 0.00 C ATOM 716 O ASP A 47 8.833 -3.884 8.136 1.00 0.00 O ATOM 717 CB ASP A 47 10.920 -4.191 5.606 1.00 0.00 C ATOM 718 CG ASP A 47 11.971 -3.267 6.221 1.00 0.00 C ATOM 719 OD1 ASP A 47 11.685 -2.682 7.252 1.00 0.00 O ATOM 720 OD2 ASP A 47 13.044 -3.160 5.650 1.00 0.00 O ATOM 0 H ASP A 47 10.659 -6.533 5.170 1.00 0.00 H new ATOM 0 HA ASP A 47 10.945 -5.119 7.588 1.00 0.00 H new ATOM 0 HB2 ASP A 47 11.372 -4.806 4.828 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.136 -3.601 5.131 1.00 0.00 H new ATOM 725 N ILE A 48 7.939 -4.803 6.360 1.00 0.00 N ATOM 726 CA ILE A 48 6.584 -4.293 6.717 1.00 0.00 C ATOM 727 C ILE A 48 5.835 -5.342 7.548 1.00 0.00 C ATOM 728 O ILE A 48 4.763 -5.093 8.062 1.00 0.00 O ATOM 729 CB ILE A 48 5.865 -3.992 5.376 1.00 0.00 C ATOM 730 CG1 ILE A 48 4.971 -5.175 4.957 1.00 0.00 C ATOM 731 CG2 ILE A 48 6.900 -3.720 4.276 1.00 0.00 C ATOM 732 CD1 ILE A 48 4.608 -5.062 3.470 1.00 0.00 C ATOM 0 H ILE A 48 7.983 -5.350 5.500 1.00 0.00 H new ATOM 0 HA ILE A 48 6.631 -3.391 7.327 1.00 0.00 H new ATOM 0 HB ILE A 48 5.239 -3.111 5.515 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.489 -6.116 5.142 1.00 0.00 H new ATOM 0 HG13 ILE A 48 4.064 -5.187 5.561 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.387 -3.510 3.338 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.511 -2.862 4.556 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.538 -4.595 4.152 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.976 -5.903 3.185 1.00 0.00 H new ATOM 0 HD12 ILE A 48 4.071 -4.129 3.296 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.519 -5.073 2.871 1.00 0.00 H new ATOM 744 N ALA A 49 6.391 -6.517 7.674 1.00 0.00 N ATOM 745 CA ALA A 49 5.710 -7.578 8.460 1.00 0.00 C ATOM 746 C ALA A 49 5.984 -7.412 9.954 1.00 0.00 C ATOM 747 O ALA A 49 5.100 -7.108 10.729 1.00 0.00 O ATOM 748 CB ALA A 49 6.304 -8.892 7.950 1.00 0.00 C ATOM 0 H ALA A 49 7.287 -6.785 7.266 1.00 0.00 H new ATOM 0 HA ALA A 49 4.627 -7.540 8.338 1.00 0.00 H new ATOM 0 HB1 ALA A 49 5.851 -9.727 8.483 1.00 0.00 H new ATOM 0 HB2 ALA A 49 6.105 -8.992 6.883 1.00 0.00 H new ATOM 0 HB3 ALA A 49 7.381 -8.895 8.120 1.00 0.00 H new ATOM 754 N ARG A 50 7.199 -7.623 10.363 1.00 0.00 N ATOM 755 CA ARG A 50 7.536 -7.496 11.807 1.00 0.00 C ATOM 756 C ARG A 50 7.465 -6.032 12.267 1.00 0.00 C ATOM 757 O ARG A 50 7.540 -5.742 13.445 1.00 0.00 O ATOM 758 CB ARG A 50 8.962 -8.041 11.924 1.00 0.00 C ATOM 759 CG ARG A 50 9.970 -6.980 11.478 1.00 0.00 C ATOM 760 CD ARG A 50 9.862 -6.766 9.969 1.00 0.00 C ATOM 761 NE ARG A 50 11.017 -5.889 9.636 1.00 0.00 N ATOM 762 CZ ARG A 50 12.235 -6.349 9.741 1.00 0.00 C ATOM 763 NH1 ARG A 50 12.868 -6.256 10.877 1.00 0.00 N ATOM 764 NH2 ARG A 50 12.817 -6.904 8.714 1.00 0.00 N ATOM 0 H ARG A 50 7.979 -7.879 9.758 1.00 0.00 H new ATOM 0 HA ARG A 50 6.835 -8.041 12.440 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.164 -8.335 12.954 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.069 -8.936 11.311 1.00 0.00 H new ATOM 0 HG2 ARG A 50 9.781 -6.043 12.002 1.00 0.00 H new ATOM 0 HG3 ARG A 50 10.981 -7.293 11.739 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.912 -7.711 9.429 1.00 0.00 H new ATOM 0 HD3 ARG A 50 8.916 -6.296 9.701 1.00 0.00 H new ATOM 0 HE ARG A 50 10.858 -4.930 9.326 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.412 -5.825 11.681 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.819 -6.614 10.962 1.00 0.00 H new ATOM 0 HH21 ARG A 50 12.321 -6.980 7.826 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.768 -7.262 8.799 1.00 0.00 H new ATOM 778 N LYS A 51 7.327 -5.108 11.353 1.00 0.00 N ATOM 779 CA LYS A 51 7.260 -3.672 11.753 1.00 0.00 C ATOM 780 C LYS A 51 5.943 -3.386 12.483 1.00 0.00 C ATOM 781 O LYS A 51 5.931 -2.881 13.589 1.00 0.00 O ATOM 782 CB LYS A 51 7.323 -2.907 10.430 1.00 0.00 C ATOM 783 CG LYS A 51 7.183 -1.406 10.682 1.00 0.00 C ATOM 784 CD LYS A 51 8.559 -0.799 10.971 1.00 0.00 C ATOM 785 CE LYS A 51 8.647 0.588 10.324 1.00 0.00 C ATOM 786 NZ LYS A 51 10.092 0.788 10.008 1.00 0.00 N ATOM 0 H LYS A 51 7.258 -5.285 10.351 1.00 0.00 H new ATOM 0 HA LYS A 51 8.062 -3.386 12.434 1.00 0.00 H new ATOM 0 HB2 LYS A 51 8.268 -3.112 9.927 1.00 0.00 H new ATOM 0 HB3 LYS A 51 6.528 -3.248 9.766 1.00 0.00 H new ATOM 0 HG2 LYS A 51 6.737 -0.922 9.813 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.513 -1.230 11.524 1.00 0.00 H new ATOM 0 HD2 LYS A 51 8.716 -0.722 12.047 1.00 0.00 H new ATOM 0 HD3 LYS A 51 9.344 -1.446 10.580 1.00 0.00 H new ATOM 0 HE2 LYS A 51 8.037 0.640 9.422 1.00 0.00 H new ATOM 0 HE3 LYS A 51 8.282 1.361 11.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 10.224 1.718 9.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 10.649 0.742 10.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 10.411 0.043 9.356 1.00 0.00 H new ATOM 800 N GLY A 52 4.834 -3.725 11.881 1.00 0.00 N ATOM 801 CA GLY A 52 3.509 -3.504 12.541 1.00 0.00 C ATOM 802 C GLY A 52 3.127 -2.012 12.602 1.00 0.00 C ATOM 803 O GLY A 52 1.962 -1.679 12.697 1.00 0.00 O ATOM 0 H GLY A 52 4.787 -4.148 10.954 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.739 -4.052 11.998 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.537 -3.911 13.552 1.00 0.00 H new ATOM 807 N GLN A 53 4.073 -1.109 12.575 1.00 0.00 N ATOM 808 CA GLN A 53 3.717 0.339 12.662 1.00 0.00 C ATOM 809 C GLN A 53 3.691 0.988 11.278 1.00 0.00 C ATOM 810 O GLN A 53 3.121 2.048 11.101 1.00 0.00 O ATOM 811 CB GLN A 53 4.822 0.978 13.509 1.00 0.00 C ATOM 812 CG GLN A 53 5.184 0.061 14.678 1.00 0.00 C ATOM 813 CD GLN A 53 4.029 0.029 15.680 1.00 0.00 C ATOM 814 OE1 GLN A 53 2.924 -0.341 15.339 1.00 0.00 O ATOM 815 NE2 GLN A 53 4.240 0.406 16.912 1.00 0.00 N ATOM 0 H GLN A 53 5.070 -1.309 12.497 1.00 0.00 H new ATOM 0 HA GLN A 53 2.725 0.473 13.094 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.703 1.161 12.894 1.00 0.00 H new ATOM 0 HB3 GLN A 53 4.489 1.946 13.885 1.00 0.00 H new ATOM 0 HG2 GLN A 53 5.391 -0.945 14.314 1.00 0.00 H new ATOM 0 HG3 GLN A 53 6.092 0.417 15.165 1.00 0.00 H new ATOM 0 HE21 GLN A 53 5.168 0.717 17.198 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.477 0.390 17.588 1.00 0.00 H new ATOM 824 N PHE A 54 4.313 0.385 10.300 1.00 0.00 N ATOM 825 CA PHE A 54 4.319 1.008 8.945 1.00 0.00 C ATOM 826 C PHE A 54 2.925 1.543 8.614 1.00 0.00 C ATOM 827 O PHE A 54 1.922 0.932 8.928 1.00 0.00 O ATOM 828 CB PHE A 54 4.739 -0.095 7.972 1.00 0.00 C ATOM 829 CG PHE A 54 3.647 -1.128 7.851 1.00 0.00 C ATOM 830 CD1 PHE A 54 2.478 -0.843 7.134 1.00 0.00 C ATOM 831 CD2 PHE A 54 3.814 -2.381 8.446 1.00 0.00 C ATOM 832 CE1 PHE A 54 1.480 -1.815 7.017 1.00 0.00 C ATOM 833 CE2 PHE A 54 2.817 -3.352 8.332 1.00 0.00 C ATOM 834 CZ PHE A 54 1.648 -3.070 7.616 1.00 0.00 C ATOM 0 H PHE A 54 4.812 -0.501 10.379 1.00 0.00 H new ATOM 0 HA PHE A 54 5.005 1.853 8.885 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.952 0.335 6.994 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.658 -0.566 8.320 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.348 0.125 6.673 1.00 0.00 H new ATOM 0 HD2 PHE A 54 4.717 -2.599 8.996 1.00 0.00 H new ATOM 0 HE1 PHE A 54 0.578 -1.598 6.464 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.948 -4.319 8.795 1.00 0.00 H new ATOM 0 HZ PHE A 54 0.876 -3.820 7.525 1.00 0.00 H new ATOM 844 N ASP A 55 2.859 2.695 8.012 1.00 0.00 N ATOM 845 CA ASP A 55 1.537 3.300 7.691 1.00 0.00 C ATOM 846 C ASP A 55 0.717 2.421 6.739 1.00 0.00 C ATOM 847 O ASP A 55 -0.469 2.241 6.932 1.00 0.00 O ATOM 848 CB ASP A 55 1.872 4.639 7.034 1.00 0.00 C ATOM 849 CG ASP A 55 1.073 5.752 7.717 1.00 0.00 C ATOM 850 OD1 ASP A 55 1.431 6.116 8.825 1.00 0.00 O ATOM 851 OD2 ASP A 55 0.113 6.215 7.123 1.00 0.00 O ATOM 0 H ASP A 55 3.668 3.247 7.727 1.00 0.00 H new ATOM 0 HA ASP A 55 0.924 3.411 8.585 1.00 0.00 H new ATOM 0 HB2 ASP A 55 2.940 4.840 7.116 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.634 4.605 5.971 1.00 0.00 H new ATOM 856 N ILE A 56 1.307 1.895 5.697 1.00 0.00 N ATOM 857 CA ILE A 56 0.494 1.069 4.750 1.00 0.00 C ATOM 858 C ILE A 56 1.225 -0.208 4.320 1.00 0.00 C ATOM 859 O ILE A 56 2.385 -0.388 4.612 1.00 0.00 O ATOM 860 CB ILE A 56 0.258 2.005 3.569 1.00 0.00 C ATOM 861 CG1 ILE A 56 -0.670 3.149 4.039 1.00 0.00 C ATOM 862 CG2 ILE A 56 -0.343 1.210 2.406 1.00 0.00 C ATOM 863 CD1 ILE A 56 -1.776 3.446 3.021 1.00 0.00 C ATOM 0 H ILE A 56 2.294 1.997 5.462 1.00 0.00 H new ATOM 0 HA ILE A 56 -0.432 0.713 5.202 1.00 0.00 H new ATOM 0 HB ILE A 56 1.191 2.442 3.214 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.120 2.881 4.995 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.079 4.050 4.206 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.513 1.876 1.560 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.346 0.418 2.112 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -1.290 0.770 2.717 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.404 4.256 3.392 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.328 3.740 2.072 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.384 