USER MOD reduce.3.24.130724 H: found=0, std=0, add=896, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 899 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 152 GLN : amide:sc= 0.04 X(o=0.081,f=0.13) USER MOD Set 1.2: A 153 SER OG : rot 180:sc= 0.0415 USER MOD Set 2.1: A 129 SER OG : rot 180:sc= -0.251 USER MOD Set 2.2: A 142 HIS :FLIP no HE2:sc= -1.89 F(o=-4.4!,f=-2.1) USER MOD Set 3.1: A 61 SER OG : rot 158:sc= 1.29 USER MOD Set 3.2: A 84 HIS : no HD1:sc= 1.02 K(o=2.3,f=-6.5!) USER MOD Single : A 37 TYR OH : rot 120:sc= 0.196 USER MOD Single : A 38 CYS SG : rot -150:sc= -2.86! USER MOD Single : A 40 GLN : amide:sc= -6.65! C(o=-6.6!,f=-10!) USER MOD Single : A 41 LYS NZ :NH3+ -166:sc= -0.0231 (180deg=-0.213) USER MOD Single : A 42 HIS : no HE2:sc= -0.0151 K(o=-0.015,f=-1.1) USER MOD Single : A 49 TYR OH : rot 150:sc= 0 USER MOD Single : A 58 THR OG1 : rot -125:sc= 0.158 USER MOD Single : A 60 LYS NZ :NH3+ -170:sc= 1.07 (180deg=0.627) USER MOD Single : A 66 LYS NZ :NH3+ 159:sc= -0.105 (180deg=-0.497) USER MOD Single : A 69 CYS SG : rot 72:sc= -1.92! USER MOD Single : A 75 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.021) USER MOD Single : A 80 GLN : amide:sc= 0.106 K(o=0.11,f=-1.1) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 125 LYS NZ :NH3+ -105:sc= -1.2 (180deg=-3.38!) USER MOD Single : A 127 HIS :FLIP no HD1:sc= -0.717 F(o=-1.7!,f=-0.72) USER MOD Single : A 136 LYS NZ :NH3+ 148:sc= 2.47 (180deg=1.08) USER MOD Single : A 138 SER OG : rot 111:sc= 0.816 USER MOD Single : A 146 THR OG1 : rot 85:sc= -0.478 USER MOD Single : A 147 ASN : amide:sc= -3.02! C(o=-3!,f=-3.1!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 GLN :FLIP amide:sc= -5.95! C(o=-8.9!,f=-6!) USER MOD Single : A 159 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0132) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 33 11.008 -13.759 4.177 1.00 0.00 N ATOM 2 CA GLY A 33 10.135 -13.915 5.322 1.00 0.00 C ATOM 3 C GLY A 33 10.111 -12.692 6.196 1.00 0.00 C ATOM 4 O GLY A 33 10.269 -12.782 7.415 1.00 0.00 O ATOM 0 HA2 GLY A 33 9.124 -14.132 4.977 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.462 -14.772 5.910 1.00 0.00 H new ATOM 8 N LEU A 34 9.933 -11.548 5.568 1.00 0.00 N ATOM 9 CA LEU A 34 10.096 -10.276 6.244 1.00 0.00 C ATOM 10 C LEU A 34 8.745 -9.665 6.610 1.00 0.00 C ATOM 11 O LEU A 34 7.769 -10.381 6.847 1.00 0.00 O ATOM 12 CB LEU A 34 10.880 -9.325 5.337 1.00 0.00 C ATOM 13 CG LEU A 34 12.065 -9.964 4.605 1.00 0.00 C ATOM 14 CD1 LEU A 34 12.930 -8.908 3.945 1.00 0.00 C ATOM 15 CD2 LEU A 34 12.884 -10.818 5.544 1.00 0.00 C ATOM 0 H LEU A 34 9.674 -11.472 4.584 1.00 0.00 H new ATOM 0 HA LEU A 34 10.645 -10.439 7.172 1.00 0.00 H new ATOM 0 HB2 LEU A 34 10.198 -8.906 4.597 1.00 0.00 H new ATOM 0 HB3 LEU A 34 11.248 -8.494 5.938 1.00 0.00 H new ATOM 0 HG LEU A 34 11.665 -10.610 3.823 1.00 0.00 H new ATOM 0 HD11 LEU A 34 13.764 -9.389 3.433 1.00 0.00 H new ATOM 0 HD12 LEU A 34 12.334 -8.349 3.223 1.00 0.00 H new ATOM 0 HD13 LEU A 34 13.315 -8.227 4.704 1.00 0.00 H new ATOM 0 HD21 LEU A 34 13.719 -11.260 5.000 1.00 0.00 H new ATOM 0 HD22 LEU A 34 13.267 -10.201 6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 34 12.258 -11.611 5.954 1.00 0.00 H new ATOM 27 N LEU A 35 8.722 -8.339 6.667 1.00 0.00 N ATOM 28 CA LEU A 35 7.513 -7.563 6.934 1.00 0.00 C ATOM 29 C LEU A 35 6.383 -8.003 5.999 1.00 0.00 C ATOM 30 O LEU A 35 6.629 -8.366 4.846 1.00 0.00 O ATOM 31 CB LEU A 35 7.824 -6.071 6.735 1.00 0.00 C ATOM 32 CG LEU A 35 8.562 -5.353 7.887 1.00 0.00 C ATOM 33 CD1 LEU A 35 9.559 -6.264 8.580 1.00 0.00 C ATOM 34 CD2 LEU A 35 9.286 -4.123 7.359 1.00 0.00 C ATOM 0 H LEU A 35 9.552 -7.763 6.528 1.00 0.00 H new ATOM 0 HA LEU A 35 7.188 -7.732 7.961 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.423 -5.967 5.831 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.884 -5.549 6.556 1.00 0.00 H new ATOM 0 HG LEU A 35 7.809 -5.058 8.618 1.00 0.00 H new ATOM 0 HD11 LEU A 35 10.054 -5.718 9.383 1.00 0.00 H new ATOM 0 HD12 LEU A 35 9.037 -7.126 8.996 1.00 0.00 H new ATOM 0 HD13 LEU A 35 10.303 -6.604 7.860 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.803 -3.625 8.179 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.011 -4.424 6.603 1.00 0.00 H new ATOM 0 HD23 LEU A 35 8.563 -3.438 6.916 1.00 0.00 H new ATOM 46 N ARG A 36 5.152 -8.002 6.497 1.00 0.00 N ATOM 47 CA ARG A 36 4.017 -8.463 5.705 1.00 0.00 C ATOM 48 C ARG A 36 3.493 -7.353 4.821 1.00 0.00 C ATOM 49 O ARG A 36 3.362 -6.213 5.249 1.00 0.00 O ATOM 50 CB ARG A 36 2.878 -8.952 6.598 1.00 0.00 C ATOM 51 CG ARG A 36 3.290 -10.029 7.583 1.00 0.00 C ATOM 52 CD ARG A 36 2.250 -10.197 8.675 1.00 0.00 C ATOM 53 NE ARG A 36 2.671 -11.159 9.689 1.00 0.00 N ATOM 54 CZ ARG A 36 3.339 -10.833 10.793 1.00 0.00 C ATOM 55 NH1 ARG A 36 3.737 -9.581 10.996 1.00 0.00 N ATOM 56 NH2 ARG A 36 3.626 -11.767 11.691 1.00 0.00 N ATOM 0 H ARG A 36 4.915 -7.690 7.439 1.00 0.00 H new ATOM 0 HA ARG A 36 4.373 -9.290 5.090 1.00 0.00 H new ATOM 0 HB2 ARG A 36 2.472 -8.104 7.150 1.00 0.00 H new ATOM 0 HB3 ARG A 36 2.075 -9.336 5.969 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.426 -10.974 7.057 1.00 0.00 H new ATOM 0 HG3 ARG A 36 4.251 -9.771 8.028 1.00 0.00 H new ATOM 0 HD2 ARG A 36 2.061 -9.233 9.147 1.00 0.00 H new ATOM 0 HD3 ARG A 36 1.310 -10.525 8.232 1.00 0.00 H new ATOM 0 HE ARG A 36 2.439 -12.141 9.542 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.531 -8.862 10.303 1.00 0.00 H new ATOM 0 HH12 ARG A 36 4.248 -9.340 11.845 1.00 0.00 H new ATOM 0 HH21 ARG A 36 3.335 -12.732 11.534 1.00 0.00 H new ATOM 0 HH22 ARG A 36 4.138 -11.520 12.538 1.00 0.00 H new ATOM 70 N TYR A 37 3.194 -7.684 3.589 1.00 0.00 N ATOM 71 CA TYR A 37 2.522 -6.753 2.715 1.00 0.00 C ATOM 72 C TYR A 37 1.331 -7.457 2.108 1.00 0.00 C ATOM 73 O TYR A 37 1.307 -8.686 2.018 1.00 0.00 O ATOM 74 CB TYR A 37 3.465 -6.217 1.629 1.00 0.00 C ATOM 75 CG TYR A 37 3.228 -6.787 0.253 1.00 0.00 C ATOM 76 CD1 TYR A 37 3.643 -8.066 -0.063 1.00 0.00 C ATOM 77 CD2 TYR A 37 2.583 -6.045 -0.727 1.00 0.00 C ATOM 78 CE1 TYR A 37 3.429 -8.595 -1.311 1.00 0.00 C ATOM 79 CE2 TYR A 37 2.362 -6.571 -1.981 1.00 0.00 C ATOM 80 CZ TYR A 37 2.789 -7.846 -2.265 1.00 0.00 C ATOM 81 OH TYR A 37 2.568 -8.377 -3.503 1.00 0.00 O ATOM 0 H TYR A 37 3.405 -8.589 3.169 1.00 0.00 H new ATOM 0 HA TYR A 37 2.190 -5.887 3.288 1.00 0.00 H new ATOM 0 HB2 TYR A 37 3.363 -5.133 1.581 1.00 0.00 H new ATOM 0 HB3 TYR A 37 4.493 -6.428 1.923 1.00 0.00 H new ATOM 0 HD1 TYR A 37 4.145 -8.661 0.686 1.00 0.00 H new ATOM 0 HD2 TYR A 37 2.250 -5.042 -0.503 1.00 0.00 H new ATOM 0 HE1 TYR A 37 3.763 -9.596 -1.541 1.00 0.00 H new ATOM 0 HE2 TYR A 37 1.857 -5.986 -2.735 1.00 0.00 H new ATOM 0 HH TYR A 37 1.605 -8.400 -3.682 1.00 0.00 H new ATOM 91 N CYS A 38 0.345 -6.696 1.720 1.00 0.00 N ATOM 92 CA CYS A 38 -0.836 -7.260 1.120 1.00 0.00 C ATOM 93 C CYS A 38 -1.626 -6.162 0.454 1.00 0.00 C ATOM 94 O CYS A 38 -1.806 -5.095 1.024 1.00 0.00 O ATOM 95 CB CYS A 38 -1.669 -7.950 2.203 1.00 0.00 C ATOM 96 SG CYS A 38 -2.041 -6.882 3.613 1.00 0.00 S ATOM 0 H CYS A 38 0.335 -5.680 1.808 1.00 0.00 H new ATOM 0 HA CYS A 38 -0.562 -7.999 0.367 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -2.604 -8.299 1.764 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -1.134 -8.832 2.556 1.00 0.00 H new ATOM 0 HG CYS A 38 -2.153 -7.605 4.687 1.00 0.00 H new ATOM 102 N VAL A 39 -2.092 -6.407 -0.746 1.00 0.00 N ATOM 103 CA VAL A 39 -2.890 -5.418 -1.436 1.00 0.00 C ATOM 104 C VAL A 39 -4.263 -6.005 -1.699 1.00 0.00 C ATOM 105 O VAL A 39 -4.394 -7.136 -2.167 1.00 0.00 O ATOM 106 CB VAL A 39 -2.222 -4.903 -2.739 1.00 0.00 C ATOM 107 CG1 VAL A 39 -0.781 -4.500 -2.474 1.00 0.00 C ATOM 108 CG2 VAL A 39 -2.292 -5.927 -3.859 1.00 0.00 C ATOM 0 H VAL A 39 -1.936 -7.273 -1.263 1.00 0.00 H new ATOM 0 HA VAL A 39 -2.981 -4.538 -0.799 1.00 0.00 H new ATOM 0 HB VAL A 39 -2.781 -4.026 -3.066 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.328 -4.141 -3.398 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.757 -3.707 -1.726 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.224 -5.362 -2.107 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.813 -5.524 -4.751 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.779 -6.838 -3.552 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -3.335 -6.155 -4.079 1.00 0.00 H new ATOM 118 N GLN A 40 -5.288 -5.267 -1.350 1.00 0.00 N ATOM 119 CA GLN A 40 -6.615 -5.828 -1.335 1.00 0.00 C ATOM 120 C GLN A 40 -7.596 -4.918 -2.058 1.00 0.00 C ATOM 121 O GLN A 40 -7.338 -3.727 -2.248 1.00 0.00 O ATOM 122 CB GLN A 40 -7.025 -6.087 0.118 1.00 0.00 C ATOM 123 CG GLN A 40 -7.198 -4.834 0.950 1.00 0.00 C ATOM 124 CD GLN A 40 -8.592 -4.269 0.832 1.00 0.00 C ATOM 125 OE1 GLN A 40 -9.550 -5.006 0.646 1.00 0.00 O ATOM 126 NE2 GLN A 40 -8.712 -2.961 0.907 1.00 0.00 N ATOM 0 H GLN A 40 -5.230 -4.286 -1.075 1.00 0.00 H new ATOM 0 HA GLN A 40 -6.625 -6.777 -1.871 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -7.961 -6.646 0.125 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -6.272 -6.720 0.588 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -6.985 -5.060 1.995 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -6.474 -4.084 0.632 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -7.887 -2.381 1.063 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.630 -2.527 0.809 1.00 0.00 H new ATOM 135 N LYS A 41 -8.719 -5.484 -2.458 1.00 0.00 N ATOM 136 CA LYS A 41 -9.683 -4.774 -3.271 1.00 0.00 C ATOM 137 C LYS A 41 -10.808 -4.222 -2.403 1.00 0.00 C ATOM 138 O LYS A 41 -11.588 -4.981 -1.810 1.00 0.00 O ATOM 139 CB LYS A 41 -10.228 -5.700 -4.359 1.00 0.00 C ATOM 140 CG LYS A 41 -11.173 -5.013 -5.334 1.00 0.00 C ATOM 141 CD LYS A 41 -11.769 -5.994 -6.336 1.00 0.00 C ATOM 142 CE LYS A 41 -10.722 -6.556 -7.286 1.00 0.00 C ATOM 143 NZ LYS A 41 -10.105 -5.497 -8.130 1.00 0.00 N ATOM 0 H LYS A 41 -8.986 -6.442 -2.230 1.00 0.00 H new ATOM 0 HA LYS A 41 -9.190 -3.930 -3.754 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.392 -6.123 -4.915 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -10.750 -6.532 -3.887 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -11.976 -4.528 -4.780 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.636 -4.230 -5.869 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -12.246 -6.814 -5.799 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -12.548 -5.494 -6.912 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -9.945 -7.059 -6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -11.182 -7.308 -7.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -9.582 -5.938 -8.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.850 -4.881 -8.