USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 988 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 ASN : amide:sc= -1.81 K(o=-1.8,f=-3.2!) USER MOD Set 1.2: A 86 THR OG1 : rot 113:sc= 0 USER MOD Single : A 1 VAL N :NH3+ 177:sc= -0.367 (180deg=-0.4) USER MOD Single : A 2 LYS NZ :NH3+ -177:sc= 0.846 (180deg=0.692) USER MOD Single : A 5 CYS SG : rot 180:sc= -1.01 USER MOD Single : A 9 THR OG1 : rot -160:sc= 0.619 USER MOD Single : A 20 THR OG1 : rot 11:sc= 1.12 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.124 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot -28:sc= 0.72 USER MOD Single : A 38 LYS NZ :NH3+ 166:sc= 1.25 (180deg=1.12) USER MOD Single : A 41 CYS SG : rot 50:sc= -1.45 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.163) USER MOD Single : A 74 ASN : amide:sc= 0.302 K(o=0.3,f=-0.9) USER MOD Single : A 79 LYS NZ :NH3+ -169:sc= 1.29 (180deg=1.03) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 167:sc= -0.0561 (180deg=-0.345) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl 163:sc= -0.0996 (180deg=-0.539) USER MOD Single : A 108 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.05) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= -1.22 USER MOD Single : A 122 ASN :FLIP amide:sc= -0.576 F(o=-1.1,f=-0.58) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 5.344 15.078 -11.608 1.00 0.00 N ATOM 2 CA VAL A 1 4.933 15.466 -10.263 1.00 0.00 C ATOM 3 C VAL A 1 5.586 14.572 -9.214 1.00 0.00 C ATOM 4 O VAL A 1 5.663 13.352 -9.379 1.00 0.00 O ATOM 5 CB VAL A 1 3.394 15.441 -10.099 1.00 0.00 C ATOM 6 CG1 VAL A 1 2.748 16.520 -10.957 1.00 0.00 C ATOM 7 CG2 VAL A 1 2.826 14.075 -10.454 1.00 0.00 C ATOM 0 H1 VAL A 1 4.848 15.668 -12.306 1.00 0.00 H new ATOM 0 H2 VAL A 1 6.370 15.211 -11.709 1.00 0.00 H new ATOM 0 H3 VAL A 1 5.107 14.078 -11.768 1.00 0.00 H new ATOM 0 HA VAL A 1 5.269 16.492 -10.112 1.00 0.00 H new ATOM 0 HB VAL A 1 3.166 15.642 -9.052 1.00 0.00 H new ATOM 0 HG11 VAL A 1 1.666 16.487 -10.829 1.00 0.00 H new ATOM 0 HG12 VAL A 1 3.120 17.498 -10.653 1.00 0.00 H new ATOM 0 HG13 VAL A 1 2.995 16.348 -12.005 1.00 0.00 H new ATOM 0 HG21 VAL A 1 1.743 14.088 -10.329 1.00 0.00 H new ATOM 0 HG22 VAL A 1 3.069 13.838 -11.490 1.00 0.00 H new ATOM 0 HG23 VAL A 1 3.258 13.320 -9.798 1.00 0.00 H new ATOM 17 N LYS A 2 6.066 15.188 -8.142 1.00 0.00 N ATOM 18 CA LYS A 2 6.817 14.467 -7.122 1.00 0.00 C ATOM 19 C LYS A 2 6.226 14.705 -5.743 1.00 0.00 C ATOM 20 O LYS A 2 5.822 15.822 -5.416 1.00 0.00 O ATOM 21 CB LYS A 2 8.278 14.913 -7.129 1.00 0.00 C ATOM 22 CG LYS A 2 8.854 15.066 -8.523 1.00 0.00 C ATOM 23 CD LYS A 2 10.327 15.428 -8.498 1.00 0.00 C ATOM 24 CE LYS A 2 10.800 15.869 -9.872 1.00 0.00 C ATOM 25 NZ LYS A 2 10.282 14.979 -10.940 1.00 0.00 N ATOM 0 H LYS A 2 5.949 16.184 -7.956 1.00 0.00 H new ATOM 0 HA LYS A 2 6.758 13.403 -7.351 1.00 0.00 H new ATOM 0 HB2 LYS A 2 8.362 15.864 -6.603 1.00 0.00 H new ATOM 0 HB3 LYS A 2 8.874 14.188 -6.575 1.00 0.00 H new ATOM 0 HG2 LYS A 2 8.720 14.135 -9.074 1.00 0.00 H new ATOM 0 HG3 LYS A 2 8.301 15.837 -9.060 1.00 0.00 H new ATOM 0 HD2 LYS A 2 10.497 16.227 -7.777 1.00 0.00 H new ATOM 0 HD3 LYS A 2 10.911 14.570 -8.166 1.00 0.00 H new ATOM 0 HE2 LYS A 2 10.472 16.892 -10.059 1.00 0.00 H new ATOM 0 HE3 LYS A 2 11.890 15.873 -9.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 10.666 15.279 -11.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 10.573 13.999 -10.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 9.244 15.034 -10.964 1.00 0.00 H new ATOM 39 N PHE A 3 6.193 13.661 -4.931 1.00 0.00 N ATOM 40 CA PHE A 3 5.661 13.766 -3.583 1.00 0.00 C ATOM 41 C PHE A 3 6.597 13.096 -2.589 1.00 0.00 C ATOM 42 O PHE A 3 7.292 12.133 -2.923 1.00 0.00 O ATOM 43 CB PHE A 3 4.265 13.138 -3.502 1.00 0.00 C ATOM 44 CG PHE A 3 3.279 13.749 -4.458 1.00 0.00 C ATOM 45 CD1 PHE A 3 2.682 14.966 -4.172 1.00 0.00 C ATOM 46 CD2 PHE A 3 2.958 13.111 -5.647 1.00 0.00 C ATOM 47 CE1 PHE A 3 1.786 15.537 -5.054 1.00 0.00 C ATOM 48 CE2 PHE A 3 2.060 13.677 -6.530 1.00 0.00 C ATOM 49 CZ PHE A 3 1.473 14.891 -6.234 1.00 0.00 C ATOM 0 H PHE A 3 6.528 12.731 -5.182 1.00 0.00 H new ATOM 0 HA PHE A 3 5.580 14.823 -3.329 1.00 0.00 H new ATOM 0 HB2 PHE A 3 4.343 12.070 -3.705 1.00 0.00 H new ATOM 0 HB3 PHE A 3 3.886 13.242 -2.485 1.00 0.00 H new ATOM 0 HD1 PHE A 3 2.920 15.474 -3.249 1.00 0.00 H new ATOM 0 HD2 PHE A 3 3.415 12.162 -5.885 1.00 0.00 H new ATOM 0 HE1 PHE A 3 1.330 16.488 -4.821 1.00 0.00 H new ATOM 0 HE2 PHE A 3 1.817 13.170 -7.452 1.00 0.00 H new ATOM 0 HZ PHE A 3 0.770 15.335 -6.924 1.00 0.00 H new ATOM 59 N ALA A 4 6.618 13.615 -1.373 1.00 0.00 N ATOM 60 CA ALA A 4 7.464 13.070 -0.325 1.00 0.00 C ATOM 61 C ALA A 4 6.657 12.171 0.604 1.00 0.00 C ATOM 62 O ALA A 4 5.561 12.533 1.040 1.00 0.00 O ATOM 63 CB ALA A 4 8.120 14.194 0.463 1.00 0.00 C ATOM 0 H ALA A 4 6.056 14.417 -1.086 1.00 0.00 H new ATOM 0 HA ALA A 4 8.245 12.469 -0.791 1.00 0.00 H new ATOM 0 HB1 ALA A 4 8.751 13.770 1.245 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.730 14.800 -0.207 1.00 0.00 H new ATOM 0 HB3 ALA A 4 7.350 14.818 0.917 1.00 0.00 H new ATOM 69 N CYS A 5 7.184 10.991 0.872 1.00 0.00 N ATOM 70 CA CYS A 5 6.550 10.070 1.793 1.00 0.00 C ATOM 71 C CYS A 5 7.502 9.720 2.931 1.00 0.00 C ATOM 72 O CYS A 5 8.687 10.055 2.889 1.00 0.00 O ATOM 73 CB CYS A 5 6.131 8.805 1.051 1.00 0.00 C ATOM 74 SG CYS A 5 5.162 9.119 -0.442 1.00 0.00 S ATOM 0 H CYS A 5 8.053 10.648 0.463 1.00 0.00 H new ATOM 0 HA CYS A 5 5.665 10.546 2.215 1.00 0.00 H new ATOM 0 HB2 CYS A 5 7.024 8.241 0.781 1.00 0.00 H new ATOM 0 HB3 CYS A 5 5.549 8.176 1.725 1.00 0.00 H new ATOM 0 HG CYS A 5 4.854 7.989 -1.005 1.00 0.00 H new ATOM 80 N ARG A 6 6.982 9.070 3.954 1.00 0.00 N ATOM 81 CA ARG A 6 7.813 8.590 5.043 1.00 0.00 C ATOM 82 C ARG A 6 8.160 7.132 4.795 1.00 0.00 C ATOM 83 O ARG A 6 7.289 6.335 4.429 1.00 0.00 O ATOM 84 CB ARG A 6 7.090 8.747 6.380 1.00 0.00 C ATOM 85 CG ARG A 6 8.005 8.696 7.597 1.00 0.00 C ATOM 86 CD ARG A 6 8.950 9.893 7.647 1.00 0.00 C ATOM 87 NE ARG A 6 10.181 9.680 6.880 1.00 0.00 N ATOM 88 CZ ARG A 6 10.653 10.532 5.965 1.00 0.00 C ATOM 89 NH1 ARG A 6 9.930 11.578 5.588 1.00 0.00 N ATOM 90 NH2 ARG A 6 11.841 10.329 5.408 1.00 0.00 N ATOM 0 H ARG A 6 5.989 8.862 4.055 1.00 0.00 H new ATOM 0 HA ARG A 6 8.729 9.180 5.086 1.00 0.00 H new ATOM 0 HB2 ARG A 6 6.556 9.697 6.381 1.00 0.00 H new ATOM 0 HB3 ARG A 6 6.341 7.960 6.470 1.00 0.00 H new ATOM 0 HG2 ARG A 6 7.402 8.671 8.504 1.00 0.00 H new ATOM 0 HG3 ARG A 6 8.587 7.774 7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 6 8.435 10.773 7.261 1.00 0.00 H new ATOM 0 HD3 ARG A 6 9.207 10.104 8.685 1.00 0.00 H new ATOM 0 HE ARG A 6 10.711 8.827 7.056 1.00 0.00 H new ATOM 0 HH11 ARG A 6 9.009 11.735 5.997 1.00 0.00 H new ATOM 0 HH12 ARG A 6 10.295 12.225 4.889 1.00 0.00 H new ATOM 0 HH21 ARG A 6 12.399 9.519 5.678 1.00 0.00 H new ATOM 0 HH22 ARG A 6 12.196 10.983 4.710 1.00 0.00 H new ATOM 104 N ALA A 7 9.424 6.788 4.983 1.00 0.00 N ATOM 105 CA ALA A 7 9.905 5.453 4.672 1.00 0.00 C ATOM 106 C ALA A 7 9.500 4.451 5.744 1.00 0.00 C ATOM 107 O ALA A 7 10.151 4.340 6.787 1.00 0.00 O ATOM 108 CB ALA A 7 11.419 5.466 4.500 1.00 0.00 C ATOM 0 H ALA A 7 10.137 7.418 5.351 1.00 0.00 H new ATOM 0 HA ALA A 7 9.444 5.140 3.735 1.00 0.00 H new ATOM 0 HB1 ALA A 7 11.767 4.460 4.267 1.00 0.00 H new ATOM 0 HB2 ALA A 7 11.687 6.140 3.686 1.00 0.00 H new ATOM 0 HB3 ALA A 7 11.887 5.808 5.423 1.00 0.00 H new ATOM 114 N ILE A 8 8.406 3.745 5.495 1.00 0.00 N ATOM 115 CA ILE A 8 7.973 2.676 6.381 1.00 0.00 C ATOM 116 C ILE A 8 8.745 1.409 6.035 1.00 0.00 C ATOM 117 O ILE A 8 9.309 0.745 6.904 1.00 0.00 O ATOM 118 CB ILE A 8 6.456 2.414 6.252 1.00 0.00 C ATOM 119 CG1 ILE A 8 5.662 3.711 6.462 1.00 0.00 C ATOM 120 CG2 ILE A 8 6.009 1.345 7.240 1.00 0.00 C ATOM 121 CD1 ILE A 8 5.874 4.347 7.820 1.00 0.00 C ATOM 0 H ILE A 8 7.803 3.894 4.686 1.00 0.00 H new ATOM 0 HA ILE A 8 8.172 2.974 7.410 1.00 0.00 H new ATOM 0 HB ILE A 8 6.257 2.051 5.243 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.942 4.426 5.689 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.600 3.501 6.332 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.938 1.176 7.133 1.00 0.00 H new ATOM 0 HG22 ILE A 8 6.545 0.417 7.039 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.224 1.676 8.256 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.280 5.258 7.892 1.00 0.00 H new ATOM 0 HD12 ILE A 8 5.566 3.651 8.600 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.929 4.591 7.947 1.00 0.00 H new ATOM 133 N THR A 9 8.765 1.092 4.751 1.00 0.00 N ATOM 134 CA THR A 9 9.582 0.010 4.234 1.00 0.00 C ATOM 135 C THR A 9 10.730 0.610 3.419 1.00 0.00 C ATOM 136 O THR A 9 10.788 1.827 3.241 1.00 0.00 O ATOM 137 CB THR A 9 8.742 -0.930 3.347 1.00 0.00 C ATOM 138 OG1 THR A 9 7.397 -0.960 3.832 1.00 0.00 O ATOM 139 CG2 THR A 9 9.299 -2.346 3.343 1.00 0.00 C ATOM 0 H THR A 9 8.217 1.577 4.041 1.00 0.00 H new ATOM 0 HA THR A 9 9.978 -0.574 5.065 1.00 0.00 H new ATOM 0 HB THR A 9 8.775 -0.548 2.327 1.00 0.00 H new ATOM 0 HG1 THR A 9 6.946 -1.763 3.497 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.680 -2.979 2.707 1.00 0.00 H new ATOM 0 HG22 THR A 9 10.320 -2.334 2.960 1.00 0.00 H new ATOM 0 HG23 THR A 9 9.297 -2.741 4.359 1.00 0.00 H new ATOM 147 N ARG A 10 11.635 -0.224 2.926 1.00 0.00 N ATOM 148 CA ARG A 10 12.771 0.262 2.155 1.00 0.00 C ATOM 149 C ARG A 10 12.845 -0.449 0.808 1.00 0.00 C ATOM 150 O ARG A 10 12.030 -1.327 0.519 1.00 0.00 O ATOM 151 CB ARG A 10 14.063 0.074 2.950 1.00 0.00 C ATOM 152 CG ARG A 10 14.024 0.775 4.297 1.00 0.00 C ATOM 153 CD ARG A 10 15.293 0.562 5.098 1.00 0.00 C ATOM 154 NE ARG A 10 15.134 1.051 6.466 1.00 0.00 N ATOM 155 CZ ARG A 10 16.111 1.569 7.203 1.00 0.00 C ATOM 156 NH1 ARG A 10 17.334 1.701 6.701 1.00 0.00 N ATOM 157 NH2 ARG A 10 15.853 1.975 8.439 1.00 0.00 N ATOM 0 H ARG A 10 11.605 -1.237 3.045 1.00 0.00 H new ATOM 0 HA ARG A 10 12.640 1.327 1.963 1.00 0.00 H new ATOM 0 HB2 ARG A 10 14.240 -0.991 3.103 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.902 0.456 2.369 1.00 0.00 H new ATOM 0 HG2 ARG A 10 13.870 1.843 4.143 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.171 0.409 4.869 1.00 0.00 H new ATOM 0 HD2 ARG A 10 15.544 -0.498 5.113 1.00 0.00 H new ATOM 0 HD3 ARG A 10 16.123 1.079 4.617 1.00 0.00 H new ATOM 0 HE ARG A 10 14.206 0.990 6.885 1.00 0.00 H new ATOM 0 HH11 ARG A 10 17.528 1.404 5.745 1.00 0.00 H new ATOM 0 HH12 ARG A 10 18.079 2.099 7.272 1.00 0.00 H new ATOM 0 HH21 ARG A 10 14.910 1.889 8.818 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.598 2.374 9.011 1.00 0.00 H new ATOM 171 N GLY A 11 13.816 -0.070 -0.010 1.00 0.00 N ATOM 172 CA GLY A 11 13.906 -0.604 -1.352 1.00 0.00 C ATOM 173 C GLY A 11 13.281 0.335 -2.361 1.00 0.00 C ATOM 174 O GLY A 11 13.078 1.513 -2.068 1.00 0.00 O ATOM 0 H GLY A 11 14.545 0.600 0.234 1.00 0.00 H new ATOM 0 HA2 GLY A 11 14.952 -0.773 -1.609 1.00 0.00 H new ATOM 0 HA3 GLY A 11 13.406 -1.572 -1.395 1.00 0.00 H new ATOM 178 N ARG A 12 12.977 -0.177 -3.541 1.00 0.00 N ATOM 179 CA ARG A 12 12.344 0.625 -4.577 1.00 0.00 C ATOM 180 C ARG A 12 11.595 -0.265 -5.556 1.00 0.00 C ATOM 181 O ARG A 12 11.994 -1.410 -5.801 1.00 0.00 O ATOM 182 CB ARG A 12 13.384 1.495 -5.301 1.00 0.00 C ATOM 183 CG ARG A 12 14.502 0.724 -6.000 1.00 0.00 C ATOM 184 CD ARG A 12 14.137 0.374 -7.434 1.00 0.00 C ATOM 185 NE ARG A 12 13.902 1.571 -8.241 1.00 0.00 N ATOM 186 CZ ARG A 12 13.440 1.560 -9.492 1.00 0.00 C ATOM 187 NH1 ARG A 12 13.170 0.416 -10.106 1.00 0.00 N ATOM 188 NH2 ARG A 12 13.265 2.703 -10.136 1.00 0.00 N ATOM 0 H ARG A 12 13.158 -1.145 -3.807 1.00 0.00 H new ATOM 0 HA ARG A 12 11.621 1.291 -4.106 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.870 2.108 -6.041 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.831 2.176 -4.577 1.00 0.00 H new ATOM 0 HG2 ARG A 12 15.414 1.321 -5.993 1.00 0.00 H new ATOM 0 HG3 ARG A 12 14.714 -0.190 -5.446 1.00 0.00 H new ATOM 0 HD2 ARG A 12 14.939 -0.214 -7.880 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.243 -0.250 -7.440 1.00 0.00 H new ATOM 0 HE ARG A 12 14.105 2.477 -7.818 1.00 0.00 H new ATOM 0 HH11 ARG A 12 13.315 -0.470 -9.621 1.00 0.00 H new ATOM 0 HH12 ARG A 12 12.817 0.422 -11.063 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.483 3.587 -9.675 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.912 2.700 -11.093 1.00 0.00 H new ATOM 202 N ALA A 13 10.507 0.261 -6.098 1.00 0.00 N ATOM 203 CA ALA A 13 9.693 -0.465 -7.055 1.00 0.00 C ATOM 204 C ALA A 13 9.032 0.497 -8.029 1.00 0.00 C ATOM 205 O ALA A 13 8.773 1.654 -7.698 1.00 0.00 O ATOM 206 CB ALA A 13 8.641 -1.292 -6.334 1.00 0.00 C ATOM 0 H ALA A 13 10.166 1.199 -5.887 1.00 0.00 H new ATOM 0 HA ALA A 13 10.339 -1.138 -7.618 1.00 0.00 H new ATOM 0 HB1 ALA A 13 8.038 -1.831 -7.065 1.00 0.00 H new ATOM 0 HB2 ALA A 13 9.130 -2.005 -5.671 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.999 -0.634 -5.749 1.00 0.00 H new ATOM 212 N GLU A 14 8.770 0.018 -9.228 1.00 0.00 N ATOM 213 CA GLU A 14 8.118 0.818 -10.247 1.00 0.00 C ATOM 214 C GLU A 14 7.077 -0.017 -10.975 1.00 0.00 C ATOM 215 O GLU A 14 7.371 -1.120 -11.435 1.00 0.00 O ATOM 216 CB GLU A 14 9.154 1.353 -11.235 1.00 0.00 C ATOM 217 CG GLU A 14 10.055 0.269 -11.806 1.00 0.00 C ATOM 218 CD GLU A 14 10.997 0.787 -12.865 1.00 0.00 C ATOM 219 OE1 GLU A 14 10.558 0.947 -14.019 1.00 0.00 O ATOM 220 OE2 GLU A 14 12.186 1.024 -12.553 1.00 0.00 O ATOM 0 H GLU A 14 9.001 -0.931 -9.523 1.00 0.00 H new ATOM 0 HA GLU A 14 7.620 1.663 -9.771 1.00 0.00 H new ATOM 0 HB2 GLU A 14 8.640 1.857 -12.053 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.769 2.102 -10.736 1.00 0.00 H new ATOM 0 HG2 GLU A 14 10.635 -0.178 -10.998 1.00 0.00 H new ATOM 0 HG3 GLU A 14 9.438 -0.523 -12.231 1.00 0.00 H new ATOM 227 N GLY A 15 5.861 0.486 -11.055 1.00 0.00 N ATOM 228 CA GLY A 15 4.817 -0.248 -11.738 1.00 0.00 C ATOM 229 C GLY A 15 3.632 0.621 -12.074 1.00 0.00 C ATOM 230 O GLY A 15 3.568 1.780 -11.654 1.00 0.00 O ATOM 0 H GLY A 15 5.576 1.383 -10.663 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.219 -0.680 -12.654 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.490 -1.078 -11.112 1.00 0.00 H new ATOM 234 N GLU A 16 2.704 0.069 -12.840 1.00 0.00 N ATOM 235 CA GLU A 16 1.496 0.776 -13.203 1.00 0.00 C ATOM 236 C GLU A 16 0.599 0.919 -11.975 1.00 0.00 C ATOM 237 O GLU A 16 0.327 -0.059 -11.278 1.00 0.00 O ATOM 238 CB GLU A 16 0.767 0.017 -14.313 1.00 0.00 C ATOM 239 CG GLU A 16 1.677 -0.489 -15.430 1.00 