USER MOD reduce.3.24.130724 H: found=0, std=0, add=683, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 682 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 21 TYR OH : rot 15:sc= 0.793 USER MOD Set 1.2: A 39 LYS NZ :NH3+ 169:sc= 0.924 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -158:sc= 2.15 (180deg=1.5) USER MOD Single : A 25 LYS NZ :NH3+ 161:sc= 0.12 (180deg=0.042) USER MOD Single : A 29 GLN : amide:sc= -0.0299 X(o=-0.03,f=-0.26) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -133:sc= 0.297 USER MOD Single : A 35 HIS : no HD1:sc= -4.18! C(o=-4.2!,f=-6.9!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 154:sc= -1.15 (180deg=-1.64) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -76:sc= 1.09 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 176:sc= 1.27 (180deg=1.18) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 163:sc= 2.39 (180deg=1.96) USER MOD Single : A 50 SER OG : rot 74:sc= 0.0936 USER MOD Single : A 51 TYR OH : rot -140:sc=-0.000573 USER MOD Single : A 52 CYS SG : rot 62:sc= 1.29 USER MOD Single : A 53 GLN : amide:sc= -0.397 K(o=-0.4,f=-2.1) USER MOD Single : A 55 GLN : amide:sc= -0.0564 X(o=-0.056,f=-0.063) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.16 K(o=-0.16,f=-1.4!) USER MOD Single : A 61 SER OG : rot -81:sc= 1.28 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 74 ASN : amide:sc=-0.000205 X(o=-0.0002,f=-0.31) USER MOD Single : A 75 HIS : no HD1:sc= 0.618 K(o=0.62,f=-5.4!) USER MOD Single : A 76 THR OG1 : rot 14:sc= 0.418 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 169:sc= 1.24 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= -0.0689 K(o=-0.069,f=-1.3!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.118 USER MOD Single : B 196 THR OG1 : rot 180:sc= 0 USER MOD Single : B 199 CYS SG : rot 180:sc= -0.0263 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 13.287 -6.866 -0.526 1.00 10.00 N ATOM 2 CA TYR A 21 11.921 -6.401 -0.730 1.00 10.00 C ATOM 3 C TYR A 21 11.043 -6.779 0.454 1.00 10.00 C ATOM 4 O TYR A 21 11.122 -7.898 0.963 1.00 10.00 O ATOM 5 CB TYR A 21 11.341 -6.994 -2.018 1.00 10.00 C ATOM 6 CG TYR A 21 11.692 -6.210 -3.261 1.00 10.00 C ATOM 7 CD1 TYR A 21 10.747 -5.406 -3.887 1.00 10.00 C ATOM 8 CD2 TYR A 21 12.969 -6.270 -3.806 1.00 10.00 C ATOM 9 CE1 TYR A 21 11.067 -4.686 -5.021 1.00 10.00 C ATOM 10 CE2 TYR A 21 13.295 -5.553 -4.939 1.00 10.00 C ATOM 11 CZ TYR A 21 12.341 -4.762 -5.542 1.00 10.00 C ATOM 12 OH TYR A 21 12.668 -4.037 -6.666 1.00 10.00 O ATOM 0 HA TYR A 21 11.942 -5.315 -0.818 1.00 10.00 H new ATOM 0 HB2 TYR A 21 11.701 -8.017 -2.131 1.00 10.00 H new ATOM 0 HB3 TYR A 21 10.256 -7.046 -1.927 1.00 10.00 H new ATOM 0 HD1 TYR A 21 9.748 -5.343 -3.481 1.00 10.00 H new ATOM 0 HD2 TYR A 21 13.719 -6.888 -3.335 1.00 10.00 H new ATOM 0 HE1 TYR A 21 10.322 -4.066 -5.498 1.00 10.00 H new ATOM 0 HE2 TYR A 21 14.292 -5.611 -5.351 1.00 10.00 H new ATOM 0 HH TYR A 21 11.983 -3.355 -6.826 1.00 10.00 H new ATOM 22 N ILE A 22 10.222 -5.840 0.895 1.00 10.00 N ATOM 23 CA ILE A 22 9.319 -6.071 2.010 1.00 10.00 C ATOM 24 C ILE A 22 7.931 -6.379 1.476 1.00 10.00 C ATOM 25 O ILE A 22 7.339 -5.572 0.759 1.00 10.00 O ATOM 26 CB ILE A 22 9.251 -4.849 2.957 1.00 10.00 C ATOM 27 CG1 ILE A 22 10.597 -4.637 3.660 1.00 10.00 C ATOM 28 CG2 ILE A 22 8.134 -5.016 3.981 1.00 10.00 C ATOM 29 CD1 ILE A 22 10.956 -5.732 4.642 1.00 10.00 C ATOM 0 H ILE A 22 10.163 -4.904 0.494 1.00 10.00 H new ATOM 0 HA ILE A 22 9.700 -6.916 2.584 1.00 10.00 H new ATOM 0 HB ILE A 22 9.032 -3.967 2.356 1.00 10.00 H new ATOM 0 HG12 ILE A 22 11.382 -4.566 2.907 1.00 10.00 H new ATOM 0 HG13 ILE A 22 10.574 -3.683 4.187 1.00 10.00 H new ATOM 0 HG21 ILE A 22 8.107 -4.144 4.635 1.00 10.00 H new ATOM 0 HG22 ILE A 22 7.179 -5.113 3.465 1.00 10.00 H new ATOM 0 HG23 ILE A 22 8.317 -5.911 4.576 1.00 10.00 H new ATOM 0 HD11 ILE A 22 11.921 -5.510 5.098 1.00 10.00 H new ATOM 0 HD12 ILE A 22 10.193 -5.789 5.418 1.00 10.00 H new ATOM 0 HD13 ILE A 22 11.013 -6.686 4.118 1.00 10.00 H new ATOM 41 N LYS A 23 7.423 -7.551 1.807 1.00 10.00 N ATOM 42 CA LYS A 23 6.110 -7.958 1.344 1.00 10.00 C ATOM 43 C LYS A 23 5.046 -7.666 2.392 1.00 10.00 C ATOM 44 O LYS A 23 5.035 -8.263 3.473 1.00 10.00 O ATOM 45 CB LYS A 23 6.116 -9.444 0.994 1.00 10.00 C ATOM 46 CG LYS A 23 4.847 -9.915 0.309 1.00 10.00 C ATOM 47 CD LYS A 23 4.619 -11.398 0.546 1.00 10.00 C ATOM 48 CE LYS A 23 4.067 -11.663 1.935 1.00 10.00 C ATOM 49 NZ LYS A 23 5.081 -12.276 2.827 1.00 10.00 N ATOM 0 H LYS A 23 7.898 -8.237 2.394 1.00 10.00 H new ATOM 0 HA LYS A 23 5.869 -7.383 0.450 1.00 10.00 H new ATOM 0 HB2 LYS A 23 6.967 -9.652 0.345 1.00 10.00 H new ATOM 0 HB3 LYS A 23 6.262 -10.022 1.906 1.00 10.00 H new ATOM 0 HG2 LYS A 23 3.995 -9.348 0.684 1.00 10.00 H new ATOM 0 HG3 LYS A 23 4.913 -9.720 -0.761 1.00 10.00 H new ATOM 0 HD2 LYS A 23 3.926 -11.784 -0.201 1.00 10.00 H new ATOM 0 HD3 LYS A 23 5.558 -11.936 0.418 1.00 10.00 H new ATOM 0 HE2 LYS A 23 3.718 -10.727 2.371 1.00 10.00 H new ATOM 0 HE3 LYS A 23 3.202 -12.322 1.862 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 4.603 -12.774 3.605 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 5.656 -12.952 2.285 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 5.695 -11.533 3.217 1.00 10.00 H new ATOM 63 N LEU A 24 4.162 -6.737 2.063 1.00 10.00 N ATOM 64 CA LEU A 24 3.077 -6.353 2.947 1.00 10.00 C ATOM 65 C LEU A 24 1.826 -7.141 2.589 1.00 10.00 C ATOM 66 O LEU A 24 1.569 -7.409 1.411 1.00 10.00 O ATOM 67 CB LEU A 24 2.803 -4.851 2.830 1.00 10.00 C ATOM 68 CG LEU A 24 4.031 -3.951 2.988 1.00 10.00 C ATOM 69 CD1 LEU A 24 3.743 -2.559 2.444 1.00 10.00 C ATOM 70 CD2 LEU A 24 4.448 -3.874 4.449 1.00 10.00 C ATOM 0 H LEU A 24 4.178 -6.230 1.178 1.00 10.00 H new ATOM 0 HA LEU A 24 3.360 -6.575 3.976 1.00 10.00 H new ATOM 0 HB2 LEU A 24 2.351 -4.655 1.858 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.068 -4.572 3.585 1.00 10.00 H new ATOM 0 HG LEU A 24 4.852 -4.383 2.416 1.00 10.00 H new ATOM 0 HD11 LEU A 24 4.626 -1.932 2.564 1.00 10.00 H new ATOM 0 HD12 LEU A 24 3.487 -2.627 1.387 1.00 10.00 H new ATOM 0 HD13 LEU A 24 2.909 -2.120 2.991 1.00 10.00 H new ATOM 0 HD21 LEU A 24 5.322 -3.230 4.544 1.00 10.00 H new ATOM 0 HD22 LEU A 24 3.629 -3.464 5.040 1.00 10.00 H new ATOM 0 HD23 LEU A 24 4.692 -4.873 4.811 1.00 10.00 H new ATOM 82 N LYS A 25 1.054 -7.514 3.595 1.00 10.00 N ATOM 83 CA LYS A 25 -0.164 -8.271 3.374 1.00 10.00 C ATOM 84 C LYS A 25 -1.384 -7.360 3.420 1.00 10.00 C ATOM 85 O LYS A 25 -1.838 -6.963 4.494 1.00 10.00 O ATOM 86 CB LYS A 25 -0.308 -9.384 4.414 1.00 10.00 C ATOM 87 CG LYS A 25 0.743 -10.477 4.292 1.00 10.00 C ATOM 88 CD LYS A 25 0.436 -11.653 5.209 1.00 10.00 C ATOM 89 CE LYS A 25 -0.778 -12.437 4.731 1.00 10.00 C ATOM 90 NZ LYS A 25 -1.072 -13.606 5.601 1.00 10.00 N ATOM 0 H LYS A 25 1.250 -7.304 4.574 1.00 10.00 H new ATOM 0 HA LYS A 25 -0.100 -8.722 2.384 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -0.250 -8.947 5.411 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -1.297 -9.832 4.319 1.00 10.00 H new ATOM 0 HG2 LYS A 25 0.791 -10.823 3.259 1.00 10.00 H new ATOM 0 HG3 LYS A 25 1.723 -10.069 4.538 1.00 10.00 H new ATOM 0 HD2 LYS A 25 1.301 -12.314 5.255 1.00 10.00 H new ATOM 0 HD3 LYS A 25 0.259 -11.289 6.221 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -1.646 -11.778 4.705 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -0.608 -12.780 3.710 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -2.054 -13.914 5.449 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -0.424 -14.385 5.366 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -0.944 -13.338 6.598 1.00 10.00 H new ATOM 104 N VAL A 26 -1.893 -7.009 2.249 1.00 10.00 N ATOM 105 CA VAL A 26 -3.072 -6.162 2.159 1.00 10.00 C ATOM 106 C VAL A 26 -4.312 -7.028 2.306 1.00 10.00 C ATOM 107 O VAL A 26 -4.652 -7.795 1.403 1.00 10.00 O ATOM 108 CB VAL A 26 -3.139 -5.399 0.819 1.00 10.00 C ATOM 109 CG1 VAL A 26 -4.107 -4.230 0.917 1.00 10.00 C ATOM 110 CG2 VAL A 26 -1.757 -4.923 0.389 1.00 10.00 C ATOM 0 H VAL A 26 -1.509 -7.297 1.349 1.00 10.00 H new ATOM 0 HA VAL A 26 -3.017 -5.422 2.957 1.00 10.00 H new ATOM 0 HB VAL A 26 -3.507 -6.086 0.057 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -4.141 -3.704 -0.037 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -5.102 -4.601 1.162 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -3.773 -3.545 1.697 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.835 -4.389 -0.558 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -1.349 -4.257 1.149 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -1.098 -5.782 0.268 1.00 10.00 H new ATOM 120 N ILE A 27 -4.965 -6.926 3.453 1.00 10.00 N ATOM 121 CA ILE A 27 -6.153 -7.720 3.727 1.00 10.00 C ATOM 122 C ILE A 27 -7.405 -7.028 3.210 1.00 10.00 C ATOM 123 O ILE A 27 -7.812 -5.990 3.735 1.00 10.00 O ATOM 124 CB ILE A 27 -6.313 -8.000 5.240 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.994 -8.514 5.837 1.00 10.00 C ATOM 126 CG2 ILE A 27 -7.437 -9.001 5.484 1.00 10.00 C ATOM 127 CD1 ILE A 27 -4.488 -9.797 5.209 1.00 10.00 C ATOM 0 H ILE A 27 -4.692 -6.300 4.211 1.00 10.00 H new ATOM 0 HA ILE A 27 -6.026 -8.669 3.206 1.00 10.00 H new ATOM 0 HB ILE A 27 -6.573 -7.065 5.736 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -4.232 -7.742 5.725 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -5.130 -8.675 6.906 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.534 -9.185 6.554 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -8.373 -8.598 5.099 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -7.208 -9.937 4.974 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -3.554 -10.092 5.686 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -5.229 -10.585 5.344 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -4.317 -9.638 4.144 1.00 10.00 H new ATOM 139 N GLY A 28 -8.002 -7.599 2.173 1.00 10.00 N ATOM 140 CA GLY A 28 -9.209 -7.032 1.610 1.00 10.00 C ATOM 141 C GLY A 28 -10.444 -7.413 2.404 1.00 10.00 C ATOM 142 O GLY A 28 -10.436 -8.399 3.148 1.00 10.00 O ATOM 0 H GLY A 28 -7.671 -8.446 1.712 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -9.119 -5.946 1.580 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -9.322 -7.371 0.580 1.00 10.00 H new ATOM 146 N GLN A 29 -11.507 -6.638 2.244 1.00 10.00 N ATOM 147 CA GLN A 29 -12.765 -6.878 2.943 1.00 10.00 