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -9.451 -4.930 -7.553 1.00 0.00 H new ATOM 157 N HIS A 42 -10.882 -2.897 -2.350 1.00 0.00 N ATOM 158 CA HIS A 42 -11.833 -2.200 -1.497 1.00 0.00 C ATOM 159 C HIS A 42 -12.949 -1.620 -2.346 1.00 0.00 C ATOM 160 O HIS A 42 -12.881 -0.465 -2.764 1.00 0.00 O ATOM 161 CB HIS A 42 -11.125 -1.072 -0.736 1.00 0.00 C ATOM 162 CG HIS A 42 -11.973 -0.392 0.297 1.00 0.00 C ATOM 163 ND1 HIS A 42 -12.982 0.498 -0.016 1.00 0.00 N ATOM 164 CD2 HIS A 42 -11.953 -0.468 1.647 1.00 0.00 C ATOM 165 CE1 HIS A 42 -13.537 0.938 1.096 1.00 0.00 C ATOM 166 NE2 HIS A 42 -12.933 0.368 2.119 1.00 0.00 N ATOM 0 H HIS A 42 -10.284 -2.278 -2.897 1.00 0.00 H new ATOM 0 HA HIS A 42 -12.252 -2.905 -0.780 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -10.239 -1.479 -0.250 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -10.781 -0.327 -1.453 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -13.255 0.772 -0.960 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -11.288 -1.075 2.244 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -14.350 1.646 1.158 1.00 0.00 H new ATOM 269 N TYR A 49 -9.518 0.100 -4.270 1.00 0.00 N ATOM 270 CA TYR A 49 -8.425 -0.793 -3.931 1.00 0.00 C ATOM 271 C TYR A 49 -7.373 -0.027 -3.130 1.00 0.00 C ATOM 272 O TYR A 49 -7.191 1.175 -3.331 1.00 0.00 O ATOM 273 CB TYR A 49 -7.845 -1.384 -5.233 1.00 0.00 C ATOM 274 CG TYR A 49 -6.364 -1.686 -5.218 1.00 0.00 C ATOM 275 CD1 TYR A 49 -5.874 -2.885 -4.724 1.00 0.00 C ATOM 276 CD2 TYR A 49 -5.456 -0.765 -5.718 1.00 0.00 C ATOM 277 CE1 TYR A 49 -4.518 -3.153 -4.723 1.00 0.00 C ATOM 278 CE2 TYR A 49 -4.105 -1.025 -5.721 1.00 0.00 C ATOM 279 CZ TYR A 49 -3.638 -2.217 -5.222 1.00 0.00 C ATOM 280 OH TYR A 49 -2.284 -2.470 -5.222 1.00 0.00 O ATOM 0 HA TYR A 49 -8.775 -1.617 -3.309 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -8.382 -2.305 -5.462 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -8.046 -0.687 -6.047 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -6.562 -3.621 -4.334 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -5.816 0.174 -6.112 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -4.150 -4.091 -4.333 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -3.414 -0.294 -6.114 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.864 -2.006 -5.976 1.00 0.00 H new ATOM 290 N ASP A 50 -6.715 -0.709 -2.204 1.00 0.00 N ATOM 291 CA ASP A 50 -5.647 -0.097 -1.426 1.00 0.00 C ATOM 292 C ASP A 50 -4.542 -1.103 -1.165 1.00 0.00 C ATOM 293 O ASP A 50 -4.790 -2.295 -0.964 1.00 0.00 O ATOM 294 CB ASP A 50 -6.143 0.512 -0.094 1.00 0.00 C ATOM 295 CG ASP A 50 -7.096 -0.379 0.681 1.00 0.00 C ATOM 296 OD1 ASP A 50 -6.628 -1.237 1.464 1.00 0.00 O ATOM 297 OD2 ASP A 50 -8.324 -0.216 0.521 1.00 0.00 O ATOM 0 H ASP A 50 -6.901 -1.685 -1.973 1.00 0.00 H new ATOM 0 HA ASP A 50 -5.257 0.728 -2.023 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.280 0.735 0.534 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.639 1.460 -0.303 1.00 0.00 H new ATOM 302 N PHE A 51 -3.319 -0.613 -1.214 1.00 0.00 N ATOM 303 CA PHE A 51 -2.147 -1.423 -0.960 1.00 0.00 C ATOM 304 C PHE A 51 -1.780 -1.294 0.510 1.00 0.00 C ATOM 305 O PHE A 51 -1.732 -0.197 1.045 1.00 0.00 O ATOM 306 CB PHE A 51 -1.010 -0.972 -1.900 1.00 0.00 C ATOM 307 CG PHE A 51 0.324 -0.724 -1.246 1.00 0.00 C ATOM 308 CD1 PHE A 51 0.569 0.470 -0.589 1.00 0.00 C ATOM 309 CD2 PHE A 51 1.335 -1.669 -1.308 1.00 0.00 C ATOM 310 CE1 PHE A 51 1.791 0.718 -0.001 1.00 0.00 C ATOM 311 CE2 PHE A 51 2.562 -1.425 -0.725 1.00 0.00 C ATOM 312 CZ PHE A 51 2.790 -0.230 -0.070 1.00 0.00 C ATOM 0 H PHE A 51 -3.111 0.361 -1.432 1.00 0.00 H new ATOM 0 HA PHE A 51 -2.337 -2.477 -1.165 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -0.879 -1.731 -2.671 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -1.322 -0.057 -2.403 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -0.208 1.218 -0.536 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.161 -2.605 -1.817 1.00 0.00 H new ATOM 0 HE1 PHE A 51 1.965 1.652 0.512 1.00 0.00 H new ATOM 0 HE2 PHE A 51 3.344 -2.168 -0.781 1.00 0.00 H new ATOM 0 HZ PHE A 51 3.749 -0.039 0.387 1.00 0.00 H new ATOM 322 N ARG A 52 -1.562 -2.403 1.180 1.00 0.00 N ATOM 323 CA ARG A 52 -1.333 -2.367 2.611 1.00 0.00 C ATOM 324 C ARG A 52 0.063 -2.849 2.964 1.00 0.00 C ATOM 325 O ARG A 52 0.435 -3.997 2.709 1.00 0.00 O ATOM 326 CB ARG A 52 -2.404 -3.177 3.337 1.00 0.00 C ATOM 327 CG ARG A 52 -3.811 -2.717 2.998 1.00 0.00 C ATOM 328 CD ARG A 52 -4.849 -3.380 3.874 1.00 0.00 C ATOM 329 NE ARG A 52 -6.198 -2.931 3.540 1.00 0.00 N ATOM 330 CZ ARG A 52 -7.295 -3.313 4.191 1.00 0.00 C ATOM 331 NH1 ARG A 52 -7.210 -4.156 5.211 1.00 0.00 N ATOM 332 NH2 ARG A 52 -8.477 -2.854 3.817 1.00 0.00 N ATOM 0 H ARG A 52 -1.538 -3.334 0.764 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.404 -1.331 2.942 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -2.297 -4.230 3.077 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -2.248 -3.097 4.413 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -3.877 -1.635 3.113 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.023 -2.939 1.952 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -4.786 -4.462 3.759 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -4.639 -3.158 4.920 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.307 -2.284 2.759 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.301 -4.516 5.501 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -8.054 -4.445 5.706 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.548 -2.208 3.031 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.318 -3.146 4.315 1.00 0.00 H new ATOM 346 N LEU A 53 0.822 -1.943 3.545 1.00 0.00 N ATOM 347 CA LEU A 53 2.204 -2.185 3.910 1.00 0.00 C ATOM 348 C LEU A 53 2.308 -2.354 5.431 1.00 0.00 C ATOM 349 O LEU A 53 2.256 -1.372 6.172 1.00 0.00 O ATOM 350 CB LEU A 53 3.037 -0.983 3.439 1.00 0.00 C ATOM 351 CG LEU A 53 4.528 -1.217 3.209 1.00 0.00 C ATOM 352 CD1 LEU A 53 4.752 -2.133 2.020 1.00 0.00 C ATOM 353 CD2 LEU A 53 5.239 0.110 2.988 1.00 0.00 C ATOM 0 H LEU A 53 0.493 -1.006 3.780 1.00 0.00 H new ATOM 0 HA LEU A 53 2.576 -3.095 3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.605 -0.616 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.929 -0.187 4.176 1.00 0.00 H new ATOM 0 HG LEU A 53 4.940 -1.698 4.096 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.821 -2.286 1.875 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.270 -3.093 2.204 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.326 -1.679 1.125 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.302 -0.069 2.825 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.817 0.608 2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.108 0.743 3.865 1.00 0.00 H new ATOM 365 N GLU A 54 2.411 -3.592 5.903 1.00 0.00 N ATOM 366 CA GLU A 54 2.503 -3.844 7.338 1.00 0.00 C ATOM 367 C GLU A 54 3.902 -3.513 7.827 1.00 0.00 C ATOM 368 O GLU A 54 4.886 -4.123 7.414 1.00 0.00 O ATOM 369 CB GLU A 54 2.094 -5.292 7.669 1.00 0.00 C ATOM 370 CG GLU A 54 2.211 -5.679 9.139 1.00 0.00 C ATOM 371 CD GLU A 54 3.582 -6.203 9.531 1.00 0.00 C ATOM 372 OE1 GLU A 54 3.846 -7.405 9.318 1.00 0.00 O ATOM 373 OE2 GLU A 54 4.386 -5.426 10.076 1.00 0.00 O ATOM 0 H GLU A 54 2.433 -4.429 5.321 1.00 0.00 H new ATOM 0 HA GLU A 54 1.803 -3.195 7.865 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.062 -5.443 7.351 1.00 0.00 H new ATOM 0 HB3 GLU A 54 2.712 -5.971 7.081 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.976 -4.810 9.753 1.00 0.00 H new ATOM 0 HG3 GLU A 54 1.464 -6.440 9.365 1.00 0.00 H new ATOM 380 N LEU A 55 3.970 -2.536 8.708 1.00 0.00 N ATOM 381 CA LEU A 55 5.227 -1.951 9.109 1.00 0.00 C ATOM 382 C LEU A 55 5.604 -2.338 10.530 1.00 0.00 C ATOM 383 O LEU A 55 5.043 -1.813 11.487 1.00 0.00 O ATOM 384 CB LEU A 55 5.113 -0.435 9.042 1.00 0.00 C ATOM 385 CG LEU A 55 6.431 0.293 8.881 1.00 0.00 C ATOM 386 CD1 LEU A 55 6.771 0.408 7.413 1.00 0.00 C ATOM 387 CD2 LEU A 55 6.375 1.659 9.545 1.00 0.00 C ATOM 0 H LEU A 55 3.154 -2.127 9.164 1.00 0.00 H new ATOM 0 HA LEU A 55 5.997 -2.322 8.433 1.00 0.00 H new ATOM 0 HB2 LEU A 55 4.463 -0.170 8.208 1.00 0.00 H new ATOM 0 HB3 LEU A 55 4.626 -0.080 9.951 1.00 0.00 H new ATOM 0 HG LEU A 55 7.218 -0.277 9.375 1.00 0.00 H new ATOM 0 HD11 LEU A 55 7.720 0.932 7.299 1.00 0.00 H new ATOM 0 HD12 LEU A 55 6.853 -0.589 6.979 1.00 0.00 H new ATOM 0 HD13 LEU A 55 5.986 0.964 6.900 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.332 2.165 9.418 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.586 2.254 9.086 1.00 0.00 H new ATOM 0 HD23 LEU A 55 6.167 1.538 10.608 1.00 0.00 H new ATOM 399 N ASP A 56 6.561 -3.241 10.663 1.00 0.00 N ATOM 400 CA ASP A 56 7.155 -3.551 11.964 1.00 0.00 C ATOM 401 C ASP A 56 6.083 -3.956 12.986 1.00 0.00 C ATOM 402 O ASP A 56 6.180 -3.635 14.170 1.00 0.00 O ATOM 403 CB ASP A 56 7.943 -2.330 12.466 1.00 0.00 C ATOM 404 CG ASP A 56 8.902 -2.651 13.598 1.00 0.00 C ATOM 405 OD1 ASP A 56 9.972 -3.234 13.324 1.00 0.00 O ATOM 406 OD2 ASP A 56 8.611 -2.293 14.762 1.00 0.00 O ATOM 0 H ASP A 56 6.948 -3.777 9.886 1.00 0.00 H new ATOM 0 HA ASP A 56 7.830 -4.398 11.846 1.00 0.00 H new ATOM 0 HB2 ASP A 56 8.505 -1.903 11.635 1.00 0.00 H new ATOM 0 HB3 ASP A 56 7.240 -1.567 12.801 1.00 0.00 H new ATOM 411 N GLY A 57 5.051 -4.647 12.520 1.00 0.00 N ATOM 412 CA GLY A 57 4.029 -5.146 13.418 1.00 0.00 C ATOM 413 C GLY A 57 2.794 -4.268 13.468 1.00 0.00 C ATOM 414 O GLY A 57 1.999 -4.353 14.403 1.00 0.00 O ATOM 0 H GLY A 57 4.904 -4.871 11.536 1.00 0.00 H new ATOM 0 HA2 GLY A 57 3.740 -6.150 13.107 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.447 -5.231 14.421 1.00 0.00 H new ATOM 418 N THR A 58 2.627 -3.426 12.463 1.00 0.00 N ATOM 419 CA THR A 58 1.374 -2.716 12.271 1.00 0.00 C ATOM 420 C THR A 58 0.973 -2.790 10.807 1.00 0.00 C ATOM 421 O THR A 58 1.684 -2.297 9.938 1.00 0.00 O ATOM 422 CB THR A 58 1.443 -1.234 12.730 1.00 0.00 C ATOM 423 OG1 THR A 58 0.190 -0.579 12.473 1.00 0.00 O ATOM 424 CG2 THR A 58 2.578 -0.464 12.054 1.00 0.00 C ATOM 0 H THR A 58 3.343 -3.217 11.767 1.00 0.00 H new ATOM 0 HA THR A 58 0.624 -3.202 12.895 1.00 0.00 H new ATOM 0 HB THR A 58 1.646 -1.240 13.801 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.345 0.223 11.932 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.581 0.566 12.410 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.531 -0.935 12.295 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.432 -0.474 10.974 1.00 0.00 H new ATOM 432 N LEU A 59 -0.152 -3.431 10.520 1.00 0.00 N ATOM 433 CA LEU A 59 -0.591 -3.554 9.144 1.00 0.00 C ATOM 434 C LEU A 59 -1.124 -2.218 8.670 1.00 0.00 C ATOM 435 O LEU A 59 -2.296 -1.885 8.860 1.00 0.00 O ATOM 436 CB LEU A 59 -1.640 -4.657 8.992 1.00 0.00 C ATOM 437 CG LEU A 59 -2.173 -4.859 7.570 1.00 0.00 C ATOM 438 CD1 LEU A 59 -1.069 -5.271 6.614 1.00 0.00 C ATOM 439 CD2 LEU A 59 -3.284 -5.885 7.557 1.00 0.00 C ATOM 0 H LEU A 59 -0.765 -3.865 11.210 1.00 0.00 H new ATOM 0 HA LEU A 59 0.259 -3.838 8.523 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.209 -5.596 9.338 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.480 -4.431 9.649 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.571 -3.903 7.231 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.484 -5.405 5.615 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.303 -4.496 6.587 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.626 -6.208 6.952 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.649 -6.014 6.538 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.905 -6.837 7.930 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.100 -5.545 8.194 1.00 0.00 H new ATOM 451 N LYS A 60 -0.247 -1.450 8.054 1.00 0.00 N ATOM 452 CA LYS A 60 -0.581 -0.120 7.628 1.00 0.00 C ATOM 453 C LYS A 60 -1.159 -0.175 6.234 1.00 0.00 C ATOM 454 O LYS A 60 -1.097 -1.208 5.570 1.00 0.00 O ATOM 455 CB LYS A 60 0.644 0.767 7.691 1.00 0.00 C ATOM 456 CG LYS A 60 1.309 0.739 9.050 1.00 0.00 C ATOM 457 CD LYS A 60 2.371 1.792 9.159 1.00 0.00 C ATOM 458 CE LYS A 60 1.806 3.207 9.141 1.00 0.00 C ATOM 459 NZ LYS A 60 0.995 3.503 10.350 1.00 0.00 N ATOM 0 H LYS A 60 0.709 -1.735 7.839 1.00 0.00 H new ATOM 0 HA LYS A 60 -1.331 0.308 8.293 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.359 0.448 6.933 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.360 1.791 7.450 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.560 0.893 9.827 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.749 -0.243 9.222 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.932 1.642 10.082 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.076 1.677 8.335 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.625 3.923 9.071 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.190 3.339 8.