2.554 2.874 1.00 0.00 H new ATOM 875 N ALA A 57 0.541 -1.118 3.649 1.00 0.00 N ATOM 876 CA ALA A 57 1.209 -2.391 3.243 1.00 0.00 C ATOM 877 C ALA A 57 0.466 -3.064 2.079 1.00 0.00 C ATOM 878 O ALA A 57 -0.550 -3.693 2.276 1.00 0.00 O ATOM 879 CB ALA A 57 1.081 -3.259 4.490 1.00 0.00 C ATOM 0 H ALA A 57 -0.437 -1.029 3.372 1.00 0.00 H new ATOM 0 HA ALA A 57 2.234 -2.234 2.908 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.542 -4.230 4.307 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.582 -2.771 5.326 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.027 -3.398 4.730 1.00 0.00 H new ATOM 885 N ILE A 58 0.968 -2.975 0.876 1.00 0.00 N ATOM 886 CA ILE A 58 0.268 -3.635 -0.260 1.00 0.00 C ATOM 887 C ILE A 58 1.058 -4.851 -0.711 1.00 0.00 C ATOM 888 O ILE A 58 2.271 -4.848 -0.744 1.00 0.00 O ATOM 889 CB ILE A 58 0.190 -2.586 -1.368 1.00 0.00 C ATOM 890 CG1 ILE A 58 -0.806 -1.501 -0.961 1.00 0.00 C ATOM 891 CG2 ILE A 58 -0.282 -3.244 -2.663 1.00 0.00 C ATOM 892 CD1 ILE A 58 -0.219 -0.684 0.188 1.00 0.00 C ATOM 0 H ILE A 58 1.825 -2.478 0.634 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.727 -3.984 0.015 1.00 0.00 H new ATOM 0 HB ILE A 58 1.175 -2.145 -1.524 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.023 -0.853 -1.810 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.750 -1.953 -0.656 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.337 -2.495 -3.453 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.422 -4.025 -2.952 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.268 -3.683 -2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.926 0.091 0.482 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.025 -1.338 1.038 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.714 -0.221 -0.134 1.00 0.00 H new ATOM 904 N ILE A 59 0.370 -5.894 -1.048 1.00 0.00 N ATOM 905 CA ILE A 59 1.054 -7.130 -1.489 1.00 0.00 C ATOM 906 C ILE A 59 0.090 -7.958 -2.348 1.00 0.00 C ATOM 907 O ILE A 59 -0.520 -8.888 -1.868 1.00 0.00 O ATOM 908 CB ILE A 59 1.372 -7.892 -0.200 1.00 0.00 C ATOM 909 CG1 ILE A 59 2.235 -7.030 0.728 1.00 0.00 C ATOM 910 CG2 ILE A 59 2.115 -9.177 -0.550 1.00 0.00 C ATOM 911 CD1 ILE A 59 2.684 -7.862 1.932 1.00 0.00 C ATOM 0 H ILE A 59 -0.649 -5.945 -1.037 1.00 0.00 H new ATOM 0 HA ILE A 59 1.949 -6.925 -2.077 1.00 0.00 H new ATOM 0 HB ILE A 59 0.442 -8.132 0.315 1.00 0.00 H new ATOM 0 HG12 ILE A 59 3.104 -6.655 0.188 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.669 -6.161 1.064 1.00 0.00 H new ATOM 0 HG21 ILE A 59 2.345 -9.725 0.364 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.490 -9.794 -1.196 1.00 0.00 H new ATOM 0 HG23 ILE A 59 3.042 -8.932 -1.069 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.298 -7.247 2.591 1.00 0.00 H new ATOM 0 HD12 ILE A 59 1.809 -8.215 2.477 1.00 0.00 H new ATOM 0 HD13 ILE A 59 3.266 -8.717 1.587 1.00 0.00 H new ATOM 923 N ASP A 60 -0.071 -7.616 -3.596 1.00 0.00 N ATOM 924 CA ASP A 60 -1.024 -8.381 -4.470 1.00 0.00 C ATOM 925 C ASP A 60 -0.998 -9.878 -4.140 1.00 0.00 C ATOM 926 O ASP A 60 0.005 -10.541 -4.307 1.00 0.00 O ATOM 927 CB ASP A 60 -0.519 -8.161 -5.888 1.00 0.00 C ATOM 928 CG ASP A 60 -0.860 -6.743 -6.347 1.00 0.00 C ATOM 929 OD1 ASP A 60 -1.606 -6.078 -5.648 1.00 0.00 O ATOM 930 OD2 ASP A 60 -0.368 -6.345 -7.391 1.00 0.00 O ATOM 0 H ASP A 60 0.412 -6.843 -4.054 1.00 0.00 H new ATOM 0 HA ASP A 60 -2.051 -8.044 -4.329 1.00 0.00 H new ATOM 0 HB2 ASP A 60 0.559 -8.316 -5.928 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -0.971 -8.889 -6.561 1.00 0.00 H new ATOM 935 N VAL A 61 -2.098 -10.409 -3.670 1.00 0.00 N ATOM 936 CA VAL A 61 -2.144 -11.860 -3.317 1.00 0.00 C ATOM 937 C VAL A 61 -2.518 -12.714 -4.538 1.00 0.00 C ATOM 938 O VAL A 61 -2.775 -13.896 -4.415 1.00 0.00 O ATOM 939 CB VAL A 61 -3.198 -11.957 -2.192 1.00 0.00 C ATOM 940 CG1 VAL A 61 -4.450 -12.711 -2.663 1.00 0.00 C ATOM 941 CG2 VAL A 61 -2.589 -12.697 -0.997 1.00 0.00 C ATOM 0 H VAL A 61 -2.968 -9.899 -3.515 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.177 -12.241 -2.990 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.491 -10.946 -1.909 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.172 -12.762 -1.848 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.894 -12.186 -3.509 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.174 -13.721 -2.967 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.328 -12.769 -0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.288 -13.698 -1.304 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.717 -12.151 -0.636 1.00 0.00 H new ATOM 951 N ASN A 62 -2.549 -12.140 -5.709 1.00 0.00 N ATOM 952 CA ASN A 62 -2.906 -12.949 -6.911 1.00 0.00 C ATOM 953 C ASN A 62 -2.401 -12.282 -8.188 1.00 0.00 C ATOM 954 O ASN A 62 -3.168 -11.928 -9.060 1.00 0.00 O ATOM 955 CB ASN A 62 -4.427 -13.008 -6.917 1.00 0.00 C ATOM 956 CG ASN A 62 -4.891 -14.285 -6.214 1.00 0.00 C ATOM 957 OD1 ASN A 62 -5.408 -14.234 -5.117 1.00 0.00 O ATOM 958 ND2 ASN A 62 -4.723 -15.436 -6.803 1.00 0.00 N ATOM 0 H ASN A 62 -2.345 -11.156 -5.886 1.00 0.00 H new ATOM 0 HA ASN A 62 -2.454 -13.940 -6.874 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.837 -12.133 -6.413 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -4.798 -12.989 -7.942 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -5.026 -16.294 -6.342 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -4.289 -15.479 -7.725 1.00 0.00 H new ATOM 965 N LEU A 63 -1.117 -12.120 -8.315 1.00 0.00 N ATOM 966 CA LEU A 63 -0.569 -11.492 -9.546 1.00 0.00 C ATOM 967 C LEU A 63 0.669 -12.258 -10.000 1.00 0.00 C ATOM 968 O LEU A 63 1.563 -12.524 -9.223 1.00 0.00 O ATOM 969 CB LEU A 63 -0.209 -10.066 -9.147 1.00 0.00 C ATOM 970 CG LEU A 63 -0.520 -9.137 -10.317 1.00 0.00 C ATOM 971 CD1 LEU A 63 -2.034 -8.958 -10.425 1.00 0.00 C ATOM 972 CD2 LEU A 63 0.145 -7.781 -10.082 1.00 0.00 C ATOM 0 H LEU A 63 -0.423 -12.395 -7.620 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.279 -11.504 -10.373 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -0.775 -9.766 -8.265 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.847 -10.002 -8.884 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.137 -9.568 -11.242 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.263 -8.295 -11.259 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.504 -9.927 -10.592 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.416 -8.524 -9.501 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.077 -7.117 -10.918 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.237 -7.343 -9.160 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.224 -7.914 -10.001 1.00 0.00 H new ATOM 984 N ASP A 64 0.727 -12.635 -11.246 1.00 0.00 N ATOM 985 CA ASP A 64 1.905 -13.409 -11.722 1.00 0.00 C ATOM 986 C ASP A 64 1.934 -14.759 -11.001 1.00 0.00 C ATOM 987 O ASP A 64 2.910 -15.483 -11.048 1.00 0.00 O ATOM 988 CB ASP A 64 3.125 -12.566 -11.336 1.00 0.00 C ATOM 989 CG ASP A 64 3.835 -12.074 -12.599 1.00 0.00 C ATOM 990 OD1 ASP A 64 4.584 -12.848 -13.174 1.00 0.00 O ATOM 991 OD2 ASP A 64 3.620 -10.932 -12.968 1.00 0.00 O ATOM 0 H ASP A 64 0.015 -12.442 -11.951 1.00 0.00 H new ATOM 0 HA ASP A 64 1.881 -13.603 -12.794 1.00 0.00 H new ATOM 0 HB2 ASP A 64 2.814 -11.716 -10.728 1.00 0.00 H new ATOM 0 HB3 ASP A 64 3.810 -13.158 -10.729 1.00 0.00 H new ATOM 996 N GLY A 65 0.866 -15.095 -10.321 1.00 0.00 N ATOM 997 CA GLY A 65 0.820 -16.385 -9.582 1.00 0.00 C ATOM 998 C GLY A 65 0.327 -16.118 -8.161 1.00 0.00 C ATOM 999 O GLY A 65 -0.661 -16.680 -7.736 1.00 0.00 O ATOM 0 H GLY A 65 0.023 -14.526 -10.248 1.00 0.00 H new ATOM 0 HA2 GLY A 65 0.156 -17.086 -10.087 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.809 -16.843 -9.559 1.00 0.00 H new ATOM 1003 N GLU A 66 1.020 -15.245 -7.449 1.00 0.00 N ATOM 1004 CA GLU A 66 0.661 -14.859 -6.033 1.00 0.00 C ATOM 1005 C GLU A 66 1.933 -14.785 -5.177 1.00 0.00 C ATOM 1006 O GLU A 66 2.154 -15.627 -4.330 1.00 0.00 O ATOM 1007 CB GLU A 66 -0.267 -15.944 -5.473 1.00 0.00 C ATOM 1008 CG GLU A 66 -0.408 -15.774 -3.960 1.00 0.00 C ATOM 1009 CD GLU A 66 -0.024 -17.077 -3.256 1.00 0.00 C ATOM 1010 OE1 GLU A 66 0.153 -18.070 -3.943 1.00 0.00 O ATOM 1011 OE2 GLU A 66 0.086 -17.061 -2.042 1.00 0.00 O ATOM 0 H GLU A 66 1.848 -14.768 -7.805 1.00 0.00 H new ATOM 0 HA GLU A 66 0.170 -13.886 -6.018 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -1.246 -15.879 -5.948 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.134 -16.932 -5.702 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.231 -14.961 -3.615 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.433 -15.502 -3.709 1.00 0.00 H new ATOM 1018 N PRO A 67 2.728 -13.775 -5.421 1.00 0.00 N ATOM 1019 CA PRO A 67 3.982 -13.592 -4.657 1.00 0.00 C ATOM 1020 C PRO A 67 3.709 -12.803 -3.371 1.00 0.00 C ATOM 1021 O PRO A 67 4.542 -12.052 -2.905 1.00 0.00 O ATOM 1022 CB PRO A 67 4.850 -12.776 -5.606 1.00 0.00 C ATOM 1023 CG PRO A 67 3.893 -12.039 -6.499 1.00 0.00 C ATOM 1024 CD PRO A 67 2.546 -12.722 -6.419 1.00 0.00 C