C ATOM 148 C GLN A 29 -13.375 -8.217 2.518 1.00 10.00 C ATOM 149 O GLN A 29 -14.068 -8.874 3.294 1.00 10.00 O ATOM 150 CB GLN A 29 -13.737 -5.732 2.647 1.00 10.00 C ATOM 151 CG GLN A 29 -15.011 -5.746 3.479 1.00 10.00 C ATOM 152 CD GLN A 29 -14.761 -5.458 4.945 1.00 10.00 C ATOM 153 OE1 GLN A 29 -14.608 -4.304 5.346 1.00 10.00 O ATOM 154 NE2 GLN A 29 -14.751 -6.501 5.758 1.00 10.00 N ATOM 0 H GLN A 29 -11.524 -5.826 1.627 1.00 10.00 H new ATOM 0 HA GLN A 29 -12.572 -6.921 4.015 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -13.222 -4.786 2.812 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -14.008 -5.767 1.592 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -15.706 -5.006 3.082 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -15.492 -6.720 3.382 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -14.882 -7.441 5.384 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -14.613 -6.366 6.759 1.00 10.00 H new ATOM 163 N ASP A 30 -13.085 -8.623 1.289 1.00 10.00 N ATOM 164 CA ASP A 30 -13.604 -9.874 0.742 1.00 10.00 C ATOM 165 C ASP A 30 -12.621 -11.033 0.938 1.00 10.00 C ATOM 166 O ASP A 30 -12.677 -12.027 0.214 1.00 10.00 O ATOM 167 CB ASP A 30 -13.941 -9.707 -0.746 1.00 10.00 C ATOM 168 CG ASP A 30 -12.805 -9.098 -1.543 1.00 10.00 C ATOM 169 OD1 ASP A 30 -12.524 -7.897 -1.360 1.00 10.00 O ATOM 170 OD2 ASP A 30 -12.192 -9.811 -2.362 1.00 10.00 O ATOM 0 H ASP A 30 -12.489 -8.101 0.646 1.00 10.00 H new ATOM 0 HA ASP A 30 -14.514 -10.119 1.289 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -14.193 -10.680 -1.168 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -14.826 -9.078 -0.845 1.00 10.00 H new ATOM 175 N SER A 31 -11.720 -10.886 1.912 1.00 10.00 N ATOM 176 CA SER A 31 -10.733 -11.920 2.253 1.00 10.00 C ATOM 177 C SER A 31 -9.645 -12.099 1.185 1.00 10.00 C ATOM 178 O SER A 31 -8.953 -13.117 1.164 1.00 10.00 O ATOM 179 CB SER A 31 -11.431 -13.257 2.523 1.00 10.00 C ATOM 180 OG SER A 31 -12.420 -13.116 3.530 1.00 10.00 O ATOM 0 H SER A 31 -11.652 -10.047 2.488 1.00 10.00 H new ATOM 0 HA SER A 31 -10.230 -11.577 3.157 1.00 10.00 H new ATOM 0 HB2 SER A 31 -11.890 -13.624 1.605 1.00 10.00 H new ATOM 0 HB3 SER A 31 -10.696 -14.000 2.831 1.00 10.00 H new ATOM 0 HG SER A 31 -12.854 -13.981 3.685 1.00 10.00 H new ATOM 186 N SER A 32 -9.491 -11.116 0.311 1.00 10.00 N ATOM 187 CA SER A 32 -8.470 -11.163 -0.729 1.00 10.00 C ATOM 188 C SER A 32 -7.132 -10.705 -0.152 1.00 10.00 C ATOM 189 O SER A 32 -7.046 -9.627 0.438 1.00 10.00 O ATOM 190 CB SER A 32 -8.888 -10.253 -1.882 1.00 10.00 C ATOM 191 OG SER A 32 -9.760 -9.235 -1.420 1.00 10.00 O ATOM 0 H SER A 32 -10.062 -10.271 0.300 1.00 10.00 H new ATOM 0 HA SER A 32 -8.362 -12.183 -1.098 1.00 10.00 H new ATOM 0 HB2 SER A 32 -8.005 -9.805 -2.338 1.00 10.00 H new ATOM 0 HB3 SER A 32 -9.383 -10.840 -2.656 1.00 10.00 H new ATOM 0 HG SER A 32 -10.534 -9.172 -2.017 1.00 10.00 H new ATOM 197 N GLU A 33 -6.099 -11.523 -0.292 1.00 10.00 N ATOM 198 CA GLU A 33 -4.789 -11.165 0.228 1.00 10.00 C ATOM 199 C GLU A 33 -3.882 -10.665 -0.889 1.00 10.00 C ATOM 200 O GLU A 33 -3.542 -11.411 -1.813 1.00 10.00 O ATOM 201 CB GLU A 33 -4.142 -12.359 0.930 1.00 10.00 C ATOM 202 CG GLU A 33 -4.880 -12.806 2.181 1.00 10.00 C ATOM 203 CD GLU A 33 -4.033 -13.693 3.071 1.00 10.00 C ATOM 204 OE1 GLU A 33 -3.819 -13.337 4.247 1.00 10.00 O ATOM 205 OE2 GLU A 33 -3.572 -14.751 2.599 1.00 10.00 O ATOM 0 H GLU A 33 -6.142 -12.430 -0.757 1.00 10.00 H new ATOM 0 HA GLU A 33 -4.924 -10.363 0.953 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -4.089 -13.195 0.232 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -3.117 -12.101 1.196 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -5.197 -11.928 2.745 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -5.784 -13.343 1.893 1.00 10.00 H new ATOM 212 N ILE A 34 -3.508 -9.396 -0.812 1.00 10.00 N ATOM 213 CA ILE A 34 -2.635 -8.799 -1.813 1.00 10.00 C ATOM 214 C ILE A 34 -1.196 -8.765 -1.308 1.00 10.00 C ATOM 215 O ILE A 34 -0.923 -8.286 -0.207 1.00 10.00 O ATOM 216 CB ILE A 34 -3.068 -7.362 -2.185 1.00 10.00 C ATOM 217 CG1 ILE A 34 -4.599 -7.221 -2.174 1.00 10.00 C ATOM 218 CG2 ILE A 34 -2.501 -6.979 -3.546 1.00 10.00 C ATOM 219 CD1 ILE A 34 -5.299 -7.924 -3.322 1.00 10.00 C ATOM 0 H ILE A 34 -3.795 -8.760 -0.068 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.708 -9.420 -2.705 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.669 -6.680 -1.434 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -4.982 -7.617 -1.233 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.855 -6.162 -2.202 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -2.812 -5.965 -3.798 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -1.413 -7.027 -3.513 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.872 -7.671 -4.302 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -6.375 -7.774 -3.238 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -4.948 -7.513 -4.269 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -5.077 -8.991 -3.285 1.00 10.00 H new ATOM 231 N HIS A 35 -0.290 -9.286 -2.116 1.00 10.00 N ATOM 232 CA HIS A 35 1.126 -9.320 -1.785 1.00 10.00 C ATOM 233 C HIS A 35 1.809 -8.087 -2.352 1.00 10.00 C ATOM 234 O HIS A 35 2.212 -8.068 -3.520 1.00 10.00 O ATOM 235 CB HIS A 35 1.790 -10.576 -2.360 1.00 10.00 C ATOM 236 CG HIS A 35 1.416 -11.854 -1.675 1.00 10.00 C ATOM 237 ND1 HIS A 35 2.367 -12.642 -1.080 1.00 10.00 N ATOM 238 CD2 HIS A 35 0.203 -12.440 -1.529 1.00 10.00 C ATOM 239 CE1 HIS A 35 1.723 -13.683 -0.589 1.00 10.00 C ATOM 240 NE2 HIS A 35 0.411 -13.605 -0.836 1.00 10.00 N ATOM 0 H HIS A 35 -0.514 -9.698 -3.022 1.00 10.00 H new ATOM 0 HA HIS A 35 1.227 -9.337 -0.700 1.00 10.00 H new ATOM 0 HB2 HIS A 35 1.530 -10.656 -3.415 1.00 10.00 H new ATOM 0 HB3 HIS A 35 2.872 -10.455 -2.307 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -0.743 -12.063 -1.888 1.00 10.00 H new ATOM 0 HE1 HIS A 35 2.195 -14.495 -0.056 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -0.300 -14.283 -0.561 1.00 10.00 H new ATOM 248 N PHE A 36 1.914 -7.053 -1.541 1.00 10.00 N ATOM 249 CA PHE A 36 2.541 -5.820 -1.973 1.00 10.00 C ATOM 250 C PHE A 36 4.013 -5.819 -1.581 1.00 10.00 C ATOM 251 O PHE A 36 4.354 -5.633 -0.415 1.00 10.00 O ATOM 252 CB PHE A 36 1.822 -4.621 -1.357 1.00 10.00 C ATOM 253 CG PHE A 36 1.714 -3.436 -2.271 1.00 10.00 C ATOM 254 CD1 PHE A 36 2.723 -3.138 -3.169 1.00 10.00 C ATOM 255 CD2 PHE A 36 0.596 -2.622 -2.229 1.00 10.00 C ATOM 256 CE1 PHE A 36 2.617 -2.050 -4.011 1.00 10.00 C ATOM 257 CE2 PHE A 36 0.485 -1.531 -3.066 1.00 10.00 C ATOM 258 CZ PHE A 36 1.496 -1.243 -3.958 1.00 10.00 C ATOM 0 H PHE A 36 1.573 -7.042 -0.580 1.00 10.00 H new ATOM 0 HA PHE A 36 2.470 -5.746 -3.058 1.00 10.00 H new ATOM 0 HB2 PHE A 36 0.820 -4.927 -1.056 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.349 -4.321 -0.451 1.00 10.00 H new ATOM 0 HD1 PHE A 36 3.603 -3.763 -3.212 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -0.199 -2.843 -1.533 1.00 10.00 H new ATOM 0 HE1 PHE A 36 3.409 -1.829 -4.711 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -0.393 -0.903 -3.023 1.00 10.00 H new ATOM 0 HZ PHE A 36 1.412 -0.389 -4.614 1.00 10.00 H new ATOM 268 N LYS A 37 4.880 -6.037 -2.555 1.00 10.00 N ATOM 269 CA LYS A 37 6.313 -6.064 -2.298 1.00 10.00 C ATOM 270 C LYS A 37 6.939 -4.711 -2.602 1.00 10.00 C ATOM 271 O LYS A 37 6.980 -4.269 -3.755 1.00 10.00 O ATOM 272 CB LYS A 37 6.992 -7.179 -3.104 1.00 10.00 C ATOM 273 CG LYS A 37 6.503 -7.296 -4.542 1.00 10.00 C ATOM 274 CD LYS A 37 7.007 -8.565 -5.204 1.00 10.00 C ATOM 275 CE LYS A 37 8.525 -8.615 -5.237 1.00 10.00 C ATOM 276 NZ LYS A 37 9.029 -9.859 -5.871 1.00 10.00 N ATOM 0 H LYS A 37 4.620 -6.198 -3.528 1.00 10.00 H new ATOM 0 HA LYS A 37 6.466 -6.276 -1.240 1.00 10.00 H new ATOM 0 HB2 LYS A 37 8.068 -7.004 -3.111 1.00 10.00 H new ATOM 0 HB3 LYS A 37 6.827 -8.130 -2.598 1.00 10.00 H new ATOM 0 HG2 LYS A 37 5.413 -7.285 -4.558 1.00 10.00 H new ATOM 0 HG3 LYS A 37 6.839 -6.430 -5.112 1.00 10.00 H new ATOM 0 HD2 LYS A 37 6.626 -9.433 -4.666 1.00 10.00 H new ATOM 0 HD3 LYS A 37 6.618 -8.624 -6.221 1.00 10.00 H new ATOM 0 HE2 LYS A 37 8.904 -7.751 -5.783 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.912 -8.544 -4.220 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 10.069 -9.851 -5.872 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 8.690 -10.684 -5.336 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 8.682 -9.915 -6.850 1.00 10.00 H new ATOM 290 N VAL A 38 7.412 -4.056 -1.554 1.00 10.00 N ATOM 291 CA VAL A 38 8.023 -2.743 -1.678 1.00 10.00 C ATOM 292 C VAL A 38 9.528 -2.812 -1.439 1.00 10.00 C ATOM 293 O VAL A 38 10.049 -3.835 -0.996 1.00 10.00 O ATOM 294 CB VAL A 38 7.393 -1.737 -0.688 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.886 -1.672 -0.881 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.728 -2.103 0.752 1.00 10.00 C ATOM 0 H VAL A 38 7.384 -4.416 -0.600 1.00 10.00 H new ATOM 0 HA VAL A 38 7.840 -2.400 -2.696 1.00 10.00 H new ATOM 0 HB VAL A 38 7.814 -0.753 -0.894 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.459 -0.959 -0.176 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.663 -1.353 -1.899 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.454 -2.657 -0.707 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.272 -1.379 1.427 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.342 -3.098 0.974 1.00 10.00 H new ATOM 0 HG23 VAL A 38 8.810 -2.095 0.887 1.00 10.00 H new ATOM 306 N LYS A 39 10.217 -1.722 -1.738 1.00 10.00 N ATOM 307 CA LYS A 39 11.657 -1.652 -1.553 1.00 10.00 C ATOM 308 C LYS A 39 12.048 -0.342 -0.877 1.00 10.00 C ATOM 309 O LYS A 39 11.499 0.721 -1.193 1.00 10.00 O ATOM 310 CB LYS A 39 12.376 -1.789 -2.899 1.00 10.00 C ATOM 311 CG LYS A 39 13.890 -1.873 -2.777 1.00 10.00 C ATOM 312 CD LYS A 39 14.541 -2.260 -4.095 1.00 10.00 C ATOM 313 CE LYS A 39 14.357 -1.180 -5.147 1.00 10.00 C ATOM 314 NZ LYS A 39 14.437 -1.729 -6.526 1.00 10.00 N ATOM 0 H LYS A 39 9.799 -0.870 -2.112 1.00 10.00 H new ATOM 0 HA LYS A 39 11.960 -2.478 -0.909 1.00 10.00 H new ATOM 0 HB2 LYS A 39 12.011 -2.682 -3.407 1.00 10.00 H new ATOM 0 HB3 LYS A 39 12.118 -0.937 -3.527 1.00 10.00 H new ATOM 0 HG2 LYS A 39 14.282 -0.911 -2.446 1.00 10.00 H new ATOM 0 HG3 LYS A 39 14.153 -2.604 -2.013 1.00 10.00 H new ATOM 0 HD2 LYS A 39 15.605 -2.438 -3.938 1.00 10.00 H new