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 0.494 4.405 10.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 0.303 2.741 10.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.619 3.570 11.179 1.00 0.00 H new ATOM 473 N SER A 61 -1.714 0.919 5.782 1.00 0.00 N ATOM 474 CA SER A 61 -2.487 0.890 4.557 1.00 0.00 C ATOM 475 C SER A 61 -2.317 2.167 3.757 1.00 0.00 C ATOM 476 O SER A 61 -2.175 3.248 4.318 1.00 0.00 O ATOM 477 CB SER A 61 -3.960 0.646 4.883 1.00 0.00 C ATOM 478 OG SER A 61 -4.124 -0.585 5.580 1.00 0.00 O ATOM 0 H SER A 61 -1.650 1.832 6.232 1.00 0.00 H new ATOM 0 HA SER A 61 -2.117 0.072 3.939 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.344 1.467 5.489 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.543 0.629 3.962 1.00 0.00 H new ATOM 0 HG SER A 61 -4.963 -0.565 6.085 1.00 0.00 H new ATOM 484 N TRP A 62 -2.304 2.017 2.444 1.00 0.00 N ATOM 485 CA TRP A 62 -2.152 3.133 1.530 1.00 0.00 C ATOM 486 C TRP A 62 -3.027 2.922 0.300 1.00 0.00 C ATOM 487 O TRP A 62 -2.771 2.041 -0.521 1.00 0.00 O ATOM 488 CB TRP A 62 -0.679 3.311 1.134 1.00 0.00 C ATOM 489 CG TRP A 62 0.113 4.042 2.165 1.00 0.00 C ATOM 490 CD1 TRP A 62 0.281 5.388 2.251 1.00 0.00 C ATOM 491 CD2 TRP A 62 0.837 3.476 3.263 1.00 0.00 C ATOM 492 NE1 TRP A 62 1.051 5.698 3.341 1.00 0.00 N ATOM 493 CE2 TRP A 62 1.408 4.544 3.975 1.00 0.00 C ATOM 494 CE3 TRP A 62 1.055 2.175 3.714 1.00 0.00 C ATOM 495 CZ2 TRP A 62 2.180 4.352 5.113 1.00 0.00 C ATOM 496 CZ3 TRP A 62 1.823 1.985 4.845 1.00 0.00 C ATOM 497 CH2 TRP A 62 2.376 3.068 5.532 1.00 0.00 C ATOM 0 H TRP A 62 -2.399 1.113 1.981 1.00 0.00 H new ATOM 0 HA TRP A 62 -2.475 4.046 2.031 1.00 0.00 H new ATOM 0 HB2 TRP A 62 -0.232 2.331 0.966 1.00 0.00 H new ATOM 0 HB3 TRP A 62 -0.624 3.852 0.189 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -0.132 6.108 1.561 1.00 0.00 H new ATOM 0 HE1 TRP A 62 1.315 6.640 3.632 1.00 0.00 H new ATOM 0 HE3 TRP A 62 0.631 1.332 3.189 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 2.609 5.187 5.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 1.999 0.982 5.205 1.00 0.00 H new ATOM 0 HH2 TRP A 62 2.972 2.885 6.414 1.00 0.00 H new ATOM 508 N ALA A 63 -4.058 3.738 0.186 1.00 0.00 N ATOM 509 CA ALA A 63 -5.081 3.548 -0.828 1.00 0.00 C ATOM 510 C ALA A 63 -4.771 4.301 -2.112 1.00 0.00 C ATOM 511 O ALA A 63 -3.840 5.099 -2.158 1.00 0.00 O ATOM 512 CB ALA A 63 -6.429 3.984 -0.275 1.00 0.00 C ATOM 0 H ALA A 63 -4.211 4.547 0.789 1.00 0.00 H new ATOM 0 HA ALA A 63 -5.106 2.488 -1.080 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.197 3.842 -1.035 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.673 3.386 0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.385 5.037 0.004 1.00 0.00 H new ATOM 518 N VAL A 64 -5.561 4.020 -3.149 1.00 0.00 N ATOM 519 CA VAL A 64 -5.525 4.762 -4.415 1.00 0.00 C ATOM 520 C VAL A 64 -5.963 6.225 -4.178 1.00 0.00 C ATOM 521 O VAL A 64 -6.229 6.589 -3.030 1.00 0.00 O ATOM 522 CB VAL A 64 -6.434 4.059 -5.450 1.00 0.00 C ATOM 523 CG1 VAL A 64 -5.909 2.666 -5.753 1.00 0.00 C ATOM 524 CG2 VAL A 64 -7.877 4.002 -4.963 1.00 0.00 C ATOM 0 H VAL A 64 -6.249 3.267 -3.137 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.509 4.777 -4.808 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.418 4.642 -6.371 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -6.559 2.183 -6.483 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -4.899 2.738 -6.157 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -5.892 2.076 -4.836 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.494 3.503 -5.710 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.923 3.448 -4.025 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -8.248 5.015 -4.804 1.00 0.00 H new ATOM 534 N PRO A 65 -6.094 7.107 -5.207 1.00 0.00 N ATOM 535 CA PRO A 65 -6.047 6.796 -6.660 1.00 0.00 C ATOM 536 C PRO A 65 -4.742 6.181 -7.171 1.00 0.00 C ATOM 537 O PRO A 65 -3.708 6.217 -6.504 1.00 0.00 O ATOM 538 CB PRO A 65 -6.229 8.169 -7.318 1.00 0.00 C ATOM 539 CG PRO A 65 -6.908 8.995 -6.291 1.00 0.00 C ATOM 540 CD PRO A 65 -6.323 8.548 -4.991 1.00 0.00 C ATOM 0 HA PRO A 65 -6.800 6.042 -6.890 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -5.270 8.601 -7.602 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -6.828 8.096 -8.226 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -6.732 10.058 -6.459 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -7.987 8.843 -6.312 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -5.396 9.074 -4.764 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.004 8.728 -4.159 1.00 0.00 H new ATOM 548 N LYS A 66 -4.840 5.610 -8.376 1.00 0.00 N ATOM 549 CA LYS A 66 -3.693 5.175 -9.178 1.00 0.00 C ATOM 550 C LYS A 66 -3.161 3.798 -8.775 1.00 0.00 C ATOM 551 O LYS A 66 -2.844 3.539 -7.611 1.00 0.00 O ATOM 552 CB LYS A 66 -2.562 6.205 -9.127 1.00 0.00 C ATOM 553 CG LYS A 66 -1.492 5.983 -10.187 1.00 0.00 C ATOM 554 CD LYS A 66 -1.965 6.422 -11.565 1.00 0.00 C ATOM 555 CE LYS A 66 -1.973 7.936 -11.693 1.00 0.00 C ATOM 556 NZ LYS A 66 -0.604 8.505 -11.575 1.00 0.00 N ATOM 0 H LYS A 66 -5.737 5.434 -8.830 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.061 5.090 -10.200 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -2.984 7.203 -9.251 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -2.098 6.175 -8.141 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -0.593 6.537 -9.918 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.221 4.928 -10.215 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.314 5.994 -12.328 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.967 6.035 -11.748 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.403 8.218 -12.654 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.613 8.363 -10.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -0.583 9.451 -12.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -0.343 8.577 -10.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 0.073 7.886 -12.065 1.00 0.00 H new ATOM 570 N GLY A 67 -3.051 2.923 -9.769 1.00 0.00 N ATOM 571 CA GLY A 67 -2.433 1.626 -9.580 1.00 0.00 C ATOM 572 C GLY A 67 -1.115 1.531 -10.332 1.00 0.00 C ATOM 573 O GLY A 67 -0.490 2.557 -10.601 1.00 0.00 O ATOM 0 H GLY A 67 -3.386 3.095 -10.717 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.262 1.453 -8.518 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.109 0.844 -9.926 1.00 0.00 H new ATOM 577 N PRO A 68 -0.669 0.316 -10.696 1.00 0.00 N ATOM 578 CA PRO A 68 0.605 0.111 -11.411 1.00 0.00 C ATOM 579 C PRO A 68 0.668 0.886 -12.729 1.00 0.00 C ATOM 580 O PRO A 68 -0.261 0.821 -13.541 1.00 0.00 O ATOM 581 CB PRO A 68 0.628 -1.398 -11.677 1.00 0.00 C ATOM 582 CG PRO A 68 -0.292 -1.982 -10.662 1.00 0.00 C ATOM 583 CD PRO A 68 -1.367 -0.957 -10.445 1.00 0.00 C ATOM 0 HA PRO A 68 1.456 0.469 -10.831 1.00 0.00 H new ATOM 0 HB2 PRO A 68 0.294 -1.625 -12.689 1.00 0.00 H new ATOM 0 HB3 PRO A 68 1.635 -1.801 -11.575 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -0.715 -2.923 -11.013 1.00 0.00 H new ATOM 0 HG3 PRO A 68 0.236 -2.197 -9.733 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -2.204 -1.100 -11.128 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -1.770 -1.003 -9.433 1.00 0.00 H new ATOM 591 N CYS A 69 1.761 1.617 -12.937 1.00 0.00 N ATOM 592 CA CYS A 69 1.916 2.459 -14.117 1.00 0.00 C ATOM 593 C CYS A 69 3.363 2.437 -14.618 1.00 0.00 C ATOM 594 O CYS A 69 4.129 1.528 -14.288 1.00 0.00 O ATOM 595 CB CYS A 69 1.488 3.894 -13.793 1.00 0.00 C ATOM 596 SG CYS A 69 -0.226 4.049 -13.239 1.00 0.00 S ATOM 0 H CYS A 69 2.556 1.642 -12.298 1.00 0.00 H new ATOM 0 HA CYS A 69 1.278 2.066 -14.908 1.00 0.00 H new ATOM 0 HB2 CYS A 69 2.145 4.291 -13.020 1.00 0.00 H new ATOM 0 HB3 CYS A 69 1.629 4.512 -14.680 1.00 0.00 H new ATOM 0 HG CYS A 69 -0.339 3.568 -12.036 1.00 0.00 H new ATOM 602 N LEU A 70 3.726 3.425 -15.434 1.00 0.00 N ATOM 603 CA LEU A 70 5.083 3.536 -15.968 1.00 0.00 C ATOM 604 C LEU A 70 6.003 4.193 -14.948 1.00 0.00 C ATOM 605 O LEU A 70 6.512 5.295 -15.162 1.00 0.00 O ATOM 606 CB LEU A 70 5.100 4.352 -17.265 1.00 0.00 C ATOM 607 CG LEU A 70 4.426 3.713 -18.490 1.00 0.00 C ATOM 608 CD1 LEU A 70 5.006 2.334 -18.769 1.00 0.00 C ATOM 609 CD2 LEU A 70 2.914 3.633 -18.318 1.00 0.00 C ATOM 0 H LEU A 70 3.095 4.165 -15.742 1.00 0.00 H new ATOM 0 HA LEU A 70 5.438 2.528 -16.182 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.617 5.310 -17.071 1.00 0.00 H new ATOM 0 HB3 LEU A 70 6.138 4.565 -17.520 1.00 0.00 H new ATOM 0 HG LEU A 70 4.630 4.354 -19.348 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.514 1.902 -19.640 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.075 2.421 -18.963 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.845 1.690 -17.904 1.00 0.00 H new ATOM 0 HD21 LEU A 70 2.471 3.176 -19.203 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.679 3.029 -17.441 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.509 4.636 -18.186 1.00 0.00 H new ATOM 621 N ASP A 71 6.203 3.518 -13.835 1.00 0.00 N ATOM 622 CA ASP A 71 7.006 4.050 -12.749 1.00 0.00 C ATOM 623 C ASP A 71 8.443 3.517 -12.810 1.00 0.00 C ATOM 624 O ASP A 71 8.695 2.485 -13.435 1.00 0.00 O ATOM 625 CB ASP A 71 6.344 3.720 -11.401 1.00 0.00 C ATOM 626 CG ASP A 71 5.757 2.317 -11.344 1.00 0.00 C ATOM 627 OD1 ASP A 71 6.529 1.343 -11.271 1.00 0.00 O ATOM 628 OD2 ASP A 71 4.515 2.187 -11.383 1.00 0.00 O ATOM 0 H ASP A 71 5.817 2.591 -13.656 1.00 0.00 H new ATOM 0 HA ASP A 71 7.061 5.134 -12.853 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.081 3.830 -10.606 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.554 4.445 -11.205 1.00 0.00 H new ATOM 633 N PRO A 72 9.418 4.206 -12.167 1.00 0.00 N ATOM 634 CA PRO A 72 9.188 5.409 -11.369 1.00 0.00 C ATOM 635 C PRO A 72 9.119 6.671 -12.191 1.00 0.00 C ATOM 636 O PRO A 72 9.981 6.908 -13.045 1.00 0.00 O ATOM 637 CB PRO A 72 10.414 5.514 -10.467 1.00 0.00 C ATOM 638 CG PRO A 72 11.283 4.341 -10.807 1.00 0.00 C ATOM 639 CD PRO A 72 10.840 3.865 -12.165 1.00 0.00 C ATOM 0 HA PRO A 72 8.234 5.323 -10.848 1.00 0.00 H new ATOM 0 HB2 PRO A 72 10.943 6.452 -10.636 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.127 5.494 -9.416 1.00 0.00 H new ATOM 0 HG2 PRO A 72 12.335 4.627 -10.820 1.00 0.00 H new ATOM 0 HG3 PRO A 72 11.177 3.550 -10.064 1.00 0.00 H new ATOM 0 HD2 PRO A 72 11.380 4.367 -12.968 1.00 0.00 H new ATOM 0 HD3 PRO A 72 11.002 2.795 -12.293 1.00 0.00 H new ATOM 647 N ALA A 73 8.121 7.489 -11.868 1.00 0.00 N ATOM 648 CA ALA A 73 7.887 8.773 -12.511 1.00 0.00 C ATOM 649 C ALA A 73 6.468 9.205 -12.235 1.00 0.00 C ATOM 650 O ALA A 73 6.176 10.386 -12.052 1.00 0.00 O ATOM 651 CB ALA A 73 8.116 8.679 -14.000 1.00 0.00 