0.00 C ATOM 240 CD GLU A 16 2.549 0.594 -16.046 1.00 0.00 C ATOM 241 OE1 GLU A 16 2.117 1.232 -17.025 1.00 0.00 O ATOM 242 OE2 GLU A 16 3.688 0.786 -15.568 1.00 0.00 O ATOM 0 H GLU A 16 2.770 -0.874 -13.223 1.00 0.00 H new ATOM 0 HA GLU A 16 1.751 1.770 -13.570 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.244 -0.832 -13.873 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.008 0.669 -14.746 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.317 -1.278 -15.036 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.063 -0.937 -16.211 1.00 0.00 H new ATOM 249 N ALA A 17 0.159 2.135 -11.710 1.00 0.00 N ATOM 250 CA ALA A 17 -0.627 2.424 -10.523 1.00 0.00 C ATOM 251 C ALA A 17 -2.085 2.054 -10.712 1.00 0.00 C ATOM 252 O ALA A 17 -2.653 2.229 -11.787 1.00 0.00 O ATOM 253 CB ALA A 17 -0.504 3.890 -10.153 1.00 0.00 C ATOM 0 H ALA A 17 0.334 2.945 -12.305 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.232 1.815 -9.710 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.098 4.091 -9.262 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.541 4.129 -9.954 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.866 4.505 -10.977 1.00 0.00 H new ATOM 259 N LEU A 18 -2.676 1.529 -9.657 1.00 0.00 N ATOM 260 CA LEU A 18 -4.074 1.162 -9.659 1.00 0.00 C ATOM 261 C LEU A 18 -4.782 1.935 -8.556 1.00 0.00 C ATOM 262 O LEU A 18 -4.500 1.742 -7.371 1.00 0.00 O ATOM 263 CB LEU A 18 -4.204 -0.351 -9.452 1.00 0.00 C ATOM 264 CG LEU A 18 -5.529 -0.979 -9.892 1.00 0.00 C ATOM 265 CD1 LEU A 18 -5.353 -2.479 -10.065 1.00 0.00 C ATOM 266 CD2 LEU A 18 -6.631 -0.695 -8.883 1.00 0.00 C ATOM 0 H LEU A 18 -2.198 1.346 -8.775 1.00 0.00 H new ATOM 0 HA LEU A 18 -4.536 1.412 -10.614 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.395 -0.842 -9.993 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.057 -0.567 -8.394 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.821 -0.536 -10.844 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.298 -2.923 -10.378 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.593 -2.671 -10.823 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.041 -2.920 -9.118 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.561 -1.153 -9.221 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.353 -1.110 -7.914 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.770 0.382 -8.790 1.00 0.00 H new ATOM 278 N VAL A 19 -5.684 2.824 -8.939 1.00 0.00 N ATOM 279 CA VAL A 19 -6.315 3.709 -7.973 1.00 0.00 C ATOM 280 C VAL A 19 -7.727 3.253 -7.631 1.00 0.00 C ATOM 281 O VAL A 19 -8.634 3.312 -8.460 1.00 0.00 O ATOM 282 CB VAL A 19 -6.359 5.169 -8.471 1.00 0.00 C ATOM 283 CG1 VAL A 19 -6.952 6.084 -7.409 1.00 0.00 C ATOM 284 CG2 VAL A 19 -4.970 5.638 -8.865 1.00 0.00 C ATOM 0 H VAL A 19 -5.994 2.952 -9.902 1.00 0.00 H new ATOM 0 HA VAL A 19 -5.700 3.664 -7.074 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.000 5.211 -9.352 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -6.973 7.108 -7.782 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -7.967 5.761 -7.176 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -6.341 6.039 -6.507 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -5.020 6.669 -9.214 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -4.307 5.578 -8.002 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.584 5.003 -9.663 1.00 0.00 H new ATOM 294 N THR A 20 -7.886 2.791 -6.405 1.00 0.00 N ATOM 295 CA THR A 20 -9.187 2.466 -5.855 1.00 0.00 C ATOM 296 C THR A 20 -9.114 2.641 -4.340 1.00 0.00 C ATOM 297 O THR A 20 -8.620 1.783 -3.615 1.00 0.00 O ATOM 298 CB THR A 20 -9.646 1.033 -6.257 1.00 0.00 C ATOM 299 OG1 THR A 20 -10.939 0.729 -5.717 1.00 0.00 O ATOM 300 CG2 THR A 20 -8.648 -0.032 -5.816 1.00 0.00 C ATOM 0 H THR A 20 -7.112 2.630 -5.760 1.00 0.00 H new ATOM 0 HA THR A 20 -9.940 3.139 -6.265 1.00 0.00 H new ATOM 0 HB THR A 20 -9.702 1.022 -7.346 1.00 0.00 H new ATOM 0 HG1 THR A 20 -11.339 1.544 -5.348 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.009 -1.016 -6.117 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.682 0.159 -6.283 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.539 -0.002 -4.732 1.00 0.00 H new ATOM 308 N LYS A 21 -9.531 3.810 -3.876 1.00 0.00 N ATOM 309 CA LYS A 21 -9.399 4.151 -2.468 1.00 0.00 C ATOM 310 C LYS A 21 -10.307 3.286 -1.606 1.00 0.00 C ATOM 311 O LYS A 21 -9.829 2.403 -0.896 1.00 0.00 O ATOM 312 CB LYS A 21 -9.679 5.638 -2.239 1.00 0.00 C ATOM 313 CG LYS A 21 -10.743 6.216 -3.158 1.00 0.00 C ATOM 314 CD LYS A 21 -11.744 7.055 -2.389 1.00 0.00 C ATOM 315 CE LYS A 21 -12.678 7.804 -3.323 1.00 0.00 C ATOM 316 NZ LYS A 21 -13.799 8.441 -2.586 1.00 0.00 N ATOM 0 H LYS A 21 -9.961 4.535 -4.451 1.00 0.00 H new ATOM 0 HA LYS A 21 -8.370 3.951 -2.170 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.989 5.784 -1.204 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.753 6.197 -2.376 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.269 6.827 -3.927 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -11.262 5.406 -3.670 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -12.327 6.413 -1.728 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.214 7.766 -1.756 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.117 8.567 -3.863 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -13.077 7.115 -4.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.415 8.943 -3.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.349 7.710 -2.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.419 9.117 -1.893 1.00 0.00 H new ATOM 330 N GLU A 22 -11.612 3.545 -1.678 1.00 0.00 N ATOM 331 CA GLU A 22 -12.602 2.769 -0.931 1.00 0.00 C ATOM 332 C GLU A 22 -12.241 2.667 0.558 1.00 0.00 C ATOM 333 O GLU A 22 -11.460 3.468 1.079 1.00 0.00 O ATOM 334 CB GLU A 22 -12.746 1.378 -1.562 1.00 0.00 C ATOM 335 CG GLU A 22 -13.699 1.340 -2.751 1.00 0.00 C ATOM 336 CD GLU A 22 -13.542 2.530 -3.681 1.00 0.00 C ATOM 337 OE1 GLU A 22 -12.629 2.519 -4.531 1.00 0.00 O ATOM 338 OE2 GLU A 22 -14.342 3.488 -3.562 1.00 0.00 O ATOM 0 H GLU A 22 -12.010 4.290 -2.249 1.00 0.00 H new ATOM 0 HA GLU A 22 -13.559 3.287 -0.987 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -11.764 1.031 -1.884 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -13.098 0.679 -0.803 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -13.531 0.422 -3.314 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -14.725 1.306 -2.385 1.00 0.00 H new ATOM 345 N TYR A 23 -12.865 1.726 1.253 1.00 0.00 N ATOM 346 CA TYR A 23 -12.562 1.473 2.654 1.00 0.00 C ATOM 347 C TYR A 23 -13.001 0.067 3.037 1.00 0.00 C ATOM 348 O TYR A 23 -13.588 -0.156 4.094 1.00 0.00 O ATOM 349 CB TYR A 23 -13.226 2.528 3.559 1.00 0.00 C ATOM 350 CG TYR A 23 -14.688 2.802 3.259 1.00 0.00 C ATOM 351 CD1 TYR A 23 -15.055 3.684 2.248 1.00 0.00 C ATOM 352 CD2 TYR A 23 -15.698 2.196 3.995 1.00 0.00 C ATOM 353 CE1 TYR A 23 -16.381 3.951 1.979 1.00 0.00 C ATOM 354 CE2 TYR A 23 -17.029 2.462 3.735 1.00 0.00 C ATOM 355 CZ TYR A 23 -17.365 3.338 2.727 1.00 0.00 C ATOM 356 OH TYR A 23 -18.691 3.605 2.466 1.00 0.00 O ATOM 0 H TYR A 23 -13.589 1.121 0.865 1.00 0.00 H new ATOM 0 HA TYR A 23 -11.484 1.549 2.797 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -13.138 2.203 4.596 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -12.671 3.462 3.470 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -14.287 4.169 1.663 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -15.439 1.505 4.784 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -16.648 4.636 1.188 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -17.802 1.985 4.320 1.00 0.00 H new ATOM 0 HH TYR A 23 -19.255 3.092 3.081 1.00 0.00 H new ATOM 366 N ILE A 24 -12.688 -0.883 2.165 1.00 0.00 N ATOM 367 CA ILE A 24 -13.084 -2.272 2.360 1.00 0.00 C ATOM 368 C ILE A 24 -12.263 -2.945 3.458 1.00 0.00 C ATOM 369 O ILE A 24 -11.352 -2.342 4.036 1.00 0.00 O ATOM 370 CB ILE A 24 -12.940 -3.089 1.056 1.00 0.00 C ATOM 371 CG1 ILE A 24 -11.489 -3.053 0.555 1.00 0.00 C ATOM 372 CG2 ILE A 24 -13.891 -2.559 -0.010 1.00 0.00 C ATOM 373 CD1 ILE A 24 -11.232 -3.947 -0.641 1.00 0.00 C ATOM 0 H ILE A 24 -12.157 -0.715 1.310 1.00 0.00 H new ATOM 0 HA ILE A 24 -14.132 -2.253 2.660 1.00 0.00 H new ATOM 0 HB ILE A 24 -13.202 -4.126 1.266 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -11.231 -2.027 0.292 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -10.826 -3.350 1.368 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -13.778 -3.145 -0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -14.918 -2.638 0.347 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -13.659 -1.515 -0.218 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -10.186 -3.868 -0.937 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -11.457 -4.980 -0.378 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -11.868 -3.637 -1.470 1.00 0.00 H new ATOM 385 N SER A 25 -12.591 -4.200 3.730 1.00 0.00 N ATOM 386 CA SER A 25 -11.923 -4.973 4.763 1.00 0.00 C ATOM 387 C SER A 25 -10.698 -5.678 4.189 1.00 0.00 C ATOM 388 O SER A 25 -10.779 -6.349 3.157 1.00 0.00 O ATOM 389 CB SER A 25 -12.902 -5.997 5.354 1.00 0.00 C ATOM 390 OG SER A 25 -12.315 -6.762 6.394 1.00 0.00 O ATOM 0 H SER A 25 -13.327 -4.709 3.241 1.00 0.00 H new ATOM 0 HA SER A 25 -11.591 -4.300 5.554 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.780 -5.478 5.738 1.00 0.00 H new ATOM 0 HB3 SER A 25 -13.247 -6.665 4.565 1.00 0.00 H new ATOM 0 HG SER A 25 -12.973 -7.399 6.743 1.00 0.00 H new ATOM 396 N PHE A 26 -9.560 -5.505 4.845 1.00 0.00 N ATOM 397 CA PHE A 26 -8.334 -6.154 4.421 1.00 0.00 C ATOM 398 C PHE A 26 -8.288 -7.578 4.960 1.00 0.00 C ATOM 399 O PHE A 26 -7.848 -7.812 6.080 1.00 0.00 O ATOM 400 CB PHE A 26 -7.108 -5.371 4.901 1.00 0.00 C ATOM 401 CG PHE A 26 -5.849 -5.701 4.148 1.00 0.00 C ATOM 402 CD1 PHE A 26 -5.526 -5.014 2.987 1.00 0.00 C ATOM 403 CD2 PHE A 26 -4.989 -6.690 4.599 1.00 0.00 C ATOM 404 CE1 PHE A 26 -4.372 -5.310 2.289 1.00 0.00 C ATOM 405 CE2 PHE A 26 -3.833 -6.991 3.904 1.00 0.00 C ATOM 406 CZ PHE A 26 -3.525 -6.299 2.747 1.00 0.00 C ATOM 0 H PHE A 26 -9.463 -4.919 5.674 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.317 -6.181 3.331 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -7.309 -4.304 4.806 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -6.951 -5.573 5.961 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.185 -4.239 2.625 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -5.225 -7.231 5.503 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.132 -4.768 1.386 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.171 -7.765 4.264 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.622 -6.532 2.202 1.00 0.00 H new ATOM 416 N LEU A 27 -8.794 -8.513 4.173 1.00 0.00 N ATOM 417 CA LEU A 27 -8.757 -9.923 4.535 1.00 0.00 C ATOM 418 C LEU A 27 -8.089 -10.728 3.429 1.00 0.00 C ATOM 419 O LEU A 27 -6.922 -11.099 3.529 1.00 0.00 O ATOM 420 CB LEU A 27 -10.172 -10.462 4.770 1.00 0.00 C ATOM 421 CG LEU A 27 -10.973 -9.771 5.877 1.00 0.00 C ATOM 422 CD1 LEU A 27 -12.399 -10.293 5.900 1.00 0.00 C ATOM 423 CD2 LEU A 27 -10.315 -9.986 7.230 1.00 0.00 C ATOM 0 H LEU A 27 -9.238 -8.321 3.275 1.00 0.00 H new ATOM 0 HA LEU A 27 -8.185 -10.021 5.457 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.731 -10.380 3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.101 -11.524 5.007 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.993 -8.701 5.669 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.957 -9.793 6.692 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.875 -10.094 4.940 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -12.390 -11.367 6.085 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -10.900 -9.487 8.003 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.266 -11.053 7.445 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.307 -9.572 7.214 1.00 0.00 H new ATOM 435 N GLY A 28 -8.838 -10.974 2.363 1.00 0.00 N ATOM 436 CA GLY A 28 -8.315 -11.714 1.235 1.00 0.00 C ATOM 437 C GLY A 28 -9.010 -11.324 -0.050 1.00 0.00 C ATOM 438 O GLY A 28 -9.616 -12.158 -0.718 1.00 0.00 O ATOM 0 H GLY A 28 -9.806 -10.671 2.260 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.245 -11.530 1.142 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -8.441 -12.783 1.409 1.00 0.00 H new ATOM 442 N GLY A 29 -8.926 -10.047 -0.392 1.00 0.00 N ATOM 443 CA GLY A 29 -9.598 -9.548 -1.577 1.00 0.00 C ATOM 444 C GLY A 29 -8.768 -9.726 -2.832 1.00 0.00 C ATOM 445 O GLY A 29 -9.052 -9.120 -3.859 1.00 0.00 O ATOM 0 H GLY A 29 -8.403 -9.344 0.131 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -10.549 -10.067 -1.697 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.827 -8.491 -1.443 1.00 0.00 H new ATOM 449 N ILE A 30 -7.748 -10.563 -2.745 1.00 0.00 N ATOM 450 CA ILE A 30 -6.858 -10.831 -3.862 1.00 0.00 C ATOM 451 C ILE A 30 -6.631 -12.336 -3.978 1.00 0.00 C ATOM 452 O ILE A 30 -6.412 -13.009 -2.970 1.00 0.00 O ATOM 453 CB ILE A 30 -5.494 -10.126 -3.672 1.00 0.00 C ATOM 454 CG1 ILE A 30 -5.697 -8.626 -3.434 1.00 0.00 C ATOM 455 CG2 ILE A 30 -4.596 -10.357 -4.881 1.00 0.00 C ATOM 456 CD1 ILE A 30 -4.416 -7.865 -3.165 1.00 0.00 C ATOM 0 H ILE A 30 -7.513 -11.077 -1.896 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.323 -10.446 -4.770 1.00 0.00 H new ATOM 0 HB ILE A 30 -5.005 -10.554 -2.796 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.188 -8.194 -4.306 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.372 -8.491 -2.589 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.642 -9.853 -4.727 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.425 -11.426 -5.008 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.078 -9.958 -5.774 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.645 -6.811 -3.007 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.933 -8.269 -2.275 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.746 -7.967 -4.019 1.00 0.00 H new ATOM 468 N ASP A 31 -6.712 -12.862 -5.194 1.00 0.00 N ATOM 469 CA ASP A 31 -6.474 -14.281 -5.432 1.00 0.00 C ATOM 470 C ASP A 31 -5.019 -14.629 -5.148 1.00 0.00 C ATOM 471 O ASP A 31 -4.110 -13.920 -5.574 1.00 0.00 O ATOM 472 CB ASP A 31 -6.822 -14.650 -6.872 1.00 0.00 C ATOM 473 CG ASP A 31 -6.769 -16.143 -7.109 1.00 0.00 C ATOM 474 OD1 ASP A 31 -5.669 -16.668 -7.359 1.00 0.00 O ATOM 475 OD2 ASP A 31 -7.833 -16.796 -7.044 1.00 0.00 O ATOM 0 H ASP A 31 -6.941 -12.327 -6.032 1.00 0.00 H new ATOM 0 HA ASP A 31 -7.114 -14.851 -4.759 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -7.820 -14.282 -7.108 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -6.130 -14.152 -7.550 1.00 0.00 H new ATOM 480 N LYS A 32 -4.807 -15.735 -4.455 1.00 0.00 N ATOM 481 CA LYS A 32 -3.477 -16.100 -3.989 1.00 0.00 C ATOM 482 C LYS A 32 -2.641 -16.768 -5.080 1.00 0.00 C ATOM 483 O LYS A 32 -1.450 -17.006 -4.885 1.00 0.00 O ATOM 484 CB LYS A 32 -3.581 -17.026 -2.772 1.00 0.00 C ATOM 485 CG LYS A 32 -4.331 -18.326 -3.041 1.00 0.00 C ATOM 486 CD LYS A 32 -4.457 -19.174 -1.784 1.00 0.00 C ATOM 487 CE LYS A 32 -5.288 -18.473 -0.716 1.00 0.00 C ATOM 488 NZ LYS A 32 -5.371 -19.267 0.539 1.00 0.00 N ATOM 0 H LYS A 32 -5.540 -16.398 -4.201 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.970 -15.177 -3.709 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -2.576 -17.264 -2.423 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.080 -16.492 -1.964 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -5.324 -18.099 -3.428 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -3.810 -18.894 -3.812 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.916 -20.130 -2.034 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.464 -19.391 -1.389 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -4.851 -17.498 -0.499 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.293 -18.294 -1.