ATOM 0 HD3 LYS A 39 14.111 -3.195 -4.453 1.00 10.00 H new ATOM 0 HE2 LYS A 39 13.391 -0.696 -5.005 1.00 10.00 H new ATOM 0 HE3 LYS A 39 15.120 -0.413 -5.017 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 14.125 -1.007 -7.206 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 15.419 -2.000 -6.735 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 13.823 -2.565 -6.603 1.00 10.00 H new ATOM 328 N MET A 40 12.992 -0.429 0.055 1.00 10.00 N ATOM 329 CA MET A 40 13.470 0.738 0.789 1.00 10.00 C ATOM 330 C MET A 40 14.251 1.681 -0.119 1.00 10.00 C ATOM 331 O MET A 40 15.455 1.508 -0.325 1.00 10.00 O ATOM 332 CB MET A 40 14.344 0.309 1.968 1.00 10.00 C ATOM 333 CG MET A 40 14.782 1.472 2.845 1.00 10.00 C ATOM 334 SD MET A 40 13.387 2.417 3.492 1.00 10.00 S ATOM 335 CE MET A 40 12.594 1.178 4.512 1.00 10.00 C ATOM 0 H MET A 40 13.444 -1.303 0.321 1.00 10.00 H new ATOM 0 HA MET A 40 12.597 1.271 1.167 1.00 10.00 H new ATOM 0 HB2 MET A 40 13.795 -0.409 2.576 1.00 10.00 H new ATOM 0 HB3 MET A 40 15.228 -0.204 1.589 1.00 10.00 H new ATOM 0 HG2 MET A 40 15.375 1.092 3.676 1.00 10.00 H new ATOM 0 HG3 MET A 40 15.428 2.134 2.268 1.00 10.00 H new ATOM 0 HE1 MET A 40 12.034 1.667 5.309 1.00 10.00 H new ATOM 0 HE2 MET A 40 11.913 0.585 3.901 1.00 10.00 H new ATOM 0 HE3 MET A 40 13.351 0.527 4.948 1.00 10.00 H new ATOM 345 N THR A 41 13.541 2.675 -0.641 1.00 10.00 N ATOM 346 CA THR A 41 14.097 3.681 -1.541 1.00 10.00 C ATOM 347 C THR A 41 12.955 4.345 -2.293 1.00 10.00 C ATOM 348 O THR A 41 13.054 5.485 -2.753 1.00 10.00 O ATOM 349 CB THR A 41 15.087 3.074 -2.572 1.00 10.00 C ATOM 350 OG1 THR A 41 16.028 4.065 -2.996 1.00 10.00 O ATOM 351 CG2 THR A 41 14.359 2.501 -3.790 1.00 10.00 C ATOM 0 H THR A 41 12.548 2.807 -0.448 1.00 10.00 H new ATOM 0 HA THR A 41 14.650 4.399 -0.935 1.00 10.00 H new ATOM 0 HB THR A 41 15.612 2.257 -2.078 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.648 3.671 -3.645 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.087 2.086 -4.487 1.00 10.00 H new ATOM 0 HG22 THR A 41 13.675 1.715 -3.469 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.795 3.293 -4.283 1.00 10.00 H new ATOM 359 N THR A 42 11.868 3.603 -2.393 1.00 10.00 N ATOM 360 CA THR A 42 10.692 4.047 -3.100 1.00 10.00 C ATOM 361 C THR A 42 9.851 5.011 -2.261 1.00 10.00 C ATOM 362 O THR A 42 9.783 4.887 -1.033 1.00 10.00 O ATOM 363 CB THR A 42 9.841 2.822 -3.501 1.00 10.00 C ATOM 364 OG1 THR A 42 9.366 2.137 -2.330 1.00 10.00 O ATOM 365 CG2 THR A 42 10.662 1.853 -4.340 1.00 10.00 C ATOM 0 H THR A 42 11.780 2.673 -1.983 1.00 10.00 H new ATOM 0 HA THR A 42 11.018 4.585 -3.990 1.00 10.00 H new ATOM 0 HB THR A 42 8.993 3.179 -4.085 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.099 1.623 -1.932 1.00 10.00 H new ATOM 0 HG21 THR A 42 10.046 0.996 -4.613 1.00 10.00 H new ATOM 0 HG22 THR A 42 11.006 2.356 -5.244 1.00 10.00 H new ATOM 0 HG23 THR A 42 11.523 1.512 -3.764 1.00 10.00 H new ATOM 373 N HIS A 43 9.236 5.984 -2.922 1.00 10.00 N ATOM 374 CA HIS A 43 8.369 6.939 -2.246 1.00 10.00 C ATOM 375 C HIS A 43 6.982 6.313 -2.127 1.00 10.00 C ATOM 376 O HIS A 43 6.525 5.655 -3.064 1.00 10.00 O ATOM 377 CB HIS A 43 8.227 8.247 -3.041 1.00 10.00 C ATOM 378 CG HIS A 43 9.481 9.044 -3.287 1.00 10.00 C ATOM 379 ND1 HIS A 43 9.431 10.177 -4.067 1.00 10.00 N ATOM 380 CD2 HIS A 43 10.754 8.896 -2.821 1.00 10.00 C ATOM 381 CE1 HIS A 43 10.646 10.685 -4.053 1.00 10.00 C ATOM 382 NE2 HIS A 43 11.469 9.953 -3.307 1.00 10.00 N ATOM 0 H HIS A 43 9.322 6.132 -3.928 1.00 10.00 H new ATOM 0 HA HIS A 43 8.805 7.170 -1.274 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.784 8.008 -4.008 1.00 10.00 H new ATOM 0 HB3 HIS A 43 7.518 8.887 -2.515 1.00 10.00 H new ATOM 0 HD2 HIS A 43 11.124 8.100 -2.192 1.00 10.00 H new ATOM 0 HE1 HIS A 43 10.937 11.582 -4.580 1.00 10.00 H new ATOM 0 HE2 HIS A 43 12.455 10.146 -3.130 1.00 10.00 H new ATOM 390 N LEU A 44 6.290 6.519 -1.011 1.00 10.00 N ATOM 391 CA LEU A 44 4.954 5.939 -0.859 1.00 10.00 C ATOM 392 C LEU A 44 3.936 6.675 -1.733 1.00 10.00 C ATOM 393 O LEU A 44 2.793 6.238 -1.874 1.00 10.00 O ATOM 394 CB LEU A 44 4.490 5.930 0.602 1.00 10.00 C ATOM 395 CG LEU A 44 5.196 4.917 1.511 1.00 10.00 C ATOM 396 CD1 LEU A 44 4.511 4.844 2.868 1.00 10.00 C ATOM 397 CD2 LEU A 44 5.223 3.544 0.863 1.00 10.00 C ATOM 0 H LEU A 44 6.618 7.068 -0.216 1.00 10.00 H new ATOM 0 HA LEU A 44 5.020 4.903 -1.190 1.00 10.00 H new ATOM 0 HB2 LEU A 44 4.634 6.927 1.017 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.419 5.728 0.624 1.00 10.00 H new ATOM 0 HG LEU A 44 6.223 5.252 1.658 1.00 10.00 H new ATOM 0 HD11 LEU A 44 5.027 4.120 3.498 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.540 5.824 3.344 1.00 10.00 H new ATOM 0 HD13 LEU A 44 3.474 4.536 2.736 1.00 10.00 H new ATOM 0 HD21 LEU A 44 5.728 2.840 1.524 1.00 10.00 H new ATOM 0 HD22 LEU A 44 4.202 3.206 0.684 1.00 10.00 H new ATOM 0 HD23 LEU A 44 5.758 3.600 -0.085 1.00 10.00 H new ATOM 409 N LYS A 45 4.363 7.788 -2.321 1.00 10.00 N ATOM 410 CA LYS A 45 3.511 8.575 -3.207 1.00 10.00 C ATOM 411 C LYS A 45 3.081 7.734 -4.404 1.00 10.00 C ATOM 412 O LYS A 45 1.901 7.677 -4.759 1.00 10.00 O ATOM 413 CB LYS A 45 4.267 9.820 -3.685 1.00 10.00 C ATOM 414 CG LYS A 45 3.483 10.675 -4.670 1.00 10.00 C ATOM 415 CD LYS A 45 2.309 11.361 -3.996 1.00 10.00 C ATOM 416 CE LYS A 45 1.467 12.147 -4.987 1.00 10.00 C ATOM 417 NZ LYS A 45 0.335 12.838 -4.316 1.00 10.00 N ATOM 0 H LYS A 45 5.302 8.168 -2.199 1.00 10.00 H new ATOM 0 HA LYS A 45 2.622 8.887 -2.659 1.00 10.00 H new ATOM 0 HB2 LYS A 45 4.530 10.428 -2.820 1.00 10.00 H new ATOM 0 HB3 LYS A 45 5.202 9.509 -4.152 1.00 10.00 H new ATOM 0 HG2 LYS A 45 4.142 11.425 -5.108 1.00 10.00 H new ATOM 0 HG3 LYS A 45 3.121 10.052 -5.488 1.00 10.00 H new ATOM 0 HD2 LYS A 45 1.687 10.614 -3.503 1.00 10.00 H new ATOM 0 HD3 LYS A 45 2.677 12.032 -3.220 1.00 10.00 H new ATOM 0 HE2 LYS A 45 2.092 12.881 -5.495 1.00 10.00 H new ATOM 0 HE3 LYS A 45 1.081 11.473 -5.752 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -0.178 13.418 -5.010 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -0.311 12.132 -3.910 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 0.701 13.448 -3.558 1.00 10.00 H new ATOM 431 N LYS A 46 4.052 7.058 -5.001 1.00 10.00 N ATOM 432 CA LYS A 46 3.805 6.211 -6.156 1.00 10.00 C ATOM 433 C LYS A 46 3.136 4.909 -5.721 1.00 10.00 C ATOM 434 O LYS A 46 2.443 4.257 -6.500 1.00 10.00 O ATOM 435 CB LYS A 46 5.127 5.927 -6.872 1.00 10.00 C ATOM 436 CG LYS A 46 4.970 5.425 -8.302 1.00 10.00 C ATOM 437 CD LYS A 46 6.281 5.520 -9.067 1.00 10.00 C ATOM 438 CE LYS A 46 6.562 6.948 -9.510 1.00 10.00 C ATOM 439 NZ LYS A 46 7.987 7.146 -9.888 1.00 10.00 N ATOM 0 H LYS A 46 5.026 7.081 -4.700 1.00 10.00 H new ATOM 0 HA LYS A 46 3.134 6.724 -6.845 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.724 6.839 -6.883 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.686 5.187 -6.299 1.00 10.00 H new ATOM 0 HG2 LYS A 46 4.627 4.391 -8.291 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.205 6.009 -8.813 1.00 10.00 H new ATOM 0 HD2 LYS A 46 7.098 5.165 -8.438 1.00 10.00 H new ATOM 0 HD3 LYS A 46 6.243 4.867 -9.939 1.00 10.00 H new ATOM 0 HE2 LYS A 46 5.924 7.196 -10.359 1.00 10.00 H new ATOM 0 HE3 LYS A 46 6.302 7.635 -8.705 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 8.134 8.132 -10.183 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 8.595 6.935 -9.071 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 8.229 6.510 -10.674 1.00 10.00 H new ATOM 453 N LEU A 47 3.340 4.545 -4.462 1.00 10.00 N ATOM 454 CA LEU A 47 2.765 3.322 -3.906 1.00 10.00 C ATOM 455 C LEU A 47 1.240 3.376 -3.924 1.00 10.00 C ATOM 456 O LEU A 47 0.576 2.435 -4.367 1.00 10.00 O ATOM 457 CB LEU A 47 3.239 3.113 -2.461 1.00 10.00 C ATOM 458 CG LEU A 47 4.409 2.143 -2.264 1.00 10.00 C ATOM 459 CD1 LEU A 47 4.029 0.748 -2.722 1.00 10.00 C ATOM 460 CD2 LEU A 47 5.656 2.629 -2.987 1.00 10.00 C ATOM 0 H LEU A 47 3.902 5.081 -3.801 1.00 10.00 H new ATOM 0 HA LEU A 47 3.100 2.491 -4.526 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.525 4.082 -2.051 1.00 10.00 H new ATOM 0 HB3 LEU A 47 2.395 2.755 -1.872 1.00 10.00 H new ATOM 0 HG LEU A 47 4.637 2.105 -1.199 1.00 10.00 H new ATOM 0 HD11 LEU A 47 4.873 0.074 -2.574 1.00 10.00 H new ATOM 0 HD12 LEU A 47 3.176 0.394 -2.142 1.00 10.00 H new ATOM 0 HD13 LEU A 47 3.765 0.772 -3.779 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.468 1.920 -2.828 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.449 2.711 -4.054 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.945 3.605 -2.597 1.00 10.00 H new ATOM 472 N LYS A 48 0.700 4.493 -3.458 1.00 10.00 N ATOM 473 CA LYS A 48 -0.743 4.683 -3.384 1.00 10.00 C ATOM 474 C LYS A 48 -1.406 4.636 -4.761 1.00 10.00 C ATOM 475 O LYS A 48 -2.454 4.012 -4.924 1.00 10.00 O ATOM 476 CB LYS A 48 -1.059 6.008 -2.686 1.00 10.00 C ATOM 477 CG LYS A 48 -0.487 6.098 -1.277 1.00 10.00 C ATOM 478 CD LYS A 48 -0.825 7.423 -0.605 1.00 10.00 C ATOM 479 CE LYS A 48 -2.299 7.515 -0.243 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.594 8.705 0.599 1.00 10.00 N ATOM 0 H LYS A 48 1.244 5.288 -3.123 1.00 10.00 H new ATOM 0 HA LYS A 48 -1.153 3.857 -2.803 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.664 6.829 -3.284 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -2.140 6.138 -2.641 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -0.876 5.277 -0.675 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.596 5.978 -1.317 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.222 7.537 0.296 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.563 8.245 -1.271 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.894 7.560 -1.155 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.599 6.612 0.289 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.616 8.895 0.585 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -2.289 8.523 1.576 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -2.083 9.530 0.225 1.00 10.00 H new ATOM 494 N GLU A 49 -0.798 5.272 -5.756 1.00 10.00 N ATOM 495 CA GLU A 49 -1.377 5.290 -7.098 1.00 10.00 C ATOM 496 C GLU A 49 -1.237 3.937 -7.797 1.00 10.00 C ATOM 497 O GLU A 49 -2.168 3.483 -8.462 1.00 10.00 O ATOM 498 CB GLU A 49 -0.761 6.399 -7.960 1.00 10.00 C ATOM 499 CG GLU A 49 0.751 6.491 -7.867 1.00 10.00 C ATOM 500 CD GLU A 49 1.360 7.237 -9.034 