C ATOM 0 H ALA A 73 7.442 7.272 -11.139 1.00 0.00 H new ATOM 0 HA ALA A 73 8.586 9.506 -12.108 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.935 9.651 -14.458 1.00 0.00 H new ATOM 0 HB2 ALA A 73 9.145 8.374 -14.191 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.434 7.944 -14.427 1.00 0.00 H new ATOM 657 N VAL A 74 5.590 8.222 -12.198 1.00 0.00 N ATOM 658 CA VAL A 74 4.196 8.460 -11.911 1.00 0.00 C ATOM 659 C VAL A 74 3.782 7.778 -10.621 1.00 0.00 C ATOM 660 O VAL A 74 3.007 6.822 -10.627 1.00 0.00 O ATOM 661 CB VAL A 74 3.297 8.010 -13.076 1.00 0.00 C ATOM 662 CG1 VAL A 74 3.387 9.000 -14.227 1.00 0.00 C ATOM 663 CG2 VAL A 74 3.688 6.616 -13.547 1.00 0.00 C ATOM 0 H VAL A 74 5.824 7.243 -12.365 1.00 0.00 H new ATOM 0 HA VAL A 74 4.067 9.535 -11.786 1.00 0.00 H new ATOM 0 HB VAL A 74 2.267 7.978 -12.722 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.746 8.668 -15.043 1.00 0.00 H new ATOM 0 HG12 VAL A 74 3.062 9.983 -13.887 1.00 0.00 H new ATOM 0 HG13 VAL A 74 4.418 9.059 -14.576 1.00 0.00 H new ATOM 0 HG21 VAL A 74 3.041 6.316 -14.371 1.00 0.00 H new ATOM 0 HG22 VAL A 74 4.725 6.623 -13.884 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.579 5.910 -12.724 1.00 0.00 H new ATOM 673 N LYS A 75 4.351 8.265 -9.519 1.00 0.00 N ATOM 674 CA LYS A 75 3.920 7.871 -8.186 1.00 0.00 C ATOM 675 C LYS A 75 2.401 7.731 -8.099 1.00 0.00 C ATOM 676 O LYS A 75 1.647 8.589 -8.559 1.00 0.00 O ATOM 677 CB LYS A 75 4.399 8.875 -7.120 1.00 0.00 C ATOM 678 CG LYS A 75 4.630 10.305 -7.604 1.00 0.00 C ATOM 679 CD LYS A 75 3.395 10.922 -8.238 1.00 0.00 C ATOM 680 CE LYS A 75 3.475 12.441 -8.280 1.00 0.00 C ATOM 681 NZ LYS A 75 4.650 12.926 -9.053 1.00 0.00 N ATOM 0 H LYS A 75 5.117 8.938 -9.528 1.00 0.00 H new ATOM 0 HA LYS A 75 4.373 6.899 -7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 75 3.664 8.899 -6.316 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.329 8.503 -6.691 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.946 10.921 -6.762 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.445 10.311 -8.328 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.276 10.537 -9.251 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.510 10.621 -7.677 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.562 12.838 -8.724 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.528 12.828 -7.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 4.614 13.963 -9.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.525 12.642 -8.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.633 12.512 -10.007 1.00 0.00 H new ATOM 695 N ARG A 76 1.965 6.628 -7.536 1.00 0.00 N ATOM 696 CA ARG A 76 0.559 6.418 -7.277 1.00 0.00 C ATOM 697 C ARG A 76 0.150 7.251 -6.081 1.00 0.00 C ATOM 698 O ARG A 76 0.933 7.411 -5.140 1.00 0.00 O ATOM 699 CB ARG A 76 0.289 4.944 -6.987 1.00 0.00 C ATOM 700 CG ARG A 76 0.761 4.003 -8.080 1.00 0.00 C ATOM 701 CD ARG A 76 0.826 2.572 -7.574 1.00 0.00 C ATOM 702 NE ARG A 76 -0.416 2.170 -6.913 1.00 0.00 N ATOM 703 CZ ARG A 76 -0.558 1.049 -6.209 1.00 0.00 C ATOM 704 NH1 ARG A 76 0.452 0.190 -6.107 1.00 0.00 N ATOM 705 NH2 ARG A 76 -1.712 0.790 -5.612 1.00 0.00 N ATOM 0 H ARG A 76 2.568 5.858 -7.247 1.00 0.00 H new ATOM 0 HA ARG A 76 -0.017 6.714 -8.154 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.779 4.673 -6.052 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -0.782 4.804 -6.838 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.084 4.061 -8.932 1.00 0.00 H new ATOM 0 HG3 ARG A 76 1.745 4.313 -8.432 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.027 1.901 -8.409 1.00 0.00 H new ATOM 0 HD3 ARG A 76 1.658 2.471 -6.877 1.00 0.00 H new ATOM 0 HE ARG A 76 -1.224 2.787 -6.997 1.00 0.00 H new ATOM 0 HH11 ARG A 76 1.339 0.389 -6.569 1.00 0.00 H new ATOM 0 HH12 ARG A 76 0.339 -0.668 -5.567 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -2.487 1.448 -5.693 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -1.825 -0.068 -5.072 1.00 0.00 H new ATOM 719 N LEU A 77 -1.049 7.804 -6.127 1.00 0.00 N ATOM 720 CA LEU A 77 -1.578 8.533 -4.994 1.00 0.00 C ATOM 721 C LEU A 77 -1.876 7.534 -3.885 1.00 0.00 C ATOM 722 O LEU A 77 -2.970 7.002 -3.789 1.00 0.00 O ATOM 723 CB LEU A 77 -2.834 9.317 -5.416 1.00 0.00 C ATOM 724 CG LEU A 77 -3.281 10.435 -4.465 1.00 0.00 C ATOM 725 CD1 LEU A 77 -4.230 11.398 -5.155 1.00 0.00 C ATOM 726 CD2 LEU A 77 -3.903 9.885 -3.219 1.00 0.00 C ATOM 0 H LEU A 77 -1.671 7.761 -6.934 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.855 9.261 -4.627 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.652 9.754 -6.398 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.658 8.612 -5.528 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.386 10.986 -4.176 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.529 12.179 -4.455 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.730 11.850 -6.011 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.114 10.858 -5.494 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.207 10.707 -2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.776 9.288 -3.481 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.179 9.259 -2.697 1.00 0.00 H new ATOM 738 N ALA A 78 -0.872 7.298 -3.052 1.00 0.00 N ATOM 739 CA ALA A 78 -0.965 6.340 -1.970 1.00 0.00 C ATOM 740 C ALA A 78 -1.363 7.042 -0.688 1.00 0.00 C ATOM 741 O ALA A 78 -0.514 7.470 0.084 1.00 0.00 O ATOM 742 CB ALA A 78 0.369 5.622 -1.791 1.00 0.00 C ATOM 0 H ALA A 78 0.031 7.769 -3.112 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.728 5.601 -2.214 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.289 4.904 -0.975 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.627 5.098 -2.712 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.146 6.350 -1.558 1.00 0.00 H new ATOM 748 N VAL A 79 -2.650 7.177 -0.462 1.00 0.00 N ATOM 749 CA VAL A 79 -3.116 7.864 0.723 1.00 0.00 C ATOM 750 C VAL A 79 -2.943 6.987 1.936 1.00 0.00 C ATOM 751 O VAL A 79 -3.384 5.838 1.947 1.00 0.00 O ATOM 752 CB VAL A 79 -4.585 8.301 0.595 1.00 0.00 C ATOM 753 CG1 VAL A 79 -5.207 8.572 1.962 1.00 0.00 C ATOM 754 CG2 VAL A 79 -4.665 9.554 -0.260 1.00 0.00 C ATOM 0 H VAL A 79 -3.386 6.825 -1.074 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.512 8.764 0.836 1.00 0.00 H new ATOM 0 HB VAL A 79 -5.143 7.491 0.126 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.245 8.879 1.835 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.168 7.665 2.566 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -4.653 9.366 2.463 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.705 9.866 -0.352 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.087 10.351 0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.260 9.345 -1.250 1.00 0.00 H new ATOM 764 N GLN A 80 -2.273 7.532 2.941 1.00 0.00 N ATOM 765 CA GLN A 80 -2.044 6.816 4.171 1.00 0.00 C ATOM 766 C GLN A 80 -3.380 6.563 4.846 1.00 0.00 C ATOM 767 O GLN A 80 -3.956 7.432 5.504 1.00 0.00 O ATOM 768 CB GLN A 80 -1.081 7.604 5.057 1.00 0.00 C ATOM 769 CG GLN A 80 -0.719 6.909 6.360 1.00 0.00 C ATOM 770 CD GLN A 80 0.466 7.553 7.055 1.00 0.00 C ATOM 771 OE1 GLN A 80 0.711 8.753 6.920 1.00 0.00 O ATOM 772 NE2 GLN A 80 1.210 6.759 7.806 1.00 0.00 N ATOM 0 H GLN A 80 -1.880 8.473 2.921 1.00 0.00 H new ATOM 0 HA GLN A 80 -1.578 5.850 3.975 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.167 7.799 4.496 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -1.526 8.572 5.287 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.580 6.926 7.028 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.492 5.862 6.158 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.974 5.770 7.892 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.020 7.135 8.299 1.00 0.00 H new ATOM 781 N VAL A 81 -3.851 5.354 4.649 1.00 0.00 N ATOM 782 CA VAL A 81 -5.181 4.948 5.026 1.00 0.00 C ATOM 783 C VAL A 81 -5.129 4.205 6.366 1.00 0.00 C ATOM 784 O VAL A 81 -4.042 3.832 6.809 1.00 0.00 O ATOM 785 CB VAL A 81 -5.800 4.112 3.865 1.00 0.00 C ATOM 786 CG1 VAL A 81 -6.627 2.933 4.340 1.00 0.00 C ATOM 787 CG2 VAL A 81 -6.632 5.011 2.961 1.00 0.00 C ATOM 0 H VAL A 81 -3.307 4.610 4.212 1.00 0.00 H new ATOM 0 HA VAL A 81 -5.833 5.808 5.180 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.964 3.692 3.306 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -7.026 2.398 3.478 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -6.000 2.261 4.926 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.451 3.291 4.958 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.060 4.418 2.153 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -7.434 5.468 3.541 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.998 5.792 2.541 1.00 0.00 H new ATOM 797 N GLU A 82 -6.284 4.035 7.013 1.00 0.00 N ATOM 798 CA GLU A 82 -6.368 3.480 8.369 1.00 0.00 C ATOM 799 C GLU A 82 -5.465 2.275 8.601 1.00 0.00 C ATOM 800 O GLU A 82 -5.208 1.469 7.705 1.00 0.00 O ATOM 801 CB GLU A 82 -7.799 3.077 8.687 1.00 0.00 C ATOM 802 CG GLU A 82 -8.757 4.245 8.712 1.00 0.00 C ATOM 803 CD GLU A 82 -10.178 3.819 9.007 1.00 0.00 C ATOM 804 OE1 GLU A 82 -10.888 3.408 8.063 1.00 0.00 O ATOM 805 OE2 GLU A 82 -10.594 3.888 10.182 1.00 0.00 O ATOM 0 H GLU A 82 -7.190 4.278 6.612 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.026 4.276 9.030 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -8.139 2.353 7.946 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.822 2.577 9.655 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.432 4.962 9.466 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.726 4.757 7.750 1.00 0.00 H new ATOM 812 N ASP A 83 -5.029 2.156 9.839 1.00 0.00 N ATOM 813 CA ASP A 83 -4.151 1.070 10.251 1.00 0.00 C ATOM 814 C ASP A 83 -4.974 -0.136 10.650 1.00 0.00 C ATOM 815 O ASP A 83 -5.653 -0.133 11.678 1.00 0.00 O ATOM 816 CB ASP A 83 -3.246 1.499 11.408 1.00 0.00 C ATOM 817 CG ASP A 83 -2.046 2.298 10.944 1.00 0.00 C ATOM 818 OD1 ASP A 83 -2.233 3.411 10.407 1.00 0.00 O ATOM 819 OD2 ASP A 83 -0.906 1.813 11.104 1.00 0.00 O ATOM 0 H ASP A 83 -5.270 2.805 10.588 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.514 0.807 9.406 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -3.824 2.095 12.114 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.903 0.614 11.944 1.00 0.00 H new ATOM 824 N HIS A 84 -4.923 -1.156 9.822 1.00 0.00 N ATOM 825 CA HIS A 84 -5.754 -2.330 9.996 1.00 0.00 C ATOM 826 C HIS A 84 -5.047 -3.388 10.843 1.00 0.00 C ATOM 827 O HIS A 84 -3.818 -3.434 10.889 1.00 0.00 O ATOM 828 CB HIS A 84 -6.140 -2.881 8.622 1.00 0.00 C ATOM 829 CG HIS A 84 -7.014 -1.942 7.842 1.00 0.00 C ATOM 830 ND1 HIS A 84 -6.551 -1.152 6.806 1.00 0.00 N ATOM 831 CD2 HIS A 84 -8.330 -1.656 7.966 1.00 0.00 C ATOM 832 CE1 HIS A 84 -7.547 -0.426 6.331 1.00 0.00 C ATOM 833 NE2 HIS A 84 -8.634 -0.714 7.018 1.00 0.00 N ATOM 0 H HIS A 84 -4.306 -1.197 9.011 1.00 0.00 H new ATOM 0 HA HIS A 84 -6.660 -2.050 10.533 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -5.235 -3.086 8.051 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -6.659 -3.831 8.749 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -9.015 -2.090 8.680 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.482 0.283 5.518 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -9.555 -0.302 6.868 1.00 0.00 H new ATOM 842 N PRO A 85 -5.825 -4.230 11.549 1.00 0.00 N ATOM 843 CA PRO A 85 -5.288 -5.315 12.387 1.00 0.00 C ATOM 844 C PRO A 85 -4.409 -6.288 11.601 1.00 0.00 C ATOM 845 O PRO A 85 -4.674 -6.585 10.433 1.00 0.00 O ATOM 846 CB PRO A 85 -6.541 -6.032 12.908 1.00 0.00 C ATOM 847 CG PRO A 85 -7.658 -5.568 12.037 1.00 0.00 C ATOM 848 CD PRO A 85 -7.294 -4.181 11.604 1.00 0.00 C ATOM 0 HA PRO A 85 -4.645 -4.926 13.176 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -6.425 -7.114 12.853 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.729 -5.784 13.953 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.781 -6.226 11.177 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.603 -5.572 12.579 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -7.727 -3.934 10.635 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.647 -3.431 12.312 1.00 0.00 H new ATOM 856 N LEU A 86 -3.372 -6.791 12.264 1.00 0.00 N ATOM 857 CA LEU A 86 -2.382 -7.658 11.633 1.00 0.00 C ATOM 858 C LEU A 86 -3.005 -8.928 11.074 1.00 0.00 C ATOM 859 O LEU A 86 -3.755 -9.617 11.766 1.00 0.00 O ATOM 860 CB LEU A 86 -1.283 -8.038 12.633 1.00 0.00 C ATOM 861 CG LEU A 86 -0.353 -6.902 13.062 1.00 0.00 C ATOM 862 CD1 LEU A 86 0.677 -7.402 14.059 1.00 0.00 C ATOM 863 CD2 LEU A 86 0.340 -6.302 11.856 1.00 0.00 C ATOM 0 H LEU A 86 -3.194 -6.610 13.252 1.00 0.00 H new ATOM 0 HA LEU A 86 -1.953 -7.094 10.805 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.756 -8.452 13.524 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -0.678 -8.832 12.195 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.956 -6.130 13.541 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.329 -6.579 14.352 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.170 -7.794 14.940 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.273 -8.192 13.601 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.998 -5.495 12.179 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.928 -7.071 11.354 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.406 -5.908 11.166 1.00 0.00 H new ATOM 875 N ASP A 87 -2.695 -9.202 9.804 1.00 0.00 N ATOM 876 CA ASP A 87 -3.044 -10.463 9.138 1.00 0.00 C ATOM 877 C ASP A 87 -4.526 -10.537 8.760 1.00 0.00 C ATOM 878 O ASP A 87 -4.929 -11.394 7.980 1.00 0.00 O ATOM 879 CB ASP A 87 -2.648 -11.666 10.008 1.00 0.00 C ATOM 880 CG ASP A 87 -2.810 -12.990 9.290 1.00 0.00 C ATOM 881 OD1 ASP A 87 -1.926 -13.342 8.478 1.00 0.00 O ATOM 882 OD2 ASP A 87 -3.819 -13.685 9.528 1.00 0.00 O ATOM 0 H ASP A 87 -2.191 -8.550 9.203 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.476 -10.496 8.208 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.611 -11.554 10.324 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -3.258 -11.671 10.912 1.00 0.00 H new ATOM 887 N TYR A 88 -5.328 -9.607 9.264 1.00 0.00 N ATOM 888 CA TYR A 88 -6.767 -9.604 8.989 1.00 0.00 C ATOM 889 C TYR A 88 -7.052 -8.946 7.644 1.00 0.00 C ATOM 890 O TYR A 88 -8.138 -8.428 7.388 1.00 0.00 O ATOM 891 CB TYR A 88 -7.501 -8.883 10.115 1.00 0.00 C ATOM 892 CG TYR A 88 -9.007 -9.063 10.090 1.00 0.00 C ATOM 893 CD1 TYR A 88 -9.576 -10.329 10.002 1.00 0.00 C ATOM 894 CD2 TYR A 88 -9.856 -7.965 10.163 1.00 0.00 C ATOM 895 CE1 TYR A 88 -10.949 -10.492 9.985 1.00 0.00 C ATOM 896 CE2 TYR A 88 -11.229 -8.122 10.148 1.00 0.00 C ATOM 897 CZ TYR A 88 -11.769 -9.386 10.059 1.00 0.00 C ATOM 898 OH TYR A 88 -13.136 -9.543 10.041 1.00 0.00 O ATOM 0 H TYR A 88 -5.011 -8.845 9.864 1.00 0.00 H new ATOM 0 HA TYR A 88 -7.125 -10.632 8.939 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -7.119 -9.242 11.071 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -7.272 -7.819 10.060 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.936 -11.197 9.946 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -9.436 -6.973 10.233 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -11.377 -11.481 9.914 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -11.875 -7.258 10.206 1.00 0.00 H new ATOM 0 HH TYR A 88 -13.567 -8.665 10.102 1.00 0.00 H new ATOM 908 N ALA A 89 -6.053 -8.980 6.793 1.00 0.00 N ATOM 909 CA ALA A 89 -6.159 -8.455 5.442 1.00 0.00 C ATOM 910 C ALA A 89 -6.965 -9.397 4.559 1.00 0.00 C ATOM 911 O ALA A 89 -7.407 -9.018 3.477 1.00 0.00 O ATOM 912 CB ALA A 89 -4.772 -8.247 4.857 1.00 0.00 C ATOM 0 H ALA A 89 -5.138 -9.373 7.014 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.677 -7.497 5.482 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -4.860 -7.853 3.844 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.219 -7.540 5.475 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -4.241 -9.199 4.832 1.00 0.00 H new ATOM 918 N ASP A 90 -7.146 -10.628 5.034 1.00 0.00 N ATOM 919 CA ASP A 90 -7.869 -11.652 4.284 1.00 0.00 C ATOM 920 C ASP A 90 -9.278 -11.205 3.950 1.00 0.00 C ATOM 921 O ASP A 90 -9.681 -11.198 2.787 1.00 0.00 O ATOM 922 CB ASP A 90 -7.960 -12.955 5.074 1.00 0.00 C ATOM 923 CG ASP A 90 -6.628 -13.641 5.250 1.00 0.00 C ATOM 924 OD1 ASP A 90 -6.149 -14.278 4.291 1.00 0.00 O ATOM 925 OD2 ASP A 90 -6.058 -13.556 6.352 1.00 0.00 O ATOM 0 H ASP A 90 -6.799 -10.941 5.941 1.00 0.00 H new ATOM 0 HA ASP A 90 -7.308 -11.814 3.364 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -8.386 -12.748 6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -8.645 -13.633 4.565 1.00 0.00 H new ATOM 930 N PHE A 91 -10.032 -10.850 4.976 1.00 0.00 N ATOM 931 CA PHE A 91 -11.445 -10.572 4.803 1.00 0.00 C ATOM 932 C PHE A 91 -11.889 -9.422 5.695 1.00 0.00 C ATOM 933 O PHE A 91 -11.696 -9.463 6.908 1.00 0.00 O ATOM 934 CB PHE A 91 -12.249 -11.832 5.135 1.00 0.00 C ATOM 935 CG PHE A 91 -13.614 -11.872 4.514 1.00 0.00 C ATOM 936 CD1 PHE A 91 -14.648 -11.106 5.021 1.00 0.00 C ATOM 937 CD2 PHE A 91 -13.860 -12.689 3.424 1.00 0.00 C ATOM 938 CE1 PHE A 91 -15.904 -11.155 4.450 1.00 0.00 C ATOM 939 CE2 PHE A 91 -15.112 -12.740 2.849 1.00 0.00 C ATOM 940 CZ PHE A 91 -16.136 -11.972 3.364 1.00 0.00 C ATOM 0 H PHE A 91 -9.691 -10.748 5.932 1.00 0.00 H new ATOM 0 HA PHE A 91 -11.622 -10.281 3.767 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -11.687 -12.706 4.806 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -12.352 -11.909 6.217 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -14.471 -10.464 5.871 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -13.062 -13.294 3.019 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -16.705 -10.553 4.854 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -15.291 -13.380 1.997 1.00 0.00 H new ATOM 0 HZ PHE A 91 -17.118 -12.011 2.917 1.00 0.00 H new ATOM 950 N GLU A 92 -12.479 -8.397 5.098 1.00 0.00 N ATOM 951 CA GLU A 92 -13.085 -7.326 5.871 1.00 0.00 C ATOM 952 C GLU A 92 -14.572 -7.236 5.568 1.00 0.00 C ATOM 953 O GLU A 92 -15.411 -7.321 6.469 1.00 0.00 O ATOM 954 CB GLU A 92 -12.401 -5.991 5.605 1.00 0.00 C ATOM 955 CG GLU A 92 -11.008 -5.929 6.195 1.00 0.00 C ATOM 956 CD GLU A 92 -10.344 -4.582 6.015 1.00 0.00 C ATOM 957 OE1 GLU A 92 -10.609 -3.901 5.007 1.00 0.00 O ATOM 958 OE2 GLU A 92 -9.552 -4.194 6.898 1.00 0.00 O ATOM 0 H GLU A 92 -12.550 -8.285 4.087 1.00 0.00 H new ATOM 0 HA GLU A 92 -12.954 -7.558 6.928 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -12.345 -5.822 4.530 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -13.006 -5.186 6.023 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -11.060 -6.162 7.259 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -10.389 -6.697 5.731 1.00 0.00 H new ATOM 965 N GLY A 93 -14.887 -7.069 4.295 1.00 0.00 N ATOM 966 CA GLY A 93 -16.263 -7.055 3.853 1.00 0.00 C ATOM 967 C GLY A 93 -16.515 -8.120 2.808 1.00 0.00 C ATOM 968 O GLY A 93 -15.576 -8.579 2.177 1.00 0.00 O ATOM 0 H GLY A 93 -14.202 -6.941 3.550 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -16.923 -7.216 4.706 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -16.505 -6.075 3.442 1.00 0.00 H new ATOM 1103 N ASP A 104 -18.249 -4.839 -1.456 1.00 0.00 N ATOM 1104 CA ASP A 104 -17.450 -5.026 -0.231 1.00 0.00 C ATOM 1105 C ASP A 104 -15.978 -5.242 -0.574 1.00 0.00 C ATOM 1106 O ASP A 104 -15.527 -4.796 -1.627 1.00 0.00 O ATOM 1107 CB ASP A 104 -17.990 -6.100 0.710 1.00 0.00 C ATOM 1108 CG ASP A 104 -19.047 -5.548 1.654 1.00 0.00 C ATOM 1109 OD1 ASP A 104 -18.674 -4.985 2.705 1.00 0.00 O ATOM 1110 OD2 ASP A 104 -20.254 -5.670 1.354 1.00 0.00 O ATOM 0 HA ASP A 104 -17.538 -4.099 0.336 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -18.416 -6.915 0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -17.169 -6.520 1.291 1.00 0.00 H new ATOM 1115 N VAL A 105 -15.221 -5.904 0.300 1.00 0.00 N ATOM 1116 CA VAL A 105 -13.786 -5.655 0.347 1.00 0.00 C ATOM 1117 C VAL A 105 -12.978 -6.782 1.007 1.00 0.00 C ATOM 1118 O VAL A 105 -13.171 -7.084 2.182 1.00 0.00 O ATOM 1119 CB VAL A 105 -13.592 -4.333 1.127 1.00 0.00 C ATOM 1120 CG1 VAL A 105 -14.559 -4.280 2.304 1.00 0.00 C ATOM 1121 CG2 VAL A 105 -12.169 -4.166 1.616 1.00 0.00 C ATOM 0 H VAL A 105 -15.566 -6.596 0.965 1.00 0.00 H new ATOM 0 HA VAL A 105 -13.409 -5.598 -0.674 1.00 0.00 H new ATOM 0 HB VAL A 105 -13.801 -3.511 0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -14.418 -3.347 2.849 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -15.584 -4.333 1.936 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -14.368 -5.122 2.970 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -12.079 -3.225 2.158 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -11.913 -4.992 2.279 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -11.490 -4.160 0.764 1.00 0.00 H new ATOM 1131 N ILE A 106 -12.051 -7.393 0.261 1.00 0.00 N ATOM 1132 CA ILE A 106 -11.136 -8.380 0.853 1.00 0.00 C ATOM 1133 C ILE A 106 -9.782 -8.359 0.177 1.00 0.00 C ATOM 1134 O ILE A 106 -9.517 -7.556 -0.719 1.00 0.00 O ATOM 1135 CB ILE A 106 -11.623 -9.865 0.821 1.00 0.00 C ATOM 1136 CG1 ILE A 106 -11.433 -10.512 -0.568 1.00 0.00 C ATOM 1137 CG2 ILE A 106 -13.064 -10.003 1.276 1.00 0.00 C ATOM 1138 CD1 ILE A 106 -12.077 -9.760 -1.699 1.00 0.00 C ATOM 0 H ILE A 106 -11.914 -7.227 -0.736 1.00 0.00 H new ATOM 0 HA ILE A 106 -11.089 -8.063 1.895 1.00 0.00 H new ATOM 0 HB ILE A 106 -10.993 -10.403 1.529 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -10.366 -10.603 -0.770 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -11.839 -11.523 -0.543 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -13.359 -11.052 1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -13.159 -9.637 2.298 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -13.710 -9.420 0.620 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -11.893 -10.285 -2.636 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -13.151 -9.692 -1.526 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.654 -8.757 -1.756 1.00 0.00 H new ATOM 1150 N VAL A 107 -8.969 -9.308 0.591 1.00 0.00 N ATOM 1151 CA VAL A 107 -7.637 -9.503 0.087 1.00 0.00 C ATOM 1152 C VAL A 107 -7.659 -9.844 -1.400 1.00 0.00 C ATOM 1153 O VAL A 107 -8.612 -10.443 -1.906 1.00 0.00 O ATOM 1154 CB VAL A 107 -6.939 -10.626 0.882 1.00 0.00 C ATOM 1155 CG1 VAL A 107 -7.340 -12.009 0.380 1.00 0.00 C ATOM 1156 CG2 VAL A 107 -5.428 -10.450 0.865 1.00 0.00 C ATOM 0 H VAL A 107 -9.230 -9.983 1.310 1.00 0.00 H new ATOM 0 HA VAL A 107 -7.080 -8.574 0.211 1.00 0.00 H new ATOM 0 HB VAL A 107 -7.275 -10.549 1.916 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -6.827 -12.772 0.966 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -8.418 -12.136 0.484 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -7.063 -12.110 -0.669 