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -5.945 -18.753 1.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -5.811 -20.188 0.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -4.415 -19.416 0.919 1.00 0.00 H new ATOM 502 N GLU A 33 -3.249 -17.067 -6.224 1.00 0.00 N ATOM 503 CA GLU A 33 -2.540 -17.781 -7.276 1.00 0.00 C ATOM 504 C GLU A 33 -2.413 -16.963 -8.560 1.00 0.00 C ATOM 505 O GLU A 33 -1.447 -17.128 -9.304 1.00 0.00 O ATOM 506 CB GLU A 33 -3.225 -19.115 -7.565 1.00 0.00 C ATOM 507 CG GLU A 33 -3.155 -20.092 -6.401 1.00 0.00 C ATOM 508 CD GLU A 33 -3.590 -21.488 -6.785 1.00 0.00 C ATOM 509 OE1 GLU A 33 -4.811 -21.735 -6.867 1.00 0.00 O ATOM 510 OE2 GLU A 33 -2.710 -22.342 -7.031 1.00 0.00 O ATOM 0 H GLU A 33 -4.217 -16.830 -6.443 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.529 -17.962 -6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.270 -18.932 -7.815 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.763 -19.570 -8.441 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.134 -20.126 -6.021 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.786 -19.730 -5.589 1.00 0.00 H new ATOM 517 N THR A 34 -3.375 -16.092 -8.838 1.00 0.00 N ATOM 518 CA THR A 34 -3.295 -15.272 -10.045 1.00 0.00 C ATOM 519 C THR A 34 -3.355 -13.766 -9.739 1.00 0.00 C ATOM 520 O THR A 34 -3.201 -12.937 -10.641 1.00 0.00 O ATOM 521 CB THR A 34 -4.390 -15.660 -11.067 1.00 0.00 C ATOM 522 OG1 THR A 34 -4.302 -14.830 -12.231 1.00 0.00 O ATOM 523 CG2 THR A 34 -5.778 -15.549 -10.460 1.00 0.00 C ATOM 0 H THR A 34 -4.202 -15.935 -8.261 1.00 0.00 H new ATOM 0 HA THR A 34 -2.320 -15.476 -10.488 1.00 0.00 H new ATOM 0 HB THR A 34 -4.224 -16.699 -11.352 1.00 0.00 H new ATOM 0 HG1 THR A 34 -3.919 -13.962 -11.986 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.524 -15.828 -11.204 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.854 -16.216 -9.601 1.00 0.00 H new ATOM 0 HG23 THR A 34 -5.953 -14.522 -10.138 1.00 0.00 H new ATOM 531 N GLY A 35 -3.568 -13.410 -8.474 1.00 0.00 N ATOM 532 CA GLY A 35 -3.558 -12.006 -8.080 1.00 0.00 C ATOM 533 C GLY A 35 -4.755 -11.223 -8.599 1.00 0.00 C ATOM 534 O GLY A 35 -4.661 -10.014 -8.820 1.00 0.00 O ATOM 0 H GLY A 35 -3.747 -14.066 -7.714 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.536 -11.942 -6.992 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -2.643 -11.540 -8.446 1.00 0.00 H new ATOM 538 N ILE A 36 -5.871 -11.911 -8.804 1.00 0.00 N ATOM 539 CA ILE A 36 -7.112 -11.263 -9.228 1.00 0.00 C ATOM 540 C ILE A 36 -7.902 -10.796 -8.013 1.00 0.00 C ATOM 541 O ILE A 36 -8.126 -11.566 -7.082 1.00 0.00 O ATOM 542 CB ILE A 36 -8.003 -12.218 -10.059 1.00 0.00 C ATOM 543 CG1 ILE A 36 -7.277 -12.666 -11.329 1.00 0.00 C ATOM 544 CG2 ILE A 36 -9.329 -11.555 -10.412 1.00 0.00 C ATOM 545 CD1 ILE A 36 -6.980 -11.548 -12.298 1.00 0.00 C ATOM 0 H ILE A 36 -5.945 -12.921 -8.684 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.834 -10.412 -9.850 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.212 -13.098 -9.451 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.340 -13.147 -11.048 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.883 -13.418 -11.834 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.937 -12.246 -10.996 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -9.858 -11.290 -9.497 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.141 -10.654 -10.996 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.465 -11.950 -13.170 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.913 -11.081 -12.611 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.347 -10.805 -11.813 1.00 0.00 H new ATOM 557 N VAL A 37 -8.313 -9.537 -8.019 1.00 0.00 N ATOM 558 CA VAL A 37 -9.117 -8.987 -6.931 1.00 0.00 C ATOM 559 C VAL A 37 -10.475 -9.689 -6.842 1.00 0.00 C ATOM 560 O VAL A 37 -11.191 -9.813 -7.835 1.00 0.00 O ATOM 561 CB VAL A 37 -9.339 -7.466 -7.104 1.00 0.00 C ATOM 562 CG1 VAL A 37 -10.213 -6.904 -5.990 1.00 0.00 C ATOM 563 CG2 VAL A 37 -8.006 -6.738 -7.144 1.00 0.00 C ATOM 0 H VAL A 37 -8.104 -8.874 -8.765 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.563 -9.158 -6.008 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.857 -7.309 -8.050 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.350 -5.833 -6.140 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -11.184 -7.400 -6.004 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.731 -7.077 -5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.179 -5.669 -7.266 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.467 -6.914 -6.213 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.414 -7.108 -7.981 1.00 0.00 H new ATOM 573 N LYS A 38 -10.809 -10.148 -5.645 1.00 0.00 N ATOM 574 CA LYS A 38 -12.062 -10.857 -5.400 1.00 0.00 C ATOM 575 C LYS A 38 -13.178 -9.877 -5.071 1.00 0.00 C ATOM 576 O LYS A 38 -14.308 -10.018 -5.538 1.00 0.00 O ATOM 577 CB LYS A 38 -11.897 -11.825 -4.225 1.00 0.00 C ATOM 578 CG LYS A 38 -10.791 -12.848 -4.408 1.00 0.00 C ATOM 579 CD LYS A 38 -11.134 -13.855 -5.490 1.00 0.00 C ATOM 580 CE LYS A 38 -10.007 -14.853 -5.680 1.00 0.00 C ATOM 581 NZ LYS A 38 -10.362 -15.932 -6.639 1.00 0.00 N ATOM 0 H LYS A 38 -10.223 -10.041 -4.817 1.00 0.00 H new ATOM 0 HA LYS A 38 -12.319 -11.409 -6.304 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.698 -11.250 -3.321 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.839 -12.350 -4.067 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.863 -12.338 -4.666 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -10.618 -13.370 -3.467 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.050 -14.382 -5.224 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.326 -13.335 -6.428 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -9.119 -14.331 -6.037 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.751 -15.296 -4.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.502 -16.446 -6.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -11.028 -16.591 -6.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -10.805 -15.515 -7.483 1.00 0.00 H new ATOM 595 N GLU A 39 -12.841 -8.882 -4.268 1.00 0.00 N ATOM 596 CA GLU A 39 -13.823 -7.954 -3.734 1.00 0.00 C ATOM 597 C GLU A 39 -14.003 -6.762 -4.662 1.00 0.00 C ATOM 598 O GLU A 39 -13.046 -6.045 -4.960 1.00 0.00 O ATOM 599 CB GLU A 39 -13.376 -7.478 -2.352 1.00 0.00 C ATOM 600 CG GLU A 39 -14.465 -6.769 -1.567 1.00 0.00 C ATOM 601 CD GLU A 39 -15.681 -7.645 -1.349 1.00 0.00 C ATOM 602 OE1 GLU A 39 -15.603 -8.594 -0.542 1.00 0.00 O ATOM 603 OE2 GLU A 39 -16.728 -7.387 -1.982 1.00 0.00 O ATOM 0 H GLU A 39 -11.884 -8.695 -3.969 1.00 0.00 H new ATOM 0 HA GLU A 39 -14.781 -8.468 -3.651 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.027 -8.336 -1.778 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.527 -6.805 -2.467 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.068 -6.456 -0.601 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -14.762 -5.865 -2.098 1.00 0.00 H new ATOM 610 N ASP A 40 -15.227 -6.543 -5.116 1.00 0.00 N ATOM 611 CA ASP A 40 -15.503 -5.433 -6.017 1.00 0.00 C ATOM 612 C ASP A 40 -15.491 -4.106 -5.271 1.00 0.00 C ATOM 613 O ASP A 40 -16.085 -3.967 -4.197 1.00 0.00 O ATOM 614 CB ASP A 40 -16.842 -5.615 -6.734 1.00 0.00 C ATOM 615 CG ASP A 40 -17.186 -4.417 -7.603 1.00 0.00 C ATOM 616 OD1 ASP A 40 -16.345 -4.021 -8.437 1.00 0.00 O ATOM 617 OD2 ASP A 40 -18.288 -3.853 -7.439 1.00 0.00 O ATOM 0 H ASP A 40 -16.039 -7.113 -4.879 1.00 0.00 H new ATOM 0 HA ASP A 40 -14.711 -5.422 -6.765 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -16.804 -6.513 -7.351 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -17.631 -5.768 -5.997 1.00 0.00 H new ATOM 622 N CYS A 41 -14.809 -3.136 -5.853 1.00 0.00 N ATOM 623 CA CYS A 41 -14.729 -1.799 -5.287 1.00 0.00 C ATOM 624 C CYS A 41 -15.230 -0.776 -6.300 1.00 0.00 C ATOM 625 O CYS A 41 -15.762 0.272 -5.932 1.00 0.00 O ATOM 626 CB CYS A 41 -13.285 -1.494 -4.886 1.00 0.00 C ATOM 627 SG CYS A 41 -12.567 -2.715 -3.763 1.00 0.00 S ATOM 0 H CYS A 41 -14.297 -3.251 -6.728 1.00 0.00 H new ATOM 0 HA CYS A 41 -15.358 -1.744 -4.399 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -12.672 -1.437 -5.786 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -13.249 -0.513 -4.413 1.00 0.00 H new ATOM 0 HG CYS A 41 -12.766 -3.909 -4.236 1.00 0.00 H new ATOM 633 N GLU A 42 -15.079 -1.121 -7.577 1.00 0.00 N ATOM 634 CA GLU A 42 -15.480 -0.267 -8.690 1.00 0.00 C ATOM 635 C GLU A 42 -15.049 -0.949 -9.982 1.00 0.00 C ATOM 636 O GLU A 42 -15.872 -1.341 -10.808 1.00 0.00 O ATOM 637 CB GLU A 42 -14.820 1.118 -8.587 1.00 0.00 C ATOM 638 CG GLU A 42 -15.644 2.254 -9.185 1.00 0.00 C ATOM 639 CD GLU A 42 -15.967 2.063 -10.652 1.00 0.00 C ATOM 640 OE1 GLU A 42 -15.110 2.375 -11.504 1.00 0.00 O ATOM 641 OE2 GLU A 42 -17.095 1.613 -10.961 1.00 0.00 O ATOM 0 H GLU A 42 -14.671 -2.009 -7.870 1.00 0.00 H new ATOM 0 HA GLU A 42 -16.560 -0.122 -8.670 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -14.628 1.338 -7.537 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -13.852 1.084 -9.088 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.575 2.349 -8.626 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -15.100 3.190 -9.060 1.00 0.00 H new ATOM 648 N ILE A 43 -13.742 -1.123 -10.114 1.00 0.00 N ATOM 649 CA ILE A 43 -13.148 -1.768 -11.273 1.00 0.00 C ATOM 650 C ILE A 43 -12.479 -3.078 -10.865 1.00 0.00 C ATOM 651 O ILE A 43 -11.253 -3.190 -10.814 1.00 0.00 O ATOM 652 CB ILE A 43 -12.128 -0.845 -11.974 1.00 0.00 C ATOM 653 CG1 ILE A 43 -11.219 -0.160 -10.942 1.00 0.00 C ATOM 654 CG2 ILE A 43 -12.853 0.190 -12.822 1.00 0.00 C ATOM 655 CD1 ILE A 43 -10.147 0.719 -11.553 1.00 0.00 C ATOM 0 H ILE A 43 -13.062 -0.819 -9.417 1.00 0.00 H new ATOM 0 HA ILE A 43 -13.949 -1.981 -11.981 1.00 0.00 H new ATOM 0 HB ILE A 43 -11.501 -1.452 -12.627 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -11.834 0.445 -10.276 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -10.742 -0.925 -10.329 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -12.123 0.835 -13.311 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -13.455 -0.315 -13.577 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -13.501 0.793 -12.185 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -9.548 1.166 -10.760 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.506 0.117 -12.197 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -10.615 1.507 -12.143 1.00 0.00 H new ATOM 667 N LYS A 44 -13.306 -4.053 -10.534 1.00 0.00 N ATOM 668 CA LYS A 44 -12.831 -5.354 -10.084 1.00 0.00 C ATOM 669 C LYS A 44 -12.736 -6.329 -11.256 1.00 0.00 C ATOM 670 O LYS A 44 -13.582 -6.327 -12.151 1.00 0.00 O ATOM 671 CB LYS A 44 -13.772 -5.882 -8.984 1.00 0.00 C ATOM 672 CG LYS A 44 -13.545 -7.331 -8.561 1.00 0.00 C ATOM 673 CD LYS A 44 -14.358 -8.296 -9.416 1.00 0.00 C ATOM 674 CE LYS A 44 -14.247 -9.724 -8.918 1.00 0.00 C ATOM 675 NZ LYS A 44 -14.976 -10.663 -9.808 1.00 0.00 N ATOM 0 H LYS A 44 -14.322 -3.969 -10.568 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.828 -5.254 -9.669 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -13.668 -5.245 -8.105 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -14.800 -5.781 -9.331 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.486 -7.574 -8.644 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.819 -7.452 -7.513 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -15.404 -7.991 -9.413 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.014 -8.244 -10.449 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.197 -10.012 -8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.649 -9.791 -7.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.882 -11.632 -9.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.982 -10.401 -9.