1.00 10.00 C ATOM 501 OE1 GLU A 49 1.980 6.590 -9.899 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.221 8.477 -9.095 1.00 10.00 O ATOM 0 H GLU A 49 0.084 5.776 -5.664 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.440 5.498 -6.977 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.040 6.233 -9.000 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.191 7.356 -7.663 1.00 10.00 H new ATOM 0 HG2 GLU A 49 1.025 6.991 -6.938 1.00 10.00 H new ATOM 0 HG3 GLU A 49 1.171 5.486 -7.824 1.00 10.00 H new ATOM 509 N SER A 50 -0.091 3.282 -7.624 1.00 10.00 N ATOM 510 CA SER A 50 0.151 1.987 -8.258 1.00 10.00 C ATOM 511 C SER A 50 -0.895 0.952 -7.845 1.00 10.00 C ATOM 512 O SER A 50 -1.303 0.117 -8.654 1.00 10.00 O ATOM 513 CB SER A 50 1.553 1.483 -7.924 1.00 10.00 C ATOM 514 OG SER A 50 2.536 2.398 -8.379 1.00 10.00 O ATOM 0 H SER A 50 0.682 3.624 -7.053 1.00 10.00 H new ATOM 0 HA SER A 50 0.071 2.129 -9.336 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.648 1.345 -6.847 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.714 0.509 -8.386 1.00 10.00 H new ATOM 0 HG SER A 50 2.541 3.188 -7.799 1.00 10.00 H new ATOM 520 N TYR A 51 -1.331 1.009 -6.590 1.00 10.00 N ATOM 521 CA TYR A 51 -2.340 0.080 -6.099 1.00 10.00 C ATOM 522 C TYR A 51 -3.662 0.336 -6.808 1.00 10.00 C ATOM 523 O TYR A 51 -4.316 -0.595 -7.276 1.00 10.00 O ATOM 524 CB TYR A 51 -2.523 0.223 -4.588 1.00 10.00 C ATOM 525 CG TYR A 51 -3.406 -0.850 -3.981 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.935 -2.147 -3.807 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.711 -0.569 -3.587 1.00 10.00 C ATOM 528 CE1 TYR A 51 -3.736 -3.130 -3.258 1.00 10.00 C ATOM 529 CE2 TYR A 51 -5.516 -1.546 -3.036 1.00 10.00 C ATOM 530 CZ TYR A 51 -5.025 -2.824 -2.876 1.00 10.00 C ATOM 531 OH TYR A 51 -5.827 -3.798 -2.332 1.00 10.00 O ATOM 0 H TYR A 51 -1.003 1.684 -5.900 1.00 10.00 H new ATOM 0 HA TYR A 51 -2.006 -0.936 -6.309 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.545 0.193 -4.107 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.954 1.201 -4.373 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.926 -2.390 -4.106 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -5.101 0.430 -3.714 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -3.355 -4.132 -3.129 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -6.525 -1.310 -2.732 1.00 10.00 H new ATOM 0 HH TYR A 51 -6.739 -3.703 -2.679 1.00 10.00 H new ATOM 541 N CYS A 52 -4.030 1.609 -6.904 1.00 10.00 N ATOM 542 CA CYS A 52 -5.269 2.005 -7.560 1.00 10.00 C ATOM 543 C CYS A 52 -5.259 1.584 -9.027 1.00 10.00 C ATOM 544 O CYS A 52 -6.288 1.181 -9.571 1.00 10.00 O ATOM 545 CB CYS A 52 -5.467 3.515 -7.442 1.00 10.00 C ATOM 546 SG CYS A 52 -5.313 4.137 -5.752 1.00 10.00 S ATOM 0 H CYS A 52 -3.484 2.387 -6.534 1.00 10.00 H new ATOM 0 HA CYS A 52 -6.099 1.502 -7.065 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.735 4.019 -8.074 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.453 3.775 -7.827 1.00 10.00 H new ATOM 0 HG CYS A 52 -4.111 3.909 -5.314 1.00 10.00 H new ATOM 552 N GLN A 53 -4.082 1.657 -9.648 1.00 10.00 N ATOM 553 CA GLN A 53 -3.921 1.279 -11.050 1.00 10.00 C ATOM 554 C GLN A 53 -4.242 -0.196 -11.251 1.00 10.00 C ATOM 555 O GLN A 53 -4.788 -0.583 -12.283 1.00 10.00 O ATOM 556 CB GLN A 53 -2.497 1.572 -11.523 1.00 10.00 C ATOM 557 CG GLN A 53 -2.169 3.054 -11.572 1.00 10.00 C ATOM 558 CD GLN A 53 -0.725 3.324 -11.935 1.00 10.00 C ATOM 559 OE1 GLN A 53 0.158 2.507 -11.670 1.00 10.00 O ATOM 560 NE2 GLN A 53 -0.471 4.475 -12.537 1.00 10.00 N ATOM 0 H GLN A 53 -3.223 1.976 -9.199 1.00 10.00 H new ATOM 0 HA GLN A 53 -4.619 1.871 -11.642 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -1.792 1.073 -10.858 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -2.357 1.144 -12.515 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -2.819 3.541 -12.299 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -2.385 3.501 -10.602 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -1.232 5.124 -12.738 1.00 10.00 H new ATOM 0 HE22 GLN A 53 0.485 4.713 -12.800 1.00 10.00 H new ATOM 569 N ARG A 54 -3.899 -1.021 -10.269 1.00 10.00 N ATOM 570 CA ARG A 54 -4.173 -2.449 -10.358 1.00 10.00 C ATOM 571 C ARG A 54 -5.646 -2.724 -10.068 1.00 10.00 C ATOM 572 O ARG A 54 -6.249 -3.619 -10.662 1.00 10.00 O ATOM 573 CB ARG A 54 -3.287 -3.250 -9.396 1.00 10.00 C ATOM 574 CG ARG A 54 -3.517 -4.754 -9.478 1.00 10.00 C ATOM 575 CD ARG A 54 -2.392 -5.543 -8.827 1.00 10.00 C ATOM 576 NE ARG A 54 -2.625 -6.988 -8.907 1.00 10.00 N ATOM 577 CZ ARG A 54 -1.724 -7.875 -9.332 1.00 10.00 C ATOM 578 NH1 ARG A 54 -0.517 -7.478 -9.721 1.00 10.00 N ATOM 579 NH2 ARG A 54 -2.034 -9.165 -9.378 1.00 10.00 N ATOM 0 H ARG A 54 -3.435 -0.729 -9.409 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.943 -2.770 -11.374 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -2.240 -3.037 -9.614 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -3.475 -2.916 -8.376 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -4.461 -5.003 -8.993 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -3.608 -5.050 -10.523 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -1.448 -5.299 -9.314 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -2.297 -5.247 -7.782 1.00 10.00 H new ATOM 0 HE ARG A 54 -3.538 -7.339 -8.618 1.00 10.00 H new ATOM 0 HH11 ARG A 54 -0.273 -6.488 -9.696 1.00 10.00 H new ATOM 0 HH12 ARG A 54 0.166 -8.163 -10.044 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -2.961 -9.477 -9.088 1.00 10.00 H new ATOM 0 HH22 ARG A 54 -1.345 -9.844 -9.703 1.00 10.00 H new ATOM 593 N GLN A 55 -6.220 -1.942 -9.161 1.00 10.00 N ATOM 594 CA GLN A 55 -7.627 -2.096 -8.797 1.00 10.00 C ATOM 595 C GLN A 55 -8.522 -1.644 -9.948 1.00 10.00 C ATOM 596 O GLN A 55 -9.543 -2.267 -10.237 1.00 10.00 O ATOM 597 CB GLN A 55 -7.953 -1.284 -7.539 1.00 10.00 C ATOM 598 CG GLN A 55 -7.097 -1.642 -6.330 1.00 10.00 C ATOM 599 CD GLN A 55 -7.159 -3.115 -5.973 1.00 10.00 C ATOM 600 OE1 GLN A 55 -6.358 -3.916 -6.452 1.00 10.00 O ATOM 601 NE2 GLN A 55 -8.106 -3.479 -5.126 1.00 10.00 N ATOM 0 H GLN A 55 -5.735 -1.195 -8.664 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.812 -3.150 -8.591 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.826 -0.224 -7.760 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -9.002 -1.433 -7.285 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -6.062 -1.366 -6.531 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.424 -1.052 -5.473 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.751 -2.783 -4.752 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -8.192 -4.456 -4.847 1.00 10.00 H new ATOM 610 N GLY A 56 -8.131 -0.557 -10.601 1.00 10.00 N ATOM 611 CA GLY A 56 -8.903 -0.039 -11.713 1.00 10.00 C ATOM 612 C GLY A 56 -9.524 1.307 -11.396 1.00 10.00 C ATOM 613 O GLY A 56 -9.996 2.011 -12.290 1.00 10.00 O ATOM 0 H GLY A 56 -7.290 -0.024 -10.379 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -8.260 0.056 -12.588 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.689 -0.749 -11.971 1.00 10.00 H new ATOM 617 N VAL A 57 -9.512 1.667 -10.123 1.00 10.00 N ATOM 618 CA VAL A 57 -10.080 2.934 -9.678 1.00 10.00 C ATOM 619 C VAL A 57 -9.031 4.041 -9.700 1.00 10.00 C ATOM 620 O VAL A 57 -7.830 3.766 -9.682 1.00 10.00 O ATOM 621 CB VAL A 57 -10.668 2.829 -8.253 1.00 10.00 C ATOM 622 CG1 VAL A 57 -12.086 2.288 -8.302 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.790 1.960 -7.362 1.00 10.00 C ATOM 0 H VAL A 57 -9.114 1.099 -9.375 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.884 3.177 -10.373 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.695 3.830 -7.822 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -12.485 2.221 -7.290 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.710 2.957 -8.894 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -12.082 1.298 -8.757 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -10.227 1.903 -6.365 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -9.721 0.958 -7.786 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.793 2.396 -7.297 1.00 10.00 H new ATOM 633 N PRO A 58 -9.471 5.308 -9.771 1.00 10.00 N ATOM 634 CA PRO A 58 -8.565 6.461 -9.778 1.00 10.00 C ATOM 635 C PRO A 58 -7.892 6.655 -8.422 1.00 10.00 C ATOM 636 O PRO A 58 -8.169 5.924 -7.474 1.00 10.00 O ATOM 637 CB PRO A 58 -9.488 7.639 -10.094 1.00 10.00 C ATOM 638 CG PRO A 58 -10.837 7.200 -9.647 1.00 10.00 C ATOM 639 CD PRO A 58 -10.886 5.717 -9.874 1.00 10.00 C ATOM 0 HA PRO A 58 -7.751 6.345 -10.494 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -9.172 8.540 -9.569 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -9.481 7.872 -11.159 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -10.997 7.439 -8.596 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -11.619 7.707 -10.212 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.504 5.217 -9.129 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.305 5.474 -10.851 1.00 10.00 H new ATOM 647 N MET A 59 -7.019 7.647 -8.328 1.00 10.00 N ATOM 648 CA MET A 59 -6.315 7.913 -7.079 1.00 10.00 C ATOM 649 C MET A 59 -7.208 8.674 -6.103 1.00 10.00 C ATOM 650 O MET A 59 -8.169 9.330 -6.510 1.00 10.00 O ATOM 651 CB MET A 59 -5.033 8.703 -7.339 1.00 10.00 C ATOM 652 CG MET A 59 -3.963 8.479 -6.283 1.00 10.00 C ATOM 653 SD MET A 59 -2.543 9.567 -6.488 1.00 10.00 S ATOM 654 CE MET A 59 -1.471 8.970 -5.183 1.00 10.00 C ATOM 0 H MET A 59 -6.781 8.277 -9.094 1.00 10.00 H new ATOM 0 HA MET A 59 -6.051 6.954 -6.633 1.00 10.00 H new ATOM 0 HB2 MET A 59 -4.635 8.424 -8.315 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.272 9.765 -7.384 1.00 10.00 H new ATOM 0 HG2 MET A 59 -4.396 8.636 -5.295 1.00 10.00 H new ATOM 0 HG3 MET A 59 -3.630 7.442 -6.324 1.00 10.00 H new ATOM 0 HE1 MET A 59 -0.546 9.546 -5.180 1.00 10.00 H new ATOM 0 HE2 MET A 59 -1.971 9.082 -4.221 1.00 10.00 H new ATOM 0 HE3 MET A 59 -1.243 7.918 -5.353 1.00 10.00 H new ATOM 664 N ASN A 60 -6.884 8.553 -4.814 1.00 10.00 N ATOM 665 CA ASN A 60 -7.619 9.212 -3.727 1.00 10.00 C ATOM 666 C ASN A 60 -8.979 8.555 -3.511 1.00 10.00 C ATOM 667 O ASN A 60 -9.855 9.106 -2.846 1.00 10.00 O ATOM 668 CB ASN A 60 -7.780 10.716 -3.988 1.00 10.00 C ATOM 669 CG ASN A 60 -8.000 11.506 -2.708 1.00 10.00 C ATOM 670 OD1 ASN A 60 -7.505 11.137 -1.642 1.00 10.00 O ATOM 671 ND2 ASN A 60 -8.746 