ATOM 0 HA PRO A 67 4.444 -14.531 -4.352 1.00 0.00 H new ATOM 0 HB2 PRO A 67 5.486 -12.082 -5.056 1.00 0.00 H new ATOM 0 HB3 PRO A 67 5.509 -13.421 -6.186 1.00 0.00 H new ATOM 0 HG2 PRO A 67 3.810 -10.998 -6.188 1.00 0.00 H new ATOM 0 HG3 PRO A 67 4.257 -12.037 -7.526 1.00 0.00 H new ATOM 0 HD2 PRO A 67 1.764 -12.024 -6.121 1.00 0.00 H new ATOM 0 HD3 PRO A 67 2.253 -13.136 -7.384 1.00 0.00 H new ATOM 1032 N SER A 68 2.544 -12.955 -2.804 1.00 0.00 N ATOM 1033 CA SER A 68 2.210 -12.200 -1.561 1.00 0.00 C ATOM 1034 C SER A 68 2.605 -12.999 -0.317 1.00 0.00 C ATOM 1035 O SER A 68 2.316 -12.608 0.795 1.00 0.00 O ATOM 1036 CB SER A 68 0.700 -12.019 -1.621 1.00 0.00 C ATOM 1037 OG SER A 68 0.071 -13.294 -1.661 1.00 0.00 O ATOM 0 H SER A 68 1.807 -13.570 -3.148 1.00 0.00 H new ATOM 0 HA SER A 68 2.743 -11.251 -1.499 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.355 -11.459 -0.752 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.427 -11.439 -2.503 1.00 0.00 H new ATOM 0 HG SER A 68 0.034 -13.669 -0.756 1.00 0.00 H new ATOM 1043 N TYR A 69 3.270 -14.106 -0.506 1.00 0.00 N ATOM 1044 CA TYR A 69 3.707 -14.955 0.648 1.00 0.00 C ATOM 1045 C TYR A 69 2.571 -15.150 1.660 1.00 0.00 C ATOM 1046 O TYR A 69 1.499 -14.577 1.543 1.00 0.00 O ATOM 1047 CB TYR A 69 4.904 -14.244 1.324 1.00 0.00 C ATOM 1048 CG TYR A 69 5.162 -12.879 0.723 1.00 0.00 C ATOM 1049 CD1 TYR A 69 5.927 -12.755 -0.443 1.00 0.00 C ATOM 1050 CD2 TYR A 69 4.631 -11.739 1.335 1.00 0.00 C ATOM 1051 CE1 TYR A 69 6.158 -11.489 -0.994 1.00 0.00 C ATOM 1052 CE2 TYR A 69 4.860 -10.476 0.782 1.00 0.00 C ATOM 1053 CZ TYR A 69 5.624 -10.351 -0.382 1.00 0.00 C ATOM 1054 OH TYR A 69 5.847 -9.104 -0.928 1.00 0.00 O ATOM 0 H TYR A 69 3.534 -14.466 -1.423 1.00 0.00 H new ATOM 0 HA TYR A 69 3.992 -15.944 0.289 1.00 0.00 H new ATOM 0 HB2 TYR A 69 4.709 -14.140 2.391 1.00 0.00 H new ATOM 0 HB3 TYR A 69 5.797 -14.860 1.222 1.00 0.00 H new ATOM 0 HD1 TYR A 69 6.338 -13.634 -0.916 1.00 0.00 H new ATOM 0 HD2 TYR A 69 4.043 -11.835 2.236 1.00 0.00 H new ATOM 0 HE1 TYR A 69 6.749 -11.391 -1.893 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.447 -9.597 1.254 1.00 0.00 H new ATOM 0 HH TYR A 69 5.224 -8.458 -0.534 1.00 0.00 H new ATOM 1064 N PRO A 70 2.856 -15.965 2.637 1.00 0.00 N ATOM 1065 CA PRO A 70 1.864 -16.254 3.695 1.00 0.00 C ATOM 1066 C PRO A 70 1.669 -15.020 4.574 1.00 0.00 C ATOM 1067 O PRO A 70 0.842 -15.005 5.463 1.00 0.00 O ATOM 1068 CB PRO A 70 2.499 -17.402 4.480 1.00 0.00 C ATOM 1069 CG PRO A 70 3.966 -17.272 4.228 1.00 0.00 C ATOM 1070 CD PRO A 70 4.118 -16.685 2.850 1.00 0.00 C ATOM 0 HA PRO A 70 0.878 -16.514 3.311 1.00 0.00 H new ATOM 0 HB2 PRO A 70 2.272 -17.327 5.544 1.00 0.00 H new ATOM 0 HB3 PRO A 70 2.124 -18.368 4.142 1.00 0.00 H new ATOM 0 HG2 PRO A 70 4.432 -16.630 4.976 1.00 0.00 H new ATOM 0 HG3 PRO A 70 4.457 -18.243 4.291 1.00 0.00 H new ATOM 0 HD2 PRO A 70 4.976 -16.015 2.793 1.00 0.00 H new ATOM 0 HD3 PRO A 70 4.268 -17.460 2.099 1.00 0.00 H new ATOM 1078 N VAL A 71 2.422 -13.977 4.332 1.00 0.00 N ATOM 1079 CA VAL A 71 2.263 -12.754 5.160 1.00 0.00 C ATOM 1080 C VAL A 71 1.085 -11.941 4.644 1.00 0.00 C ATOM 1081 O VAL A 71 0.063 -11.872 5.285 1.00 0.00 O ATOM 1082 CB VAL A 71 3.576 -11.978 5.031 1.00 0.00 C ATOM 1083 CG1 VAL A 71 3.610 -10.852 6.066 1.00 0.00 C ATOM 1084 CG2 VAL A 71 4.758 -12.918 5.277 1.00 0.00 C ATOM 0 H VAL A 71 3.133 -13.923 3.602 1.00 0.00 H new ATOM 0 HA VAL A 71 2.060 -12.986 6.205 1.00 0.00 H new ATOM 0 HB VAL A 71 3.645 -11.558 4.027 1.00 0.00 H new ATOM 0 HG11 VAL A 71 4.545 -10.300 5.973 1.00 0.00 H new ATOM 0 HG12 VAL A 71 2.772 -10.176 5.896 1.00 0.00 H new ATOM 0 HG13 VAL A 71 3.537 -11.276 7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 71 5.691 -12.362 5.184 1.00 0.00 H new ATOM 0 HG22 VAL A 71 4.685 -13.340 6.280 1.00 0.00 H new ATOM 0 HG23 VAL A 71 4.741 -13.723 4.543 1.00 0.00 H new ATOM 1094 N ALA A 72 1.198 -11.361 3.473 1.00 0.00 N ATOM 1095 CA ALA A 72 0.043 -10.606 2.898 1.00 0.00 C ATOM 1096 C ALA A 72 -1.209 -11.398 3.208 1.00 0.00 C ATOM 1097 O ALA A 72 -2.254 -10.874 3.536 1.00 0.00 O ATOM 1098 CB ALA A 72 0.300 -10.641 1.409 1.00 0.00 C ATOM 0 H ALA A 72 2.037 -11.378 2.893 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.068 -9.591 3.280 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.497 -10.110 0.890 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.255 -10.162 1.193 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.328 -11.676 1.069 1.00 0.00 H new ATOM 1104 N ASP A 73 -1.062 -12.687 3.134 1.00 0.00 N ATOM 1105 CA ASP A 73 -2.179 -13.592 3.451 1.00 0.00 C ATOM 1106 C ASP A 73 -2.595 -13.373 4.901 1.00 0.00 C ATOM 1107 O ASP A 73 -3.736 -13.098 5.213 1.00 0.00 O ATOM 1108 CB ASP A 73 -1.561 -14.968 3.313 1.00 0.00 C ATOM 1109 CG ASP A 73 -1.592 -15.408 1.849 1.00 0.00 C ATOM 1110 OD1 ASP A 73 -2.126 -14.667 1.040 1.00 0.00 O ATOM 1111 OD2 ASP A 73 -1.084 -16.479 1.561 1.00 0.00 O ATOM 0 H ASP A 73 -0.197 -13.154 2.862 1.00 0.00 H new ATOM 0 HA ASP A 73 -3.055 -13.445 2.819 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -0.533 -14.953 3.675 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -2.105 -15.684 3.929 1.00 0.00 H new ATOM 1116 N ILE A 74 -1.642 -13.491 5.783 1.00 0.00 N ATOM 1117 CA ILE A 74 -1.911 -13.294 7.234 1.00 0.00 C ATOM 1118 C ILE A 74 -2.268 -11.831 7.484 1.00 0.00 C ATOM 1119 O ILE A 74 -3.192 -11.514 8.210 1.00 0.00 O ATOM 1120 CB ILE A 74 -0.600 -13.660 7.932 1.00 0.00 C ATOM 1121 CG1 ILE A 74 -0.465 -15.183 7.988 1.00 0.00 C ATOM 1122 CG2 ILE A 74 -0.597 -13.096 9.353 1.00 0.00 C ATOM 1123 CD1 ILE A 74 1.016 -15.570 7.959 1.00 0.00 C ATOM 0 H ILE A 74 -0.674 -13.719 5.556 1.00 0.00 H new ATOM 0 HA ILE A 74 -2.740 -13.899 7.600 1.00 0.00 H new ATOM 0 HB ILE A 74 0.237 -13.237 7.376 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.934 -15.566 8.894 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -0.986 -15.635 7.144 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.338 -13.359 9.847 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.694 -12.011 9.314 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -1.433 -13.515 9.913 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.109 -16.655 7.999 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.471 -15.200 7.040 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.524 -15.130 8.817 1.00 0.00 H new ATOM 1135 N LEU A 75 -1.552 -10.940 6.862 1.00 0.00 N ATOM 1136 CA LEU A 75 -1.851 -9.498 7.028 1.00 0.00 C ATOM 1137 C LEU A 75 -3.348 -9.285 6.816 1.00 0.00 C ATOM 1138 O LEU A 75 -3.933 -8.337 7.300 1.00 0.00 O ATOM 1139 CB LEU A 75 -1.035 -8.818 5.928 1.00 0.00 C ATOM 1140 CG LEU A 75 -0.545 -7.454 6.411 1.00 0.00 C ATOM 1141 CD1 LEU A 75 0.270 -7.628 7.695 1.00 0.00 C ATOM 1142 CD2 LEU A 75 0.336 -6.827 5.325 1.00 0.00 C ATOM 0 H LEU A 75 -0.769 -11.152 6.243 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.602 -9.103 8.013 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.185 -9.443 5.654 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.644 -8.699 5.032 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.398 -6.806 6.613 1.00 0.00 H new ATOM 0 HD11 LEU A 75 0.619 -6.654 8.039 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.355 -8.082 8.464 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.127 -8.272 7.498 1.00 0.00 H new ATOM 0 HD21 LEU A 75 0.690 -5.853 5.661 1.00 0.00 H new ATOM 0 HD22 LEU A 75 1.190 -7.476 5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.245 -6.706 4.410 1.00 0.00 H new ATOM 1154 N ALA A 76 -3.968 -10.179 6.093 1.00 0.00 N ATOM 1155 CA ALA A 76 -5.424 -10.067 5.835 1.00 0.00 C ATOM 1156 C ALA A 76 -6.218 -10.776 6.937 1.00 0.00 C ATOM 1157 O ALA A 76 -7.325 -10.392 7.260 1.00 0.00 O ATOM 1158 CB ALA A 76 -5.639 -10.765 4.491 1.00 0.00 C ATOM 0 H ALA A 76 -3.518 -10.990 5.667 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.761 -9.030 5.820 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -6.696 -10.726 4.226 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.053 -10.262 3.722 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.322 -11.805 4.566 1.00 0.00 H new ATOM 1164 N GLU A 77 -5.670 -11.816 7.510 1.00 0.00 N ATOM 1165 CA GLU A 77 -6.409 -12.547 8.579 1.00 0.00 C ATOM 1166 C GLU A 77 -6.729 -11.610 9.751 1.00 0.00 C ATOM 1167 O GLU A 77 -7.688 -11.811 10.469 1.00 0.00 O ATOM 1168 CB GLU A 77 -5.479 -13.692 9.008 1.00 0.00 C ATOM 1169 CG GLU A 77 -4.424 -13.182 9.994 1.00 0.00 C ATOM 1170 CD GLU A 77 -4.752 -13.691 11.399 1.00 0.00 C ATOM 1171 OE1 GLU A 77 -4.527 -14.864 11.651 1.00 0.00 O ATOM 1172 OE2 GLU A 77 -5.224 -12.900 12.199 1.00 0.00 O ATOM 0 H GLU A 77 -4.748 -12.188 7.285 1.00 0.00 H new ATOM 0 HA GLU A 77 -7.368 -12.929 8.229 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -6.062 -14.489 9.469 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -4.991 -14.120 8.132 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.434 -13.525 9.693 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.400 -12.092 9.987 1.00 0.00 H new ATOM 1179 N ARG A 78 -5.946 -10.581 9.946 1.00 0.00 N ATOM 1180 CA ARG A 78 -6.224 -9.637 11.062 1.00 0.00 C ATOM 1181 C ARG A 78 -6.274 -8.199 10.538 1.00 0.00 C ATOM 1182 O ARG A 78 -6.973 -7.358 11.069 1.00 0.00 O ATOM 1183 CB ARG A 78 -5.071 -9.811 12.050 1.00 0.00 C ATOM 1184 CG ARG A 78 -3.742 -9.533 11.348 1.00 0.00 C ATOM 1185 CD ARG A 78 -2.602 -9.654 12.360 1.00 0.00 C ATOM 1186 NE ARG A 78 -1.402 -9.998 11.549 1.00 0.00 N ATOM 1187 CZ ARG A 78 -0.226 -10.042 12.113 1.00 0.00 C ATOM 1188 NH1 ARG A 78 -0.013 -10.847 13.116 1.00 0.00 N ATOM 1189 NH2 ARG A 78 0.740 -9.282 11.673 1.00 0.00 N ATOM 0 H ARG A 78 -5.128 -10.356 9.380 1.00 0.00 H new ATOM 0 HA ARG A 78 -7.186 -9.839 11.534 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -5.197 -9.132 12.893 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.075 -10.824 12.453 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.595 -10.239 10.531 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -3.751 -8.535 10.910 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -2.456 -8.721 12.904 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.812 -10.425 13.101 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.499 -10.199 10.554 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.766 -11.443 13.460 1.00 0.00 H new ATOM 0 HH12 ARG A 78 0.906 -10.881 13.556 1.00 0.00 H new ATOM 0 HH21 ARG A 78 0.576 -8.653 10.887 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.659 -9.318 12.115 1.00 0.00 H new ATOM 1203 N ASN A 79 -5.548 -7.918 9.493 1.00 0.00 N ATOM 1204 CA ASN A 79 -5.556 -6.543 8.913 1.00 0.00 C ATOM 1205 C ASN A 79 -5.238 -5.489 9.980 1.00 0.00 C ATOM 1206 O ASN A 79 -6.090 -5.085 10.746 1.00 0.00 O ATOM 1207 CB ASN A 79 -6.973 -6.330 8.362 1.00 0.00 C ATOM 1208 CG ASN A 79 -7.577 -7.662 7.904 1.00 0.00 C ATOM 1209 OD1 ASN A 79 -8.179 -8.370 8.686 1.00 0.00 O ATOM 1210 ND2 ASN A 79 -7.439 -8.033 6.661 1.00 0.00 N ATOM 0 H ASN A 79 -4.945 -8.585 9.011 1.00 0.00 H new ATOM 0 HA ASN A 79 -4.797 -6.441 8.137 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -7.604 -5.882 9.130 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -6.943 -5.631 7.526 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -7.837 -8.918 6.346 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -6.933 -7.438 6.004 1.00 0.00 H new ATOM 1217 N VAL A 80 -4.019 -5.025 10.010 1.00 0.00 N ATOM 1218 CA VAL A 80 -3.627 -3.971 10.997 1.00 0.00 C ATOM 1219 C VAL A 80 -3.754 -2.609 10.294 1.00 0.00 C ATOM 1220 O VAL A 80 -4.240 -2.555 9.186 1.00 0.00 O ATOM 1221 CB VAL A 80 -2.166 -4.303 11.365 1.00 0.00 C ATOM 1222 CG1 VAL A 80 -1.976 -5.822 11.431 1.00 0.00 C ATOM 1223 CG2 VAL A 80 -1.215 -3.722 10.311 1.00 0.00 C ATOM 0 H VAL A 80 -3.270 -5.331 9.389 1.00 0.00 H new ATOM 0 HA VAL A 80 -4.243 -3.936 11.895 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.942 -3.865 12.338 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.942 -6.048 11.691 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.640 -6.239 12.188 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -2.210 -6.260 10.461 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -0.186 -3.961 10.578 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.446 -4.152 9.336 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.337 -2.640 10.268 1.00 0.00 H new ATOM 1233 N PRO A 81 -3.310 -1.543 10.910 1.00 0.00 N ATOM 1234 CA PRO A 81 -3.416 -0.233 10.231 1.00 0.00 C ATOM 1235 C PRO A 81 -2.602 -0.299 8.951 1.00 0.00 C ATOM 1236 O PRO A 81 -1.404 -0.500 8.972 1.00 0.00 O ATOM 1237 CB PRO A 81 -2.858 0.755 11.248 1.00 0.00 C ATOM 1238 CG PRO A 81 -1.996 -0.076 12.140 1.00 0.00 C ATOM 1239 CD PRO A 81 -2.665 -1.426 12.221 1.00 0.00 C ATOM 0 HA PRO A 81 -4.425 0.058 9.937 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.283 1.543 10.762 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -3.656 1.242 11.808 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.987 -0.164 11.737 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.907 0.376 13.128 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -1.944 -2.226 12.391 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -3.389 -1.471 13.034 1.00 0.00 H new ATOM 1247 N PHE A 82 -3.257 -0.189 7.831 1.00 0.00 N ATOM 1248 CA PHE A 82 -2.535 -0.316 6.539 1.00 0.00 C ATOM 1249 C PHE A 82 -3.472 -0.163 5.336 1.00 0.00 C ATOM 1250 O PHE A 82 -4.432 0.582 5.352 1.00 0.00 O ATOM 1251 CB PHE A 82 -2.008 -1.757 6.573 1.00 0.00 C ATOM 1252 CG PHE A 82 -3.147 -2.762 6.381 1.00 0.00 C ATOM 1253 CD1 PHE A 82 -4.494 -2.377 6.525 1.00 0.00 C ATOM 1254 CD2 PHE A 82 -2.846 -4.094 6.071 1.00 0.00 C ATOM 1255 CE1 PHE A 82 -5.522 -3.314 6.358 1.00 0.00 C ATOM 1256 CE2 PHE A 82 -3.881 -5.032 5.910 1.00 0.00 C ATOM 1257 CZ PHE A 82 -5.214 -4.640 6.054 1.00 0.00 C ATOM 0 H PHE A 82 -4.260 -0.017 7.755 1.00 0.00 H new ATOM 0 HA PHE A 82 -1.768 0.451 6.430 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -1.262 -1.894 5.790 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.510 -1.944 7.524 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -4.736 -1.352 6.766 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -1.817 -4.401 5.955 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.553 -3.010 6.465 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.645 -6.059 5.674 1.00 0.00 H new ATOM 0 HZ PHE A 82 -6.006 -5.364 5.930 1.00 0.00 H new ATOM 1267 N ILE A 83 -3.194 -0.923 4.314 1.00 0.00 N ATOM 1268 CA ILE A 83 -4.027 -0.936 3.091 1.00 0.00 C ATOM 1269 C ILE A 83 -3.540 -2.098 2.241 1.00 0.00 C ATOM 1270 O ILE A 83 -2.404 -2.499 2.367 1.00 0.00 O ATOM 1271 CB ILE A 83 -3.781 0.412 2.430 1.00 0.00 C ATOM 1272 CG1 ILE A 83 -5.017 1.296 2.596 1.00 0.00 C ATOM 1273 CG2 ILE A 83 -3.487 0.245 0.932 1.00 0.00 C ATOM 1274 CD1 ILE A 83 -4.595 2.680 3.089 1.00 0.00 C ATOM 0 H ILE A 83 -2.395 -1.556 4.281 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.095 -1.069 3.262 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.918 0.874 2.909 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.545 1.382 1.646 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -5.709 0.842 3.305 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.315 1.224 0.484 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.600 -0.375 0.802 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -4.337 -0.233 0.445 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.477 3.309 3.207 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -4.086 2.585 4.048 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -3.920 3.134 2.364 1.00 0.00 H new ATOM 1286 N PHE A 84 -4.368 -2.655 1.404 1.00 0.00 N ATOM 1287 CA PHE A 84 -3.890 -3.821 0.593 1.00 0.00 C ATOM 1288 C PHE A 84 -4.669 -3.979 -0.718 1.00 0.00 C ATOM 1289 O PHE A 84 -5.748 -3.440 -0.915 1.00 0.00 O ATOM 1290 CB PHE A 84 -4.147 -5.024 1.507 1.00 0.00 C ATOM 1291 CG PHE A 84 -3.459 -6.278 0.985 1.00 0.00 C ATOM 1292 CD1 PHE A 84 -3.986 -6.955 -0.124 1.00 0.00 C ATOM 1293 CD2 PHE A 84 -2.309 -6.782 1.621 1.00 0.00 C ATOM 1294 CE1 PHE A 84 -3.372 -8.119 -0.600 1.00 0.00 C ATOM 1295 CE2 PHE A 84 -1.698 -7.947 1.141 1.00 0.00 C ATOM 1296 CZ PHE A 84 -2.230 -8.615 0.030 1.00 0.00 C ATOM 0 H PHE A 84 -5.333 -2.367 1.244 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.847 -3.706 0.297 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.788 -4.802 2.512 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -5.220 -5.201 1.584 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.871 -6.576 -0.614 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -1.898 -6.270 2.479 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -3.783 -8.634 -1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -0.814 -8.332 1.628 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.757 -9.513 -0.338 1.00 0.00 H new ATOM 1306 N ALA A 85 -4.127 -4.749 -1.614 1.00 0.00 N ATOM 1307 CA ALA A 85 -4.821 -4.993 -2.898 1.00 0.00 C ATOM 1308 C ALA A 85 -4.479 -6.399 -3.393 1.00 0.00 C ATOM 1309 O ALA A 85 -3.398 -6.902 -3.157 1.00 0.00 O ATOM 1310 CB ALA A 85 -4.300 -3.935 -3.868 1.00 0.00 C ATOM 0 H ALA A 85 -3.229 -5.221 -1.509 1.00 0.00 H new ATOM 0 HA ALA A 85 -5.905 -4.928 -2.802 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -4.778 -4.064 -4.839 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -4.528 -2.942 -3.480 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -3.221 -4.042 -3.978 1.00 0.00 H new ATOM 1316 N THR A 86 -5.387 -7.044 -4.065 1.00 0.00 N ATOM 1317 CA THR A 86 -5.102 -8.423 -4.558 1.00 0.00 C ATOM 1318 C THR A 86 -5.881 -8.695 -5.847 1.00 0.00 C ATOM 1319 O THR A 86 -6.841 -8.016 -6.152 1.00 0.00 O ATOM 1320 CB THR A 86 -5.583 -9.366 -3.446 1.00 0.00 C ATOM 1321 OG1 THR A 86 -5.937 -10.618 -4.019 1.00 0.00 O ATOM 1322 CG2 THR A 86 -6.803 -8.769 -2.735 1.00 0.00 C ATOM 0 H THR A 86 -6.312 -6.681 -4.295 1.00 0.00 H new ATOM 0 HA THR A 86 -4.044 -8.561 -4.780 1.00 0.00 H new ATOM 0 HB THR A 86 -4.782 -9.501 -2.719 1.00 0.00 H new ATOM 0 HG1 