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.575 -10.615 -10.766 1.00 0.00 H new ATOM 689 N GLY A 45 -11.686 -7.144 -11.253 1.00 0.00 N ATOM 690 CA GLY A 45 -11.549 -8.177 -12.258 1.00 0.00 C ATOM 691 C GLY A 45 -10.140 -8.280 -12.811 1.00 0.00 C ATOM 692 O GLY A 45 -9.829 -9.213 -13.552 1.00 0.00 O ATOM 0 H GLY A 45 -10.928 -7.106 -10.571 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.836 -9.136 -11.827 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.241 -7.975 -13.076 1.00 0.00 H new ATOM 696 N GLU A 46 -9.286 -7.337 -12.445 1.00 0.00 N ATOM 697 CA GLU A 46 -7.935 -7.291 -12.985 1.00 0.00 C ATOM 698 C GLU A 46 -6.911 -7.794 -11.976 1.00 0.00 C ATOM 699 O GLU A 46 -7.234 -8.060 -10.814 1.00 0.00 O ATOM 700 CB GLU A 46 -7.585 -5.869 -13.423 1.00 0.00 C ATOM 701 CG GLU A 46 -8.487 -5.338 -14.520 1.00 0.00 C ATOM 702 CD GLU A 46 -8.031 -3.998 -15.046 1.00 0.00 C ATOM 703 OE1 GLU A 46 -8.389 -2.967 -14.448 1.00 0.00 O ATOM 704 OE2 GLU A 46 -7.306 -3.971 -16.065 1.00 0.00 O ATOM 0 H GLU A 46 -9.503 -6.596 -11.779 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.904 -7.951 -13.852 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.645 -5.206 -12.560 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.552 -5.847 -13.770 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.517 -6.055 -15.340 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.504 -5.248 -14.138 1.00 0.00 H new ATOM 711 N SER A 47 -5.674 -7.921 -12.438 1.00 0.00 N ATOM 712 CA SER A 47 -4.586 -8.415 -11.612 1.00 0.00 C ATOM 713 C SER A 47 -3.839 -7.257 -10.957 1.00 0.00 C ATOM 714 O SER A 47 -3.574 -6.238 -11.594 1.00 0.00 O ATOM 715 CB SER A 47 -3.613 -9.229 -12.469 1.00 0.00 C ATOM 716 OG SER A 47 -4.301 -10.166 -13.284 1.00 0.00 O ATOM 0 H SER A 47 -5.400 -7.685 -13.392 1.00 0.00 H new ATOM 0 HA SER A 47 -5.006 -9.049 -10.831 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.029 -8.557 -13.098 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.908 -9.754 -11.824 1.00 0.00 H new ATOM 0 HG SER A 47 -3.654 -10.670 -13.821 1.00 0.00 H new ATOM 722 N VAL A 48 -3.502 -7.415 -9.685 1.00 0.00 N ATOM 723 CA VAL A 48 -2.690 -6.426 -8.980 1.00 0.00 C ATOM 724 C VAL A 48 -1.239 -6.892 -8.895 1.00 0.00 C ATOM 725 O VAL A 48 -0.389 -6.217 -8.310 1.00 0.00 O ATOM 726 CB VAL A 48 -3.215 -6.151 -7.556 1.00 0.00 C ATOM 727 CG1 VAL A 48 -4.583 -5.491 -7.608 1.00 0.00 C ATOM 728 CG2 VAL A 48 -3.269 -7.438 -6.743 1.00 0.00 C ATOM 0 H VAL A 48 -3.777 -8.217 -9.118 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.753 -5.500 -9.552 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.524 -5.467 -7.064 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.936 -5.305 -6.594 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.511 -4.546 -8.146 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -5.285 -6.148 -8.122 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.642 -7.221 -5.742 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.935 -8.149 -7.232 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.269 -7.866 -6.672 1.00 0.00 H new ATOM 738 N ALA A 49 -0.975 -8.042 -9.505 1.00 0.00 N ATOM 739 CA ALA A 49 0.331 -8.671 -9.480 1.00 0.00 C ATOM 740 C ALA A 49 1.354 -7.820 -10.206 1.00 0.00 C ATOM 741 O ALA A 49 1.471 -7.859 -11.432 1.00 0.00 O ATOM 742 CB ALA A 49 0.261 -10.067 -10.088 1.00 0.00 C ATOM 0 H ALA A 49 -1.672 -8.565 -10.035 1.00 0.00 H new ATOM 0 HA ALA A 49 0.647 -8.763 -8.441 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.250 -10.525 -10.062 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.438 -10.678 -9.517 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.079 -9.997 -11.121 1.00 0.00 H new ATOM 748 N GLY A 50 2.047 -7.015 -9.434 1.00 0.00 N ATOM 749 CA GLY A 50 3.117 -6.195 -9.964 1.00 0.00 C ATOM 750 C GLY A 50 2.672 -4.777 -10.263 1.00 0.00 C ATOM 751 O GLY A 50 3.374 -4.030 -10.946 1.00 0.00 O ATOM 0 H GLY A 50 1.889 -6.909 -8.432 1.00 0.00 H new ATOM 0 HA2 GLY A 50 3.939 -6.171 -9.249 1.00 0.00 H new ATOM 0 HA3 GLY A 50 3.501 -6.651 -10.876 1.00 0.00 H new ATOM 755 N ARG A 51 1.509 -4.402 -9.751 1.00 0.00 N ATOM 756 CA ARG A 51 1.012 -3.044 -9.916 1.00 0.00 C ATOM 757 C ARG A 51 1.167 -2.256 -8.621 1.00 0.00 C ATOM 758 O ARG A 51 1.390 -2.834 -7.557 1.00 0.00 O ATOM 759 CB ARG A 51 -0.450 -3.051 -10.359 1.00 0.00 C ATOM 760 CG ARG A 51 -0.640 -3.420 -11.821 1.00 0.00 C ATOM 761 CD ARG A 51 -2.093 -3.299 -12.242 1.00 0.00 C ATOM 762 NE ARG A 51 -2.249 -3.402 -13.693 1.00 0.00 N ATOM 763 CZ ARG A 51 -3.313 -2.962 -14.365 1.00 0.00 C ATOM 764 NH1 ARG A 51 -4.351 -2.445 -13.716 1.00 0.00 N ATOM 765 NH2 ARG A 51 -3.347 -3.053 -15.686 1.00 0.00 N ATOM 0 H ARG A 51 0.893 -5.017 -9.219 1.00 0.00 H new ATOM 0 HA ARG A 51 1.604 -2.559 -10.692 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.005 -3.755 -9.740 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -0.879 -2.065 -10.183 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.025 -2.771 -12.444 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -0.296 -4.441 -11.987 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.678 -4.081 -11.757 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.492 -2.344 -11.900 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.496 -3.838 -14.224 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.337 -2.383 -12.698 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.162 -2.110 -14.236 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.559 -3.460 -16.190 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -4.161 -2.716 -16.200 1.00 0.00 H new ATOM 779 N ILE A 52 1.047 -0.940 -8.717 1.00 0.00 N ATOM 780 CA ILE A 52 1.193 -0.070 -7.558 1.00 0.00 C ATOM 781 C ILE A 52 -0.177 0.243 -6.982 1.00 0.00 C ATOM 782 O ILE A 52 -0.980 0.931 -7.604 1.00 0.00 O ATOM 783 CB ILE A 52 1.924 1.246 -7.918 1.00 0.00 C ATOM 784 CG1 ILE A 52 3.306 0.952 -8.514 1.00 0.00 C ATOM 785 CG2 ILE A 52 2.050 2.147 -6.696 1.00 0.00 C ATOM 786 CD1 ILE A 52 4.217 0.164 -7.597 1.00 0.00 C ATOM 0 H ILE A 52 0.848 -0.449 -9.589 1.00 0.00 H new ATOM 0 HA ILE A 52 1.798 -0.594 -6.818 1.00 0.00 H new ATOM 0 HB ILE A 52 1.330 1.769 -8.668 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.179 0.400 -9.445 1.00 0.00 H new ATOM 0 HG13 ILE A 52 3.790 1.896 -8.767 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.567 3.066 -6.973 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.057 2.389 -6.319 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.617 1.631 -5.921 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.174 -0.003 -8.091 1.00 0.00 H new ATOM 0 HD12 ILE A 52 4.377 0.723 -6.675 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.757 -0.796 -7.364 1.00 0.00 H new ATOM 798 N LEU A 53 -0.445 -0.278 -5.799 1.00 0.00 N ATOM 799 CA LEU A 53 -1.770 -0.177 -5.209 1.00 0.00 C ATOM 800 C LEU A 53 -1.804 0.918 -4.145 1.00 0.00 C ATOM 801 O LEU A 53 -0.990 0.926 -3.218 1.00 0.00 O ATOM 802 CB LEU A 53 -2.166 -1.530 -4.614 1.00 0.00 C ATOM 803 CG LEU A 53 -3.641 -1.685 -4.232 1.00 0.00 C ATOM 804 CD1 LEU A 53 -4.544 -1.370 -5.416 1.00 0.00 C ATOM 805 CD2 LEU A 53 -3.904 -3.094 -3.730 1.00 0.00 C ATOM 0 H LEU A 53 0.237 -0.776 -5.226 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.488 0.093 -5.983 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.913 -2.310 -5.332 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.560 -1.706 -3.725 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.866 -0.976 -3.435 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -5.586 -1.487 -5.120 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -4.372 -0.344 -5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -4.321 -2.053 -6.236 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.956 -3.194 -3.461 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.660 -3.811 -4.514 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.285 -3.290 -2.854 1.00 0.00 H new ATOM 817 N VAL A 54 -2.741 1.846 -4.291 1.00 0.00 N ATOM 818 CA VAL A 54 -2.847 2.976 -3.379 1.00 0.00 C ATOM 819 C VAL A 54 -4.140 2.906 -2.571 1.00 0.00 C ATOM 820 O VAL A 54 -5.224 2.753 -3.131 1.00 0.00 O ATOM 821 CB VAL A 54 -2.803 4.318 -4.144 1.00 0.00 C ATOM 822 CG1 VAL A 54 -2.855 5.492 -3.176 1.00 0.00 C ATOM 823 CG2 VAL A 54 -1.556 4.397 -5.012 1.00 0.00 C ATOM 0 H VAL A 54 -3.440 1.838 -5.034 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.994 2.923 -2.702 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.678 4.370 -4.792 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.823 6.427 -3.736 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.778 5.447 -2.598 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.001 5.444 -2.500 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -1.542 5.349 -5.543 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.669 4.320 -4.383 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.562 3.579 -5.733 1.00 0.00 H new ATOM 833 N PHE A 55 -4.010 3.020 -1.254 1.00 0.00 N ATOM 834 CA PHE A 55 -5.160 3.030 -0.354 1.00 0.00 C ATOM 835 C PHE A 55 -5.051 4.183 0.637 1.00 0.00 C ATOM 836 O PHE A 55 -3.949 4.551 1.050 1.00 0.00 O ATOM 837 CB PHE A 55 -5.273 1.716 0.429 1.00 0.00 C ATOM 838 CG PHE A 55 -5.839 0.565 -0.352 1.00 0.00 C ATOM 839 CD1 PHE A 55 -7.136 0.609 -0.840 1.00 0.00 C ATOM 840 CD2 PHE A 55 -5.084 -0.571 -0.576 1.00 0.00 C ATOM 841 CE1 PHE A 55 -7.665 -0.458 -1.538 1.00 0.00 C ATOM 842 CE2 PHE A 55 -5.607 -1.639 -1.277 1.00 0.00 C ATOM 843 CZ PHE A 55 -6.899 -1.583 -1.758 1.00 0.00 C ATOM 0 H PHE A 55 -3.111 3.108 -0.781 1.00 0.00 H new ATOM 0 HA PHE A 55 -6.050 3.151 -0.971 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -4.283 1.439 0.792 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -5.898 1.884 1.306 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -7.740 1.489 -0.672 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -4.074 -0.624 -0.198 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -8.677 -0.412 -1.911 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.005 -2.519 -1.449 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.309 -2.419 -2.306 1.00 0.00 H new ATOM 853 N PRO A 56 -6.190 4.776 1.023 1.00 0.00 N ATOM 854 CA PRO A 56 -6.226 5.831 2.036 1.00 0.00 C ATOM 855 C PRO A 56 -6.081 5.271 3.452 1.00 0.00 C ATOM 856 O PRO A 56 -5.244 5.732 4.232 1.00 0.00 O ATOM 857 CB PRO A 56 -7.608 6.459 1.838 1.00 0.00 C ATOM 858 CG PRO A 56 -8.451 5.370 1.270 1.00 0.00 C ATOM 859 CD PRO A 56 -7.527 4.481 0.478 1.00 0.00 C ATOM 0 HA PRO A 56 -5.405 6.540 1.927 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -8.015 6.821 2.782 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -7.560 7.313 1.163 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.944 4.808 2.063 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -9.236 5.779 0.633 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.784 3.429 0.600 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -7.580 4.700 -0.588 1.00 0.00 H new ATOM 867 N GLY A 57 -6.893 4.263 3.760 1.00 0.00 N ATOM 868 CA GLY A 57 -6.897 3.666 5.081 1.00 0.00 C ATOM 869 C GLY A 57 -8.231 3.018 5.392 1.00 0.00 C ATOM 870 O GLY A 57 -9.110 3.644 5.982 1.00 0.00 O ATOM 0 H GLY A 57 -7.556 3.846 3.107 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -6.105 2.920 5.147 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -6.679 4.430 5.828 1.00 0.00 H new ATOM 969 N TYR A 66 2.270 -11.917 7.383 1.00 0.00 N ATOM 970 CA TYR A 66 2.457 -13.272 6.842 1.00 0.00 C ATOM 971 C TYR A 66 1.798 -13.452 5.477 1.00 0.00 C ATOM 972 O TYR A 66 2.453 -13.873 4.523 1.00 0.00 O ATOM 973 CB TYR A 66 1.958 -14.343 7.818 1.00 0.00 C ATOM 974 CG TYR A 66 2.704 -14.361 9.133 1.00 0.00 C ATOM 975 CD1 TYR A 66 3.999 -14.859 9.208 1.00 0.00 C ATOM 976 CD2 TYR A 66 2.118 -13.876 10.294 1.00 0.00 C ATOM 977 CE1 TYR A 66 4.687 -14.874 10.405 1.00 0.00 C ATOM 978 CE2 TYR A 66 2.799 -13.887 11.494 1.00 0.00 C ATOM 979 CZ TYR A 66 4.084 -14.387 11.543 1.00 0.00 C ATOM 980 OH TYR A 66 4.764 -14.402 12.739 1.00 0.00 O ATOM 0 HA TYR A 66 3.531 -13.399 6.708 1.00 0.00 H new ATOM 0 HB2 TYR A 66 0.898 -14.178 8.014 1.00 0.00 H new ATOM 0 HB3 TYR A 66 2.047 -15.322 7.346 1.00 0.00 H new ATOM 0 HD1 TYR A 66 4.475 -15.240 8.316 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.112 -13.484 10.258 1.00 0.00 H new ATOM 0 HE1 TYR A 66 5.693 -15.266 10.448 1.00 0.00 H new ATOM 0 HE2 TYR A 66 2.329 -13.507 12.389 1.00 0.00 H new ATOM 0 HH TYR A 66 4.197 -14.022 13.442 1.00 0.00 H new ATOM 990 N VAL A 67 0.516 -13.123 5.378 1.00 0.00 N ATOM 991 CA VAL A 67 -0.236 -13.335 4.141 1.00 0.00 C ATOM 992 C VAL A 67 0.386 -12.589 2.960 1.00 0.00 C ATOM 993 O VAL A 67 0.449 -13.119 1.851 1.00 0.00 O ATOM 994 CB VAL A 67 -1.719 -12.932 4.295 1.00 0.00 C ATOM 995 CG1 VAL A 67 -2.414 -13.844 5.292 1.00 0.00 C ATOM 996 CG2 VAL A 67 -1.858 -11.479 4.724 1.00 0.00 C ATOM 0 H VAL A 67 -0.027 -12.709 6.136 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.189 -14.404 3.934 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.197 -13.041 3.321 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.458 -13.547 5.390 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.361 -14.875 4.941 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -1.922 -13.765 6.262 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -2.914 -11.228 4.823 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.359 -11.333 5.682 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.400 -10.833 3.975 1.00 0.00 H new ATOM 1006 N LEU A 68 0.868 -11.371 3.206 1.00 0.00 N ATOM 1007 CA LEU A 68 1.493 -10.574 2.157 1.00 0.00 C ATOM 1008 C LEU A 68 2.775 -11.233 1.667 1.00 0.00 C ATOM 1009 O LEU A 68 3.099 -11.173 0.482 1.00 0.00 O ATOM 1010 CB LEU A 68 1.789 -9.158 2.655 1.00 0.00 C ATOM 1011 CG LEU A 68 0.556 -8.309 2.967 1.00 0.00 C ATOM 1012 CD1 LEU A 68 0.964 -6.922 3.441 1.00 0.00 C ATOM 1013 CD2 LEU A 68 -0.346 -8.211 1.745 1.00 0.00 C ATOM 0 H LEU A 68 0.837 -10.918 4.119 1.00 0.00 H new ATOM 0 HA LEU A 68 0.793 -10.512 1.323 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.401 -9.226 3.554 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.385 -8.642 1.902 1.00 0.00 H new ATOM 0 HG LEU A 68 0.000 -8.794 3.769 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.072 -6.334 3.657 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.569 -7.009 4.344 1.00 0.00 H new ATOM 0 HD13 LEU A 68 1.544 -6.427 2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.219 -7.603 1.985 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.203 -7.750 0.924 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.669 -9.209 1.450 1.00 0.00 H new ATOM 1025 N LEU A 69 3.489 -11.879 2.579 1.00 0.00 N ATOM 1026 CA LEU A 69 4.742 -12.540 2.242 1.00 0.00 C ATOM 1027 C LEU A 69 4.491 -13.697 1.279 1.00 0.00 C ATOM 1028 O LEU A 69 5.195 -13.852 0.281 1.00 0.00 O ATOM 1029 CB LEU A 69 5.437 -13.045 3.513 1.00 0.00 C ATOM 1030 CG LEU A 69 6.737 -13.826 3.292 1.00 0.00 C ATOM 1031 CD1 LEU A 69 7.787 -12.954 2.617 1.00 0.00 C ATOM 1032 CD2 LEU A 69 7.260 -14.367 4.613 1.00 0.00 C ATOM 0 H LEU A 69 3.221 -11.959 3.560 1.00 0.00 H new ATOM 0 HA LEU A 69 5.395 -11.817 1.753 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.653 -12.189 4.152 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.740 -13.682 4.058 1.00 0.00 H new ATOM 0 HG LEU A 69 6.522 -14.667 2.632 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.700 -13.531 2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.413 -12.616 1.650 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.001 -12.089 3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.184 -14.919 4.440 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.455 -13.538 5.294 1.00 0.00 H new ATOM 0 HD23 LEU A 69 6.517 -15.032 5.054 1.00 0.00 H new ATOM 1044 N ASN A 70 3.466 -14.485 1.575 1.00 0.00 N ATOM 1045 CA ASN A 70 3.124 -15.642 0.753 1.00 0.00 C ATOM 1046 C ASN A 70 2.699 -15.196 -0.643 1.00 0.00 C ATOM 1047 O ASN