12.596 -2.804 1.00 10.00 N ATOM 0 H ASN A 60 -6.097 7.990 -4.490 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.032 9.093 -2.816 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -6.891 11.091 -4.495 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -8.622 10.877 -4.661 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -8.929 13.164 -1.976 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -9.138 12.868 -3.706 1.00 10.00 H new ATOM 678 N SER A 61 -9.148 7.369 -4.071 1.00 10.00 N ATOM 679 CA SER A 61 -10.392 6.632 -3.925 1.00 10.00 C ATOM 680 C SER A 61 -10.285 5.667 -2.754 1.00 10.00 C ATOM 681 O SER A 61 -11.257 5.413 -2.041 1.00 10.00 O ATOM 682 CB SER A 61 -10.700 5.862 -5.209 1.00 10.00 C ATOM 683 OG SER A 61 -9.635 4.984 -5.539 1.00 10.00 O ATOM 0 H SER A 61 -8.439 6.896 -4.631 1.00 10.00 H new ATOM 0 HA SER A 61 -11.201 7.337 -3.734 1.00 10.00 H new ATOM 0 HB2 SER A 61 -11.621 5.293 -5.085 1.00 10.00 H new ATOM 0 HB3 SER A 61 -10.866 6.563 -6.027 1.00 10.00 H new ATOM 0 HG SER A 61 -8.925 5.486 -5.991 1.00 10.00 H new ATOM 689 N LEU A 62 -9.083 5.148 -2.555 1.00 10.00 N ATOM 690 CA LEU A 62 -8.824 4.202 -1.488 1.00 10.00 C ATOM 691 C LEU A 62 -7.879 4.793 -0.450 1.00 10.00 C ATOM 692 O LEU A 62 -6.902 5.467 -0.790 1.00 10.00 O ATOM 693 CB LEU A 62 -8.224 2.919 -2.063 1.00 10.00 C ATOM 694 CG LEU A 62 -9.060 2.238 -3.147 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.244 1.177 -3.867 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.315 1.624 -2.544 1.00 10.00 C ATOM 0 H LEU A 62 -8.267 5.370 -3.125 1.00 10.00 H new ATOM 0 HA LEU A 62 -9.771 3.973 -0.999 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.242 3.149 -2.475 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.070 2.212 -1.248 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.358 2.993 -3.874 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -8.857 0.705 -4.634 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.374 1.641 -4.332 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -7.914 0.424 -3.151 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -10.898 1.143 -3.329 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.034 0.883 -1.796 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -10.913 2.405 -2.074 1.00 10.00 H new ATOM 708 N ARG A 63 -8.183 4.539 0.811 1.00 10.00 N ATOM 709 CA ARG A 63 -7.371 5.016 1.916 1.00 10.00 C ATOM 710 C ARG A 63 -6.632 3.848 2.553 1.00 10.00 C ATOM 711 O ARG A 63 -7.225 2.802 2.833 1.00 10.00 O ATOM 712 CB ARG A 63 -8.236 5.729 2.963 1.00 10.00 C ATOM 713 CG ARG A 63 -9.372 4.875 3.511 1.00 10.00 C ATOM 714 CD ARG A 63 -10.121 5.586 4.624 1.00 10.00 C ATOM 715 NE ARG A 63 -11.225 4.781 5.144 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.515 5.081 4.975 1.00 10.00 C ATOM 717 NH1 ARG A 63 -12.877 6.167 4.299 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.446 4.288 5.488 1.00 10.00 N ATOM 0 H ARG A 63 -8.998 3.997 1.097 1.00 10.00 H new ATOM 0 HA ARG A 63 -6.647 5.733 1.530 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -7.601 6.045 3.790 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -8.655 6.632 2.520 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.064 4.629 2.706 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -8.971 3.933 3.886 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -9.430 5.820 5.434 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -10.508 6.535 4.252 1.00 10.00 H new ATOM 0 HE ARG A 63 -10.995 3.937 5.669 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.166 6.782 3.903 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -13.866 6.386 4.177 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -13.175 3.454 6.009 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.433 4.512 5.362 1.00 10.00 H new ATOM 732 N PHE A 64 -5.339 4.022 2.759 1.00 10.00 N ATOM 733 CA PHE A 64 -4.521 2.985 3.362 1.00 10.00 C ATOM 734 C PHE A 64 -4.367 3.246 4.850 1.00 10.00 C ATOM 735 O PHE A 64 -3.931 4.326 5.259 1.00 10.00 O ATOM 736 CB PHE A 64 -3.149 2.923 2.688 1.00 10.00 C ATOM 737 CG PHE A 64 -3.223 2.606 1.222 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.236 3.622 0.280 1.00 10.00 C ATOM 739 CD2 PHE A 64 -3.283 1.292 0.788 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.307 3.332 -1.068 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.354 0.998 -0.559 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.367 2.020 -1.488 1.00 10.00 C ATOM 0 H PHE A 64 -4.832 4.873 2.517 1.00 10.00 H new ATOM 0 HA PHE A 64 -5.015 2.024 3.221 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.643 3.879 2.821 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.541 2.168 3.186 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -3.190 4.651 0.604 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -3.274 0.489 1.511 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -3.316 4.132 -1.793 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -3.399 -0.030 -0.886 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.424 1.792 -2.542 1.00 10.00 H new ATOM 752 N LEU A 65 -4.738 2.265 5.651 1.00 10.00 N ATOM 753 CA LEU A 65 -4.656 2.388 7.093 1.00 10.00 C ATOM 754 C LEU A 65 -3.577 1.474 7.651 1.00 10.00 C ATOM 755 O LEU A 65 -3.582 0.263 7.419 1.00 10.00 O ATOM 756 CB LEU A 65 -6.006 2.065 7.733 1.00 10.00 C ATOM 757 CG LEU A 65 -7.154 2.988 7.322 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.461 2.507 7.925 1.00 10.00 C ATOM 759 CD2 LEU A 65 -6.869 4.423 7.746 1.00 10.00 C ATOM 0 H LEU A 65 -5.101 1.369 5.324 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.392 3.418 7.333 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -6.275 1.040 7.479 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -5.897 2.107 8.817 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.242 2.963 6.236 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.268 3.174 7.623 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.674 1.497 7.573 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.381 2.503 9.012 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -7.698 5.063 7.444 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.753 4.466 8.829 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -5.952 4.768 7.269 1.00 10.00 H new ATOM 771 N PHE A 66 -2.651 2.073 8.375 1.00 10.00 N ATOM 772 CA PHE A 66 -1.551 1.354 8.988 1.00 10.00 C ATOM 773 C PHE A 66 -1.493 1.681 10.473 1.00 10.00 C ATOM 774 O PHE A 66 -1.212 2.816 10.852 1.00 10.00 O ATOM 775 CB PHE A 66 -0.234 1.737 8.306 1.00 10.00 C ATOM 776 CG PHE A 66 0.980 1.106 8.924 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.231 -0.245 8.761 1.00 10.00 C ATOM 778 CD2 PHE A 66 1.874 1.867 9.663 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.348 -0.828 9.325 1.00 10.00 C ATOM 780 CE2 PHE A 66 2.992 1.287 10.229 1.00 10.00 C ATOM 781 CZ PHE A 66 3.229 -0.061 10.058 1.00 10.00 C ATOM 0 H PHE A 66 -2.641 3.077 8.555 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.706 0.282 8.868 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.284 1.451 7.255 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -0.123 2.821 8.336 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.545 -0.850 8.186 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.694 2.923 9.797 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.532 -1.884 9.192 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.680 1.888 10.805 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.104 -0.516 10.498 1.00 10.00 H new ATOM 791 N GLU A 67 -1.796 0.684 11.302 1.00 10.00 N ATOM 792 CA GLU A 67 -1.782 0.841 12.760 1.00 10.00 C ATOM 793 C GLU A 67 -2.774 1.912 13.206 1.00 10.00 C ATOM 794 O GLU A 67 -2.546 2.618 14.190 1.00 10.00 O ATOM 795 CB GLU A 67 -0.371 1.188 13.250 1.00 10.00 C ATOM 796 CG GLU A 67 0.684 0.184 12.817 1.00 10.00 C ATOM 797 CD GLU A 67 0.458 -1.190 13.406 1.00 10.00 C ATOM 798 OE1 GLU A 67 -0.031 -2.085 12.681 1.00 10.00 O ATOM 799 OE2 GLU A 67 0.765 -1.386 14.600 1.00 10.00 O ATOM 0 H GLU A 67 -2.057 -0.251 10.988 1.00 10.00 H new ATOM 0 HA GLU A 67 -2.084 -0.108 13.202 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -0.097 2.175 12.876 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.378 1.250 14.338 1.00 10.00 H new ATOM 0 HG2 GLU A 67 0.687 0.113 11.729 1.00 10.00 H new ATOM 0 HG3 GLU A 67 1.668 0.545 13.116 1.00 10.00 H new ATOM 806 N GLY A 68 -3.870 2.037 12.469 1.00 10.00 N ATOM 807 CA GLY A 68 -4.884 3.016 12.803 1.00 10.00 C ATOM 808 C GLY A 68 -4.664 4.347 12.111 1.00 10.00 C ATOM 809 O GLY A 68 -5.602 5.121 11.925 1.00 10.00 O ATOM 0 H GLY A 68 -4.075 1.475 11.643 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -5.864 2.626 12.528 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -4.893 3.170 13.882 1.00 10.00 H new ATOM 813 N GLN A 69 -3.427 4.612 11.716 1.00 10.00 N ATOM 814 CA GLN A 69 -3.090 5.860 11.043 1.00 10.00 C ATOM 815 C GLN A 69 -3.248 5.708 9.538 1.00 10.00 C ATOM 816 O GLN A 69 -3.175 4.600 9.011 1.00 10.00 O ATOM 817 CB GLN A 69 -1.655 6.280 11.374 1.00 10.00 C ATOM 818 CG GLN A 69 -1.340 6.235 12.858 1.00 10.00 C ATOM 819 CD GLN A 69 -0.155 7.104 13.237 1.00 10.00 C ATOM 820 OE1 GLN A 69 0.754 7.328 12.438 1.00 10.00 O ATOM 821 NE2 GLN A 69 -0.159 7.596 14.464 1.00 10.00 N ATOM 0 H GLN A 69 -2.638 3.979 11.850 1.00 10.00 H new ATOM 0 HA GLN A 69 -3.772 6.633 11.396 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -0.962 5.627 10.843 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -1.486 7.292 11.005 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.216 6.559 13.420 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -1.137 5.205 13.150 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -0.932 7.386 15.095 1.00 10.00 H new ATOM 0 HE22 GLN A 69 0.611 8.186 14.780 1.00 10.00 H new ATOM 830 N ARG A 70 -3.473 6.812 8.849 1.00 10.00 N ATOM 831 CA ARG A 70 -3.631 6.773 7.403 1.00 10.00 C ATOM 832 C ARG A 70 -2.322 7.139 6.718 1.00 10.00 C ATOM 833 O ARG A 70 -1.622 8.057 7.147 1.00 10.00 O ATOM 834 CB ARG A 70 -4.764 7.700 6.950 1.00 10.00 C ATOM 835 CG ARG A 70 -4.602 9.143 7.395 1.00 10.00 C ATOM 836 CD ARG A 70 -5.761 10.002 6.913 1.00 10.00 C ATOM 837 NE ARG A 70 -5.892 9.990 5.455 1.00 10.00 N ATOM 838 CZ ARG A 70 -7.017 9.680 4.807 1.00 10.00 C ATOM 839 NH1 ARG A 70 -8.116 9.359 5.482 1.00 10.00 N ATOM 840 NH2 ARG A 70 -7.046 9.699 3.480 1.00 