THR A 86 -6.646 -11.033 -3.485 1.00 0.00 H new ATOM 0 HG21 THR A 86 -7.134 -9.448 -1.949 1.00 0.00 H new ATOM 0 HG22 THR A 86 -6.534 -7.808 -2.296 1.00 0.00 H new ATOM 0 HG23 THR A 86 -7.609 -8.626 -3.454 1.00 0.00 H new ATOM 1330 N GLY A 87 -5.488 -9.691 -6.595 1.00 0.00 N ATOM 1331 CA GLY A 87 -6.224 -10.014 -7.850 1.00 0.00 C ATOM 1332 C GLY A 87 -7.610 -10.533 -7.475 1.00 0.00 C ATOM 1333 O GLY A 87 -7.955 -11.668 -7.739 1.00 0.00 O ATOM 0 H GLY A 87 -4.691 -10.294 -6.391 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.308 -9.128 -8.479 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.681 -10.764 -8.426 1.00 0.00 H new ATOM 1337 N TYR A 88 -8.398 -9.711 -6.839 1.00 0.00 N ATOM 1338 CA TYR A 88 -9.755 -10.149 -6.419 1.00 0.00 C ATOM 1339 C TYR A 88 -10.530 -8.958 -5.833 1.00 0.00 C ATOM 1340 O TYR A 88 -11.726 -8.838 -6.015 1.00 0.00 O ATOM 1341 CB TYR A 88 -9.486 -11.237 -5.364 1.00 0.00 C ATOM 1342 CG TYR A 88 -10.503 -11.170 -4.248 1.00 0.00 C ATOM 1343 CD1 TYR A 88 -11.869 -11.219 -4.543 1.00 0.00 C ATOM 1344 CD2 TYR A 88 -10.075 -11.056 -2.921 1.00 0.00 C ATOM 1345 CE1 TYR A 88 -12.810 -11.155 -3.509 1.00 0.00 C ATOM 1346 CE2 TYR A 88 -11.015 -10.993 -1.887 1.00 0.00 C ATOM 1347 CZ TYR A 88 -12.382 -11.043 -2.180 1.00 0.00 C ATOM 1348 OH TYR A 88 -13.308 -10.981 -1.159 1.00 0.00 O ATOM 0 H TYR A 88 -8.158 -8.751 -6.592 1.00 0.00 H new ATOM 0 HA TYR A 88 -10.365 -10.528 -7.239 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.519 -12.220 -5.833 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.483 -11.113 -4.955 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -12.198 -11.306 -5.568 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -9.020 -11.017 -2.695 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -13.865 -11.192 -3.736 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -10.685 -10.906 -0.862 1.00 0.00 H new ATOM 0 HH TYR A 88 -13.074 -11.633 -0.465 1.00 0.00 H new ATOM 1358 N GLY A 89 -9.863 -8.074 -5.137 1.00 0.00 N ATOM 1359 CA GLY A 89 -10.577 -6.901 -4.557 1.00 0.00 C ATOM 1360 C GLY A 89 -10.510 -6.944 -3.025 1.00 0.00 C ATOM 1361 O GLY A 89 -11.229 -6.237 -2.347 1.00 0.00 O ATOM 0 H GLY A 89 -8.862 -8.114 -4.947 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -10.129 -5.977 -4.922 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -11.617 -6.902 -4.883 1.00 0.00 H new ATOM 1365 N SER A 90 -9.655 -7.763 -2.472 1.00 0.00 N ATOM 1366 CA SER A 90 -9.553 -7.841 -0.982 1.00 0.00 C ATOM 1367 C SER A 90 -10.819 -8.471 -0.398 1.00 0.00 C ATOM 1368 O SER A 90 -11.835 -8.571 -1.057 1.00 0.00 O ATOM 1369 CB SER A 90 -9.415 -6.392 -0.511 1.00 0.00 C ATOM 1370 OG SER A 90 -8.873 -5.605 -1.564 1.00 0.00 O ATOM 0 H SER A 90 -9.024 -8.380 -2.984 1.00 0.00 H new ATOM 0 HA SER A 90 -8.711 -8.455 -0.661 1.00 0.00 H new ATOM 0 HB2 SER A 90 -10.387 -6.000 -0.212 1.00 0.00 H new ATOM 0 HB3 SER A 90 -8.769 -6.342 0.365 1.00 0.00 H new ATOM 0 HG SER A 90 -8.491 -4.782 -1.194 1.00 0.00 H new ATOM 1376 N LYS A 91 -10.772 -8.880 0.839 1.00 0.00 N ATOM 1377 CA LYS A 91 -11.978 -9.482 1.472 1.00 0.00 C ATOM 1378 C LYS A 91 -12.706 -8.397 2.257 1.00 0.00 C ATOM 1379 O LYS A 91 -13.889 -8.483 2.522 1.00 0.00 O ATOM 1380 CB LYS A 91 -11.500 -10.591 2.435 1.00 0.00 C ATOM 1381 CG LYS A 91 -10.009 -10.903 2.252 1.00 0.00 C ATOM 1382 CD LYS A 91 -9.625 -12.078 3.152 1.00 0.00 C ATOM 1383 CE LYS A 91 -9.410 -11.572 4.581 1.00 0.00 C ATOM 1384 NZ LYS A 91 -10.516 -12.177 5.374 1.00 0.00 N ATOM 0 H LYS A 91 -9.949 -8.823 1.440 1.00 0.00 H new ATOM 0 HA LYS A 91 -12.651 -9.900 0.723 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.683 -10.282 3.464 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.084 -11.496 2.265 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -9.802 -11.145 1.210 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.409 -10.028 2.501 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.409 -12.835 3.136 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -8.717 -12.553 2.782 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -8.436 -11.876 4.965 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.443 -10.483 4.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.437 -11.876 6.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.430 -11.864 4.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.455 -13.214 5.321 1.00 0.00 H new ATOM 1398 N GLY A 92 -11.992 -7.374 2.632 1.00 0.00 N ATOM 1399 CA GLY A 92 -12.611 -6.268 3.404 1.00 0.00 C ATOM 1400 C GLY A 92 -11.730 -5.938 4.608 1.00 0.00 C ATOM 1401 O GLY A 92 -12.226 -5.633 5.674 1.00 0.00 O ATOM 0 H GLY A 92 -10.998 -7.258 2.434 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -12.727 -5.388 2.771 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -13.609 -6.555 3.737 1.00 0.00 H new ATOM 1405 N LEU A 93 -10.426 -6.009 4.444 1.00 0.00 N ATOM 1406 CA LEU A 93 -9.502 -5.703 5.585 1.00 0.00 C ATOM 1407 C LEU A 93 -10.114 -4.638 6.507 1.00 0.00 C ATOM 1408 O LEU A 93 -10.591 -3.610 6.071 1.00 0.00 O ATOM 1409 CB LEU A 93 -8.148 -5.221 5.004 1.00 0.00 C ATOM 1410 CG LEU A 93 -8.257 -4.529 3.628 1.00 0.00 C ATOM 1411 CD1 LEU A 93 -8.270 -5.573 2.511 1.00 0.00 C ATOM 1412 CD2 LEU A 93 -9.507 -3.650 3.528 1.00 0.00 C ATOM 0 H LEU A 93 -9.964 -6.265 3.571 1.00 0.00 H new ATOM 0 HA LEU A 93 -9.344 -6.599 6.185 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.689 -4.529 5.710 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.479 -6.077 4.915 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.385 -3.885 3.518 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.347 -5.072 1.546 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -7.349 -6.154 2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.124 -6.238 2.644 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.545 -3.182 2.544 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.396 -4.264 3.672 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.471 -2.878 4.296 1.00 0.00 H new ATOM 1424 N ASP A 94 -10.127 -4.901 7.783 1.00 0.00 N ATOM 1425 CA ASP A 94 -10.736 -3.930 8.746 1.00 0.00 C ATOM 1426 C ASP A 94 -9.662 -3.256 9.596 1.00 0.00 C ATOM 1427 O ASP A 94 -9.171 -3.824 10.551 1.00 0.00 O ATOM 1428 CB ASP A 94 -11.658 -4.774 9.628 1.00 0.00 C ATOM 1429 CG ASP A 94 -10.824 -5.777 10.429 1.00 0.00 C ATOM 1430 OD1 ASP A 94 -9.791 -6.192 9.931 1.00 0.00 O ATOM 1431 OD2 ASP A 94 -11.233 -6.113 11.529 1.00 0.00 O ATOM 0 H ASP A 94 -9.743 -5.746 8.206 1.00 0.00 H new ATOM 0 HA ASP A 94 -11.270 -3.132 8.230 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -12.220 -4.130 10.305 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -12.386 -5.301 9.011 1.00 0.00 H new ATOM 1436 N THR A 95 -9.293 -2.052 9.267 1.00 0.00 N ATOM 1437 CA THR A 95 -8.249 -1.364 10.070 1.00 0.00 C ATOM 1438 C THR A 95 -8.542 0.141 10.150 1.00 0.00 C ATOM 1439 O THR A 95 -9.563 0.609 9.685 1.00 0.00 O ATOM 1440 CB THR A 95 -6.941 -1.659 9.330 1.00 0.00 C ATOM 1441 OG1 THR A 95 -6.815 -0.800 8.206 1.00 0.00 O ATOM 1442 CG2 THR A 95 -6.941 -3.121 8.866 1.00 0.00 C ATOM 0 H THR A 95 -9.666 -1.518 8.482 1.00 0.00 H new ATOM 0 HA THR A 95 -8.207 -1.709 11.103 1.00 0.00 H new ATOM 0 HB THR A 95 -6.100 -1.488 10.001 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.462 -1.307 7.445 1.00 0.00 H new ATOM 0 HG21 THR A 95 -6.011 -3.335 8.339 1.00 0.00 H new ATOM 0 HG22 THR A 95 -7.027 -3.778 9.732 1.00 0.00 H new ATOM 0 HG23 THR A 95 -7.785 -3.291 8.197 1.00 0.00 H new ATOM 1450 N ARG A 96 -7.667 0.896 10.754 1.00 0.00 N ATOM 1451 CA ARG A 96 -7.905 2.368 10.889 1.00 0.00 C ATOM 1452 C ARG A 96 -8.149 3.024 9.527 1.00 0.00 C ATOM 1453 O ARG A 96 -8.587 4.154 9.446 1.00 0.00 O ATOM 1454 CB ARG A 96 -6.623 2.919 11.517 1.00 0.00 C ATOM 1455 CG ARG A 96 -6.753 2.907 13.043 1.00 0.00 C ATOM 1456 CD ARG A 96 -6.227 1.580 13.598 1.00 0.00 C ATOM 1457 NE ARG A 96 -6.956 1.383 14.882 1.00 0.00 N ATOM 1458 CZ ARG A 96 -6.861 0.245 15.517 1.00 0.00 C ATOM 1459 NH1 ARG A 96 -7.186 -0.867 14.914 1.00 0.00 N ATOM 1460 NH2 ARG A 96 -6.439 0.220 16.752 1.00 0.00 N ATOM 0 H ARG A 96 -6.795 0.560 11.162 1.00 0.00 H new ATOM 0 HA ARG A 96 -8.790 2.574 11.491 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -5.768 2.317 11.210 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -6.441 3.934 11.165 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -6.193 3.738 13.471 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -7.796 3.044 13.329 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -6.418 0.760 12.906 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.149 1.618 13.758 1.00 0.00 H new ATOM 0 HE ARG A 96 -7.528 2.135 15.265 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -7.514 -0.847 13.948 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -7.112 -1.756 15.409 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.183 1.089 17.221 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -6.365 -0.668 17.248 1.00 0.00 H new ATOM 1474 N TYR A 97 -7.856 2.342 8.458 1.00 0.00 N ATOM 1475 