A 70 3.087 -15.795 -1.648 1.00 0.00 O ATOM 1048 CB ASN A 70 2.006 -16.452 1.412 1.00 0.00 C ATOM 1049 CG ASN A 70 1.851 -17.834 0.805 1.00 0.00 C ATOM 1050 OD1 ASN A 70 2.488 -18.791 1.251 1.00 0.00 O ATOM 1051 ND2 ASN A 70 1.014 -17.957 -0.215 1.00 0.00 N ATOM 0 H ASN A 70 2.855 -14.345 2.380 1.00 0.00 H new ATOM 0 HA ASN A 70 4.007 -16.275 0.663 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.212 -16.548 2.478 1.00 0.00 H new ATOM 0 HB3 ASN A 70 1.065 -15.910 1.317 1.00 0.00 H new ATOM 0 HD21 ASN A 70 0.880 -18.866 -0.658 1.00 0.00 H new ATOM 0 HD22 ASN A 70 0.504 -17.143 -0.557 1.00 0.00 H new ATOM 1058 N LEU A 71 1.917 -14.124 -0.698 1.00 0.00 N ATOM 1059 CA LEU A 71 1.452 -13.574 -1.968 1.00 0.00 C ATOM 1060 C LEU A 71 2.619 -13.007 -2.773 1.00 0.00 C ATOM 1061 O LEU A 71 2.675 -13.149 -3.997 1.00 0.00 O ATOM 1062 CB LEU A 71 0.413 -12.473 -1.724 1.00 0.00 C ATOM 1063 CG LEU A 71 -0.870 -12.920 -1.023 1.00 0.00 C ATOM 1064 CD1 LEU A 71 -1.757 -11.722 -0.728 1.00 0.00 C ATOM 1065 CD2 LEU A 71 -1.621 -13.936 -1.869 1.00 0.00 C ATOM 0 H LEU A 71 1.590 -13.616 0.124 1.00 0.00 H new ATOM 0 HA LEU A 71 0.992 -14.382 -2.537 1.00 0.00 H new ATOM 0 HB2 LEU A 71 0.876 -11.687 -1.128 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.146 -12.031 -2.684 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.596 -13.394 -0.080 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.666 -12.057 -0.229 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.224 -11.025 -0.082 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.018 -11.224 -1.662 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.530 -14.240 -1.351 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.882 -13.489 -2.828 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.989 -14.809 -2.036 1.00 0.00 H new ATOM 1077 N ARG A 72 3.555 -12.376 -2.075 1.00 0.00 N ATOM 1078 CA ARG A 72 4.697 -11.730 -2.712 1.00 0.00 C ATOM 1079 C ARG A 72 5.671 -12.771 -3.243 1.00 0.00 C ATOM 1080 O ARG A 72 6.230 -12.612 -4.327 1.00 0.00 O ATOM 1081 CB ARG A 72 5.401 -10.816 -1.706 1.00 0.00 C ATOM 1082 CG ARG A 72 6.091 -9.605 -2.320 1.00 0.00 C ATOM 1083 CD ARG A 72 7.433 -9.933 -2.955 1.00 0.00 C ATOM 1084 NE ARG A 72 8.261 -8.730 -3.060 1.00 0.00 N ATOM 1085 CZ ARG A 72 9.366 -8.629 -3.793 1.00 0.00 C ATOM 1086 NH1 ARG A 72 9.755 -9.630 -4.570 1.00 0.00 N ATOM 1087 NH2 ARG A 72 10.071 -7.505 -3.756 1.00 0.00 N ATOM 0 H ARG A 72 3.545 -12.297 -1.058 1.00 0.00 H new ATOM 0 HA ARG A 72 4.340 -11.133 -3.551 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.669 -10.469 -0.977 1.00 0.00 H new ATOM 0 HB3 ARG A 72 6.141 -11.401 -1.160 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.437 -9.167 -3.075 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.237 -8.849 -1.548 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.949 -10.686 -2.359 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.278 -10.362 -3.945 1.00 0.00 H new ATOM 0 HE ARG A 72 7.968 -7.908 -2.532 1.00 0.00 H new ATOM 0 HH11 ARG A 72 9.205 -10.488 -4.610 1.00 0.00 H new ATOM 0 HH12 ARG A 72 10.604 -9.542 -5.128 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.764 -6.729 -3.169 1.00 0.00 H new ATOM 0 HH22 ARG A 72 10.920 -7.417 -4.314 1.00 0.00 H new ATOM 1101 N LYS A 73 5.863 -13.835 -2.476 1.00 0.00 N ATOM 1102 CA LYS A 73 6.751 -14.913 -2.857 1.00 0.00 C ATOM 1103 C LYS A 73 6.233 -15.608 -4.113 1.00 0.00 C ATOM 1104 O LYS A 73 7.005 -16.099 -4.936 1.00 0.00 O ATOM 1105 CB LYS A 73 6.857 -15.895 -1.693 1.00 0.00 C ATOM 1106 CG LYS A 73 7.927 -16.944 -1.874 1.00 0.00 C ATOM 1107 CD LYS A 73 8.126 -17.754 -0.603 1.00 0.00 C ATOM 1108 CE LYS A 73 9.179 -18.833 -0.787 1.00 0.00 C ATOM 1109 NZ LYS A 73 8.757 -19.860 -1.772 1.00 0.00 N ATOM 0 H LYS A 73 5.406 -13.971 -1.574 1.00 0.00 H new ATOM 0 HA LYS A 73 7.741 -14.516 -3.084 1.00 0.00 H new ATOM 0 HB2 LYS A 73 7.059 -15.338 -0.778 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.895 -16.390 -1.559 1.00 0.00 H new ATOM 0 HG2 LYS A 73 7.652 -17.609 -2.693 1.00 0.00 H new ATOM 0 HG3 LYS A 73 8.865 -16.465 -2.153 1.00 0.00 H new ATOM 0 HD2 LYS A 73 8.422 -17.090 0.209 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.181 -18.213 -0.311 1.00 0.00 H new ATOM 0 HE2 LYS A 73 10.112 -18.376 -1.117 1.00 0.00 H new ATOM 0 HE3 LYS A 73 9.379 -19.311 0.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 9.400 -20.676 -1.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.788 -20.170 -1.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.787 -19.456 -2.730 1.00 0.00 H new ATOM 1123 N ASN A 74 4.914 -15.619 -4.264 1.00 0.00 N ATOM 1124 CA ASN A 74 4.288 -16.220 -5.434 1.00 0.00 C ATOM 1125 C ASN A 74 4.247 -15.212 -6.580 1.00 0.00 C ATOM 1126 O ASN A 74 4.186 -15.583 -7.751 1.00 0.00 O ATOM 1127 CB ASN A 74 2.878 -16.716 -5.091 1.00 0.00 C ATOM 1128 CG ASN A 74 2.265 -17.564 -6.193 1.00 0.00 C ATOM 1129 OD1 ASN A 74 2.972 -18.202 -6.973 1.00 0.00 O ATOM 1130 ND2 ASN A 74 0.944 -17.601 -6.251 1.00 0.00 N ATOM 0 H ASN A 74 4.259 -15.219 -3.592 1.00 0.00 H new ATOM 0 HA ASN A 74 4.880 -17.079 -5.751 1.00 0.00 H new ATOM 0 HB2 ASN A 74 2.917 -17.298 -4.171 1.00 0.00 H new ATOM 0 HB3 ASN A 74 2.233 -15.858 -4.898 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.480 -18.171 -6.958 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.389 -17.059 -5.588 1.00 0.00 H new ATOM 1137 N GLY A 75 4.308 -13.935 -6.233 1.00 0.00 N ATOM 1138 CA GLY A 75 4.343 -12.895 -7.240 1.00 0.00 C ATOM 1139 C GLY A 75 2.962 -12.455 -7.675 1.00 0.00 C ATOM 1140 O GLY A 75 2.790 -11.928 -8.771 1.00 0.00 O ATOM 0 H GLY A 75 4.334 -13.600 -5.270 1.00 0.00 H new ATOM 0 HA2 GLY A 75 4.887 -12.035 -6.849 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.895 -13.254 -8.108 1.00 0.00 H new ATOM 1144 N VAL A 76 1.976 -12.663 -6.814 1.00 0.00 N ATOM 1145 CA VAL A 76 0.601 -12.297 -7.132 1.00 0.00 C ATOM 1146 C VAL A 76 0.153 -11.081 -6.330 1.00 0.00 C ATOM 1147 O VAL A 76 -0.976 -10.609 -6.469 1.00 0.00 O ATOM 1148 CB VAL A 76 -0.369 -13.465 -6.874 1.00 0.00 C ATOM 1149 CG1 VAL A 76 -0.013 -14.647 -7.758 1.00 0.00 C ATOM 1150 CG2 VAL A 76 -0.352 -13.874 -5.410 1.00 0.00 C ATOM 0 H VAL A 76 2.101 -13.082 -5.892 1.00 0.00 H new ATOM 0 HA VAL A 76 0.579 -12.051 -8.194 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.377 -13.132 -7.120 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.706 -15.466 -7.566 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -0.081 -14.352 -8.805 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.004 -14.973 -7.538 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.046 -14.700 -5.255 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.654 -14.187 -5.131 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.652 -13.028 -4.792 1.00 0.00 H new ATOM 1160 N ALA A 77 1.052 -10.577 -5.501 1.00 0.00 N ATOM 1161 CA ALA A 77 0.768 -9.416 -4.671 1.00 0.00 C ATOM 1162 C ALA A 77 1.095 -8.128 -5.417 1.00 0.00 C ATOM 1163 O ALA A 77 1.797 -8.156 -6.432 1.00 0.00 O ATOM 1164 CB ALA A 77 1.562 -9.497 -3.373 1.00 0.00 C ATOM 0 H ALA A 77 1.992 -10.956 -5.384 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.296 -9.409 -4.433 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.344 -8.624 -2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 77 1.283 -10.401 -2.832 1.00 0.00 H new ATOM 0 HB3 ALA A 77 2.628 -9.524 -3.600 1.00 0.00 H new ATOM 1170 N PRO A 78 0.567 -6.984 -4.947 1.00 0.00 N ATOM 1171 CA PRO A 78 0.932 -5.678 -5.488 1.00 0.00 C ATOM 1172 C PRO A 78 2.427 -5.427 -5.352 1.00 0.00 C ATOM 1173 O PRO A 78 3.058 -5.892 -4.406 1.00 0.00 O ATOM 1174 CB PRO A 78 0.136 -4.685 -4.636 1.00 0.00 C ATOM 1175 CG PRO A 78 -0.975 -5.485 -4.050 1.00 0.00 C ATOM 1176 CD PRO A 78 -0.436 -6.875 -3.874 1.00 0.00 C ATOM 0 HA PRO A 78 0.710 -5.593 -6.552 1.00 0.00 H new ATOM 0 HB2 PRO A 78 0.759 -4.245 -3.857 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.246 -3.863 -5.241 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -1.296 -5.067 -3.096 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.845 -5.484 -4.707 1.00 0.00 H new ATOM 0 HD2 PRO A 78 0.011 -7.012 -2.889 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -1.219 -7.627 -3.976 1.00 0.00 H new ATOM 1184 N LYS A 79 2.986 -4.694 -6.300 1.00 0.00 N ATOM 1185 CA LYS A 79 4.420 -4.466 -6.333 1.00 0.00 C ATOM 1186 C LYS A 79 4.828 -3.482 -5.241 1.00 0.00 C ATOM 1187 O LYS A 79 5.961 -3.502 -4.759 1.00 0.00 O ATOM 1188 CB LYS A 79 4.827 -3.958 -7.712 1.00 0.00 C ATOM 1189 CG LYS A 79 6.320 -4.015 -7.979 1.00 0.00 C ATOM 1190 CD LYS A 79 6.628 -3.725 -9.438 1.00 0.00 C ATOM 1191 CE LYS A 79 8.123 -3.752 -9.708 1.00 0.00 C ATOM 1192 NZ LYS A 79 8.433 -3.565 -11.150 1.00 0.00 N ATOM 0 H LYS A 79 2.468 -4.247 -7.057 1.00 0.00 H new ATOM 0 HA LYS A 79 4.938 -5.406 -6.143 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.311 -4.546 -8.471 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.488 -2.928 -7.822 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.833 -3.292 -7.345 1.00 0.00 H new ATOM 0 HG3 LYS A 79 6.703 -5.000 -7.713 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.130 -4.461 -10.069 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.226 -2.749 -9.709 1.00 0.00 H new ATOM 0 HE2 LYS A 79 8.610 -2.968 -9.128 1.00 0.00 H new ATOM 0 HE3 LYS A 79 8.535 -4.702 -9.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 9.438 -3.774 -11.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.845 -4.208 -11.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 8.233 -2.582 -11.423 1.00 0.00 H new ATOM 1206 N ALA A 80 3.883 -2.633 -4.854 1.00 0.00 N ATOM 1207 CA ALA A 80 4.081 -1.684 -3.769 1.00 0.00 C ATOM 1208 C ALA A 80 2.742 -1.094 -3.351 1.00 0.00 C ATOM 1209 O ALA A 80 1.822 -0.992 -4.167 1.00 0.00 O ATOM 1210 CB ALA A 80 5.042 -0.575 -4.180 1.00 0.00 C ATOM 0 H ALA A 80 2.959 -2.584 -5.284 1.00 0.00 H new ATOM 0 HA ALA A 80 4.521 -2.213 -2.923 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.172 0.120 -3.350 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.006 -1.009 -4.444 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.636 -0.042 -5.040 1.00 0.00 H new ATOM 1216 N ILE A 81 2.629 -0.731 -2.086 1.00 0.00 N ATOM 1217 CA ILE A 81 1.413 -0.123 -1.573 1.00 0.00 C ATOM 1218 C ILE A 81 1.727 1.192 -0.872 1.00 0.00 C ATOM 1219 O ILE A 81 2.543 1.239 0.049 1.00 0.00 O ATOM 1220 CB ILE A 81 0.654 -1.061 -0.609 1.00 0.00 C ATOM 1221 CG1 ILE A 81 1.591 -1.626 0.467 1.00 0.00 C ATOM 1222 CG2 ILE A 81 -0.015 -2.188 -1.386 1.00 0.00 C ATOM 1223 CD1 ILE A 81 0.899 -2.538 1.459 1.00 0.00 C ATOM 0 H ILE A 81 3.367 -0.847 -1.392 1.00 0.00 H new ATOM 0 HA ILE A 81 0.767 0.067 -2.430 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.117 -0.479 -0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 81 2.397 -2.177 -0.018 1.00 0.00 H new ATOM 0 HG13 ILE A 81 2.051 -0.798 1.007 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.546 -2.842 -0.694 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.721 -1.767 -2.102 1.00 0.00 H new ATOM 0 HG23 ILE A 81 0.743 -2.763 -1.918 1.00 0.00 H new ATOM 0 HD11 ILE A 81 1.624 -2.899 2.189 1.00 0.00 H new ATOM 0 HD12 ILE A 81 0.111 -1.986 1.972 1.00 0.00 H new ATOM 0 HD13 ILE A 81 0.463 -3.386 0.931 1.00 0.00 H new ATOM 1235 N ILE A 82 1.095 2.263 -1.327 1.00 0.00 N ATOM 1236 CA ILE A 82 1.341 3.582 -0.762 1.00 0.00 C ATOM 1237 C ILE A 82 0.108 4.048 -0.001 1.00 0.00 C ATOM 1238 O ILE A 82 -0.982 4.144 -0.571 1.00 0.00 O ATOM 1239 CB ILE A 82 1.701 4.625 -1.850 1.00 0.00 C ATOM 1240 CG1 ILE A 82 2.550 3.993 -2.961 1.00 0.00 C ATOM 1241 CG2 ILE A 82 2.449 5.801 -1.230 1.00 0.00 C ATOM 1242 CD1 ILE A 82 3.883 3.453 -2.488 1.00 0.00 C ATOM 0 H ILE A 82 0.410 2.246 -2.083 1.00 0.00 H new ATOM 0 HA ILE A 82 2.194 3.498 -0.088 1.00 0.00 H new ATOM 0 HB ILE A 82 0.771 4.985 -2.291 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.984 3.182 -3.420 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.726 4.738 -3.737 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.695 6.526 -2.006 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.820 6.276 -0.477 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.367 5.443 -0.763 1.00 0.00 H new ATOM 0 HD11 ILE A 82 4.422 3.023 -3.332 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.471 4.263 -2.056 1.00 0.00 H new ATOM 0 HD13 ILE A 82 3.717 2.683 -1.734 1.00 0.00 H new ATOM 1254 N ASN A 83 0.271 4.312 1.290 1.00 0.00 N ATOM 1255 CA ASN A 83 -0.855 4.685 2.143 1.00 0.00 C ATOM 1256 C ASN A 83 -0.524 5.942 2.929 1.00 0.00 C ATOM 1257 O ASN A 83 0.627 6.368 2.971 1.00 0.00 O ATOM 1258 CB ASN A 83 -1.195 3.566 3.145 1.00 0.00 C ATOM 1259 CG ASN A 83 -1.514 2.225 2.501 1.00 0.00 C ATOM 1260 OD1 ASN A 83 -1.244 1.173 3.078 1.00 0.00 O ATOM 1261 ND2 ASN A 83 -2.107 2.246 1.319 1.00 0.00 N ATOM 0 H ASN A 83 1.170 4.275 1.770 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.712 4.857 1.491 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.355 3.438 3.827 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -2.049 3.879 3.746 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.355 1.371 0.857 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -2.316 3.137 0.869 1.00 0.00 H new ATOM 1268 N LYS A 84 -1.533 6.542 3.539 1.00 0.00 N ATOM 1269 CA LYS A 84 -1.295 7.587 4.520 1.00 0.00 C ATOM 1270 C LYS A 84 -1.534 7.014 5.904 1.00 0.00 C ATOM 1271 O LYS A 84 -0.808 7.305 6.854 1.00 0.00 O ATOM 1272 CB LYS A 84 -2.193 8.804 4.291 1.00 0.00 C ATOM 1273 CG LYS A 84 -1.830 9.976 5.189 1.00 0.00 C ATOM 1274 CD LYS A 84 -2.683 11.198 4.909 1.00 0.00 C ATOM 1275 CE LYS A 84 -2.213 12.384 5.735 1.00 0.00 C ATOM 1276 NZ LYS A 84 -3.063 13.586 5.532 1.00 0.00 N ATOM 0 H LYS A 84 -2.516 6.326 3.374 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.265 7.929 4.421 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -2.120 9.114 3.248 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -3.231 8.523 4.468 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.949 9.683 6.232 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.779 10.228 5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.635 11.446 3.849 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -3.726 10.980 5.138 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.217 12.113 6.791 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.182 12.622 5.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.703 14.368 6.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.039 13.863 4.