10.00 N ATOM 0 H ARG A 70 -3.550 7.741 9.262 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.898 5.757 7.114 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -4.829 7.672 5.862 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -5.709 7.316 7.335 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -4.542 9.186 8.482 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -3.665 9.542 7.008 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -6.687 9.644 7.362 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -5.617 11.027 7.254 1.00 10.00 H new ATOM 0 HE ARG A 70 -5.072 10.234 4.899 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -8.103 9.348 6.502 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -8.972 9.123 4.980 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -6.208 9.951 2.955 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -7.906 9.462 2.985 1.00 10.00 H new ATOM 854 N ILE A 71 -1.989 6.407 5.666 1.00 10.00 N ATOM 855 CA ILE A 71 -0.757 6.642 4.923 1.00 10.00 C ATOM 856 C ILE A 71 -0.849 7.913 4.084 1.00 10.00 C ATOM 857 O ILE A 71 -1.724 8.048 3.222 1.00 10.00 O ATOM 858 CB ILE A 71 -0.418 5.447 4.002 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.277 4.159 4.823 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.858 5.718 3.214 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.807 4.222 5.879 1.00 10.00 C ATOM 0 H ILE A 71 -2.557 5.641 5.305 1.00 10.00 H new ATOM 0 HA ILE A 71 0.038 6.759 5.660 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.237 5.319 3.294 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.229 3.941 5.306 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.065 3.330 4.148 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.078 4.864 2.573 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.724 6.608 2.600 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.686 5.875 3.905 1.00 10.00 H new ATOM 0 HD11 ILE A 71 0.846 3.275 6.417 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.769 4.408 5.402 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.587 5.028 6.579 1.00 10.00 H new ATOM 873 N ALA A 72 0.059 8.840 4.343 1.00 10.00 N ATOM 874 CA ALA A 72 0.100 10.098 3.618 1.00 10.00 C ATOM 875 C ALA A 72 0.862 9.933 2.308 1.00 10.00 C ATOM 876 O ALA A 72 1.650 9.000 2.151 1.00 10.00 O ATOM 877 CB ALA A 72 0.739 11.184 4.470 1.00 10.00 C ATOM 0 H ALA A 72 0.782 8.743 5.056 1.00 10.00 H new ATOM 0 HA ALA A 72 -0.923 10.397 3.389 1.00 10.00 H new ATOM 0 HB1 ALA A 72 0.761 12.119 3.911 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.158 11.320 5.382 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.757 10.892 4.729 1.00 10.00 H new ATOM 883 N ASP A 73 0.644 10.857 1.384 1.00 10.00 N ATOM 884 CA ASP A 73 1.297 10.817 0.077 1.00 10.00 C ATOM 885 C ASP A 73 2.766 11.221 0.184 1.00 10.00 C ATOM 886 O ASP A 73 3.519 11.150 -0.789 1.00 10.00 O ATOM 887 CB ASP A 73 0.575 11.746 -0.901 1.00 10.00 C ATOM 888 CG ASP A 73 -0.690 11.139 -1.477 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.607 10.801 -0.697 1.00 10.00 O ATOM 890 OD2 ASP A 73 -0.783 11.020 -2.716 1.00 10.00 O ATOM 0 H ASP A 73 0.016 11.650 1.514 1.00 10.00 H new ATOM 0 HA ASP A 73 1.248 9.793 -0.293 1.00 10.00 H new ATOM 0 HB2 ASP A 73 0.325 12.676 -0.391 1.00 10.00 H new ATOM 0 HB3 ASP A 73 1.252 12.002 -1.716 1.00 10.00 H new ATOM 895 N ASN A 74 3.168 11.650 1.371 1.00 10.00 N ATOM 896 CA ASN A 74 4.543 12.068 1.610 1.00 10.00 C ATOM 897 C ASN A 74 5.226 11.145 2.615 1.00 10.00 C ATOM 898 O ASN A 74 6.299 11.452 3.129 1.00 10.00 O ATOM 899 CB ASN A 74 4.574 13.517 2.115 1.00 10.00 C ATOM 900 CG ASN A 74 3.888 13.683 3.456 1.00 10.00 C ATOM 901 OD1 ASN A 74 2.662 13.787 3.532 1.00 10.00 O ATOM 902 ND2 ASN A 74 4.669 13.719 4.522 1.00 10.00 N ATOM 0 H ASN A 74 2.560 11.718 2.187 1.00 10.00 H new ATOM 0 HA ASN A 74 5.088 12.008 0.668 1.00 10.00 H new ATOM 0 HB2 ASN A 74 5.610 13.847 2.198 1.00 10.00 H new ATOM 0 HB3 ASN A 74 4.091 14.163 1.382 1.00 10.00 H new ATOM 0 HD21 ASN A 74 4.261 13.836 5.449 1.00 10.00 H new ATOM 0 HD22 ASN A 74 5.680 13.629 4.417 1.00 10.00 H new ATOM 909 N HIS A 75 4.599 10.007 2.892 1.00 10.00 N ATOM 910 CA HIS A 75 5.156 9.045 3.833 1.00 10.00 C ATOM 911 C HIS A 75 6.160 8.132 3.137 1.00 10.00 C ATOM 912 O HIS A 75 6.202 8.061 1.907 1.00 10.00 O ATOM 913 CB HIS A 75 4.044 8.202 4.470 1.00 10.00 C ATOM 914 CG HIS A 75 3.438 8.816 5.694 1.00 10.00 C ATOM 915 ND1 HIS A 75 2.234 8.374 6.193 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.903 9.814 6.484 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.998 9.105 7.269 1.00 10.00 C ATOM 918 NE2 HIS A 75 2.980 9.991 7.478 1.00 10.00 N ATOM 0 H HIS A 75 3.708 9.730 2.480 1.00 10.00 H new ATOM 0 HA HIS A 75 5.669 9.602 4.617 1.00 10.00 H new ATOM 0 HB2 HIS A 75 3.259 8.038 3.732 1.00 10.00 H new ATOM 0 HB3 HIS A 75 4.448 7.223 4.729 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.824 10.363 6.354 1.00 10.00 H new ATOM 0 HE1 HIS A 75 1.126 9.001 7.898 1.00 10.00 H new ATOM 0 HE2 HIS A 75 3.030 10.671 8.237 1.00 10.00 H new ATOM 926 N THR A 76 6.971 7.449 3.922 1.00 10.00 N ATOM 927 CA THR A 76 7.967 6.526 3.395 1.00 10.00 C ATOM 928 C THR A 76 8.014 5.265 4.255 1.00 10.00 C ATOM 929 O THR A 76 7.666 5.313 5.432 1.00 10.00 O ATOM 930 CB THR A 76 9.364 7.175 3.347 1.00 10.00 C ATOM 931 OG1 THR A 76 9.506 8.118 4.417 1.00 10.00 O ATOM 932 CG2 THR A 76 9.598 7.872 2.014 1.00 10.00 C ATOM 0 H THR A 76 6.961 7.515 4.940 1.00 10.00 H new ATOM 0 HA THR A 76 7.678 6.265 2.377 1.00 10.00 H new ATOM 0 HB THR A 76 10.107 6.385 3.458 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.783 7.988 5.065 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.591 8.321 2.008 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.523 7.145 1.205 1.00 10.00 H new ATOM 0 HG23 THR A 76 8.847 8.650 1.873 1.00 10.00 H new ATOM 940 N PRO A 77 8.443 4.122 3.689 1.00 10.00 N ATOM 941 CA PRO A 77 8.522 2.856 4.435 1.00 10.00 C ATOM 942 C PRO A 77 9.597 2.887 5.522 1.00 10.00 C ATOM 943 O PRO A 77 9.707 1.965 6.332 1.00 10.00 O ATOM 944 CB PRO A 77 8.875 1.829 3.355 1.00 10.00 C ATOM 945 CG PRO A 77 9.535 2.614 2.276 1.00 10.00 C ATOM 946 CD PRO A 77 8.876 3.963 2.287 1.00 10.00 C ATOM 0 HA PRO A 77 7.595 2.635 4.963 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.540 1.059 3.746 1.00 10.00 H new ATOM 0 HB3 PRO A 77 7.983 1.323 2.985 1.00 10.00 H new ATOM 0 HG2 PRO A 77 10.607 2.701 2.456 1.00 10.00 H new ATOM 0 HG3 PRO A 77 9.413 2.127 1.308 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.568 4.750 1.989 1.00 10.00 H new ATOM 0 HD3 PRO A 77 8.032 4.003 1.599 1.00 10.00 H new ATOM 954 N LYS A 78 10.391 3.954 5.528 1.00 10.00 N ATOM 955 CA LYS A 78 11.454 4.126 6.506 1.00 10.00 C ATOM 956 C LYS A 78 10.872 4.533 7.857 1.00 10.00 C ATOM 957 O LYS A 78 11.368 4.121 8.906 1.00 10.00 O ATOM 958 CB LYS A 78 12.449 5.184 6.022 1.00 10.00 C ATOM 959 CG LYS A 78 13.599 5.450 6.987 1.00 10.00 C ATOM 960 CD LYS A 78 14.561 4.272 7.065 1.00 10.00 C ATOM 961 CE LYS A 78 15.352 4.102 5.777 1.00 10.00 C ATOM 962 NZ LYS A 78 16.384 3.040 5.894 1.00 10.00 N ATOM 0 H LYS A 78 10.314 4.719 4.857 1.00 10.00 H new ATOM 0 HA LYS A 78 11.977 3.177 6.623 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.860 4.868 5.063 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.913 6.117 5.847 1.00 10.00 H new ATOM 0 HG2 LYS A 78 14.141 6.340 6.669 1.00 10.00 H new ATOM 0 HG3 LYS A 78 13.199 5.658 7.979 1.00 10.00 H new ATOM 0 HD2 LYS A 78 15.249 4.419 7.897 1.00 10.00 H new ATOM 0 HD3 LYS A 78 14.002 3.359 7.271 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.670 3.857 4.963 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.831 5.046 5.518 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.900 2.957 4.995 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 17.050 3.285 6.654 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 15.925 2.133 6.115 1.00 10.00 H new ATOM 976 N GLU A 79 9.812 5.328 7.822 1.00 10.00 N ATOM 977 CA GLU A 79 9.163 5.792 9.039 1.00 10.00 C ATOM 978 C GLU A 79 7.977 4.895 9.377 1.00 10.00 C ATOM 979 O GLU A 79 7.726 3.909 8.677 1.00 10.00 O ATOM 980 CB GLU A 79 8.715 7.249 8.880 1.00 10.00 C ATOM 981 CG GLU A 79 7.683 7.462 7.783 1.00 10.00 C ATOM 982 CD GLU A 79 7.667 8.887 7.266 1.00 10.00 C ATOM 983 OE1 GLU A 79 7.702 9.827 8.083 1.00 10.00 O ATOM 984 OE2 GLU A 79 7.629 9.072 6.034 1.00 10.00 O ATOM 0 H GLU A 79 9.382 5.666 6.961 1.00 10.00 H new ATOM 0 HA GLU A 79 9.877 5.742 9.861 1.00 10.00 H new ATOM 0 HB2 GLU A 79 8.301 7.597 9.827 1.00 10.00 H new ATOM 0 HB3 GLU A 79 9.588 7.866 8.668 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.891 6.782 6.957 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.694 7.207 8.165 1.00 10.00 H new ATOM 991 N LEU A 80 7.270 5.235 10.458 1.00 10.00 N ATOM 992 CA LEU A 80 6.103 4.480 10.927 1.00 10.00 C ATOM 993 C LEU A 80 6.515 3.136 11.534 1.00 10.00 C ATOM 994 O LEU A 80 6.214 2.854 12.695 1.00 10.00 O ATOM 995 CB LEU A 80 5.083 4.273 9.797 1.00 10.00 C ATOM 996 CG LEU A 80 4.428 5.550 9.268 1.00 10.00 C ATOM 997 CD1 LEU A 80 3.717 5.281 7.951 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.454 6.117 10.290 1.00 10.00 C ATOM 0 H LEU A 80 7.491 6.046 11.036 1.00 10.00 H new ATOM 0 HA LEU A 80 5.627 5.071 11.709 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.580 3.769 8.968 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.300 3.603 10.154 1.00 10.00 H new ATOM 0 HG LEU A 80 5.212 6.287 9.093 1.00 10.00 H new ATOM 0 HD11 LEU A 80 3.257 6.201 7.591 1.00 10.00 H new ATOM 0 HD12 LEU A 80 4.437 4.923 7.215 1.00 10.00 H new ATOM 0 HD13 LEU A 80 2.946 4.525 8.101 1.00 10.00 H new ATOM 0 HD21 LEU A 80 2.999 7.025 9.894 1.00 10.00 H new ATOM 0 HD22 LEU A 80 2.676 5.382 10.498 1.00 10.00 H new ATOM 0 HD23 LEU A 80 3.988 6.351 11.211 1.00 10.00 H new ATOM 1010 N GLY A 81 7.210 2.317 10.755 1.00 10.00 N ATOM 1011 CA GLY A 81 7.652 1.023 11.240 1.00 10.00 C ATOM 1012 C GLY A 81 7.002 -0.120 10.492 1.00 10.00 C ATOM 1013 O GLY A 81 6.087 -0.759 11.005 1.00 10.00 O ATOM 0 H GLY A 81 7.476 2.526 9.793 1.00 10.00 H new ATOM 0 HA2 GLY A 81 8.735 0.950 11.141 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.422 0.937 12.302 1.00 10.00 H new ATOM 1017 N MET A 82 7.478 -0.378 9.279 1.00 10.00 N ATOM 1018 CA MET A 82 6.936 -1.451 8.451 1.00 10.00 C ATOM 1019 C