CA TYR A 97 -8.055 2.951 7.114 1.00 0.00 C ATOM 1476 C TYR A 97 -9.520 2.846 6.664 1.00 0.00 C ATOM 1477 O TYR A 97 -10.108 3.833 6.269 1.00 0.00 O ATOM 1478 CB TYR A 97 -7.100 2.175 6.218 1.00 0.00 C ATOM 1479 CG TYR A 97 -5.707 2.666 6.505 1.00 0.00 C ATOM 1480 CD1 TYR A 97 -4.978 2.110 7.558 1.00 0.00 C ATOM 1481 CD2 TYR A 97 -5.152 3.691 5.731 1.00 0.00 C ATOM 1482 CE1 TYR A 97 -3.689 2.574 7.839 1.00 0.00 C ATOM 1483 CE2 TYR A 97 -3.864 4.158 6.012 1.00 0.00 C ATOM 1484 CZ TYR A 97 -3.132 3.599 7.066 1.00 0.00 C ATOM 1485 OH TYR A 97 -1.862 4.060 7.345 1.00 0.00 O ATOM 0 H TYR A 97 -7.488 1.391 8.455 1.00 0.00 H new ATOM 0 HA TYR A 97 -7.846 4.021 7.091 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -7.177 1.105 6.412 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -7.351 2.327 5.168 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -5.410 1.321 8.156 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -5.718 4.121 4.918 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -3.124 2.142 8.652 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -3.434 4.950 5.416 1.00 0.00 H new ATOM 0 HH TYR A 97 -1.266 3.299 7.507 1.00 0.00 H new ATOM 1495 N SER A 98 -10.118 1.677 6.739 1.00 0.00 N ATOM 1496 CA SER A 98 -11.559 1.510 6.350 1.00 0.00 C ATOM 1497 C SER A 98 -11.744 1.367 4.836 1.00 0.00 C ATOM 1498 O SER A 98 -12.467 2.124 4.219 1.00 0.00 O ATOM 1499 CB SER A 98 -12.284 2.758 6.859 1.00 0.00 C ATOM 1500 OG SER A 98 -11.732 3.142 8.113 1.00 0.00 O ATOM 0 H SER A 98 -9.663 0.821 7.057 1.00 0.00 H new ATOM 0 HA SER A 98 -11.960 0.595 6.786 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.183 3.571 6.140 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.350 2.556 6.964 1.00 0.00 H new ATOM 0 HG SER A 98 -12.192 3.942 8.442 1.00 0.00 H new ATOM 1506 N ASN A 99 -11.144 0.375 4.241 1.00 0.00 N ATOM 1507 CA ASN A 99 -11.344 0.161 2.777 1.00 0.00 C ATOM 1508 C ASN A 99 -11.180 1.462 1.983 1.00 0.00 C ATOM 1509 O ASN A 99 -12.084 2.270 1.906 1.00 0.00 O ATOM 1510 CB ASN A 99 -12.786 -0.322 2.698 1.00 0.00 C ATOM 1511 CG ASN A 99 -12.832 -1.845 2.790 1.00 0.00 C ATOM 1512 OD1 ASN A 99 -13.752 -2.469 2.300 1.00 0.00 O ATOM 1513 ND2 ASN A 99 -11.873 -2.475 3.402 1.00 0.00 N ATOM 0 H ASN A 99 -10.527 -0.295 4.700 1.00 0.00 H new ATOM 0 HA ASN A 99 -10.618 -0.533 2.354 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -13.370 0.117 3.507 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.238 0.008 1.763 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -11.894 -3.492 3.470 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -11.100 -1.952 3.814 1.00 0.00 H new ATOM 1520 N ILE A 100 -10.038 1.663 1.383 1.00 0.00 N ATOM 1521 CA ILE A 100 -9.817 2.908 0.580 1.00 0.00 C ATOM 1522 C ILE A 100 -9.117 2.533 -0.756 1.00 0.00 C ATOM 1523 O ILE A 100 -9.804 2.037 -1.627 1.00 0.00 O ATOM 1524 CB ILE A 100 -9.023 3.849 1.497 1.00 0.00 C ATOM 1525 CG1 ILE A 100 -8.158 3.032 2.474 1.00 0.00 C ATOM 1526 CG2 ILE A 100 -10.010 4.712 2.286 1.00 0.00 C ATOM 1527 CD1 ILE A 100 -8.980 2.603 3.687 1.00 0.00 C ATOM 0 H ILE A 100 -9.246 1.021 1.412 1.00 0.00 H new ATOM 0 HA ILE A 100 -10.730 3.420 0.275 1.00 0.00 H new ATOM 0 HB ILE A 100 -8.369 4.480 0.895 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -7.760 2.153 1.968 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -7.304 3.627 2.798 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -9.460 5.386 2.942 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -10.618 5.295 1.594 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -10.657 4.070 2.885 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -8.352 2.027 4.367 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -9.357 3.487 4.202 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -9.819 1.989 3.359 1.00 0.00 H new ATOM 1539 N PRO A 101 -7.805 2.707 -0.938 1.00 0.00 N ATOM 1540 CA PRO A 101 -7.222 2.273 -2.233 1.00 0.00 C ATOM 1541 C PRO A 101 -7.041 0.756 -2.187 1.00 0.00 C ATOM 1542 O PRO A 101 -5.967 0.244 -2.432 1.00 0.00 O ATOM 1543 CB PRO A 101 -5.859 2.948 -2.278 1.00 0.00 C ATOM 1544 CG PRO A 101 -5.484 3.144 -0.847 1.00 0.00 C ATOM 1545 CD PRO A 101 -6.764 3.284 -0.058 1.00 0.00 C ATOM 0 HA PRO A 101 -7.837 2.527 -3.096 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -5.128 2.329 -2.797 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -5.906 3.899 -2.809 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -4.900 2.298 -0.484 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -4.863 4.032 -0.731 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -6.706 2.751 0.891 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -6.975 4.328 0.175 1.00 0.00 H new ATOM 1553 N LEU A 102 -8.070 0.033 -1.837 1.00 0.00 N ATOM 1554 CA LEU A 102 -7.933 -1.440 -1.734 1.00 0.00 C ATOM 1555 C LEU A 102 -8.651 -2.134 -2.882 1.00 0.00 C ATOM 1556 O LEU A 102 -9.826 -1.928 -3.099 1.00 0.00 O ATOM 1557 CB LEU A 102 -8.583 -1.795 -0.395 1.00 0.00 C ATOM 1558 CG LEU A 102 -7.538 -1.753 0.724 1.00 0.00 C ATOM 1559 CD1 LEU A 102 -6.591 -0.568 0.518 1.00 0.00 C ATOM 1560 CD2 LEU A 102 -8.243 -1.596 2.070 1.00 0.00 C ATOM 0 H LEU A 102 -8.996 0.401 -1.619 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.893 -1.761 -1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.390 -1.095 -0.176 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -9.029 -2.788 -0.450 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.965 -2.680 0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.853 -0.549 1.320 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -6.083 -0.671 -0.441 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -7.162 0.360 0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.501 -1.566 2.868 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -8.818 -0.670 2.074 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -8.914 -2.440 2.230 1.00 0.00 H new ATOM 1572 N LEU A 103 -7.939 -2.970 -3.596 1.00 0.00 N ATOM 1573 CA LEU A 103 -8.542 -3.725 -4.749 1.00 0.00 C ATOM 1574 C LEU A 103 -7.433 -4.215 -5.701 1.00 0.00 C ATOM 1575 O LEU A 103 -6.422 -4.730 -5.268 1.00 0.00 O ATOM 1576 CB LEU A 103 -9.490 -2.749 -5.469 1.00 0.00 C ATOM 1577 CG LEU A 103 -8.800 -1.398 -5.675 1.00 0.00 C ATOM 1578 CD1 LEU A 103 -8.330 -1.280 -7.124 1.00 0.00 C ATOM 1579 CD2 LEU A 103 -9.790 -0.271 -5.375 1.00 0.00 C ATOM 0 H LEU A 103 -6.952 -3.167 -3.430 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.085 -4.606 -4.406 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.788 -3.164 -6.432 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.400 -2.616 -4.884 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.943 -1.324 -5.005 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -7.839 -0.318 -7.270 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -7.627 -2.083 -7.345 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.188 -1.354 -7.792 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.300 0.692 -5.521 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -10.645 -0.349 -6.047 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.131 -0.352 -4.343 1.00 0.00 H new ATOM 1591 N THR A 104 -7.612 -4.068 -6.993 1.00 0.00 N ATOM 1592 CA THR A 104 -6.575 -4.532 -7.952 1.00 0.00 C ATOM 1593 C THR A 104 -6.426 -3.531 -9.104 1.00 0.00 C ATOM 1594 O THR A 104 -7.029 -3.678 -10.149 1.00 0.00 O ATOM 1595 CB THR A 104 -7.097 -5.871 -8.474 1.00 0.00 C ATOM 1596 OG1 THR A 104 -6.352 -6.254 -9.622 1.00 0.00 O ATOM 1597 CG2 THR A 104 -8.575 -5.732 -8.845 1.00 0.00 C ATOM 0 H THR A 104 -8.436 -3.645 -7.420 1.00 0.00 H new ATOM 0 HA THR A 104 -5.594 -4.625 -7.486 1.00 0.00 H new ATOM 0 HB THR A 104 -6.988 -6.631 -7.701 1.00 0.00 H new ATOM 0 HG1 THR A 104 -6.685 -7.113 -9.956 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.948 -6.686 -9.217 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.145 -5.438 -7.964 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.686 -4.972 -9.619 1.00 0.00 H new ATOM 1605 N LYS A 105 -5.627 -2.516 -8.924 1.00 0.00 N ATOM 1606 CA LYS A 105 -5.441 -1.511 -10.011 1.00 0.00 C ATOM 1607 C LYS A 105 -4.020 -0.945 -9.969 1.00 0.00 C ATOM 1608 O LYS A 105 -3.688 -0.162 -9.100 1.00 0.00 O ATOM 1609 CB LYS A 105 -6.460 -0.409 -9.716 1.00 0.00 C ATOM 1610 CG LYS A 105 -7.630 -0.516 -10.697 1.00 0.00 C ATOM 1611 CD LYS A 105 -8.798 -1.247 -10.032 1.00 0.00 C ATOM 1612 CE LYS A 105 -9.907 -1.474 -11.062 1.00 0.00 C ATOM 1613 NZ LYS A 105 -11.072 -1.965 -10.275 1.00 0.00 N ATOM 0 H LYS A 105 -5.095 -2.338 -8.072 1.00 0.00 H new ATOM 0 HA LYS A 105 -5.585 -1.946 -11.000 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -6.822 -0.499 -8.692 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -5.988 0.570 -9.803 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -7.944 0.479 -11.013 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -7.317 -1.051 -11.594 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -8.461 -2.201 -9.627 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -9.178 -0.662 -9.195 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -10.149 -0.552 -11.591 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -9.604 -2.203 -11.