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -4.042 13.370 5.808 1.00 0.00 H new ATOM 1290 N LYS A 85 -2.554 6.177 6.004 1.00 0.00 N ATOM 1291 CA LYS A 85 -2.832 5.466 7.233 1.00 0.00 C ATOM 1292 C LYS A 85 -2.978 3.980 6.958 1.00 0.00 C ATOM 1293 O LYS A 85 -3.992 3.531 6.425 1.00 0.00 O ATOM 1294 CB LYS A 85 -4.093 6.003 7.914 1.00 0.00 C ATOM 1295 CG LYS A 85 -4.481 5.215 9.158 1.00 0.00 C ATOM 1296 CD LYS A 85 -5.645 5.853 9.891 1.00 0.00 C ATOM 1297 CE LYS A 85 -6.077 5.010 11.082 1.00 0.00 C ATOM 1298 NZ LYS A 85 -4.928 4.638 11.952 1.00 0.00 N ATOM 0 H LYS A 85 -3.203 5.975 5.243 1.00 0.00 H new ATOM 0 HA LYS A 85 -1.992 5.624 7.909 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -3.935 7.047 8.187 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.920 5.980 7.204 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -4.745 4.196 8.875 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.623 5.148 9.827 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.361 6.849 10.231 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.484 5.977 9.207 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.811 5.562 11.669 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.569 4.105 10.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -5.283 4.260 12.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -4.352 3.914 11.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -4.344 5.479 12.135 1.00 0.00 H new ATOM 1312 N THR A 86 -1.952 3.228 7.293 1.00 0.00 N ATOM 1313 CA THR A 86 -2.000 1.790 7.167 1.00 0.00 C ATOM 1314 C THR A 86 -1.987 1.178 8.560 1.00 0.00 C ATOM 1315 O THR A 86 -1.547 1.820 9.520 1.00 0.00 O ATOM 1316 CB THR A 86 -0.818 1.257 6.324 1.00 0.00 C ATOM 1317 OG1 THR A 86 -1.018 -0.125 6.000 1.00 0.00 O ATOM 1318 CG2 THR A 86 0.505 1.422 7.061 1.00 0.00 C ATOM 0 H THR A 86 -1.071 3.592 7.656 1.00 0.00 H new ATOM 0 HA THR A 86 -2.915 1.507 6.647 1.00 0.00 H new ATOM 0 HB THR A 86 -0.778 1.842 5.405 1.00 0.00 H new ATOM 0 HG1 THR A 86 -1.154 -0.218 5.034 1.00 0.00 H new ATOM 0 HG21 THR A 86 1.316 1.038 6.443 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.676 2.478 7.269 1.00 0.00 H new ATOM 0 HG23 THR A 86 0.470 0.868 7.999 1.00 0.00 H new ATOM 1326 N GLU A 87 -2.484 -0.035 8.689 1.00 0.00 N ATOM 1327 CA GLU A 87 -2.520 -0.678 9.985 1.00 0.00 C ATOM 1328 C GLU A 87 -1.142 -1.241 10.311 1.00 0.00 C ATOM 1329 O GLU A 87 -0.417 -1.682 9.417 1.00 0.00 O ATOM 1330 CB GLU A 87 -3.586 -1.777 10.025 1.00 0.00 C ATOM 1331 CG GLU A 87 -3.884 -2.279 11.431 1.00 0.00 C ATOM 1332 CD GLU A 87 -4.233 -1.149 12.385 1.00 0.00 C ATOM 1333 OE1 GLU A 87 -3.297 -0.483 12.881 1.00 0.00 O ATOM 1334 OE2 GLU A 87 -5.435 -0.917 12.635 1.00 0.00 O ATOM 0 H GLU A 87 -2.864 -0.590 7.922 1.00 0.00 H new ATOM 0 HA GLU A 87 -2.788 0.062 10.739 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.506 -1.397 9.580 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -3.257 -2.615 9.410 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.711 -2.988 11.393 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.018 -2.819 11.813 1.00 0.00 H new ATOM 1341 N THR A 88 -0.788 -1.216 11.590 1.00 0.00 N ATOM 1342 CA THR A 88 0.530 -1.651 12.042 1.00 0.00 C ATOM 1343 C THR A 88 0.809 -3.093 11.611 1.00 0.00 C ATOM 1344 O THR A 88 1.941 -3.454 11.287 1.00 0.00 O ATOM 1345 CB THR A 88 0.643 -1.531 13.576 1.00 0.00 C ATOM 1346 OG1 THR A 88 0.197 -0.230 13.992 1.00 0.00 O ATOM 1347 CG2 THR A 88 2.076 -1.753 14.040 1.00 0.00 C ATOM 0 H THR A 88 -1.401 -0.896 12.340 1.00 0.00 H new ATOM 0 HA THR A 88 1.273 -1.001 11.580 1.00 0.00 H new ATOM 0 HB THR A 88 0.015 -2.299 14.027 1.00 0.00 H new ATOM 0 HG1 THR A 88 0.268 -0.156 14.967 1.00 0.00 H new ATOM 0 HG21 THR A 88 2.125 -1.662 15.125 1.00 0.00 H new ATOM 0 HG22 THR A 88 2.404 -2.749 13.744 1.00 0.00 H new ATOM 0 HG23 THR A 88 2.726 -1.006 13.584 1.00 0.00 H new ATOM 1355 N ILE A 89 -0.243 -3.901 11.583 1.00 0.00 N ATOM 1356 CA ILE A 89 -0.141 -5.291 11.159 1.00 0.00 C ATOM 1357 C ILE A 89 0.262 -5.382 9.687 1.00 0.00 C ATOM 1358 O ILE A 89 1.094 -6.207 9.307 1.00 0.00 O ATOM 1359 CB ILE A 89 -1.486 -6.017 11.367 1.00 0.00 C ATOM 1360 CG1 ILE A 89 -1.965 -5.830 12.808 1.00 0.00 C ATOM 1361 CG2 ILE A 89 -1.358 -7.500 11.030 1.00 0.00 C ATOM 1362 CD1 ILE A 89 -3.367 -6.336 13.049 1.00 0.00 C ATOM 0 H ILE A 89 -1.184 -3.614 11.851 1.00 0.00 H new ATOM 0 HA ILE A 89 0.626 -5.771 11.766 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.224 -5.582 10.694 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.280 -6.348 13.480 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.921 -4.771 13.062 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.318 -7.992 11.184 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.056 -7.612 9.989 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.609 -7.957 11.676 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.639 -6.171 14.091 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -4.063 -5.801 12.403 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -3.412 -7.402 12.827 1.00 0.00 H new ATOM 1374 N ILE A 90 -0.319 -4.512 8.870 1.00 0.00 N ATOM 1375 CA ILE A 90 -0.041 -4.492 7.439 1.00 0.00 C ATOM 1376 C ILE A 90 1.362 -3.949 7.173 1.00 0.00 C ATOM 1377 O ILE A 90 2.096 -4.488 6.349 1.00 0.00 O ATOM 1378 CB ILE A 90 -1.076 -3.633 6.680 1.00 0.00 C ATOM 1379 CG1 ILE A 90 -2.498 -4.124 6.980 1.00 0.00 C ATOM 1380 CG2 ILE A 90 -0.805 -3.660 5.181 1.00 0.00 C ATOM 1381 CD1 ILE A 90 -3.582 -3.292 6.326 1.00 0.00 C ATOM 0 H ILE A 90 -0.990 -3.807 9.176 1.00 0.00 H new ATOM 0 HA ILE A 90 -0.107 -5.518 7.078 1.00 0.00 H new ATOM 0 HB ILE A 90 -0.985 -2.602 7.022 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.594 -5.157 6.645 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.653 -4.123 8.059 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.546 -3.048 4.666 1.00 0.00 H new ATOM 0 HG22 ILE A 90 0.192 -3.265 4.984 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -0.867 -4.686 4.819 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.559 -3.700 6.584 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.514 -2.263 6.679 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.454 -3.313 5.244 1.00 0.00 H new ATOM 1393 N ALA A 91 1.726 -2.891 7.896 1.00 0.00 N ATOM 1394 CA ALA A 91 3.037 -2.259 7.745 1.00 0.00 C ATOM 1395 C ALA A 91 4.167 -3.264 7.968 1.00 0.00 C ATOM 1396 O ALA A 91 5.108 -3.339 7.177 1.00 0.00 O ATOM 1397 CB ALA A 91 3.164 -1.090 8.713 1.00 0.00 C ATOM 0 H ALA A 91 1.128 -2.451 8.596 1.00 0.00 H new ATOM 0 HA ALA A 91 3.122 -1.887 6.724 1.00 0.00 H new ATOM 0 HB1 ALA A 91 4.142 -0.624 8.595 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.385 -0.357 8.502 1.00 0.00 H new ATOM 0 HB3 ALA A 91 3.055 -1.451 9.736 1.00 0.00 H new ATOM 1403 N VAL A 92 4.064 -4.042 9.039 1.00 0.00 N ATOM 1404 CA VAL A 92 5.069 -5.050 9.345 1.00 0.00 C ATOM 1405 C VAL A 92 5.035 -6.174 8.312 1.00 0.00 C ATOM 1406 O VAL A 92 6.081 -6.634 7.846 1.00 0.00 O ATOM 1407 CB VAL A 92 4.872 -5.637 10.760 1.00 0.00 C ATOM 1408 CG1 VAL A 92 5.898 -6.725 11.044 1.00 0.00 C ATOM 1409 CG2 VAL A 92 4.963 -4.539 11.808 1.00 0.00 C ATOM 0 H VAL A 92 3.296 -3.994 9.708 1.00 0.00 H new ATOM 0 HA VAL A 92 6.042 -4.559 9.311 1.00 0.00 H new ATOM 0 HB VAL A 92 3.879 -6.084 10.807 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.739 -7.123 12.046 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.789 -7.527 10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.902 -6.305 10.976 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.822 -4.970 12.799 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.943 -4.065 11.754 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.189 -3.794 11.623 1.00 0.00 H new ATOM 1419 N GLY A 93 3.831 -6.591 7.943 1.00 0.00 N ATOM 1420 CA GLY A 93 3.678 -7.643 6.956 1.00 0.00 C ATOM 1421 C GLY A 93 4.277 -7.267 5.615 1.00 0.00 C ATOM 1422 O GLY A 93 4.923 -8.090 4.965 1.00 0.00 O ATOM 0 H GLY A 93 2.955 -6.219 8.310 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.154 -8.553 7.322 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.619 -7.867 6.828 1.00 0.00 H new ATOM 1426 N ALA A 94 4.073 -6.020 5.212 1.00 0.00 N ATOM 1427 CA ALA A 94 4.624 -5.515 3.965 1.00 0.00 C ATOM 1428 C ALA A 94 6.147 -5.475 4.022 1.00 0.00 C ATOM 1429 O ALA A 94 6.822 -5.816 3.053 1.00 0.00 O ATOM 1430 CB ALA A 94 4.070 -4.131 3.664 1.00 0.00 C ATOM 0 H ALA A 94 3.526 -5.337 5.736 1.00 0.00 H new ATOM 0 HA ALA A 94 4.330 -6.192 3.163 1.00 0.00 H new ATOM 0 HB1 ALA A 94 4.492 -3.766 2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.985 -4.185 3.577 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.336 -3.449 4.472 1.00 0.00 H new ATOM 1436 N ALA A 95 6.681 -5.075 5.170 1.00 0.00 N ATOM 1437 CA ALA A 95 8.123 -5.010 5.360 1.00 0.00 C ATOM 1438 C ALA A 95 8.749 -6.397 5.260 1.00 0.00 C ATOM 1439 O ALA A 95 9.845 -6.558 4.721 1.00 0.00 O ATOM 1440 CB ALA A 95 8.449 -4.377 6.701 1.00 0.00 C ATOM 0 H ALA A 95 6.135 -4.791 5.984 1.00 0.00 H new ATOM 0 HA ALA A 95 8.544 -4.391 4.568 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.531 -4.335 6.830 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.040 -3.367 6.736 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.011 -4.974 7.501 1.00 0.00 H new ATOM 1446 N MET A 96 8.042 -7.397 5.774 1.00 0.00 N ATOM 1447 CA MET A 96 8.506 -8.781 5.721 1.00 0.00 C ATOM 1448 C MET A 96 8.495 -9.298 4.287 1.00 0.00 C ATOM 1449 O MET A 96 9.391 -10.034 3.870 1.00 0.00 O ATOM 1450 CB MET A 96 7.622 -9.681 6.592 1.00 0.00 C ATOM 1451 CG MET A 96 7.662 -9.346 8.073 1.00 0.00 C ATOM 1452 SD MET A 96 6.520 -10.354 9.042 1.00 0.00 S ATOM 1453 CE MET A 96 7.177 -11.997 8.752 1.00 0.00 C ATOM 0 H MET A 96 7.140 -7.275 6.235 1.00 0.00 H new ATOM 0 HA MET A 96 9.527 -8.805 6.102 1.00 0.00 H new ATOM 0 HB2 MET A 96 6.592 -9.608 6.242 1.00 0.00 H new ATOM 0 HB3 MET A 96 7.932 -10.717 6.457 1.00 0.00 H new ATOM 0 HG2 MET A 96 8.676 -9.490 8.447 1.00 0.00 H new ATOM 0 HG3 MET A 96 7.418 -8.293 8.210 1.00 0.00 H new ATOM 0 HE1 MET A 96 6.784 -12.684 9.502 1.00 0.00 H new ATOM 0 HE2 MET A 96 6.882 -12.337 7.759 1.00 0.00 H new ATOM 0 HE3 MET A 96 8.265 -11.971 8.818 1.00 0.00 H new ATOM 1463 N ALA A 97 7.481 -8.891 3.537 1.00 0.00 N ATOM 1464 CA ALA A 97 7.280 -9.373 2.177 1.00 0.00 C ATOM 1465 C ALA A 97 8.065 -8.562 1.153 1.00 0.00 C ATOM 1466 O ALA A 97 8.021 -8.865 -0.037 1.00 0.00 O ATOM 1467 CB ALA A 97 5.801 -9.336 1.834 1.00 0.00 C ATOM 0 H ALA A 97 6.778 -8.222 3.851 1.00 0.00 H new ATOM 0 HA ALA A 97 7.650 -10.397 2.136 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.654 -9.697 0.816 1.00 0.00 H new ATOM 0 HB2 ALA A 97 5.251 -9.972 2.527 1.00 0.00 H new ATOM 0 HB3 ALA A 97 5.435 -8.312 1.912 1.00 0.00 H new ATOM 1473 N GLU A 98 8.781 -7.543 1.618 1.00 0.00 N ATOM 1474 CA GLU A 98 9.511 -6.635 0.735 1.00 0.00 C ATOM 1475 C GLU A 98 8.544 -5.895 -0.188 1.00 0.00 C ATOM 1476 O GLU A 98 8.748 -5.815 -1.402 1.00 0.00 O ATOM 1477 CB GLU A 98 10.571 -7.383 -0.079 1.00 0.00 C ATOM 1478 CG GLU A 98 11.649 -8.022 0.777 1.00 0.00 C ATOM 1479 CD GLU A 98 12.767 -8.621 -0.047 1.00 0.00 C ATOM 1480 OE1 GLU A 98 13.674 -7.867 -0.461 1.00 0.00 O ATOM 1481 OE2 GLU A 98 12.761 -9.849 -0.270 1.00 0.00 O ATOM 0 H GLU A 98 8.872 -7.323 2.610 1.00 0.00 H new ATOM 0 HA GLU A 98 10.026 -5.903 1.357 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.083 -8.156 -0.673 1.00 0.00 H new ATOM 0 HB3 GLU A 98 11.037 -6.690 -0.779 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.062 -7.274 1.453 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.202 -8.800 1.397 1.00 0.00 H new ATOM 1488 N ILE A 99 7.488 -5.374 0.417 1.00 0.00 N ATOM 1489 CA ILE A 99 6.497 -4.552 -0.266 1.00 0.00 C ATOM 1490 C ILE A 99 6.659 -3.098 0.159 1.00 0.00 C ATOM 1491 O ILE A 99 6.118 -2.688 1.182 1.00 0.00 O ATOM 1492 CB ILE A 99 5.049 -5.019 0.026 1.00 0.00 C ATOM 1493 CG1 ILE A 99 4.833 -6.437 -0.504 1.00 0.00 C ATOM 1494 CG2 ILE A 99 4.037 -4.064 -0.597 1.00 0.00 C ATOM 1495 CD1 ILE A 99 4.977 -6.546 -2.005 1.00 0.00 C ATOM 0 H ILE A 99 7.291 -5.511 1.408 1.00 0.00 H new ATOM 0 HA ILE A 99 6.667 -4.654 -1.338 1.00 0.00 H new ATOM 0 HB ILE A 99 4.901 -5.020 1.106 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.549 -7.108 -0.028 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.838 -6.777 -0.216 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.027 -4.411 -0.379 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.175 -3.066 -0.181 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.185 -4.031 -1.676 1.00 0.00 H new ATOM 0 HD11 ILE A 99 4.811 -7.579 -2.312 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.243 -5.901 -2.489 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.981 -6.237 -2.298 1.00 0.00 H new ATOM 1507 N PRO A 100 7.484 -2.330 -0.577 1.00 0.00 N ATOM 1508 CA PRO A 100 7.806 -0.939 -0.242 1.00 0.00 C ATOM 1509 C PRO A 100 6.571 -0.091 0.072 1.00 0.00 C ATOM 1510 O PRO A 100 5.896 0.410 -0.829 1.00 0.00 O ATOM 1511 CB PRO A 100 8.513 -0.407 -1.498 1.00 0.00 C ATOM 1512 CG PRO A 100 8.316 -1.450 -2.549 1.00 0.00 C ATOM 1513 CD PRO A 100 8.149 -2.747 -1.817 1.00 0.00 C ATOM 0 HA PRO A 100 8.414 -0.887 0.661 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.089 0.548 -1.810 1.00 0.00 H new ATOM 0 HB3 PRO A 100 9.573 -0.239 -1.308 1.00 0.00 H new ATOM 0 HG2 PRO A 100 7.439 -1.230 -3.158 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.171 -1.490 -3.224 1.00 0.00 H new ATOM 0 HD2 PRO A 100 7.545 -3.457 -2.382 1.00 0.00 H new ATOM 0 HD3 PRO A 100 9.107 -3.229 -1.621 1.00 0.00 H new ATOM 1521 N LEU A 101 6.277 0.037 1.358 1.00 0.00 N ATOM 1522 CA LEU A 101 5.169 0.846 1.825 1.00 0.00 C ATOM 1523 C LEU A 101 5.711 2.163 2.356 1.00 0.00 C ATOM 1524 O LEU A 101 6.609 2.183 3.203 1.00 0.00 O ATOM 1525 CB LEU A 101 4.403 0.088 2.925 1.00 0.00 C ATOM 1526 CG LEU A 101 2.988 0.598 3.268 1.00 0.00 C ATOM 1527 CD1 LEU A 101 2.256 -0.422 4.128 1.00 0.00 C ATOM 1528 CD2 LEU A 101 3.032 1.940 3.988 1.00 0.00 C ATOM 0 H LEU A 101 6.802 -0.419 2.104 1.00 0.00 H new ATOM 0 HA LEU A 101 4.480 1.049 1.006 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.323 -0.957 2.625 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.003 0.113 3.835 1.00 0.00 H new ATOM 0 HG LEU A 101 2.452 0.736 2.329 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.259 -0.051 4.363 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.174 -1.364 3.585 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.811 -0.583 5.052 