MET A 82 7.899 -2.632 8.394 1.00 10.00 C ATOM 1020 O MET A 82 9.111 -2.450 8.246 1.00 10.00 O ATOM 1021 CB MET A 82 6.660 -0.941 7.034 1.00 10.00 C ATOM 1022 CG MET A 82 5.430 -0.051 6.932 1.00 10.00 C ATOM 1023 SD MET A 82 5.241 0.694 5.300 1.00 10.00 S ATOM 1024 CE MET A 82 3.691 1.565 5.511 1.00 10.00 C ATOM 0 H MET A 82 8.240 0.143 8.845 1.00 10.00 H new ATOM 0 HA MET A 82 6.001 -1.785 8.901 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.529 -0.386 6.682 1.00 10.00 H new ATOM 0 HB3 MET A 82 6.536 -1.795 6.368 1.00 10.00 H new ATOM 0 HG2 MET A 82 4.542 -0.639 7.163 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.495 0.738 7.681 1.00 10.00 H new ATOM 0 HE1 MET A 82 3.434 2.080 4.585 1.00 10.00 H new ATOM 0 HE2 MET A 82 2.905 0.853 5.761 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.790 2.294 6.316 1.00 10.00 H new ATOM 1034 N GLU A 83 7.362 -3.839 8.518 1.00 10.00 N ATOM 1035 CA GLU A 83 8.175 -5.046 8.473 1.00 10.00 C ATOM 1036 C GLU A 83 7.583 -6.060 7.497 1.00 10.00 C ATOM 1037 O GLU A 83 6.562 -5.803 6.865 1.00 10.00 O ATOM 1038 CB GLU A 83 8.279 -5.662 9.870 1.00 10.00 C ATOM 1039 CG GLU A 83 9.699 -5.707 10.411 1.00 10.00 C ATOM 1040 CD GLU A 83 10.631 -6.514 9.532 1.00 10.00 C ATOM 1041 OE1 GLU A 83 10.394 -7.730 9.361 1.00 10.00 O ATOM 1042 OE2 GLU A 83 11.604 -5.942 9.004 1.00 10.00 O ATOM 0 H GLU A 83 6.365 -4.008 8.651 1.00 10.00 H new ATOM 0 HA GLU A 83 9.173 -4.776 8.127 1.00 10.00 H new ATOM 0 HB2 GLU A 83 7.655 -5.091 10.557 1.00 10.00 H new ATOM 0 HB3 GLU A 83 7.877 -6.675 9.842 1.00 10.00 H new ATOM 0 HG2 GLU A 83 10.081 -4.690 10.503 1.00 10.00 H new ATOM 0 HG3 GLU A 83 9.689 -6.135 11.413 1.00 10.00 H new ATOM 1049 N GLU A 84 8.243 -7.204 7.367 1.00 10.00 N ATOM 1050 CA GLU A 84 7.783 -8.263 6.476 1.00 10.00 C ATOM 1051 C GLU A 84 6.548 -8.942 7.066 1.00 10.00 C ATOM 1052 O GLU A 84 6.469 -9.131 8.283 1.00 10.00 O ATOM 1053 CB GLU A 84 8.907 -9.280 6.259 1.00 10.00 C ATOM 1054 CG GLU A 84 8.496 -10.514 5.467 1.00 10.00 C ATOM 1055 CD GLU A 84 8.161 -10.216 4.020 1.00 10.00 C ATOM 1056 OE1 GLU A 84 8.851 -9.378 3.401 1.00 10.00 O ATOM 1057 OE2 GLU A 84 7.215 -10.833 3.492 1.00 10.00 O ATOM 0 H GLU A 84 9.103 -7.423 7.870 1.00 10.00 H new ATOM 0 HA GLU A 84 7.511 -7.832 5.512 1.00 10.00 H new ATOM 0 HB2 GLU A 84 9.730 -8.788 5.740 1.00 10.00 H new ATOM 0 HB3 GLU A 84 9.286 -9.597 7.231 1.00 10.00 H new ATOM 0 HG2 GLU A 84 9.304 -11.245 5.502 1.00 10.00 H new ATOM 0 HG3 GLU A 84 7.631 -10.972 5.946 1.00 10.00 H new ATOM 1064 N GLU A 85 5.590 -9.289 6.201 1.00 10.00 N ATOM 1065 CA GLU A 85 4.344 -9.940 6.618 1.00 10.00 C ATOM 1066 C GLU A 85 3.488 -8.980 7.440 1.00 10.00 C ATOM 1067 O GLU A 85 2.646 -9.397 8.239 1.00 10.00 O ATOM 1068 CB GLU A 85 4.621 -11.225 7.417 1.00 10.00 C ATOM 1069 CG GLU A 85 5.210 -12.355 6.585 1.00 10.00 C ATOM 1070 CD GLU A 85 4.152 -13.216 5.922 1.00 10.00 C ATOM 1071 OE1 GLU A 85 3.570 -12.778 4.909 1.00 10.00 O ATOM 1072 OE2 GLU A 85 3.916 -14.345 6.397 1.00 10.00 O ATOM 0 H GLU A 85 5.656 -9.127 5.196 1.00 10.00 H new ATOM 0 HA GLU A 85 3.797 -10.217 5.717 1.00 10.00 H new ATOM 0 HB2 GLU A 85 5.306 -10.993 8.233 1.00 10.00 H new ATOM 0 HB3 GLU A 85 3.690 -11.567 7.869 1.00 10.00 H new ATOM 0 HG2 GLU A 85 5.860 -11.934 5.819 1.00 10.00 H new ATOM 0 HG3 GLU A 85 5.833 -12.982 7.223 1.00 10.00 H new ATOM 1079 N ASP A 86 3.714 -7.687 7.235 1.00 10.00 N ATOM 1080 CA ASP A 86 2.971 -6.652 7.942 1.00 10.00 C ATOM 1081 C ASP A 86 1.548 -6.574 7.405 1.00 10.00 C ATOM 1082 O ASP A 86 1.300 -6.884 6.238 1.00 10.00 O ATOM 1083 CB ASP A 86 3.669 -5.298 7.788 1.00 10.00 C ATOM 1084 CG ASP A 86 3.608 -4.455 9.045 1.00 10.00 C ATOM 1085 OD1 ASP A 86 2.488 -4.156 9.517 1.00 10.00 O ATOM 1086 OD2 ASP A 86 4.681 -4.080 9.564 1.00 10.00 O ATOM 0 H ASP A 86 4.410 -7.330 6.581 1.00 10.00 H new ATOM 0 HA ASP A 86 2.936 -6.906 9.001 1.00 10.00 H new ATOM 0 HB2 ASP A 86 4.712 -5.462 7.517 1.00 10.00 H new ATOM 0 HB3 ASP A 86 3.209 -4.749 6.966 1.00 10.00 H new ATOM 1091 N VAL A 87 0.620 -6.163 8.252 1.00 10.00 N ATOM 1092 CA VAL A 87 -0.780 -6.068 7.865 1.00 10.00 C ATOM 1093 C VAL A 87 -1.189 -4.622 7.605 1.00 10.00 C ATOM 1094 O VAL A 87 -0.948 -3.738 8.433 1.00 10.00 O ATOM 1095 CB VAL A 87 -1.705 -6.667 8.950 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -3.164 -6.610 8.518 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -1.296 -8.097 9.271 1.00 10.00 C ATOM 0 H VAL A 87 0.810 -5.889 9.216 1.00 10.00 H new ATOM 0 HA VAL A 87 -0.890 -6.641 6.944 1.00 10.00 H new ATOM 0 HB VAL A 87 -1.599 -6.066 9.853 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -3.792 -7.038 9.300 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -3.453 -5.573 8.348 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -3.293 -7.179 7.597 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -1.958 -8.502 10.036 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -1.367 -8.707 8.370 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -0.269 -8.108 9.637 1.00 10.00 H new ATOM 1107 N ILE A 88 -1.799 -4.384 6.454 1.00 10.00 N ATOM 1108 CA ILE A 88 -2.259 -3.053 6.096 1.00 10.00 C ATOM 1109 C ILE A 88 -3.683 -3.131 5.549 1.00 10.00 C ATOM 1110 O ILE A 88 -4.030 -4.069 4.826 1.00 10.00 O ATOM 1111 CB ILE A 88 -1.314 -2.371 5.073 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.744 -0.923 4.822 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -1.266 -3.152 3.764 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.658 -0.066 4.210 1.00 10.00 C ATOM 0 H ILE A 88 -1.987 -5.098 5.751 1.00 10.00 H new ATOM 0 HA ILE A 88 -2.252 -2.438 6.996 1.00 10.00 H new ATOM 0 HB ILE A 88 -0.310 -2.364 5.497 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.612 -0.920 4.163 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -2.058 -0.477 5.766 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.596 -2.651 3.066 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -0.902 -4.161 3.956 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.266 -3.203 3.334 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.034 0.946 4.061 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.203 -0.038 4.878 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.360 -0.487 3.250 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.510 -2.167 5.922 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.896 -2.142 5.479 1.00 10.00 C ATOM 1128 C GLU A 89 -6.110 -1.087 4.405 1.00 10.00 C ATOM 1129 O GLU A 89 -5.408 -0.077 4.365 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.828 -1.865 6.658 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.908 -3.000 7.664 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.739 -2.638 8.877 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.980 -2.795 8.826 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -7.158 -2.197 9.889 1.00 10.00 O ATOM 0 H GLU A 89 -4.246 -1.392 6.530 1.00 10.00 H new ATOM 0 HA GLU A 89 -6.126 -3.120 5.057 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -6.491 -0.963 7.170 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.828 -1.660 6.276 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -7.336 -3.879 7.183 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -5.902 -3.270 7.984 1.00 10.00 H new ATOM 1141 N VAL A 90 -7.080 -1.328 3.540 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.409 -0.400 2.474 1.00 10.00 C ATOM 1143 C VAL A 90 -8.927 -0.309 2.326 1.00 10.00 C ATOM 1144 O VAL A 90 -9.605 -1.317 2.133 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.756 -0.809 1.130 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -7.143 -2.226 0.728 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.116 0.182 0.034 1.00 10.00 C ATOM 0 H VAL A 90 -7.658 -2.168 3.557 1.00 10.00 H new ATOM 0 HA VAL A 90 -7.009 0.578 2.740 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.675 -0.791 1.269 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.667 -2.478 -0.219 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.814 -2.925 1.497 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -8.226 -2.290 0.618 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.647 -0.124 -0.901 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.198 0.206 -0.093 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.761 1.175 0.310 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.459 0.895 2.450 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.898 1.100 2.346 1.00 10.00 C ATOM 1159 C TYR A 91 -11.216 2.216 1.365 1.00 10.00 C ATOM 1160 O TYR A 91 -10.353 3.027 1.043 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.488 1.434 3.716 1.00 10.00 C ATOM 1162 CG TYR A 91 -11.409 0.292 4.702 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -12.402 -0.675 4.747 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -10.342 0.180 5.584 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -12.336 -1.724 5.643 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -10.271 -0.863 6.485 1.00 10.00 C ATOM 1167 CZ TYR A 91 -11.268 -1.812 6.509 1.00 10.00 C ATOM 1168 OH TYR A 91 -11.196 -2.858 7.399 1.00 10.00 O ATOM 0 H TYR A 91 -8.921 1.744 2.622 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.344 0.176 1.980 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -10.963 2.296 4.128 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.531 1.725 3.592 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -13.241 -0.607 4.070 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.556 0.920 5.564 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -13.116 -2.470 5.665 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -9.437 -0.934 7.168 1.00 10.00 H new ATOM 0 HH TYR A 91 -10.307 -2.875 7.812 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.454 2.253 0.901 1.00 10.00 N ATOM 1179 CA GLN A 92 -12.884 3.279 -0.035 1.00 10.00 C ATOM 1180 C GLN A 92 -13.282 4.546 0.713 1.00 10.00 C ATOM 1181 O GLN A 92 -14.038 4.494 1.684 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.055 2.779 -0.888 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.592 3.825 -1.851 1.00 10.00 C ATOM 1184 CD GLN A 92 -15.739 3.315 -2.695 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -15.534 2.784 -3.786 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -16.955 3.483 -2.204 1.00 10.00 N ATOM 0 H GLN A 92 -13.180 1.584 1.157 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.049 