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.962 -11.255 1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -5.070 -10.477 -0.164 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -5.168 -9.491 1.314 1.00 0.00 H new ATOM 1166 N TRP A 108 -6.626 -9.437 -2.098 1.00 0.00 N ATOM 1167 CA TRP A 108 -6.501 -9.740 -3.505 1.00 0.00 C ATOM 1168 C TRP A 108 -5.131 -10.344 -3.751 1.00 0.00 C ATOM 1169 O TRP A 108 -4.978 -11.305 -4.500 1.00 0.00 O ATOM 1170 CB TRP A 108 -6.677 -8.470 -4.329 1.00 0.00 C ATOM 1171 CG TRP A 108 -6.548 -8.688 -5.807 1.00 0.00 C ATOM 1172 CD1 TRP A 108 -7.471 -9.260 -6.632 1.00 0.00 C ATOM 1173 CD2 TRP A 108 -5.433 -8.336 -6.638 1.00 0.00 C ATOM 1174 NE1 TRP A 108 -6.996 -9.293 -7.920 1.00 0.00 N ATOM 1175 CE2 TRP A 108 -5.749 -8.729 -7.950 1.00 0.00 C ATOM 1176 CE3 TRP A 108 -4.199 -7.728 -6.396 1.00 0.00 C ATOM 1177 CZ2 TRP A 108 -4.876 -8.533 -9.017 1.00 0.00 C ATOM 1178 CZ3 TRP A 108 -3.333 -7.533 -7.456 1.00 0.00 C ATOM 1179 CH2 TRP A 108 -3.675 -7.933 -8.751 1.00 0.00 C ATOM 0 H TRP A 108 -5.855 -8.892 -1.712 1.00 0.00 H new ATOM 0 HA TRP A 108 -7.272 -10.450 -3.803 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -7.658 -8.043 -4.118 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -5.935 -7.736 -4.013 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -8.435 -9.633 -6.318 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -7.492 -9.676 -8.725 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -3.926 -7.416 -5.399 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -5.137 -8.843 -10.018 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -2.376 -7.064 -7.281 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -2.977 -7.765 -9.558 1.00 0.00 H new ATOM 1190 N ASP A 109 -4.144 -9.754 -3.100 1.00 0.00 N ATOM 1191 CA ASP A 109 -2.778 -10.236 -3.128 1.00 0.00 C ATOM 1192 C ASP A 109 -2.149 -10.064 -1.751 1.00 0.00 C ATOM 1193 O ASP A 109 -2.471 -9.127 -1.025 1.00 0.00 O ATOM 1194 CB ASP A 109 -1.982 -9.498 -4.205 1.00 0.00 C ATOM 1195 CG ASP A 109 -0.499 -9.452 -3.916 1.00 0.00 C ATOM 1196 OD1 ASP A 109 -0.053 -8.508 -3.245 1.00 0.00 O ATOM 1197 OD2 ASP A 109 0.223 -10.360 -4.362 1.00 0.00 O ATOM 0 H ASP A 109 -4.272 -8.917 -2.531 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.767 -11.297 -3.378 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -2.144 -9.985 -5.167 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.361 -8.480 -4.295 1.00 0.00 H new ATOM 1202 N ARG A 110 -1.288 -10.992 -1.389 1.00 0.00 N ATOM 1203 CA ARG A 110 -0.654 -10.997 -0.078 1.00 0.00 C ATOM 1204 C ARG A 110 0.754 -11.572 -0.179 1.00 0.00 C ATOM 1205 O ARG A 110 1.006 -12.443 -1.016 1.00 0.00 O ATOM 1206 CB ARG A 110 -1.512 -11.823 0.893 1.00 0.00 C ATOM 1207 CG ARG A 110 -0.716 -12.607 1.931 1.00 0.00 C ATOM 1208 CD ARG A 110 -0.797 -11.978 3.311 1.00 0.00 C ATOM 1209 NE ARG A 110 -2.109 -12.184 3.921 1.00 0.00 N ATOM 1210 CZ ARG A 110 -2.301 -12.440 5.215 1.00 0.00 C ATOM 1211 NH1 ARG A 110 -1.273 -12.496 6.051 1.00 0.00 N ATOM 1212 NH2 ARG A 110 -3.526 -12.648 5.673 1.00 0.00 N ATOM 0 H ARG A 110 -1.005 -11.765 -1.991 1.00 0.00 H new ATOM 0 HA ARG A 110 -0.576 -9.976 0.297 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.199 -11.153 1.410 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.120 -12.521 0.317 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -1.091 -13.630 1.977 1.00 0.00 H new ATOM 0 HG3 ARG A 110 0.327 -12.663 1.620 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -0.026 -12.406 3.952 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -0.593 -10.910 3.237 1.00 0.00 H new ATOM 0 HE ARG A 110 -2.930 -12.128 3.318 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -0.326 -12.343 5.705 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -1.430 -12.692 7.040 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.322 -12.612 5.036 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -3.674 -12.844 6.663 1.00 0.00 H new ATOM 1226 N GLY A 111 1.664 -11.078 0.659 1.00 0.00 N ATOM 1227 CA GLY A 111 3.009 -11.608 0.695 1.00 0.00 C ATOM 1228 C GLY A 111 3.908 -10.875 1.672 1.00 0.00 C ATOM 1229 O GLY A 111 3.479 -10.485 2.759 1.00 0.00 O ATOM 0 H GLY A 111 1.488 -10.317 1.315 1.00 0.00 H new ATOM 0 HA2 GLY A 111 2.971 -12.663 0.966 1.00 0.00 H new ATOM 0 HA3 GLY A 111 3.443 -11.551 -0.303 1.00 0.00 H new ATOM 1233 N ALA A 112 5.152 -10.673 1.271 1.00 0.00 N ATOM 1234 CA ALA A 112 6.137 -10.009 2.111 1.00 0.00 C ATOM 1235 C ALA A 112 6.674 -8.768 1.428 1.00 0.00 C ATOM 1236 O ALA A 112 6.584 -8.638 0.208 1.00 0.00 O ATOM 1237 CB ALA A 112 7.288 -10.947 2.415 1.00 0.00 C ATOM 0 H ALA A 112 5.507 -10.962 0.360 1.00 0.00 H new ATOM 0 HA ALA A 112 5.646 -9.721 3.041 1.00 0.00 H new ATOM 0 HB1 ALA A 112 8.017 -10.436 3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.912 -11.827 2.936 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.764 -11.253 1.483 1.00 0.00 H new ATOM 1243 N TRP A 113 7.237 -7.860 2.205 1.00 0.00 N ATOM 1244 CA TRP A 113 7.911 -6.718 1.626 1.00 0.00 C ATOM 1245 C TRP A 113 9.225 -6.453 2.329 1.00 0.00 C ATOM 1246 O TRP A 113 9.348 -6.581 3.550 1.00 0.00 O ATOM 1247 CB TRP A 113 7.035 -5.463 1.605 1.00 0.00 C ATOM 1248 CG TRP A 113 6.739 -4.852 2.940 1.00 0.00 C ATOM 1249 CD1 TRP A 113 5.766 -5.221 3.814 1.00 0.00 C ATOM 1250 CD2 TRP A 113 7.401 -3.728 3.533 1.00 0.00 C ATOM 1251 NE1 TRP A 113 5.773 -4.395 4.905 1.00 0.00 N ATOM 1252 CE2 TRP A 113 6.769 -3.473 4.758 1.00 0.00 C ATOM 1253 CE3 TRP A 113 8.464 -2.918 3.148 1.00 0.00 C ATOM 1254 CZ2 TRP A 113 7.161 -2.434 5.594 1.00 0.00 C ATOM 1255 CZ3 TRP A 113 8.857 -1.887 3.978 1.00 0.00 C ATOM 1256 CH2 TRP A 113 8.205 -1.653 5.187 1.00 0.00 C ATOM 0 H TRP A 113 7.240 -7.892 3.225 1.00 0.00 H new ATOM 0 HA TRP A 113 8.119 -6.969 0.586 1.00 0.00 H new ATOM 0 HB2 TRP A 113 7.523 -4.713 0.983 1.00 0.00 H new ATOM 0 HB3 TRP A 113 6.090 -5.711 1.122 1.00 0.00 H new ATOM 0 HD1 TRP A 113 5.085 -6.047 3.669 1.00 0.00 H new ATOM 0 HE1 TRP A 113 5.137 -4.458 5.700 1.00 0.00 H new ATOM 0 HE3 TRP A 113 8.975 -3.093 2.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 6.658 -2.251 6.532 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 9.681 -1.253 3.686 1.00 0.00 H new ATOM 0 HH2 TRP A 113 8.532 -0.837 5.815 1.00 0.00 H new ATOM 1267 N THR A 114 10.201 -6.108 1.529 1.00 0.00 N ATOM 1268 CA THR A 114 11.546 -5.878 1.996 1.00 0.00 C ATOM 1269 C THR A 114 11.861 -4.396 2.122 1.00 0.00 C ATOM 1270 O THR A 114 11.729 -3.651 1.163 1.00 0.00 O ATOM 1271 CB THR A 114 12.539 -6.508 1.017 1.00 0.00 C ATOM 1272 OG1 THR A 114 12.413 -7.931 1.054 1.00 0.00 O ATOM 1273 CG2 THR A 114 13.963 -6.071 1.320 1.00 0.00 C ATOM 0 H THR A 114 10.084 -5.977 0.524 1.00 0.00 H new ATOM 0 HA THR A 114 11.632 -6.331 2.984 1.00 0.00 H new ATOM 0 HB THR A 114 12.306 -6.163 0.010 1.00 0.00 H new ATOM 0 HG1 THR A 114 13.049 -8.332 0.425 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.645 -6.535 0.608 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.036 -4.986 1.239 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.230 -6.378 2.331 1.00 0.00 H new ATOM 1281 N PRO A 115 12.277 -3.937 3.304 1.00 0.00 N ATOM 1282 CA PRO A 115 12.792 -2.584 3.450 1.00 0.00 C ATOM 1283 C PRO A 115 14.116 -2.422 2.696 1.00 0.00 C ATOM 1284 O PRO A 115 15.090 -3.117 2.988 1.00 0.00 O ATOM 1285 CB PRO A 115 13.019 -2.436 4.954 1.00 0.00 C ATOM 1286 CG PRO A 115 13.066 -3.825 5.501 1.00 0.00 C ATOM 1287 CD PRO A 115 12.263 -4.687 4.570 1.00 0.00 C ATOM 0 HA PRO A 115 12.112 -1.834 3.046 1.00 0.00 H new ATOM 0 HB2 PRO A 115 13.949 -1.905 5.158 1.00 0.00 H new ATOM 0 HB3 PRO A 115 12.216 -1.862 5.415 1.00 0.00 H new ATOM 0 HG2 PRO A 115 14.095 -4.180 5.566 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.654 -3.857 6.509 1.00 0.00 H new ATOM 0 HD2 PRO A 115 12.708 -5.675 4.455 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.247 -4.835 4.937 1.00 0.00 H new ATOM 1295 N LEU A 116 14.149 -1.514 1.724 1.00 0.00 N ATOM 1296 CA LEU A 116 15.386 -1.239 0.995 1.00 0.00 C ATOM 1297 C LEU A 116 16.238 -0.306 1.832 1.00 0.00 C ATOM 1298 O LEU A 116 17.464 -0.410 1.870 1.00 0.00 O ATOM 1299 CB LEU A 116 15.132 -0.580 -0.369 1.00 0.00 C ATOM 1300 CG LEU A 116 14.073 -1.221 -1.277 1.00 0.00 C ATOM 1301 CD1 LEU A 116 14.285 -0.779 -2.712 1.00 0.00 C ATOM 1302 CD2 LEU A 116 14.097 -2.735 -1.166 1.00 0.00 C ATOM 0 H LEU A 116 13.345 -0.962 1.425 1.00 0.00 H new ATOM 0 HA LEU A 116 15.885 -2.191 0.814 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.843 0.456 -0.194 1.00 0.00 H new ATOM 0 HB3 LEU A 116 16.076 -0.560 -0.914 1.00 0.00 H new ATOM 0 HG LEU A 116 13.089 -0.886 -0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.530 -1.238 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.202 0.306 -2.775 1.00 0.00 H new ATOM 0 HD13 LEU A 116 15.276 -1.087 -3.045 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.336 -3.160 -1.821 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.078 -3.106 -1.462 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.894 -3.028 -0.136 1.00 0.00 H new ATOM 1314 N ASP A 117 15.556 0.617 2.483 1.00 0.00 N ATOM 1315 CA ASP A 117 16.175 1.522 3.432 1.00 0.00 C ATOM 1316 C ASP A 117 15.630 1.171 4.809 1.00 0.00 C ATOM 1317 O ASP A 117 15.534 -0.011 5.145 1.00 0.00 O ATOM 1318 CB ASP A 117 15.855 2.976 3.061 1.00 0.00 C ATOM 1319 CG ASP A 117 16.762 3.975 3.751 1.00 0.00 C ATOM 1320 OD1 ASP A 117 17.871 4.224 3.238 1.00 0.00 O ATOM 1321 OD2 ASP A 117 16.365 4.524 4.801 1.00 0.00 O ATOM 0 H ASP A 117 14.553 0.761 2.368 1.00 0.00 H new ATOM 0 HA ASP A 117 17.260 1.420 3.423 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.944 3.098 1.981 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.819 3.193 3.322 1.00 0.00 H new ATOM 1326 N ASP A 118 15.259 2.155 5.606 1.00 0.00 N ATOM 1327 CA ASP A 118 14.579 1.872 6.845 1.00 0.00 C ATOM 1328 C ASP A 118 13.076 1.807 6.594 1.00 0.00 C ATOM 1329 O ASP A 118 12.504 2.712 5.996 1.00 0.00 O ATOM 1330 CB ASP A 118 14.859 2.958 7.862 1.00 0.00 C ATOM 1331 CG ASP A 118 14.803 2.440 9.285 1.00 0.00 C ATOM 1332 OD1 ASP A 118 13.732 1.949 9.703 1.00 0.00 O ATOM 1333 OD2 ASP A 118 15.829 2.519 9.992 1.00 0.00 O ATOM 0 H ASP A 118 15.417 3.145 5.417 1.00 0.00 H new ATOM 0 HA ASP A 118 14.939 0.918 7.231 1.00 0.00 H new ATOM 0 HB2 ASP A 118 15.843 3.386 7.672 1.00 0.00 H new ATOM 0 HB3 ASP A 118 14.133 3.762 7.741 1.00 0.00 H new ATOM 1338 N PRO A 119 12.424 0.730 7.040 1.00 0.00 N ATOM 1339 CA PRO A 119 10.967 0.578 6.934 1.00 0.00 C ATOM 1340 C PRO A 119 10.277 1.459 7.937 1.00 0.00 C ATOM 1341 O PRO A 119 9.307 2.151 7.645 1.00 0.00 O ATOM 1342 CB PRO A 119 10.751 -0.882 7.332 1.00 0.00 C ATOM 1343 CG PRO A 119 11.875 -1.162 8.273 1.00 0.00 C ATOM 1344 CD PRO A 119 13.051 -0.423 7.703 1.00 0.00 C ATOM 0 HA PRO A 119 10.581 0.839 5.949 1.00 0.00 H new ATOM 0 HB2 PRO A 119 9.782 -1.028 7.810 1.00 0.00 H new ATOM 0 HB3 PRO A 119 10.781 -1.542 6.465 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.642 -0.817 9.280 1.00 0.00 H new ATOM 0 HG3 PRO A 119 12.076 -2.231 8.341 1.00 0.00 H new ATOM 0 HD2 PRO A 119 13.748 -0.112 8.481 1.00 0.00 H new ATOM 0 HD3 PRO A 119 13.612 -1.038 6.999 1.00 0.00 H new ATOM 1352 N ARG A 120 10.831 1.432 9.117 1.00 0.00 N ATOM 1353 CA ARG A 120 10.256 2.067 10.247 1.00 0.00 C ATOM 1354 C ARG A 120 10.603 3.545 10.209 1.00 0.00 C ATOM 1355 O ARG A 120 9.732 4.398 10.364 1.00 0.00 O ATOM 1356 CB ARG A 120 