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.016 2.266 4.213 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.594 1.837 4.916 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.518 2.679 3.351 1.00 0.00 H new ATOM 1540 N VAL A 102 5.186 3.260 1.841 1.00 0.00 N ATOM 1541 CA VAL A 102 5.560 4.580 2.318 1.00 0.00 C ATOM 1542 C VAL A 102 4.319 5.381 2.677 1.00 0.00 C ATOM 1543 O VAL A 102 3.249 5.173 2.105 1.00 0.00 O ATOM 1544 CB VAL A 102 6.413 5.358 1.291 1.00 0.00 C ATOM 1545 CG1 VAL A 102 7.812 4.775 1.208 1.00 0.00 C ATOM 1546 CG2 VAL A 102 5.758 5.355 -0.077 1.00 0.00 C ATOM 0 H VAL A 102 4.497 3.263 1.089 1.00 0.00 H new ATOM 0 HA VAL A 102 6.173 4.437 3.208 1.00 0.00 H new ATOM 0 HB VAL A 102 6.485 6.391 1.630 1.00 0.00 H new ATOM 0 HG11 VAL A 102 8.397 5.336 0.480 1.00 0.00 H new ATOM 0 HG12 VAL A 102 8.291 4.838 2.185 1.00 0.00 H new ATOM 0 HG13 VAL A 102 7.753 3.731 0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.380 5.910 -0.779 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.646 4.328 -0.424 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.777 5.825 -0.012 1.00 0.00 H new ATOM 1556 N GLU A 103 4.466 6.275 3.641 1.00 0.00 N ATOM 1557 CA GLU A 103 3.352 7.073 4.127 1.00 0.00 C ATOM 1558 C GLU A 103 3.351 8.450 3.465 1.00 0.00 C ATOM 1559 O GLU A 103 4.276 9.239 3.649 1.00 0.00 O ATOM 1560 CB GLU A 103 3.435 7.184 5.655 1.00 0.00 C ATOM 1561 CG GLU A 103 2.336 8.020 6.289 1.00 0.00 C ATOM 1562 CD GLU A 103 2.796 9.410 6.675 1.00 0.00 C ATOM 1563 OE1 GLU A 103 4.022 9.648 6.720 1.00 0.00 O ATOM 1564 OE2 GLU A 103 1.939 10.268 6.957 1.00 0.00 O ATOM 0 H GLU A 103 5.353 6.467 4.106 1.00 0.00 H new ATOM 0 HA GLU A 103 2.413 6.586 3.865 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.402 6.181 6.081 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.400 7.613 5.923 1.00 0.00 H new ATOM 0 HG2 GLU A 103 1.501 8.100 5.593 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.963 7.507 7.176 1.00 0.00 H new ATOM 1571 N VAL A 104 2.321 8.721 2.676 1.00 0.00 N ATOM 1572 CA VAL A 104 2.232 9.975 1.937 1.00 0.00 C ATOM 1573 C VAL A 104 1.945 11.156 2.857 1.00 0.00 C ATOM 1574 O VAL A 104 1.080 11.092 3.729 1.00 0.00 O ATOM 1575 CB VAL A 104 1.158 9.917 0.832 1.00 0.00 C ATOM 1576 CG1 VAL A 104 1.609 9.011 -0.296 1.00 0.00 C ATOM 1577 CG2 VAL A 104 -0.172 9.439 1.390 1.00 0.00 C ATOM 0 H VAL A 104 1.534 8.089 2.530 1.00 0.00 H new ATOM 0 HA VAL A 104 3.207 10.120 1.471 1.00 0.00 H new ATOM 0 HB VAL A 104 1.021 10.925 0.441 1.00 0.00 H new ATOM 0 HG11 VAL A 104 0.840 8.981 -1.068 1.00 0.00 H new ATOM 0 HG12 VAL A 104 2.536 9.394 -0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.776 8.005 0.090 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.912 9.407 0.590 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.052 8.442 1.813 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.508 10.125 2.168 1.00 0.00 H new ATOM 1587 N ARG A 105 2.686 12.236 2.656 1.00 0.00 N ATOM 1588 CA ARG A 105 2.524 13.430 3.468 1.00 0.00 C ATOM 1589 C ARG A 105 1.403 14.304 2.910 1.00 0.00 C ATOM 1590 O ARG A 105 0.664 14.942 3.662 1.00 0.00 O ATOM 1591 CB ARG A 105 3.849 14.211 3.505 1.00 0.00 C ATOM 1592 CG ARG A 105 4.027 15.095 4.733 1.00 0.00 C ATOM 1593 CD ARG A 105 3.153 16.339 4.690 1.00 0.00 C ATOM 1594 NE ARG A 105 3.142 17.036 5.972 1.00 0.00 N ATOM 1595 CZ ARG A 105 2.252 17.970 6.306 1.00 0.00 C ATOM 1596 NH1 ARG A 105 1.357 18.389 5.415 1.00 0.00 N ATOM 1597 NH2 ARG A 105 2.276 18.493 7.524 1.00 0.00 N ATOM 0 H ARG A 105 3.405 12.309 1.937 1.00 0.00 H new ATOM 0 HA ARG A 105 2.255 13.139 4.483 1.00 0.00 H new ATOM 0 HB2 ARG A 105 4.676 13.502 3.461 1.00 0.00 H new ATOM 0 HB3 ARG A 105 3.914 14.833 2.612 1.00 0.00 H new ATOM 0 HG2 ARG A 105 3.790 14.520 5.628 1.00 0.00 H new ATOM 0 HG3 ARG A 105 5.072 15.393 4.813 1.00 0.00 H new ATOM 0 HD2 ARG A 105 3.516 17.012 3.913 1.00 0.00 H new ATOM 0 HD3 ARG A 105 2.135 16.059 4.419 1.00 0.00 H new ATOM 0 HE ARG A 105 3.860 16.793 6.655 1.00 0.00 H new ATOM 0 HH11 ARG A 105 1.351 17.995 4.474 1.00 0.00 H new ATOM 0 HH12 ARG A 105 0.677 19.104 5.673 1.00 0.00 H new ATOM 0 HH21 ARG A 105 2.973 18.180 8.200 1.00 0.00 H new ATOM 0 HH22 ARG A 105 1.597 19.208 7.785 1.00 0.00 H new ATOM 1611 N ASP A 106 1.260 14.304 1.590 1.00 0.00 N ATOM 1612 CA ASP A 106 0.337 15.216 0.926 1.00 0.00 C ATOM 1613 C ASP A 106 -0.830 14.458 0.295 1.00 0.00 C ATOM 1614 O ASP A 106 -0.648 13.383 -0.281 1.00 0.00 O ATOM 1615 CB ASP A 106 1.082 16.013 -0.147 1.00 0.00 C ATOM 1616 CG ASP A 106 0.389 17.314 -0.504 1.00 0.00 C ATOM 1617 OD1 ASP A 106 -0.833 17.296 -0.754 1.00 0.00 O ATOM 1618 OD2 ASP A 106 1.067 18.364 -0.519 1.00 0.00 O ATOM 0 H ASP A 106 1.770 13.685 0.960 1.00 0.00 H new ATOM 0 HA ASP A 106 -0.068 15.898 1.674 1.00 0.00 H new ATOM 0 HB2 ASP A 106 2.091 16.229 0.203 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.180 15.402 -1.044 1.00 0.00 H new ATOM 1623 N GLU A 107 -2.025 15.035 0.400 1.00 0.00 N ATOM 1624 CA GLU A 107 -3.235 14.457 -0.178 1.00 0.00 C ATOM 1625 C GLU A 107 -3.203 14.573 -1.701 1.00 0.00 C ATOM 1626 O GLU A 107 -3.891 13.835 -2.412 1.00 0.00 O ATOM 1627 CB GLU A 107 -4.466 15.177 0.377 1.00 0.00 C ATOM 1628 CG GLU A 107 -5.784 14.479 0.078 1.00 0.00 C ATOM 1629 CD GLU A 107 -6.975 15.216 0.657 1.00 0.00 C ATOM 1630 OE1 GLU A 107 -7.254 15.053 1.863 1.00 0.00 O ATOM 1631 OE2 GLU A 107 -7.638 15.966 -0.093 1.00 0.00 O ATOM 0 H GLU A 107 -2.181 15.917 0.888 1.00 0.00 H new ATOM 0 HA GLU A 107 -3.286 13.401 0.089 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -4.358 15.278 1.457 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -4.500 16.185 -0.035 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -5.907 14.388 -1.001 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -5.755 13.467 0.482 1.00 0.00 H new ATOM 1638 N LYS A 108 -2.383 15.498 -2.194 1.00 0.00 N ATOM 1639 CA LYS A 108 -2.226 15.717 -3.627 1.00 0.00 C ATOM 1640 C LYS A 108 -1.780 14.450 -4.351 1.00 0.00 C ATOM 1641 O LYS A 108 -2.026 14.300 -5.546 1.00 0.00 O ATOM 1642 CB LYS A 108 -1.222 16.840 -3.877 1.00 0.00 C ATOM 1643 CG LYS A 108 -1.835 18.227 -3.833 1.00 0.00 C ATOM 1644 CD LYS A 108 -2.753 18.462 -5.021 1.00 0.00 C ATOM 1645 CE LYS A 108 -3.398 19.834 -4.963 1.00 0.00 C ATOM 1646 NZ LYS A 108 -4.253 20.099 -6.150 1.00 0.00 N ATOM 0 H LYS A 108 -1.812 16.113 -1.614 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.200 16.000 -4.026 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.429 16.779 -3.132 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -0.756 16.689 -4.851 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -2.396 18.350 -2.907 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.044 18.977 -3.828 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.185 18.365 -5.946 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -3.528 17.695 -5.041 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -4.000 19.913 -4.058 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -2.622 20.597 -4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -4.901 20.885 -5.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -3.653 20.351 -6.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -4.804 19.247 -6.378 1.00 0.00 H new ATOM 1660 N PHE A 109 -1.139 13.539 -3.626 1.00 0.00 N ATOM 1661 CA PHE A 109 -0.704 12.272 -4.204 1.00 0.00 C ATOM 1662 C PHE A 109 -1.902 11.481 -4.721 1.00 0.00 C ATOM 1663 O PHE A 109 -1.888 10.985 -5.844 1.00 0.00 O ATOM 1664 CB PHE A 109 0.066 11.444 -3.172 1.00 0.00 C ATOM 1665 CG PHE A 109 0.486 10.091 -3.682 1.00 0.00 C ATOM 1666 CD1 PHE A 109 1.591 9.958 -4.509 1.00 0.00 C ATOM 1667 CD2 PHE A 109 -0.227 8.953 -3.335 1.00 0.00 C ATOM 1668 CE1 PHE A 109 1.976 8.716 -4.981 1.00 0.00 C ATOM 1669 CE2 PHE A 109 0.151 7.710 -3.804 1.00 0.00 C ATOM 1670 CZ PHE A 109 1.255 7.591 -4.626 1.00 0.00 C ATOM 0 H PHE A 109 -0.909 13.654 -2.639 1.00 0.00 H new ATOM 0 HA PHE A 109 -0.040 12.490 -5.041 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.952 11.998 -2.861 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.555 11.313 -2.286 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.158 10.834 -4.788 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -1.089 9.040 -2.690 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.838 8.625 -5.625 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -0.415 6.833 -3.529 1.00 0.00 H new ATOM 0 HZ PHE A 109 1.555 6.620 -4.991 1.00 0.00 H new ATOM 1680 N PHE A 110 -2.946 11.406 -3.903 1.00 0.00 N ATOM 1681 CA PHE A 110 -4.149 10.656 -4.251 1.00 0.00 C ATOM 1682 C PHE A 110 -4.846 11.289 -5.451 1.00 0.00 C ATOM 1683 O PHE A 110 -5.475 10.606 -6.258 1.00 0.00 O ATOM 1684 CB PHE A 110 -5.113 10.617 -3.062 1.00 0.00 C ATOM 1685 CG PHE A 110 -4.545 9.961 -1.833 1.00 0.00 C ATOM 1686 CD1 PHE A 110 -4.552 8.581 -1.703 1.00 0.00 C ATOM 1687 CD2 PHE A 110 -4.014 10.723 -0.806 1.00 0.00 C ATOM 1688 CE1 PHE A 110 -4.039 7.975 -0.571 1.00 0.00 C ATOM 1689 CE2 PHE A 110 -3.499 10.123 0.326 1.00 0.00 C ATOM 1690 CZ PHE A 110 -3.513 8.748 0.445 1.00 0.00 C ATOM 0 H PHE A 110 -2.984 11.858 -2.989 1.00 0.00 H new ATOM 0 HA PHE A 110 -3.853 9.639 -4.508 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -5.408 11.636 -2.813 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -6.018 10.087 -3.359 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.963 7.972 -2.495 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.003 11.800 -0.891 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.050 6.899 -0.482 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.085 10.730 1.118 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.113 8.278 1.331 1.00 0.00 H new ATOM 1700 N GLU A 111 -4.719 12.601 -5.556 1.00 0.00 N ATOM 1701 CA GLU A 111 -5.349 13.365 -6.609 1.00 0.00 C ATOM 1702 C GLU A 111 -4.551 13.265 -7.911 1.00 0.00 C ATOM 1703 O GLU A 111 -5.111 13.317 -9.009 1.00 0.00 O ATOM 1704 CB GLU A 111 -5.432 14.816 -6.144 1.00 0.00 C ATOM 1705 CG GLU A 111 -6.325 15.684 -6.991 1.00 0.00 C ATOM 1706 CD GLU A 111 -6.268 17.143 -6.581 1.00 0.00 C ATOM 1707 OE1 GLU A 111 -5.356 17.854 -7.048 1.00 0.00 O ATOM 1708 OE2 GLU A 111 -7.121 17.584 -5.781 1.00 0.00 O ATOM 0 H GLU A 111 -4.171 13.166 -4.907 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.345 12.971 -6.810 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -5.793 14.836 -5.116 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -4.429 15.242 -6.138 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -6.032 15.591 -8.037 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -7.352 15.328 -6.915 1.00 0.00 H new ATOM 1715 N ALA A 112 -3.242 13.115 -7.778 1.00 0.00 N ATOM 1716 CA ALA A 112 -2.349 13.107 -8.931 1.00 0.00 C ATOM 1717 C ALA A 112 -2.155 11.708 -9.505 1.00 0.00 C ATOM 1718 O ALA A 112 -1.980 11.553 -10.714 1.00 0.00 O ATOM 1719 CB ALA A 112 -1.005 13.711 -8.559 1.00 0.00 C ATOM 0 H ALA A 112 -2.771 12.997 -6.881 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.819 13.713 -9.706 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -0.348 13.699 -9.428 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.148 14.739 -8.226 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -0.554 13.129 -7.755 1.00 0.00 H new ATOM 1725 N VAL A 113 -2.179 10.694 -8.646 1.00 0.00 N ATOM 1726 CA VAL A 113 -1.951 9.321 -9.086 1.00 0.00 C ATOM 1727 C VAL A 113 -3.056 8.865 -10.043 1.00 0.00 C ATOM 1728 O VAL A 113 -4.242 9.106 -9.807 1.00 0.00 O ATOM 1729 CB VAL A 113 -1.830 8.342 -7.889 1.00 0.00 C ATOM 1730 CG1 VAL A 113 -3.126 8.266 -7.094 1.00 0.00 C ATOM 1731 CG2 VAL A 113 -1.404 6.961 -8.363 1.00 0.00 C ATOM 0 H VAL A 113 -2.353 10.795 -7.646 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.000 9.307 -9.619 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.059 8.730 -7.223 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -3.003 7.571 -6.264 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.373 9.254 -6.706 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -3.931 7.919 -7.742 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -1.325 6.291 -7.507 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.144 6.572 -9.062 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.436 7.029 -8.860 1.00 0.00 H new ATOM 1741 N LYS A 114 -2.656 8.227 -11.133 1.00 0.00 N ATOM 1742 CA LYS A 114 -3.593 7.818 -12.169 1.00 0.00 C ATOM 1743 C LYS A 114 -3.624 6.302 -12.305 1.00 0.00 C ATOM 1744 O LYS A 114 -2.582 5.649 -12.232 1.00 0.00 O ATOM 1745 CB LYS A 114 -3.203 8.440 -13.513 1.00 0.00 C ATOM 1746 CG LYS A 114 -3.084 9.956 -13.488 1.00 0.00 C ATOM 1747 CD LYS A 114 -4.404 10.625 -13.141 1.00 0.00 C ATOM 1748 CE LYS A 114 -5.484 10.290 -14.157 1.00 0.00 C ATOM 1749 NZ LYS A 114 -6.754 11.004 -13.870 1.00 0.00 N ATOM 0 H LYS A 114 -1.685 7.980 -11.323 1.00 0.00 H new ATOM 0 HA LYS A 114 -4.585 8.167 -11.881 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.251 8.017 -13.833 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.945 8.157 -14.260 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.327 10.248 -12.760 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.743 10.309 -14.461 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.725 10.306 -12.149 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.265 11.705 -13.099 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.137 10.554 -15.156 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.663 9.215 -14.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.465 10.749 -14.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -7.099 10.733 -12.