3.509 -0.697 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -13.734 1.905 -1.455 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -14.861 2.454 -0.230 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.923 4.696 -1.286 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -13.786 4.157 -2.505 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -17.081 3.928 -1.295 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.767 3.167 -2.734 1.00 10.00 H new ATOM 1195 N GLU A 93 -12.752 5.673 0.267 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.057 6.955 0.880 1.00 10.00 C ATOM 1197 C GLU A 93 -14.481 7.376 0.537 1.00 10.00 C ATOM 1198 O GLU A 93 -15.032 6.954 -0.482 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.065 8.022 0.401 1.00 10.00 C ATOM 1200 CG GLU A 93 -10.664 7.861 0.971 1.00 10.00 C ATOM 1201 CD GLU A 93 -10.530 8.430 2.373 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -11.393 8.134 3.226 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -9.556 9.169 2.632 1.00 10.00 O ATOM 0 H GLU A 93 -12.106 5.726 -0.521 1.00 10.00 H new ATOM 0 HA GLU A 93 -12.969 6.854 1.962 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.010 7.990 -0.687 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -12.446 9.006 0.672 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -10.402 6.803 0.987 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -9.950 8.356 0.313 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.069 8.216 1.382 1.00 10.00 N ATOM 1211 CA GLN A 94 -16.426 8.700 1.169 1.00 10.00 C ATOM 1212 C GLN A 94 -16.481 9.566 -0.091 1.00 10.00 C ATOM 1213 O GLN A 94 -17.537 9.740 -0.702 1.00 10.00 O ATOM 1214 CB GLN A 94 -16.895 9.505 2.383 1.00 10.00 C ATOM 1215 CG GLN A 94 -18.391 9.772 2.404 1.00 10.00 C ATOM 1216 CD GLN A 94 -18.768 10.883 3.365 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -17.994 11.816 3.587 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -19.952 10.791 3.950 1.00 10.00 N ATOM 0 H GLN A 94 -14.623 8.577 2.225 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.089 7.845 1.038 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -16.619 8.969 3.291 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -16.365 10.458 2.402 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -18.724 10.035 1.400 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -18.916 8.859 2.685 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -20.565 10.003 3.740 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -20.252 11.508 4.611 1.00 10.00 H new ATOM 1227 N THR A 95 -15.326 10.096 -0.471 1.00 10.00 N ATOM 1228 CA THR A 95 -15.203 10.933 -1.648 1.00 10.00 C ATOM 1229 C THR A 95 -15.326 10.109 -2.926 1.00 10.00 C ATOM 1230 O THR A 95 -15.734 10.617 -3.971 1.00 10.00 O ATOM 1231 CB THR A 95 -13.845 11.648 -1.639 1.00 10.00 C ATOM 1232 OG1 THR A 95 -13.010 11.065 -0.629 1.00 10.00 O ATOM 1233 CG2 THR A 95 -14.012 13.131 -1.372 1.00 10.00 C ATOM 0 H THR A 95 -14.450 9.955 0.031 1.00 10.00 H new ATOM 0 HA THR A 95 -16.011 11.665 -1.626 1.00 10.00 H new ATOM 0 HB THR A 95 -13.382 11.529 -2.619 1.00 10.00 H new ATOM 0 HG1 THR A 95 -12.141 11.518 -0.621 1.00 10.00 H new ATOM 0 HG21 THR A 95 -13.034 13.613 -1.371 1.00 10.00 H new ATOM 0 HG22 THR A 95 -14.634 13.573 -2.150 1.00 10.00 H new ATOM 0 HG23 THR A 95 -14.488 13.275 -0.402 1.00 10.00 H new ATOM 1241 N GLY A 96 -14.964 8.834 -2.831 1.00 10.00 N ATOM 1242 CA GLY A 96 -15.035 7.947 -3.976 1.00 10.00 C ATOM 1243 C GLY A 96 -13.839 8.087 -4.898 1.00 10.00 C ATOM 1244 O GLY A 96 -13.582 7.221 -5.734 1.00 10.00 O ATOM 0 H GLY A 96 -14.621 8.398 -1.975 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -15.102 6.916 -3.629 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -15.947 8.155 -4.536 1.00 10.00 H new ATOM 1248 N GLY A 97 -13.101 9.173 -4.736 1.00 10.00 N ATOM 1249 CA GLY A 97 -11.939 9.422 -5.558 1.00 10.00 C ATOM 1250 C GLY A 97 -11.490 10.861 -5.464 1.00 10.00 C ATOM 1251 O GLY A 97 -12.047 11.632 -4.676 1.00 10.00 O ATOM 0 H GLY A 97 -13.290 9.894 -4.040 1.00 10.00 H new ATOM 0 HA2 GLY A 97 -11.126 8.766 -5.248 1.00 10.00 H new ATOM 0 HA3 GLY A 97 -12.168 9.179 -6.596 1.00 10.00 H new ATOM 1256 N ASP B 195 -7.485 -19.855 -2.774 1.00 10.00 N ATOM 1257 CA ASP B 195 -7.683 -18.469 -2.371 1.00 10.00 C ATOM 1258 C ASP B 195 -7.150 -17.539 -3.439 1.00 10.00 C ATOM 1259 O ASP B 195 -6.771 -17.987 -4.526 1.00 10.00 O ATOM 1260 CB ASP B 195 -6.993 -18.198 -1.035 1.00 10.00 C ATOM 1261 CG ASP B 195 -7.908 -18.482 0.134 1.00 10.00 C ATOM 1262 OD1 ASP B 195 -7.496 -19.215 1.057 1.00 10.00 O ATOM 1263 OD2 ASP B 195 -9.054 -17.994 0.122 1.00 10.00 O ATOM 0 HA ASP B 195 -8.751 -18.288 -2.248 1.00 10.00 H new ATOM 0 HB2 ASP B 195 -6.098 -18.816 -0.955 1.00 10.00 H new ATOM 0 HB3 ASP B 195 -6.667 -17.159 -0.998 1.00 10.00 H new ATOM 1268 N THR B 196 -7.099 -16.250 -3.146 1.00 10.00 N ATOM 1269 CA THR B 196 -6.597 -15.319 -4.124 1.00 10.00 C ATOM 1270 C THR B 196 -5.369 -14.583 -3.615 1.00 10.00 C ATOM 1271 O THR B 196 -5.402 -13.905 -2.584 1.00 10.00 O ATOM 1272 CB THR B 196 -7.678 -14.289 -4.502 1.00 10.00 C ATOM 1273 OG1 THR B 196 -8.973 -14.910 -4.474 1.00 10.00 O ATOM 1274 CG2 THR B 196 -7.415 -13.713 -5.891 1.00 10.00 C ATOM 0 H THR B 196 -7.393 -15.839 -2.260 1.00 10.00 H new ATOM 0 HA THR B 196 -6.320 -15.899 -5.004 1.00 10.00 H new ATOM 0 HB THR B 196 -7.647 -13.476 -3.777 1.00 10.00 H new ATOM 0 HG1 THR B 196 -9.657 -14.251 -4.713 1.00 10.00 H new ATOM 0 HG21 THR B 196 -8.191 -12.988 -6.137 1.00 10.00 H new ATOM 0 HG22 THR B 196 -6.442 -13.222 -5.903 1.00 10.00 H new ATOM 0 HG23 THR B 196 -7.424 -14.518 -6.626 1.00 10.00 H new ATOM 1282 N ALA B 197 -4.286 -14.731 -4.356 1.00 10.00 N ATOM 1283 CA ALA B 197 -3.046 -14.069 -4.037 1.00 10.00 C ATOM 1284 C ALA B 197 -2.573 -13.275 -5.239 1.00 10.00 C ATOM 1285 O ALA B 197 -2.406 -13.819 -6.331 1.00 10.00 O ATOM 1286 CB ALA B 197 -1.992 -15.081 -3.611 1.00 10.00 C ATOM 0 H ALA B 197 -4.247 -15.313 -5.193 1.00 10.00 H new ATOM 0 HA ALA B 197 -3.210 -13.387 -3.203 1.00 10.00 H new ATOM 0 HB1 ALA B 197 -1.063 -14.562 -3.374 1.00 10.00 H new ATOM 0 HB2 ALA B 197 -2.341 -15.620 -2.730 1.00 10.00 H new ATOM 0 HB3 ALA B 197 -1.816 -15.787 -4.423 1.00 10.00 H new ATOM 1292 N GLY B 198 -2.355 -11.998 -5.029 1.00 10.00 N ATOM 1293 CA GLY B 198 -1.878 -11.139 -6.087 1.00 10.00 C ATOM 1294 C GLY B 198 -0.593 -10.478 -5.684 1.00 10.00 C ATOM 1295 O GLY B 198 -0.515 -9.932 -4.593 1.00 10.00 O ATOM 0 H GLY B 198 -2.501 -11.531 -4.134 1.00 10.00 H new ATOM 0 HA2 GLY B 198 -1.726 -11.721 -6.996 1.00 10.00 H new ATOM 0 HA3 GLY B 198 -2.628 -10.382 -6.315 1.00 10.00 H new ATOM 1299 N CYS B 199 0.416 -10.509 -6.539 1.00 10.00 N ATOM 1300 CA CYS B 199 1.676 -9.881 -6.188 1.00 10.00 C ATOM 1301 C CYS B 199 1.938 -8.701 -7.109 1.00 10.00 C ATOM 1302 O CYS B 199 1.941 -8.831 -8.330 1.00 10.00 O ATOM 1303 CB CYS B 199 2.824 -10.883 -6.306 1.00 10.00 C ATOM 1304 SG CYS B 199 2.523 -12.461 -5.483 1.00 10.00 S ATOM 0 H CYS B 199 0.390 -10.951 -7.458 1.00 10.00 H new ATOM 0 HA CYS B 199 1.615 -9.533 -5.157 1.00 10.00 H new ATOM 0 HB2 CYS B 199 3.021 -11.069 -7.362 1.00 10.00 H new ATOM 0 HB3 CYS B 199 3.726 -10.435 -5.888 1.00 10.00 H new ATOM 0 HG CYS B 199 3.553 -13.238 -5.644 1.00 10.00 H new ATOM 1310 N ILE B 200 2.161 -7.550 -6.498 1.00 10.00 N ATOM 1311 CA ILE B 200 2.404 -6.321 -7.231 1.00 10.00 C ATOM 1312 C ILE B 200 3.754 -5.725 -6.844 1.00 10.00 C ATOM 1313 O ILE B 200 4.058 -5.594 -5.663 1.00 10.00 O ATOM 1314 CB ILE B 200 1.254 -5.309 -6.966 1.00 10.00 C ATOM 1315 CG1 ILE B 200 1.591 -3.907 -7.484 1.00 10.00 C ATOM 1316 CG2 ILE B 200 0.896 -5.259 -5.484 1.00 10.00 C ATOM 1317 CD1 ILE B 200 0.468 -2.909 -7.269 1.00 10.00 C ATOM 0 H ILE B 200 2.179 -7.442 -5.484 1.00 10.00 H new ATOM 0 HA ILE B 200 2.430 -6.545 -8.297 1.00 10.00 H new ATOM 0 HB ILE B 200 0.386 -5.665 -7.521 1.00 10.00 H new ATOM 0 HG12 ILE B 200 2.490 -3.547 -6.983 1.00 10.00 H new ATOM 0 HG13 ILE B 200 1.820 -3.964 -8.548 1.00 10.00 H new ATOM 0 HG21 ILE B 200 0.089 -4.543 -5.329 1.00 10.00 H new ATOM 0 HG22 ILE B 200 0.573 -6.247 -5.154 1.00 10.00 H new ATOM 0 HG23 ILE B 200 1.769 -4.952 -4.909 1.00 10.00 H new ATOM 0 HD11 ILE B 200 0.767 -1.935 -7.657 1.00 10.00 H new ATOM 0 HD12 ILE B 200 -0.426 -3.249 -7.792 1.00 10.00 H new ATOM 0 HD13 ILE B 200 0.255 -2.825 -6.203 1.00 10.00 H new ATOM 1329 N VAL B 201 4.570 -5.389 -7.839 1.00 10.00 N ATOM 1330 CA VAL B 201 5.877 -4.815 -7.572 1.00 10.00 C ATOM 1331 C VAL B 201 5.983 -3.426 -8.207 1.00 10.00 C ATOM 1332 O VAL B 201 5.653 -3.222 -9.381 1.00 10.00 O ATOM 1333 CB VAL B 201 7.030 -5.725 -8.049 1.00 10.00 C ATOM 1334 CG1 VAL B 201 7.034 -5.869 -9.567 1.00 10.00 C ATOM 1335 CG2 VAL B 201 8.364 -5.190 -7.542 1.00 10.00 C ATOM 0 H VAL B 201 4.349 -5.504 -8.828 1.00 10.00 H new ATOM 0 HA VAL B 201 5.977 -4.723 -6.491 1.00 10.00 H new ATOM 0 HB VAL B 201 6.875 -6.720 -7.632 1.00 10.00 H new ATOM 0 HG11 VAL B 201 7.858 -6.516 -9.869 1.00 10.00 H new ATOM 0 HG12 VAL B 201 6.091 -6.307 -9.893 1.00 10.00 H new ATOM 0 HG13 VAL B 201 7.156 -4.888 -10.025 1.00 10.00 H new ATOM 0 HG21 VAL B 201 9.170 -5.839 -7.884 1.00 10.00 H new ATOM 0 HG22 VAL B 201 8.522 -4.182 -7.926 1.00 10.00 H new ATOM 0 HG23 VAL B 201 8.356 -5.165 -6.452 1.00 10.00 H new ATOM 1345 N ILE B 202 6.417 -2.473 -7.407 1.00 10.00 N ATOM 1346 CA ILE B 202 6.547 -1.088 -7.830 1.00 10.00 C ATOM 1347 C ILE B 202 7.979 -0.576 -7.665 1.00 10.00 C ATOM 1348 O ILE B 202 8.629 -0.864 -6.658 1.00 10.00 O ATOM 1349 CB ILE B 202 5.571 -0.180 -7.051 1.00 10.00 C ATOM 1350 CG1 ILE B 202 5.984 1.286 -7.186 1.00 10.00 C ATOM 1351 CG2 ILE B 202 5.507 -0.594 -5.577 1.00 10.00 C ATOM 1352 CD1 ILE B 202 5.089 2.243 -6.446 1.00 10.00 C ATOM 0 H ILE B 202 6.692 -2.636 -6.438 1.00 10.00 H new ATOM 0 HA ILE B 202 6.295 -1.053 -8.890 1.00 10.00 H new ATOM 0 HB ILE B 202 4.575 -0.296 -7.478 1.00 10.00 H new ATOM 0 HG12 ILE B 202 7.004 1.401 -6.820 1.00 10.00 H new ATOM 0 HG13 ILE B 202 5.993 1.555 -8.242 1.00 10.00 H new ATOM 0 HG21 ILE B 202 4.814 0.058 -5.046 1.00 10.00 H new ATOM 0 HG22 ILE B 202 5.163 -1.626 -5.503 1.00 10.00 H new ATOM 0 HG23 ILE B 202 6.498 -0.509 -5.132 1.00 10.00 H new ATOM 0 HD11 ILE B 202 5.447 3.262 -6.591 1.00 10.00 H new ATOM 0 HD12 ILE B 202 4.071 2.159 -6.828 1.00 10.00 H new ATOM 0 HD13 ILE B 202 5.099 2.002 -5.383 1.00 10.00 H new