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -11.873 -2.143 -10.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -10.815 -2.847 -9.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -11.343 -1.248 -9.572 1.00 0.00 H new ATOM 1627 N PRO A 106 -3.227 -1.361 -10.918 1.00 0.00 N ATOM 1628 CA PRO A 106 -1.825 -0.890 -10.998 1.00 0.00 C ATOM 1629 C PRO A 106 -1.789 0.553 -11.513 1.00 0.00 C ATOM 1630 O PRO A 106 -2.175 0.830 -12.631 1.00 0.00 O ATOM 1631 CB PRO A 106 -1.186 -1.841 -12.005 1.00 0.00 C ATOM 1632 CG PRO A 106 -2.319 -2.330 -12.850 1.00 0.00 C ATOM 1633 CD PRO A 106 -3.560 -2.301 -11.993 1.00 0.00 C ATOM 0 HA PRO A 106 -1.311 -0.890 -10.037 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -0.436 -1.330 -12.609 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -0.683 -2.667 -11.503 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -2.444 -1.698 -13.729 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -2.123 -3.340 -13.209 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -4.429 -1.967 -12.560 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -3.797 -3.290 -11.600 1.00 0.00 H new ATOM 1641 N PHE A 107 -1.337 1.474 -10.707 1.00 0.00 N ATOM 1642 CA PHE A 107 -1.291 2.894 -11.161 1.00 0.00 C ATOM 1643 C PHE A 107 -2.656 3.301 -11.722 1.00 0.00 C ATOM 1644 O PHE A 107 -2.829 3.438 -12.916 1.00 0.00 O ATOM 1645 CB PHE A 107 -0.229 2.920 -12.261 1.00 0.00 C ATOM 1646 CG PHE A 107 0.654 4.134 -12.089 1.00 0.00 C ATOM 1647 CD1 PHE A 107 0.165 5.275 -11.442 1.00 0.00 C ATOM 1648 CD2 PHE A 107 1.965 4.117 -12.580 1.00 0.00 C ATOM 1649 CE1 PHE A 107 0.987 6.397 -11.285 1.00 0.00 C ATOM 1650 CE2 PHE A 107 2.786 5.239 -12.422 1.00 0.00 C ATOM 1651 CZ PHE A 107 2.298 6.379 -11.776 1.00 0.00 C ATOM 0 H PHE A 107 -0.999 1.307 -9.759 1.00 0.00 H new ATOM 0 HA PHE A 107 -1.055 3.586 -10.353 1.00 0.00 H new ATOM 0 HB2 PHE A 107 0.373 2.012 -12.220 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -0.707 2.942 -13.240 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -0.847 5.290 -11.064 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.343 3.238 -13.081 1.00 0.00 H new ATOM 0 HE1 PHE A 107 0.610 7.277 -10.785 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.798 5.224 -12.799 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.932 7.245 -11.656 1.00 0.00 H new ATOM 1661 N LEU A 108 -3.630 3.484 -10.872 1.00 0.00 N ATOM 1662 CA LEU A 108 -4.983 3.868 -11.366 1.00 0.00 C ATOM 1663 C LEU A 108 -5.864 4.323 -10.193 1.00 0.00 C ATOM 1664 O LEU A 108 -5.380 4.876 -9.221 1.00 0.00 O ATOM 1665 CB LEU A 108 -5.523 2.586 -12.006 1.00 0.00 C ATOM 1666 CG LEU A 108 -5.666 2.788 -13.515 1.00 0.00 C ATOM 1667 CD1 LEU A 108 -5.394 1.465 -14.233 1.00 0.00 C ATOM 1668 CD2 LEU A 108 -7.085 3.260 -13.837 1.00 0.00 C ATOM 0 H LEU A 108 -3.548 3.385 -9.860 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.964 4.699 -12.071 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -4.849 1.754 -11.802 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.488 2.328 -11.570 1.00 0.00 H new ATOM 0 HG LEU A 108 -4.950 3.539 -13.850 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -5.496 1.607 -15.309 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -4.382 1.129 -14.005 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -6.110 0.715 -13.897 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.185 3.404 -14.913 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.802 2.511 -13.502 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.280 4.203 -13.325 1.00 0.00 H new ATOM 1680 N ASP A 109 -7.152 4.104 -10.273 1.00 0.00 N ATOM 1681 CA ASP A 109 -8.044 4.529 -9.159 1.00 0.00 C ATOM 1682 C ASP A 109 -7.395 4.189 -7.815 1.00 0.00 C ATOM 1683 O ASP A 109 -7.646 4.831 -6.818 1.00 0.00 O ATOM 1684 CB ASP A 109 -9.337 3.737 -9.353 1.00 0.00 C ATOM 1685 CG ASP A 109 -10.486 4.707 -9.635 1.00 0.00 C ATOM 1686 OD1 ASP A 109 -10.449 5.353 -10.669 1.00 0.00 O ATOM 1687 OD2 ASP A 109 -11.382 4.788 -8.811 1.00 0.00 O ATOM 0 H ASP A 109 -7.620 3.652 -11.058 1.00 0.00 H new ATOM 0 HA ASP A 109 -8.230 5.603 -9.162 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -9.227 3.035 -10.180 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -9.553 3.148 -8.462 1.00 0.00 H new ATOM 1692 N SER A 110 -6.551 3.194 -7.782 1.00 0.00 N ATOM 1693 CA SER A 110 -5.882 2.836 -6.501 1.00 0.00 C ATOM 1694 C SER A 110 -5.382 4.107 -5.811 1.00 0.00 C ATOM 1695 O SER A 110 -5.901 4.515 -4.791 1.00 0.00 O ATOM 1696 CB SER A 110 -4.711 1.939 -6.900 1.00 0.00 C ATOM 1697 OG SER A 110 -4.676 0.805 -6.043 1.00 0.00 O ATOM 0 H SER A 110 -6.297 2.616 -8.583 1.00 0.00 H new ATOM 0 HA SER A 110 -6.552 2.333 -5.804 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.817 1.622 -7.938 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.774 2.492 -6.830 1.00 0.00 H new ATOM 0 HG SER A 110 -3.927 0.226 -6.297 1.00 0.00 H new ATOM 1703 N GLU A 111 -4.389 4.746 -6.368 1.00 0.00 N ATOM 1704 CA GLU A 111 -3.872 6.000 -5.748 1.00 0.00 C ATOM 1705 C GLU A 111 -5.022 6.986 -5.555 1.00 0.00 C ATOM 1706 O GLU A 111 -5.192 7.570 -4.501 1.00 0.00 O ATOM 1707 CB GLU A 111 -2.865 6.554 -6.754 1.00 0.00 C ATOM 1708 CG GLU A 111 -1.468 6.034 -6.418 1.00 0.00 C ATOM 1709 CD GLU A 111 -1.491 4.505 -6.362 1.00 0.00 C ATOM 1710 OE1 GLU A 111 -1.887 3.902 -7.346 1.00 0.00 O ATOM 1711 OE2 GLU A 111 -1.114 3.964 -5.336 1.00 0.00 O ATOM 0 H GLU A 111 -3.915 4.455 -7.223 1.00 0.00 H new ATOM 0 HA GLU A 111 -3.418 5.827 -4.772 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -3.143 6.254 -7.765 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -2.874 7.644 -6.731 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -0.753 6.370 -7.169 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -1.139 6.438 -5.461 1.00 0.00 H new ATOM 1718 N LEU A 112 -5.823 7.163 -6.568 1.00 0.00 N ATOM 1719 CA LEU A 112 -6.977 8.106 -6.443 1.00 0.00 C ATOM 1720 C LEU A 112 -7.798 7.712 -5.220 1.00 0.00 C ATOM 1721 O LEU A 112 -8.023 8.498 -4.321 1.00 0.00 O ATOM 1722 CB LEU A 112 -7.820 7.936 -7.717 1.00 0.00 C ATOM 1723 CG LEU A 112 -6.919 7.746 -8.941 1.00 0.00 C ATOM 1724 CD1 LEU A 112 -7.725 8.007 -10.214 1.00 0.00 C ATOM 1725 CD2 LEU A 112 -5.741 8.722 -8.873 1.00 0.00 C ATOM 0 H LEU A 112 -5.733 6.701 -7.473 1.00 0.00 H new ATOM 0 HA LEU A 112 -6.651 9.140 -6.329 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.482 7.076 -7.609 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.455 8.811 -7.859 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.540 6.724 -8.953 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.084 7.872 -11.085 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.560 7.308 -10.266 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.107 9.028 -10.200 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.103 8.583 -9.746 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -6.117 9.745 -8.857 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -5.164 8.533 -7.968 1.00 0.00 H new ATOM 1737 N GLU A 113 -8.230 6.486 -5.178 1.00 0.00 N ATOM 1738 CA GLU A 113 -9.019 6.009 -4.016 1.00 0.00 C ATOM 1739 C GLU A 113 -8.140 6.024 -2.774 1.00 0.00 C ATOM 1740 O GLU A 113 -8.614 5.966 -1.657 1.00 0.00 O ATOM 1741 CB GLU A 113 -9.408 4.571 -4.373 1.00 0.00 C ATOM 1742 CG GLU A 113 -10.327 4.596 -5.591 1.00 0.00 C ATOM 1743 CD GLU A 113 -11.464 3.591 -5.398 1.00 0.00 C ATOM 1744 OE1 GLU A 113 -11.177 2.467 -5.022 1.00 0.00 O ATOM 1745 OE2 GLU A 113 -12.603 3.964 -5.628 1.00 0.00 O ATOM 0 H GLU A 113 -8.068 5.789 -5.905 1.00 0.00 H new ATOM 0 HA GLU A 113 -9.892 6.629 -3.812 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -8.516 3.981 -4.585 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -9.911 4.096 -3.531 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -10.734 5.598 -5.732 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.762 4.352 -6.491 1.00 0.00 H new ATOM 1752 N ALA A 114 -6.853 6.083 -2.971 1.00 0.00 N ATOM 1753 CA ALA A 114 -5.924 6.072 -1.812 1.00 0.00 C ATOM 1754 C ALA A 114 -5.935 7.394 -1.056 1.00 0.00 C ATOM 1755 O ALA A 114 -5.527 7.455 0.086 1.00 0.00 O ATOM 1756 CB ALA A 114 -4.541 5.823 -2.411 1.00 0.00 C ATOM 0 H ALA A 114 -6.406 6.138 -3.886 1.00 0.00 H new ATOM 0 HA ALA A 114 -6.216 5.310 -1.089 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -3.798 5.801 -1.614 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.538 4.868 -2.936 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.299 6.622 -3.111 1.00 0.00 H new ATOM 1762 N VAL A 115 -6.358 8.460 -1.666 1.00 0.00 N ATOM 1763 CA VAL A 115 -6.325 9.748 -0.920 1.00 0.00 C ATOM 1764 C VAL A 115 -7.725 10.325 -0.666 1.00 0.00 C ATOM 1765 O VAL A 115 -7.958 10.960 0.343 1.00 0.00 O ATOM 1766 CB VAL A 115 -5.505 10.696 -1.799 1.00 0.00 C ATOM 1767 CG1 VAL A 115 -5.030 11.883 -0.961 1.00 0.00 C ATOM 1768 CG2 VAL A 115 -4.287 