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.589 12.030 -13.897 1.00 0.00 H new ATOM 1763 N THR A 115 -4.815 5.748 -12.492 1.00 0.00 N ATOM 1764 CA THR A 115 -4.964 4.325 -12.735 1.00 0.00 C ATOM 1765 C THR A 115 -4.455 3.972 -14.130 1.00 0.00 C ATOM 1766 O THR A 115 -5.147 4.192 -15.128 1.00 0.00 O ATOM 1767 CB THR A 115 -6.438 3.887 -12.602 1.00 0.00 C ATOM 1768 OG1 THR A 115 -6.992 4.395 -11.381 1.00 0.00 O ATOM 1769 CG2 THR A 115 -6.559 2.371 -12.616 1.00 0.00 C ATOM 0 H THR A 115 -5.693 6.267 -12.479 1.00 0.00 H new ATOM 0 HA THR A 115 -4.375 3.797 -11.985 1.00 0.00 H new ATOM 0 HB THR A 115 -6.988 4.290 -13.452 1.00 0.00 H new ATOM 0 HG1 THR A 115 -7.928 4.114 -11.305 1.00 0.00 H new ATOM 0 HG21 THR A 115 -7.608 2.089 -12.521 1.00 0.00 H new ATOM 0 HG22 THR A 115 -6.162 1.983 -13.554 1.00 0.00 H new ATOM 0 HG23 THR A 115 -5.994 1.953 -11.783 1.00 0.00 H new ATOM 1777 N GLY A 116 -3.239 3.454 -14.195 1.00 0.00 N ATOM 1778 CA GLY A 116 -2.666 3.071 -15.465 1.00 0.00 C ATOM 1779 C GLY A 116 -1.247 3.576 -15.642 1.00 0.00 C ATOM 1780 O GLY A 116 -0.437 2.926 -16.295 1.00 0.00 O ATOM 0 H GLY A 116 -2.638 3.292 -13.387 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -2.674 1.984 -15.550 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.289 3.458 -16.272 1.00 0.00 H new ATOM 1784 N ASP A 117 -0.942 4.728 -15.056 1.00 0.00 N ATOM 1785 CA ASP A 117 0.379 5.337 -15.217 1.00 0.00 C ATOM 1786 C ASP A 117 1.375 4.787 -14.211 1.00 0.00 C ATOM 1787 O ASP A 117 0.993 4.232 -13.187 1.00 0.00 O ATOM 1788 CB ASP A 117 0.304 6.862 -15.124 1.00 0.00 C ATOM 1789 CG ASP A 117 -0.028 7.484 -16.463 1.00 0.00 C ATOM 1790 OD1 ASP A 117 0.871 7.536 -17.331 1.00 0.00 O ATOM 1791 OD2 ASP A 117 -1.190 7.892 -16.668 1.00 0.00 O ATOM 0 H ASP A 117 -1.585 5.259 -14.468 1.00 0.00 H new ATOM 0 HA ASP A 117 0.733 5.075 -16.214 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -0.452 7.146 -14.392 1.00 0.00 H new ATOM 0 HB3 ASP A 117 1.256 7.253 -14.766 1.00 0.00 H new ATOM 1796 N ARG A 118 2.658 4.967 -14.501 1.00 0.00 N ATOM 1797 CA ARG A 118 3.710 4.321 -13.733 1.00 0.00 C ATOM 1798 C ARG A 118 4.144 5.174 -12.548 1.00 0.00 C ATOM 1799 O ARG A 118 4.499 6.347 -12.699 1.00 0.00 O ATOM 1800 CB ARG A 118 4.923 4.022 -14.621 1.00 0.00 C ATOM 1801 CG ARG A 118 6.010 3.234 -13.905 1.00 0.00 C ATOM 1802 CD ARG A 118 7.262 3.092 -14.758 1.00 0.00 C ATOM 1803 NE ARG A 118 7.944 4.372 -14.963 1.00 0.00 N ATOM 1804 CZ ARG A 118 9.276 4.506 -15.016 1.00 0.00 C ATOM 1805 NH1 ARG A 118 10.066 3.452 -14.860 1.00 0.00 N ATOM 1806 NH2 ARG A 118 9.820 5.699 -15.216 1.00 0.00 N ATOM 0 H ARG A 118 2.993 5.556 -15.263 1.00 0.00 H new ATOM 0 HA ARG A 118 3.302 3.385 -13.352 1.00 0.00 H new ATOM 0 HB2 ARG A 118 4.595 3.463 -15.497 1.00 0.00 H new ATOM 0 HB3 ARG A 118 5.342 4.962 -14.981 1.00 0.00 H new ATOM 0 HG2 ARG A 118 6.263 3.732 -12.969 1.00 0.00 H new ATOM 0 HG3 ARG A 118 5.632 2.245 -13.648 1.00 0.00 H new ATOM 0 HD2 ARG A 118 7.946 2.391 -14.281 1.00 0.00 H new ATOM 0 HD3 ARG A 118 6.994 2.667 -15.725 1.00 0.00 H new ATOM 0 HE ARG A 118 7.372 5.209 -15.072 1.00 0.00 H new ATOM 0 HH11 ARG A 118 9.660 2.530 -14.698 1.00 0.00 H new ATOM 0 HH12 ARG A 118 11.079 3.563 -14.902 1.00 0.00 H new ATOM 0 HH21 ARG A 118 9.224 6.519 -15.330 1.00 0.00 H new ATOM 0 HH22 ARG A 118 10.835 5.797 -15.256 1.00 0.00 H new ATOM 1820 N VAL A 119 4.134 4.567 -11.376 1.00 0.00 N ATOM 1821 CA VAL A 119 4.616 5.217 -10.171 1.00 0.00 C ATOM 1822 C VAL A 119 5.937 4.600 -9.749 1.00 0.00 C ATOM 1823 O VAL A 119 6.025 3.390 -9.520 1.00 0.00 O ATOM 1824 CB VAL A 119 3.610 5.105 -9.003 1.00 0.00 C ATOM 1825 CG1 VAL A 119 4.187 5.711 -7.730 1.00 0.00 C ATOM 1826 CG2 VAL A 119 2.297 5.782 -9.360 1.00 0.00 C ATOM 0 H VAL A 119 3.794 3.616 -11.232 1.00 0.00 H new ATOM 0 HA VAL A 119 4.744 6.274 -10.403 1.00 0.00 H new ATOM 0 HB VAL A 119 3.419 4.047 -8.824 1.00 0.00 H new ATOM 0 HG11 VAL A 119 3.461 5.620 -6.922 1.00 0.00 H new ATOM 0 HG12 VAL A 119 5.101 5.183 -7.457 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.413 6.764 -7.898 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.602 5.692 -8.525 1.00 0.00 H new ATOM 0 HG22 VAL A 119 2.477 6.836 -9.571 1.00 0.00 H new ATOM 0 HG23 VAL A 119 1.869 5.304 -10.241 1.00 0.00 H new ATOM 1836 N VAL A 120 6.967 5.423 -9.678 1.00 0.00 N ATOM 1837 CA VAL A 120 8.265 4.975 -9.219 1.00 0.00 C ATOM 1838 C VAL A 120 8.422 5.309 -7.744 1.00 0.00 C ATOM 1839 O VAL A 120 8.666 6.459 -7.378 1.00 0.00 O ATOM 1840 CB VAL A 120 9.413 5.622 -10.023 1.00 0.00 C ATOM 1841 CG1 VAL A 120 10.760 5.073 -9.579 1.00 0.00 C ATOM 1842 CG2 VAL A 120 9.212 5.402 -11.514 1.00 0.00 C ATOM 0 H VAL A 120 6.927 6.410 -9.934 1.00 0.00 H new ATOM 0 HA VAL A 120 8.321 3.897 -9.369 1.00 0.00 H new ATOM 0 HB VAL A 120 9.402 6.694 -9.828 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.554 5.543 -10.159 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.909 5.287 -8.521 1.00 0.00 H new ATOM 0 HG13 VAL A 120 10.784 3.995 -9.738 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.031 5.865 -12.064 1.00 0.00 H new ATOM 0 HG22 VAL A 120 9.193 4.333 -11.725 1.00 0.00 H new ATOM 0 HG23 VAL A 120 8.268 5.850 -11.824 1.00 0.00 H new ATOM 1852 N VAL A 121 8.246 4.313 -6.899 1.00 0.00 N ATOM 1853 CA VAL A 121 8.329 4.523 -5.469 1.00 0.00 C ATOM 1854 C VAL A 121 9.666 4.037 -4.925 1.00 0.00 C ATOM 1855 O VAL A 121 9.986 2.848 -4.977 1.00 0.00 O ATOM 1856 CB VAL A 121 7.157 3.844 -4.715 1.00 0.00 C ATOM 1857 CG1 VAL A 121 7.015 2.383 -5.112 1.00 0.00 C ATOM 1858 CG2 VAL A 121 7.340 3.973 -3.207 1.00 0.00 C ATOM 0 H VAL A 121 8.045 3.353 -7.178 1.00 0.00 H new ATOM 0 HA VAL A 121 8.252 5.597 -5.297 1.00 0.00 H new ATOM 0 HB VAL A 121 6.239 4.358 -4.999 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.184 1.936 -4.565 1.00 0.00 H new ATOM 0 HG12 VAL A 121 6.824 2.314 -6.183 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.935 1.850 -4.873 1.00 0.00 H new ATOM 0 HG21 VAL A 121 6.507 3.490 -2.697 1.00 0.00 H new ATOM 0 HG22 VAL A 121 8.273 3.494 -2.911 1.00 0.00 H new ATOM 0 HG23 VAL A 121 7.371 5.028 -2.933 1.00 0.00 H new ATOM 1868 N ASN A 122 10.458 4.969 -4.427 1.00 0.00 N ATOM 1869 CA ASN A 122 11.719 4.628 -3.801 1.00 0.00 C ATOM 1870 C ASN A 122 11.535 4.691 -2.295 1.00 0.00 C ATOM 1871 O ASN A 122 11.651 5.755 -1.686 1.00 0.00 O ATOM 1872 CB ASN A 122 12.826 5.587 -4.248 1.00 0.00 C ATOM 1873 CG ASN A 122 14.163 4.890 -4.420 1.00 0.00 C ATOM 1874 OD1 ASN A 122 14.936 4.809 -3.352 1.00 0.00 O flip ATOM 1875 ND2 ASN A 122 14.493 4.427 -5.512 1.00 0.00 N flip ATOM 0 H ASN A 122 10.249 5.967 -4.445 1.00 0.00 H new ATOM 0 HA ASN A 122 12.018 3.623 -4.099 1.00 0.00 H new ATOM 0 HB2 ASN A 122 12.539 6.054 -5.190 1.00 0.00 H new ATOM 0 HB3 ASN A 122 12.928 6.386 -3.514 1.00 0.00 H new ATOM 0 HD21 ASN A 122 13.866 4.511 -6.312 1.00 0.00 H new ATOM 0 HD22 ASN A 122 15.393 3.959 -5.617 1.00 0.00 H new ATOM 1882 N ALA A 123 11.223 3.552 -1.701 1.00 0.00 N ATOM 1883 CA ALA A 123 10.874 3.491 -0.289 1.00 0.00 C ATOM 1884 C ALA A 123 12.093 3.701 0.592 1.00 0.00 C ATOM 1885 O ALA A 123 11.980 4.188 1.711 1.00 0.00 O ATOM 1886 CB ALA A 123 10.205 2.165 0.031 1.00 0.00 C ATOM 0 H ALA A 123 11.204 2.650 -2.177 1.00 0.00 H new ATOM 0 HA ALA A 123 10.172 4.298 -0.080 1.00 0.00 H new ATOM 0 HB1 ALA A 123 9.949 2.133 1.090 1.00 0.00 H new ATOM 0 HB2 ALA A 123 9.298 2.062 -0.565 1.00 0.00 H new ATOM 0 HB3 ALA A 123 10.887 1.348 -0.203 1.00 0.00 H new ATOM 1892 N ASP A 124 13.260 3.361 0.065 1.00 0.00 N ATOM 1893 CA ASP A 124 14.509 3.459 0.817 1.00 0.00 C ATOM 1894 C ASP A 124 14.819 4.909 1.189 1.00 0.00 C ATOM 1895 O ASP A 124 15.558 5.173 2.138 1.00 0.00 O ATOM 1896 CB ASP A 124 15.656 2.858 0.002 1.00 0.00 C ATOM 1897 CG ASP A 124 16.909 2.633 0.827 1.00 0.00 C ATOM 1898 OD1 ASP A 124 16.873 1.794 1.749 1.00 0.00 O ATOM 1899 OD2 ASP A 124 17.939 3.282 0.545 1.00 0.00 O ATOM 0 H ASP A 124 13.371 3.012 -0.887 1.00 0.00 H new ATOM 0 HA ASP A 124 14.396 2.896 1.743 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.333 1.909 -0.426 1.00 0.00 H new ATOM 0 HB3 ASP A 124 15.889 3.521 -0.831 1.00 0.00 H new ATOM 1904 N GLU A 125 14.251 5.849 0.441 1.00 0.00 N ATOM 1905 CA GLU A 125 14.426 7.262 0.740 1.00 0.00 C ATOM 1906 C GLU A 125 13.077 7.928 1.013 1.00 0.00 C ATOM 1907 O GLU A 125 13.014 9.121 1.321 1.00 0.00 O ATOM 1908 CB GLU A 125 15.143 7.965 -0.415 1.00 0.00 C ATOM 1909 CG GLU A 125 14.375 7.952 -1.727 1.00 0.00 C ATOM 1910 CD GLU A 125 15.126 8.649 -2.843 1.00 0.00 C ATOM 1911 OE1 GLU A 125 15.581 9.793 -2.637 1.00 0.00 O ATOM 1912 OE2 GLU A 125 15.272 8.054 -3.930 1.00 0.00 O ATOM 0 H GLU A 125 13.668 5.657 -0.374 1.00 0.00 H new ATOM 0 HA GLU A 125 15.039 7.350 1.637 1.00 0.00 H new ATOM 0 HB2 GLU A 125 15.337 8.999 -0.131 1.00 0.00 H new ATOM 0 HB3 GLU A 125 16.112 7.490 -0.569 1.00 0.00 H new ATOM 0 HG2 GLU A 125 14.174 6.921 -2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 125 13.409 8.437 -1.584 1.00 0.00 H new ATOM 1919 N GLY A 126 12.005 7.144 0.906 1.00 0.00 N ATOM 1920 CA GLY A 126 10.664 7.660 1.130 1.00 0.00 C ATOM 1921 C GLY A 126 10.290 8.745 0.139 1.00 0.00 C ATOM 1922 O GLY A 126 10.046 9.888 0.521 1.00 0.00 O ATOM 0 H GLY A 126 12.043 6.153 0.666 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.946 6.843 1.058 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.595 8.057 2.143 1.00 0.00 H new ATOM 1926 N TYR A 127 10.240 8.399 -1.136 1.00 0.00 N ATOM 1927 CA TYR A 127 9.945 9.380 -2.167 1.00 0.00 C ATOM 1928 C TYR A 127 9.285 8.708 -3.362 1.00 0.00 C ATOM 1929 O TYR A 127 9.646 7.587 -3.727 1.00 0.00 O ATOM 1930 CB TYR A 127 11.235 10.081 -2.596 1.00 0.00 C ATOM 1931 CG TYR A 127 11.023 11.476 -3.136 1.00 0.00 C ATOM 1932 CD1 TYR A 127 10.850 12.548 -2.269 1.00 0.00 C ATOM 1933 CD2 TYR A 127 10.999 11.725 -4.502 1.00 0.00 C ATOM 1934 CE1 TYR A 127 10.659 13.828 -2.748 1.00 0.00 C ATOM 1935 CE2 TYR A 127 10.807 13.004 -4.988 1.00 0.00 C ATOM 1936 CZ TYR A 127 10.640 14.050 -4.105 1.00 0.00 C ATOM 1937 OH TYR A 127 10.454 15.326 -4.581 1.00 0.00 O ATOM 0 H TYR A 127 10.399 7.452 -1.481 1.00 0.00 H new ATOM 0 HA TYR A 127 9.255 10.122 -1.765 1.00 0.00 H new ATOM 0 HB2 TYR A 127 11.911 10.131 -1.742 1.00 0.00 H new ATOM 0 HB3 TYR A 127 11.728 9.478 -3.358 1.00 0.00 H new ATOM 0 HD1 TYR A 127 10.865 12.377 -1.203 1.00 0.00 H new ATOM 0 HD2 TYR A 127 11.132 10.907 -5.194 1.00 0.00 H new ATOM 0 HE1 TYR A 127 10.525 14.651 -2.061 1.00 0.00 H new ATOM 0 HE2 TYR A 127 10.788 13.183 -6.053 1.00 0.00 H new ATOM 0 HH TYR A 127 10.467 15.315 -5.561 1.00 0.00 H new ATOM 1947 N VAL A 128 8.316 9.388 -3.961 1.00 0.00 N ATOM 1948 CA VAL A 128 7.607 8.843 -5.112 1.00 0.00 C ATOM 1949 C VAL A 128 7.704 9.774 -6.320 1.00 0.00 C ATOM 1950 O VAL A 128 7.580 10.997 -6.197 1.00 0.00 O ATOM 1951 CB VAL A 128 6.118 8.556 -4.797 1.00 0.00 C ATOM 1952 CG1 VAL A 128 5.990 7.429 -3.781 1.00 0.00 C ATOM 1953 CG2 VAL A 128 5.415 9.806 -4.292 1.00 0.00 C ATOM 0 H VAL A 128 8.004 10.315 -3.671 1.00 0.00 H new ATOM 0 HA VAL A 128 8.094 7.898 -5.352 1.00 0.00 H new ATOM 0 HB VAL A 128 5.635 8.245 -5.723 1.00 0.00 H new ATOM 0 HG11 VAL A 128 4.936 7.244 -3.574 1.00 0.00 H new ATOM 0 HG12 VAL A 128 6.446 6.524 -4.182 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.497 7.712 -2.858 1.00 0.00 H new ATOM 0 HG21 VAL A 128 4.371 9.575 -4.079 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.903 10.155 -3.382 1.00 0.00 H new ATOM 0 HG23 VAL A 128 5.466 10.585 -5.053 1.00 0.00 H new ATOM 1963 N GLU A 129 7.956 9.180 -7.473 1.00 0.00 N ATOM 1964 CA GLU A 129 8.037 9.905 -8.730 1.00 0.00 C ATOM 1965 C GLU A 129 6.995 9.358 -9.697 1.00 0.00 C ATOM 1966 O GLU A 129 7.064 8.193 -10.100 1.00 0.00 O ATOM 1967 CB GLU A 129 9.443 9.756 -9.319 1.00 0.00 C ATOM 1968 CG GLU A 129 9.605 10.307 -10.728 1.00 0.00 C ATOM 1969 CD GLU A 129 9.621 11.821 -10.785 1.00 0.00 C ATOM 1970 OE1 GLU A 129 10.680 12.415 -10.497 1.00 0.00 O ATOM 1971 OE2 GLU A 129 8.599 12.424 -11.168 1.00 0.00 O ATOM 0 H GLU A 129 8.111 8.176 -7.565 1.00 0.00 H new ATOM 0 HA GLU A 129 7.840 10.963 -8.559 1.00 0.00 H new ATOM 0 HB2 GLU A 129 10.152 10.260 -8.663 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.710 8.699 -9.324 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.532 9.925 -11.155 1.00 0.00 H new ATOM 0 HG3 GLU A 129 8.791 9.936 -11.351 1.00 0.00 H new ATOM 1978 N LEU A 130 6.021 10.180 -10.052 1.00 0.00 N ATOM 1979 CA LEU A 130 4.982 9.746 -10.971 1.00 0.00 C ATOM 1980 C LEU A 130 5.379 10.051 -12.406 1.00 0.00 C ATOM 1981 O LEU A 130 5.685 11.198 -12.750 1.00 0.00 O ATOM 1982 CB LEU A 130 3.640 10.416 -10.665 1.00 0.00 C ATOM 1983 CG LEU A 130 2.505 10.028 -11.618 1.00 0.00 C ATOM 1984 CD1 LEU A 130 2.083 8.584 -11.397 1.00 0.00 C ATOM 1985 CD2 LEU A 130 1.319 10.965 -11.449 1.00 0.00 C ATOM 0 H LEU A 130 5.928 11.141 -9.722 1.00 0.00 H new ATOM 0 HA LEU A 130 4.868 8.670 -10.842 1.00 0.00 H new ATOM 0 HB2 LEU A 130 3.345 10.162 -9.647 1.00 0.00 H new ATOM 0 HB3 LEU A 130 3.772 11.497 -10.699 1.00 0.00 H new ATOM 0 HG LEU A 130 2.873 10.121 -12.640 1.00 0.00 H new ATOM 0 HD11 LEU A 130 1.276 8.331 -12.085 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.933 7.925 -11.577 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.737 8.459 -10.371 1.00 0.00 H new ATOM 0 HD21 LEU A 130 0.524 10.673 -12.135 1.00 0.00 H new ATOM 0 HD22 LEU A 130 0.953 10.908 -10.424 1.00 0.00 H new ATOM 0 HD23 LEU A 130 1.629 11.987 -11.667 1.00 0.00 H new ATOM 1997 N ILE A 131 5.366 9.030 -13.243 1.00 0.00 N ATOM 1998 CA ILE A 131 5.689 9.204 -14.642 1.00 0.00 C ATOM 1999 C ILE A 131 4.408 9.236 -15.446 1.00 0.00 C ATOM 2000 O ILE A 131 3.707 8.232 -15.569 1.00 0.00 O ATOM 2001 CB ILE A 131 6.581 8.073 -15.173 1.00 0.00 C ATOM 2002 CG1 ILE A 131 7.722 7.783 -14.195 1.00 0.00 C ATOM 2003 CG2 ILE A 131 7.134 8.434 -16.543 1.00 0.00 C ATOM 2004 CD1 ILE A 131 8.669 8.949 -13.998 1.00 0.00 C ATOM 0 H ILE A 131 5.135 8.073 -12.976 1.00 0.00 H new ATOM 0 HA ILE A 131 6.237 10.141 -14.743 1.00 0.00 H new ATOM 0 HB ILE A 131 5.975 7.172 -15.270 1.00 0.00 H new ATOM 0 HG12 ILE A 131 7.299 7.503 -13.230 1.00 0.00 H new ATOM 0 HG13 ILE A 131 8.288 6.924 -14.556 1.00 0.00 H new ATOM 0 HG21 ILE A 131 7.764 7.622 -16.906 1.00 0.00 H new ATOM 0 HG22 ILE A 131 6.309 8.592 -17.238 1.00 0.00 H new ATOM 0 HG23 ILE A 131 7.725 9.347 -16.468 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.450 8.668 -13.292 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.122 9.216 -14.953 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.117 9.804 -13.607 1.00 0.00 H new ATOM 2016 N GLU A 132 4.123 10.396 -15.981 1.00 0.00 N ATOM 2017 CA GLU A 132 2.890 10.636 -16.711 1.00 0.00 C ATOM 2018 C GLU A 132 3.121 10.383 -18.190 1.00 0.00 C ATOM 2019 O GLU A 132 3.680 11.225 -18.894 1.00 0.00 O ATOM 2020 CB GLU A 132 2.426 12.076 -16.477 1.00 0.00 C ATOM 2021 CG GLU A 132 2.239 12.424 -15.005 1.00 0.00 C ATOM 2022 CD GLU A 132 2.428 13.901 -14.721 1.00 0.00 C ATOM 2023 OE1 GLU A 132 1.480 14.684 -14.926 1.00 0.00 O ATOM 2024 OE2 GLU A 132 3.544 14.290 -14.309 1.00 0.00 O ATOM 0 H GLU A 132 4.738 11.208 -15.926 1.00 0.00 H new ATOM 0 HA GLU A 132 2.113 9.958 -16.356 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.154 12.759 -16.914 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.484 12.236 -17.002 1.00 0.00 H new ATOM 0 HG2 GLU A 132 1.240 12.123 -14.690 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.948 11.850 -14.408 1.00 0.00 H new