10.801 1.398 11.504 1.00 0.00 C ATOM 1357 CG ARG A 120 9.825 1.384 12.663 1.00 0.00 C ATOM 1358 CD ARG A 120 9.148 2.723 12.809 1.00 0.00 C ATOM 1359 NE ARG A 120 7.901 2.624 13.564 1.00 0.00 N ATOM 1360 CZ ARG A 120 6.784 3.290 13.270 1.00 0.00 C ATOM 1361 NH1 ARG A 120 6.746 4.100 12.218 1.00 0.00 N ATOM 1362 NH2 ARG A 120 5.704 3.137 14.032 1.00 0.00 N ATOM 0 H ARG A 120 11.712 0.956 9.313 1.00 0.00 H new ATOM 0 HA ARG A 120 9.170 1.972 10.244 1.00 0.00 H new ATOM 0 HB2 ARG A 120 11.082 0.372 11.265 1.00 0.00 H new ATOM 0 HB3 ARG A 120 11.710 1.914 11.813 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.076 0.608 12.504 1.00 0.00 H new ATOM 0 HG3 ARG A 120 10.351 1.135 13.585 1.00 0.00 H new ATOM 0 HD2 ARG A 120 9.822 3.418 13.311 1.00 0.00 H new ATOM 0 HD3 ARG A 120 8.942 3.135 11.821 1.00 0.00 H new ATOM 0 HE ARG A 120 7.884 2.002 14.372 1.00 0.00 H new ATOM 0 HH11 ARG A 120 7.573 4.214 11.632 1.00 0.00 H new ATOM 0 HH12 ARG A 120 5.890 4.608 11.996 1.00 0.00 H new ATOM 0 HH21 ARG A 120 5.733 2.512 14.838 1.00 0.00 H new ATOM 0 HH22 ARG A 120 4.847 3.645 13.811 1.00 0.00 H new ATOM 1376 N GLU A 121 11.873 3.843 9.969 1.00 0.00 N ATOM 1377 CA GLU A 121 12.308 5.230 9.903 1.00 0.00 C ATOM 1378 C GLU A 121 11.808 5.858 8.639 1.00 0.00 C ATOM 1379 O GLU A 121 11.255 6.927 8.678 1.00 0.00 O ATOM 1380 CB GLU A 121 13.816 5.370 9.917 1.00 0.00 C ATOM 1381 CG GLU A 121 14.290 6.805 9.782 1.00 0.00 C ATOM 1382 CD GLU A 121 15.780 6.942 9.988 1.00 0.00 C ATOM 1383 OE1 GLU A 121 16.540 6.736 9.018 1.00 0.00 O ATOM 1384 OE2 GLU A 121 16.200 7.248 11.122 1.00 0.00 O ATOM 0 H GLU A 121 12.610 3.154 9.819 1.00 0.00 H new ATOM 0 HA GLU A 121 11.902 5.724 10.786 1.00 0.00 H new ATOM 0 HB2 GLU A 121 14.203 4.953 10.847 1.00 0.00 H new ATOM 0 HB3 GLU A 121 14.236 4.779 9.103 1.00 0.00 H new ATOM 0 HG2 GLU A 121 14.027 7.180 8.793 1.00 0.00 H new ATOM 0 HG3 GLU A 121 13.767 7.427 10.508 1.00 0.00 H new ATOM 1391 N GLY A 122 12.029 5.184 7.525 1.00 0.00 N ATOM 1392 CA GLY A 122 11.623 5.696 6.231 1.00 0.00 C ATOM 1393 C GLY A 122 10.195 6.201 6.236 1.00 0.00 C ATOM 1394 O GLY A 122 9.884 7.233 5.651 1.00 0.00 O ATOM 0 H GLY A 122 12.491 4.275 7.492 1.00 0.00 H new ATOM 0 HA2 GLY A 122 12.291 6.505 5.937 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.726 4.910 5.483 1.00 0.00 H new ATOM 1398 N LEU A 123 9.340 5.481 6.939 1.00 0.00 N ATOM 1399 CA LEU A 123 7.933 5.816 7.025 1.00 0.00 C ATOM 1400 C LEU A 123 7.736 7.040 7.944 1.00 0.00 C ATOM 1401 O LEU A 123 6.769 7.792 7.821 1.00 0.00 O ATOM 1402 CB LEU A 123 7.190 4.573 7.545 1.00 0.00 C ATOM 1403 CG LEU A 123 5.707 4.451 7.198 1.00 0.00 C ATOM 1404 CD1 LEU A 123 4.912 5.402 8.035 1.00 0.00 C ATOM 1405 CD2 LEU A 123 5.470 4.714 5.721 1.00 0.00 C ATOM 0 H LEU A 123 9.603 4.648 7.466 1.00 0.00 H new ATOM 0 HA LEU A 123 7.531 6.090 6.050 1.00 0.00 H new ATOM 0 HB2 LEU A 123 7.700 3.689 7.162 1.00 0.00 H new ATOM 0 HB3 LEU A 123 7.286 4.551 8.631 1.00 0.00 H new ATOM 0 HG LEU A 123 5.383 3.432 7.411 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.855 5.312 7.784 1.00 0.00 H new ATOM 0 HD12 LEU A 123 5.056 5.167 9.089 1.00 0.00 H new ATOM 0 HD13 LEU A 123 5.245 6.422 7.842 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.407 4.621 5.501 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.805 5.721 5.472 1.00 0.00 H new ATOM 0 HD23 LEU A 123 6.028 3.989 5.128 1.00 0.00 H new ATOM 1417 N GLU A 124 8.668 7.233 8.865 1.00 0.00 N ATOM 1418 CA GLU A 124 8.672 8.400 9.743 1.00 0.00 C ATOM 1419 C GLU A 124 9.350 9.579 9.063 1.00 0.00 C ATOM 1420 O GLU A 124 8.804 10.679 8.986 1.00 0.00 O ATOM 1421 CB GLU A 124 9.411 8.072 11.030 1.00 0.00 C ATOM 1422 CG GLU A 124 8.788 6.935 11.794 1.00 0.00 C ATOM 1423 CD GLU A 124 7.379 7.252 12.249 1.00 0.00 C ATOM 1424 OE1 GLU A 124 7.227 7.899 13.307 1.00 0.00 O ATOM 1425 OE2 GLU A 124 6.421 6.864 11.552 1.00 0.00 O ATOM 0 H GLU A 124 9.442 6.589 9.027 1.00 0.00 H new ATOM 0 HA GLU A 124 7.639 8.666 9.967 1.00 0.00 H new ATOM 0 HB2 GLU A 124 10.445 7.820 10.794 1.00 0.00 H new ATOM 0 HB3 GLU A 124 9.435 8.958 11.664 1.00 0.00 H new ATOM 0 HG2 GLU A 124 8.773 6.044 11.167 1.00 0.00 H new ATOM 0 HG3 GLU A 124 9.404 6.703 12.663 1.00 0.00 H new ATOM 1432 N LYS A 125 10.539 9.305 8.552 1.00 0.00 N ATOM 1433 CA LYS A 125 11.395 10.302 7.947 1.00 0.00 C ATOM 1434 C LYS A 125 10.790 10.801 6.637 1.00 0.00 C ATOM 1435 O LYS A 125 11.096 11.905 6.192 1.00 0.00 O ATOM 1436 CB LYS A 125 12.813 9.721 7.748 1.00 0.00 C ATOM 1437 CG LYS A 125 12.895 8.545 6.795 1.00 0.00 C ATOM 1438 CD LYS A 125 14.319 8.232 6.349 1.00 0.00 C ATOM 1439 CE LYS A 125 14.888 9.266 5.381 1.00 0.00 C ATOM 1440 NZ LYS A 125 15.411 10.477 6.067 1.00 0.00 N ATOM 0 H LYS A 125 10.940 8.367 8.548 1.00 0.00 H new ATOM 0 HA LYS A 125 11.477 11.163 8.610 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.466 10.513 7.381 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.202 9.411 8.718 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.470 7.665 7.277 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.284 8.754 5.917 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.963 8.173 7.227 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.337 7.251 5.874 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.689 8.810 4.800 1.00 0.00 H new ATOM 0 HE3 LYS A 125 14.111 9.561 4.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 14.745 11.265 5.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.520 10.281 7.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.335 10.733 5.663 1.00 0.00 H new ATOM 1454 N GLY A 126 9.925 9.994 6.027 1.00 0.00 N ATOM 1455 CA GLY A 126 9.163 10.466 4.884 1.00 0.00 C ATOM 1456 C GLY A 126 9.576 9.816 3.582 1.00 0.00 C ATOM 1457 O GLY A 126 8.968 10.061 2.541 1.00 0.00 O ATOM 0 H GLY A 126 9.739 9.029 6.301 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.104 10.275 5.058 1.00 0.00 H new ATOM 0 HA3 GLY A 126 9.282 11.546 4.797 1.00 0.00 H new ATOM 1461 N HIS A 127 10.605 8.986 3.636 1.00 0.00 N ATOM 1462 CA HIS A 127 11.090 8.303 2.444 1.00 0.00 C ATOM 1463 C HIS A 127 11.153 6.799 2.658 1.00 0.00 C ATOM 1464 O HIS A 127 12.092 6.284 3.264 1.00 0.00 O ATOM 1465 CB HIS A 127 12.464 8.842 2.031 1.00 0.00 C ATOM 1466 CG HIS A 127 12.408 10.113 1.236 1.00 0.00 C ATOM 1467 ND1 HIS A 127 12.447 10.317 -0.102 1.00 0.00 N flip ATOM 1468 CD2 HIS A 127 12.301 11.364 1.805 1.00 0.00 C flip ATOM 1469 CE1 HIS A 127 12.364 11.670 -0.312 1.00 0.00 C flip ATOM 1470 NE2 HIS A 127 12.276 12.279 0.854 1.00 0.00 N flip ATOM 0 H HIS A 127 11.120 8.768 4.489 1.00 0.00 H new ATOM 0 HA HIS A 127 10.383 8.500 1.638 1.00 0.00 H new ATOM 0 HB2 HIS A 127 13.060 9.012 2.927 1.00 0.00 H new ATOM 0 HB3 HIS A 127 12.980 8.081 1.445 1.00 0.00 H new ATOM 0 HD2 HIS A 127 12.246 11.564 2.865 1.00 0.00 H new ATOM 0 HE1 HIS A 127 12.370 12.157 -1.276 1.00 0.00 H new ATOM 0 HE2 HIS A 127 12.201 13.286 0.997 1.00 0.00 H new ATOM 1479 N LEU A 128 10.146 6.104 2.154 1.00 0.00 N ATOM 1480 CA LEU A 128 10.087 4.656 2.252 1.00 0.00 C ATOM 1481 C LEU A 128 10.619 3.989 1.003 1.00 0.00 C ATOM 1482 O LEU A 128 10.289 4.372 -0.119 1.00 0.00 O ATOM 1483 CB LEU A 128 8.658 4.151 2.522 1.00 0.00 C ATOM 1484 CG LEU A 128 8.390 3.712 3.958 1.00 0.00 C ATOM 1485 CD1 LEU A 128 7.484 2.504 4.030 1.00 0.00 C ATOM 1486 CD2 LEU A 128 9.685 3.431 4.651 1.00 0.00 C ATOM 0 H LEU A 128 9.353 6.524 1.669 1.00 0.00 H new ATOM 0 HA LEU A 128 10.719 4.387 3.098 1.00 0.00 H new ATOM 0 HB2 LEU A 128 7.954 4.942 2.262 1.00 0.00 H new ATOM 0 HB3 LEU A 128 8.454 3.312 1.857 1.00 0.00 H new ATOM 0 HG LEU A 128 7.873 4.529 4.461 1.00 0.00 H new ATOM 0 HD11 LEU A 128 7.324 2.231 5.073 1.00 0.00 H new ATOM 0 HD12 LEU A 128 6.526 2.739 3.565 1.00 0.00 H new ATOM 0 HD13 LEU A 128 7.948 1.670 3.504 1.00 0.00 H new ATOM 0 HD21 LEU A 128 9.488 3.118 5.676 1.00 0.00 H new ATOM 0 HD22 LEU A 128 10.215 2.637 4.124 1.00 0.00 H new ATOM 0 HD23 LEU A 128 10.297 4.333 4.658 1.00 0.00 H new ATOM 1498 N SER A 129 11.440 2.984 1.218 1.00 0.00 N ATOM 1499 CA SER A 129 11.938 2.151 0.145 1.00 0.00 C ATOM 1500 C SER A 129 11.672 0.697 0.490 1.00 0.00 C ATOM 1501 O SER A 129 12.029 0.239 1.574 1.00 0.00 O ATOM 1502 CB SER A 129 13.432 2.389 -0.070 1.00 0.00 C ATOM 1503 OG SER A 129 13.696 3.755 -0.339 1.00 0.00 O ATOM 0 H SER A 129 11.781 2.721 2.143 1.00 0.00 H new ATOM 0 HA SER A 129 11.425 2.405 -0.783 1.00 0.00 H new ATOM 0 HB2 SER A 129 13.985 2.076 0.816 1.00 0.00 H new ATOM 0 HB3 SER A 129 13.786 1.777 -0.899 1.00 0.00 H new ATOM 0 HG SER A 129 14.659 3.882 -0.472 1.00 0.00 H new ATOM 1509 N PHE A 130 11.027 -0.022 -0.414 1.00 0.00 N ATOM 1510 CA PHE A 130 10.628 -1.389 -0.143 1.00 0.00 C ATOM 1511 C PHE A 130 10.560 -2.237 -1.401 1.00 0.00 C ATOM 1512 O PHE A 130 10.677 -1.738 -2.515 1.00 0.00 O ATOM 1513 CB PHE A 130 9.282 -1.424 0.578 1.00 0.00 C ATOM 1514 CG PHE A 130 8.236 -0.505 0.020 1.00 0.00 C ATOM 1515 CD1 PHE A 130 8.217 0.830 0.377 1.00 0.00 C ATOM 1516 CD2 PHE A 130 7.261 -0.975 -0.841 1.00 0.00 C ATOM 1517 CE1 PHE A 130 7.254 1.672 -0.122 1.00 0.00 C ATOM 1518 CE2 PHE A 130 6.295 -0.134 -1.337 1.00 0.00 C ATOM 1519 CZ PHE A 130 6.292 1.186 -0.980 1.00 0.00 C ATOM 0 H PHE A 130 10.770 0.320 -1.340 1.00 0.00 H new ATOM 0 HA PHE A 130 11.398 -1.817 0.499 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.899 -2.444 0.550 1.00 0.00 H new ATOM 0 HB3 PHE A 130 9.442 -1.172 1.626 1.00 0.00 H new ATOM 0 HD1 PHE A 130 8.966 1.214 1.054 1.00 0.00 H new ATOM 0 HD2 PHE A 130 7.259 -2.016 -1.127 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.251 2.715 0.158 1.00 0.00 H new ATOM 0 HE2 PHE A 130 5.539 -0.515 -2.008 1.00 0.00 H new ATOM 0 HZ PHE A 130 5.534 1.849 -1.371 1.00 0.00 H new ATOM 1529 N ALA A 131 10.384 -3.532 -1.192 1.00 0.00 N ATOM 1530 CA ALA A 131 10.287 -4.495 -2.267 1.00 0.00 C ATOM 1531 C ALA A 131 9.115 -5.431 -2.021 1.00 0.00 C ATOM 1532 O ALA A 131 9.024 -6.050 -0.972 1.00 0.00 O ATOM 1533 CB ALA A 131 11.586 -5.276 -2.385 1.00 0.00 C ATOM 0 H ALA A 131 10.304 -3.943 -0.262 1.00 0.00 H new ATOM 0 HA ALA A 131 10.116 -3.969 -3.206 1.00 0.00 H new ATOM 0 HB1 ALA A 131 11.504 -5.999 -3.197 1.00 0.00 H new ATOM 0 HB2 ALA A 131 12.406 -4.589 -2.593 1.00 0.00 H new ATOM 0 HB3 ALA A 131 11.781 -5.801 -1.450 1.00 0.00 H new ATOM 1539 N LEU A 132 8.220 -5.518 -2.986 1.00 0.00 N ATOM 1540 CA LEU A 132 7.016 -6.323 -2.840 1.00 0.00 C ATOM 1541 C LEU A 132 7.258 -7.745 -3.310 1.00 0.00 C ATOM 1542 O LEU A 132 8.005 -7.966 -4.258 1.00 0.00 O ATOM 1543 CB LEU A 132 5.863 -5.706 -3.639 1.00 0.00 C ATOM 1544 CG LEU A 132 4.977 -4.720 -2.876 1.00 0.00 C ATOM 1545 CD1 LEU A 132 5.807 -3.700 -2.126 1.00 0.00 C ATOM 1546 CD2 LEU A 132 4.025 -4.017 -3.824 1.00 0.00 C ATOM 0 H LEU A 132 8.302 -5.040 -3.884 1.00 0.00 H new ATOM 0 HA LEU A 132 6.750 -6.344 -1.783 1.00 0.00 H new ATOM 0 HB2 LEU A 132 6.280 -5.194 -4.506 1.00 0.00 H new ATOM 0 HB3 LEU A 132 5.235 -6.513 -4.016 1.00 0.00 H new ATOM 0 HG LEU A 132 4.399 -5.290 -2.149 1.00 0.00 H new ATOM 0 HD11 LEU A 132 5.147 -3.014 -1.594 1.00 0.00 H new ATOM 0 HD12 LEU A 132 6.452 -4.211 -1.411 1.00 0.00 H new ATOM 0 HD13 LEU A 132 6.420 -3.140 -2.832 1.00 0.00 H new ATOM 0 HD21 LEU A 132 3.403 -3.319 -3.264 1.00 0.00 H new ATOM 0 HD22 LEU A 132 4.596 -3.471 -4.575 1.00 0.00 H new ATOM 0 HD23 LEU A 132 3.391 -4.754 -4.316 1.00 0.00 H new ATOM 1558 N ASP A 133 6.650 -8.700 -2.626 1.00 0.00 N ATOM 1559 CA