9.955 -2.360 1.00 0.00 C ATOM 0 H VAL A 115 -6.716 8.501 -2.620 1.00 0.00 H new ATOM 0 HA VAL A 115 -5.892 9.607 0.070 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.125 11.051 -2.622 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.446 12.559 -1.586 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.893 12.414 -0.560 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -4.412 11.523 -0.139 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.705 10.632 -2.985 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.667 9.598 -1.537 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.621 9.106 -2.957 1.00 0.00 H new ATOM 1778 N LEU A 116 -8.651 10.149 -1.567 1.00 0.00 N ATOM 1779 CA LEU A 116 -10.004 10.740 -1.342 1.00 0.00 C ATOM 1780 C LEU A 116 -10.960 9.746 -0.662 1.00 0.00 C ATOM 1781 O LEU A 116 -11.953 10.142 -0.086 1.00 0.00 O ATOM 1782 CB LEU A 116 -10.498 11.145 -2.741 1.00 0.00 C ATOM 1783 CG LEU A 116 -11.359 10.039 -3.356 1.00 0.00 C ATOM 1784 CD1 LEU A 116 -12.806 10.209 -2.891 1.00 0.00 C ATOM 1785 CD2 LEU A 116 -11.298 10.137 -4.883 1.00 0.00 C ATOM 0 H LEU A 116 -8.535 9.630 -2.437 1.00 0.00 H new ATOM 0 HA LEU A 116 -9.963 11.593 -0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -11.076 12.067 -2.675 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -9.645 11.349 -3.388 1.00 0.00 H new ATOM 0 HG LEU A 116 -10.986 9.065 -3.040 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -13.423 9.423 -3.327 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -12.849 10.143 -1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -13.179 11.182 -3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -11.911 9.350 -5.323 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -11.674 11.110 -5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -10.266 10.021 -5.214 1.00 0.00 H new ATOM 1797 N VAL A 117 -10.688 8.469 -0.711 1.00 0.00 N ATOM 1798 CA VAL A 117 -11.621 7.510 -0.046 1.00 0.00 C ATOM 1799 C VAL A 117 -11.412 7.524 1.467 1.00 0.00 C ATOM 1800 O VAL A 117 -12.283 7.149 2.225 1.00 0.00 O ATOM 1801 CB VAL A 117 -11.295 6.142 -0.621 1.00 0.00 C ATOM 1802 CG1 VAL A 117 -12.320 5.124 -0.115 1.00 0.00 C ATOM 1803 CG2 VAL A 117 -11.362 6.211 -2.144 1.00 0.00 C ATOM 0 H VAL A 117 -9.878 8.054 -1.172 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.663 7.776 -0.224 1.00 0.00 H new ATOM 0 HB VAL A 117 -10.295 5.840 -0.310 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -12.090 4.141 -0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -12.283 5.081 0.974 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.319 5.425 -0.432 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -11.129 5.232 -2.563 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.365 6.508 -2.451 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.640 6.942 -2.507 1.00 0.00 H new ATOM 1813 N GLN A 118 -10.267 7.959 1.916 1.00 0.00 N ATOM 1814 CA GLN A 118 -10.014 7.999 3.384 1.00 0.00 C ATOM 1815 C GLN A 118 -11.103 8.812 4.081 1.00 0.00 C ATOM 1816 O GLN A 118 -11.265 8.750 5.283 1.00 0.00 O ATOM 1817 CB GLN A 118 -8.652 8.675 3.539 1.00 0.00 C ATOM 1818 CG GLN A 118 -7.540 7.666 3.239 1.00 0.00 C ATOM 1819 CD GLN A 118 -6.197 8.238 3.699 1.00 0.00 C ATOM 1820 OE1 GLN A 118 -5.251 7.504 3.908 1.00 0.00 O ATOM 1821 NE2 GLN A 118 -6.072 9.526 3.864 1.00 0.00 N ATOM 0 H GLN A 118 -9.498 8.288 1.332 1.00 0.00 H new ATOM 0 HA GLN A 118 -10.023 7.005 3.832 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -8.578 9.525 2.861 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -8.541 9.064 4.551 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -7.741 6.724 3.750 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -7.509 7.449 2.171 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -6.866 10.142 3.689 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -5.180 9.917 4.168 1.00 0.00 H new ATOM 1830 N ILE A 119 -11.845 9.581 3.337 1.00 0.00 N ATOM 1831 CA ILE A 119 -12.914 10.406 3.959 1.00 0.00 C ATOM 1832 C ILE A 119 -14.233 10.262 3.189 1.00 0.00 C ATOM 1833 O ILE A 119 -15.279 10.660 3.664 1.00 0.00 O ATOM 1834 CB ILE A 119 -12.371 11.827 3.867 1.00 0.00 C ATOM 1835 CG1 ILE A 119 -13.363 12.812 4.502 1.00 0.00 C ATOM 1836 CG2 ILE A 119 -12.136 12.191 2.399 1.00 0.00 C ATOM 1837 CD1 ILE A 119 -14.522 13.097 3.539 1.00 0.00 C ATOM 0 H ILE A 119 -11.757 9.674 2.325 1.00 0.00 H new ATOM 0 HA ILE A 119 -13.139 10.110 4.983 1.00 0.00 H new ATOM 0 HB ILE A 119 -11.426 11.886 4.407 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -13.749 12.399 5.434 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -12.852 13.742 4.752 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -11.748 13.207 2.334 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -11.416 11.499 1.963 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -13.077 12.127 1.853 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.217 13.797 4.003 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.132 13.530 2.618 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -15.042 12.167 3.310 1.00 0.00 H new ATOM 1849 N SER A 120 -14.196 9.692 2.011 1.00 0.00 N ATOM 1850 CA SER A 120 -15.451 9.522 1.222 1.00 0.00 C ATOM 1851 C SER A 120 -16.596 9.107 2.147 1.00 0.00 C ATOM 1852 O SER A 120 -17.633 9.738 2.190 1.00 0.00 O ATOM 1853 CB SER A 120 -15.139 8.411 0.222 1.00 0.00 C ATOM 1854 OG SER A 120 -14.617 8.982 -0.971 1.00 0.00 O ATOM 0 H SER A 120 -13.351 9.338 1.563 1.00 0.00 H new ATOM 0 HA SER A 120 -15.759 10.442 0.725 1.00 0.00 H new ATOM 0 HB2 SER A 120 -14.419 7.713 0.650 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.042 7.842 0.001 1.00 0.00 H new ATOM 0 HG SER A 120 -14.282 8.270 -1.555 1.00 0.00 H new ATOM 1860 N LYS A 121 -16.410 8.057 2.895 1.00 0.00 N ATOM 1861 CA LYS A 121 -17.483 7.611 3.824 1.00 0.00 C ATOM 1862 C LYS A 121 -18.791 7.409 3.058 1.00 0.00 C ATOM 1863 O LYS A 121 -19.483 8.352 2.735 1.00 0.00 O ATOM 1864 CB LYS A 121 -17.613 8.749 4.838 1.00 0.00 C ATOM 1865 CG LYS A 121 -16.452 8.685 5.840 1.00 0.00 C ATOM 1866 CD LYS A 121 -16.522 7.387 6.655 1.00 0.00 C ATOM 1867 CE LYS A 121 -17.763 7.399 7.550 1.00 0.00 C ATOM 1868 NZ LYS A 121 -18.011 5.966 7.877 1.00 0.00 N ATOM 0 H LYS A 121 -15.563 7.489 2.903 1.00 0.00 H new ATOM 0 HA LYS A 121 -17.255 6.661 4.306 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -17.609 9.710 4.323 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -18.565 8.673 5.364 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -15.501 8.738 5.309 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -16.492 9.545 6.509 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -16.555 6.528 5.985 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -15.625 7.281 7.265 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -17.594 7.987 8.452 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -18.617 7.841 7.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -18.848 5.890 8.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -18.174 5.433 6.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -17.184 5.574 8.371 1.00 0.00 H new ATOM 1882 N GLU A 122 -19.111 6.180 2.746 1.00 0.00 N ATOM 1883 CA GLU A 122 -20.358 5.886 1.981 1.00 0.00 C ATOM 1884 C GLU A 122 -20.538 6.927 0.884 1.00 0.00 C ATOM 1885 O GLU A 122 -21.643 7.238 0.485 1.00 0.00 O ATOM 1886 CB GLU A 122 -21.501 5.943 3.001 1.00 0.00 C ATOM 1887 CG GLU A 122 -21.701 7.378 3.491 1.00 0.00 C ATOM 1888 CD GLU A 122 -23.007 7.470 4.282 1.00 0.00 C ATOM 1889 OE1 GLU A 122 -23.531 6.430 4.646 1.00 0.00 O ATOM 1890 OE2 GLU A 122 -23.461 8.579 4.511 1.00 0.00 O ATOM 0 H GLU A 122 -18.556 5.360 2.991 1.00 0.00 H new ATOM 0 HA GLU A 122 -20.328 4.911 1.495 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -22.421 5.574 2.548 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -21.278 5.291 3.845 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -20.862 7.680 4.118 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -21.728 8.063 2.643 1.00 0.00 H new ATOM 1897 N VAL A 123 -19.437 7.453 0.406 1.00 0.00 N ATOM 1898 CA VAL A 123 -19.455 8.485 -0.672 1.00 0.00 C ATOM 1899 C VAL A 123 -20.800 9.214 -0.735 1.00 0.00 C ATOM 1900 O VAL A 123 -21.026 10.076 0.099 1.00 0.00 O ATOM 1901 CB VAL A 123 -19.192 7.716 -1.969 1.00 0.00 C ATOM 1902 CG1 VAL A 123 -17.782 7.125 -1.933 1.00 0.00 C ATOM 1903 CG2 VAL A 123 -20.212 6.583 -2.119 1.00 0.00 C ATOM 0 H VAL A 123 -18.503 7.201 0.729 1.00 0.00 H new ATOM 0 HA VAL A 123 -18.707 9.258 -0.493 1.00 0.00 H new ATOM 0 HB VAL A 123 -19.284 8.398 -2.814 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -17.593 6.577 -2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -17.053 7.929 -1.833 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -17.693 6.447 -1.084 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -20.019 6.040 -3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -20.125 5.901 -1.273 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -21.218 7.001 -2.147 1.00 0.00 H new TER 1913 VAL A 123