ASP A 133 6.672 -10.092 -3.073 1.00 0.00 C ATOM 1560 C ASP A 133 5.503 -10.878 -2.506 1.00 0.00 C ATOM 1561 O ASP A 133 5.589 -11.428 -1.405 1.00 0.00 O ATOM 1562 CB ASP A 133 7.973 -10.785 -2.678 1.00 0.00 C ATOM 1563 CG ASP A 133 8.943 -10.892 -3.839 1.00 0.00 C ATOM 1564 OD1 ASP A 133 8.493 -11.194 -4.961 1.00 0.00 O ATOM 1565 OD2 ASP A 133 10.157 -10.718 -3.625 1.00 0.00 O ATOM 0 H ASP A 133 6.135 -8.542 -1.760 1.00 0.00 H new ATOM 0 HA ASP A 133 6.594 -10.069 -4.160 1.00 0.00 H new ATOM 0 HB2 ASP A 133 8.443 -10.233 -1.864 1.00 0.00 H new ATOM 0 HB3 ASP A 133 7.750 -11.783 -2.300 1.00 0.00 H new ATOM 1570 N GLY A 134 4.406 -10.925 -3.250 1.00 0.00 N ATOM 1571 CA GLY A 134 3.266 -11.693 -2.811 1.00 0.00 C ATOM 1572 C GLY A 134 2.790 -12.691 -3.831 1.00 0.00 C ATOM 1573 O GLY A 134 3.583 -13.354 -4.502 1.00 0.00 O ATOM 0 H GLY A 134 4.289 -10.447 -4.143 1.00 0.00 H new ATOM 0 HA2 GLY A 134 3.524 -12.219 -1.892 1.00 0.00 H new ATOM 0 HA3 GLY A 134 2.449 -11.012 -2.571 1.00 0.00 H new ATOM 1577 N GLU A 135 1.485 -12.783 -3.935 1.00 0.00 N ATOM 1578 CA GLU A 135 0.825 -13.736 -4.797 1.00 0.00 C ATOM 1579 C GLU A 135 0.748 -13.229 -6.235 1.00 0.00 C ATOM 1580 O GLU A 135 1.027 -13.967 -7.181 1.00 0.00 O ATOM 1581 CB GLU A 135 -0.562 -13.987 -4.228 1.00 0.00 C ATOM 1582 CG GLU A 135 -1.506 -14.717 -5.161 1.00 0.00 C ATOM 1583 CD GLU A 135 -2.758 -15.194 -4.459 1.00 0.00 C ATOM 1584 OE1 GLU A 135 -2.715 -16.272 -3.828 1.00 0.00 O ATOM 1585 OE2 GLU A 135 -3.792 -14.500 -4.528 1.00 0.00 O ATOM 0 H GLU A 135 0.841 -12.188 -3.414 1.00 0.00 H new ATOM 0 HA GLU A 135 1.394 -14.665 -4.830 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.464 -14.564 -3.308 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -1.008 -13.030 -3.958 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -1.783 -14.057 -5.983 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -0.991 -15.572 -5.599 1.00 0.00 H new ATOM 1592 N LYS A 136 0.377 -11.968 -6.393 1.00 0.00 N ATOM 1593 CA LYS A 136 0.263 -11.358 -7.708 1.00 0.00 C ATOM 1594 C LYS A 136 1.249 -10.214 -7.857 1.00 0.00 C ATOM 1595 O LYS A 136 1.873 -10.054 -8.908 1.00 0.00 O ATOM 1596 CB LYS A 136 -1.156 -10.844 -7.959 1.00 0.00 C ATOM 1597 CG LYS A 136 -2.171 -11.941 -8.223 1.00 0.00 C ATOM 1598 CD LYS A 136 -3.224 -12.015 -7.132 1.00 0.00 C ATOM 1599 CE LYS A 136 -4.295 -13.038 -7.472 1.00 0.00 C ATOM 1600 NZ LYS A 136 -5.249 -13.240 -6.353 1.00 0.00 N ATOM 0 H LYS A 136 0.148 -11.343 -5.620 1.00 0.00 H new ATOM 0 HA LYS A 136 0.492 -12.128 -8.445 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -1.480 -10.264 -7.095 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -1.140 -10.165 -8.811 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -2.655 -11.763 -9.183 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.658 -12.900 -8.297 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -2.753 -12.279 -6.185 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -3.682 -11.035 -6.998 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -4.840 -12.711 -8.358 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -3.822 -13.988 -7.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -6.189 -13.467 -6.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -4.920 -14.024 -5.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -5.307 -12.371 -5.785 1.00 0.00 H new ATOM 1614 N LEU A 137 1.394 -9.421 -6.808 1.00 0.00 N ATOM 1615 CA LEU A 137 2.283 -8.275 -6.856 1.00 0.00 C ATOM 1616 C LEU A 137 3.684 -8.653 -6.407 1.00 0.00 C ATOM 1617 O LEU A 137 3.889 -9.665 -5.732 1.00 0.00 O ATOM 1618 CB LEU A 137 1.753 -7.112 -6.005 1.00 0.00 C ATOM 1619 CG LEU A 137 1.142 -5.941 -6.783 1.00 0.00 C ATOM 1620 CD1 LEU A 137 0.718 -4.841 -5.824 1.00 0.00 C ATOM 1621 CD2 LEU A 137 2.136 -5.382 -7.787 1.00 0.00 C ATOM 0 H LEU A 137 0.911 -9.549 -5.919 1.00 0.00 H new ATOM 0 HA LEU A 137 2.325 -7.945 -7.894 1.00 0.00 H new ATOM 0 HB2 LEU A 137 1.000 -7.501 -5.320 1.00 0.00 H new ATOM 0 HB3 LEU A 137 2.572 -6.731 -5.395 1.00 0.00 H new ATOM 0 HG LEU A 137 0.270 -6.311 -7.322 1.00 0.00 H new ATOM 0 HD11 LEU A 137 0.285 -4.014 -6.387 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -0.023 -5.232 -5.127 1.00 0.00 H new ATOM 0 HD13 LEU A 137 1.587 -4.487 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 137 1.680 -4.552 -8.327 1.00 0.00 H new ATOM 0 HD22 LEU A 137 3.024 -5.029 -7.262 1.00 0.00 H new ATOM 0 HD23 LEU A 137 2.418 -6.163 -8.493 1.00 0.00 H new ATOM 1633 N SER A 138 4.634 -7.831 -6.811 1.00 0.00 N ATOM 1634 CA SER A 138 6.036 -8.010 -6.487 1.00 0.00 C ATOM 1635 C SER A 138 6.838 -6.892 -7.142 1.00 0.00 C ATOM 1636 O SER A 138 6.295 -6.101 -7.920 1.00 0.00 O ATOM 1637 CB SER A 138 6.540 -9.402 -6.930 1.00 0.00 C ATOM 1638 OG SER A 138 7.953 -9.493 -6.909 1.00 0.00 O ATOM 0 H SER A 138 4.450 -7.007 -7.383 1.00 0.00 H new ATOM 0 HA SER A 138 6.168 -7.960 -5.406 1.00 0.00 H new ATOM 0 HB2 SER A 138 6.119 -10.164 -6.274 1.00 0.00 H new ATOM 0 HB3 SER A 138 6.179 -9.613 -7.937 1.00 0.00 H new ATOM 0 HG SER A 138 8.231 -10.100 -6.192 1.00 0.00 H new ATOM 1644 N GLY A 139 8.101 -6.801 -6.792 1.00 0.00 N ATOM 1645 CA GLY A 139 8.971 -5.803 -7.371 1.00 0.00 C ATOM 1646 C GLY A 139 9.601 -4.928 -6.317 1.00 0.00 C ATOM 1647 O GLY A 139 9.885 -5.387 -5.216 1.00 0.00 O ATOM 0 H GLY A 139 8.550 -7.409 -6.107 1.00 0.00 H new ATOM 0 HA2 GLY A 139 9.753 -6.295 -7.950 1.00 0.00 H new ATOM 0 HA3 GLY A 139 8.402 -5.184 -8.065 1.00 0.00 H new ATOM 1651 N ARG A 140 9.780 -3.658 -6.633 1.00 0.00 N ATOM 1652 CA ARG A 140 10.444 -2.726 -5.733 1.00 0.00 C ATOM 1653 C ARG A 140 9.807 -1.347 -5.853 1.00 0.00 C ATOM 1654 O ARG A 140 9.702 -0.804 -6.951 1.00 0.00 O ATOM 1655 CB ARG A 140 11.940 -2.681 -6.057 1.00 0.00 C ATOM 1656 CG ARG A 140 12.654 -3.988 -5.743 1.00 0.00 C ATOM 1657 CD ARG A 140 13.912 -4.170 -6.569 1.00 0.00 C ATOM 1658 NE ARG A 140 14.869 -3.089 -6.369 1.00 0.00 N ATOM 1659 CZ ARG A 140 16.115 -3.270 -5.940 1.00 0.00 C ATOM 1660 NH1 ARG A 140 16.556 -4.492 -5.651 1.00 0.00 N ATOM 1661 NH2 ARG A 140 16.919 -2.224 -5.801 1.00 0.00 N ATOM 0 H ARG A 140 9.473 -3.244 -7.513 1.00 0.00 H new ATOM 0 HA ARG A 140 10.327 -3.060 -4.702 1.00 0.00 H new ATOM 0 HB2 ARG A 140 12.071 -2.446 -7.113 1.00 0.00 H new ATOM 0 HB3 ARG A 140 12.405 -1.874 -5.491 1.00 0.00 H new ATOM 0 HG2 ARG A 140 12.911 -4.014 -4.684 1.00 0.00 H new ATOM 0 HG3 ARG A 140 11.977 -4.822 -5.927 1.00 0.00 H new ATOM 0 HD2 ARG A 140 14.380 -5.119 -6.308 1.00 0.00 H new ATOM 0 HD3 ARG A 140 13.646 -4.225 -7.625 1.00 0.00 H new ATOM 0 HE ARG A 140 14.565 -2.136 -6.570 1.00 0.00 H new ATOM 0 HH11 ARG A 140 15.937 -5.296 -5.758 1.00 0.00 H new ATOM 0 HH12 ARG A 140 17.512 -4.625 -5.322 1.00 0.00 H new ATOM 0 HH21 ARG A 140 16.581 -1.288 -6.023 1.00 0.00 H new ATOM 0 HH22 ARG A 140 17.876 -2.356 -5.472 1.00 0.00 H new ATOM 1675 N TRP A 141 9.379 -0.788 -4.726 1.00 0.00 N ATOM 1676 CA TRP A 141 8.608 0.454 -4.722 1.00 0.00 C ATOM 1677 C TRP A 141 9.102 1.422 -3.636 1.00 0.00 C ATOM 1678 O TRP A 141 9.885 1.051 -2.759 1.00 0.00 O ATOM 1679 CB TRP A 141 7.120 0.156 -4.494 1.00 0.00 C ATOM 1680 CG TRP A 141 6.487 -0.738 -5.524 1.00 0.00 C ATOM 1681 CD1 TRP A 141 6.614 -2.096 -5.625 1.00 0.00 C ATOM 1682 CD2 TRP A 141 5.602 -0.341 -6.578 1.00 0.00 C ATOM 1683 NE1 TRP A 141 5.878 -2.562 -6.686 1.00 0.00 N ATOM 1684 CE2 TRP A 141 5.245 -1.505 -7.285 1.00 0.00 C ATOM 1685 CE3 TRP A 141 5.080 0.886 -6.996 1.00 0.00 C ATOM 1686 CZ2 TRP A 141 4.389 -1.478 -8.383 1.00 0.00 C ATOM 1687 CZ3 TRP A 141 4.231 0.913 -8.086 1.00 0.00 C ATOM 1688 CH2 TRP A 141 3.892 -0.262 -8.768 1.00 0.00 C ATOM 0 H TRP A 141 9.553 -1.176 -3.799 1.00 0.00 H new ATOM 0 HA TRP A 141 8.746 0.926 -5.695 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.003 -0.305 -3.513 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.575 1.100 -4.470 1.00 0.00 H new ATOM 0 HD1 TRP A 141 7.207 -2.712 -4.966 1.00 0.00 H new ATOM 0 HE1 TRP A 141 5.813 -3.536 -6.980 1.00 0.00 H new ATOM 0 HE3 TRP A 141 5.336 1.797 -6.476 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 4.127 -2.383 -8.911 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 3.822 1.856 -8.417 1.00 0.00 H new ATOM 0 HH2 TRP A 141 3.225 -0.208 -9.615 1.00 0.00 H new ATOM 1699 N HIS A 142 8.636 2.663 -3.719 1.00 0.00 N ATOM 1700 CA HIS A 142 8.965 3.721 -2.762 1.00 0.00 C ATOM 1701 C HIS A 142 7.704 4.488 -2.374 1.00 0.00 C ATOM 1702 O HIS A 142 6.937 4.880 -3.248 1.00 0.00 O ATOM 1703 CB HIS A 142 9.950 4.737 -3.370 1.00 0.00 C ATOM 1704 CG HIS A 142 11.395 4.339 -3.354 1.00 0.00 C ATOM 1705 ND1 HIS A 142 11.997 3.162 -3.089 1.00 0.00 N flip ATOM 1706 CD2 HIS A 142 12.410 5.221 -3.657 1.00 0.00 C flip ATOM 1707 CE1 HIS A 142 13.350 3.350 -3.238 1.00 0.00 C flip ATOM 1708 NE2 HIS A 142 13.569 4.602 -3.580 1.00 0.00 N flip ATOM 0 H HIS A 142 8.009 2.970 -4.463 1.00 0.00 H new ATOM 0 HA HIS A 142 9.415 3.240 -1.893 1.00 0.00 H new ATOM 0 HB2 HIS A 142 9.656 4.925 -4.403 1.00 0.00 H new ATOM 0 HB3 HIS A 142 9.847 5.680 -2.833 1.00 0.00 H new ATOM 0 HD1 HIS A 142 11.533 2.292 -2.826 1.00 0.00 H new ATOM 0 HD2 HIS A 142 12.275 6.260 -3.918 1.00 0.00 H new ATOM 0 HE1 HIS A 142 14.109 2.595 -3.098 1.00 0.00 H new ATOM 1717 N LEU A 143 7.471 4.657 -1.075 1.00 0.00 N ATOM 1718 CA LEU A 143 6.465 5.608 -0.589 1.00 0.00 C ATOM 1719 C LEU A 143 7.119 6.905 -0.132 1.00 0.00 C ATOM 1720 O LEU A 143 8.030 6.882 0.682 1.00 0.00 O ATOM 1721 CB LEU A 143 5.684 5.023 0.579 1.00 0.00 C ATOM 1722 CG LEU A 143 4.795 3.863 0.234 1.00 0.00 C ATOM 1723 CD1 LEU A 143 4.187 3.262 1.462 1.00 0.00 C ATOM 1724 CD2 LEU A 143 3.722 4.280 -0.730 1.00 0.00 C ATOM 0 H LEU A 143 7.962 4.151 -0.338 1.00 0.00 H new ATOM 0 HA LEU A 143 5.787 5.812 -1.418 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.391 4.704 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.073 5.811 1.018 1.00 0.00 H new ATOM 0 HG LEU A 143 5.414 3.104 -0.244 1.00 0.00 H new ATOM 0 HD11 LEU A 143 3.549 2.425 1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 143 4.978 2.908 2.124 1.00 0.00 H new ATOM 0 HD13 LEU A 143 3.591 4.014 1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 143 3.091 3.423 -0.965 1.00 0.00 H new ATOM 0 HD22 LEU A 143 3.115 5.066 -0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 143 4.181 4.654 -1.645 1.00 0.00 H new ATOM 1736 N ILE A 144 6.665 8.032 -0.651 1.00 0.00 N ATOM 1737 CA ILE A 144 7.154 9.327 -0.189 1.00 0.00 C ATOM 1738 C ILE A 144 5.988 10.174 0.321 1.00 0.00 C ATOM 1739 O ILE A 144 4.995 10.334 -0.377 1.00 0.00 O ATOM 1740 CB ILE A 144 7.861 10.106 -1.322 1.00 0.00 C ATOM 1741 CG1 ILE A 144 8.677 9.172 -2.228 1.00 0.00 C ATOM 1742 CG2 ILE A 144 8.761 11.168 -0.719 1.00 0.00 C ATOM 1743 CD1 ILE A 144 9.838 8.489 -1.536 1.00 0.00 C ATOM 0 H ILE A 144 5.962 8.081 -1.389 1.00 0.00 H new ATOM 0 HA ILE A 144 7.870 9.137 0.611 1.00 0.00 H new ATOM 0 HB ILE A 144 7.097 10.577 -1.941 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.013 8.410 -2.636 1.00 0.00 H new ATOM 0 HG13 ILE A 144 9.059 9.746 -3.072 1.00 0.00 H new ATOM 0 HG21 ILE A 144 9.260 11.718 -1.517 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.162 11.857 -0.123 1.00 0.00 H new ATOM 0 HG23 ILE A 144 9.508 10.693 -0.083 1.00 0.00 H new ATOM 0 HD11 ILE A 144 10.360 7.849 -2.247 1.00 0.00 H new ATOM 0 HD12 ILE A 144 10.527 9.242 -1.152 1.00 0.00 H new ATOM 0 HD13 ILE A 144 9.464 7.884 -0.710 1.00 0.00 H new ATOM 1755 N ARG A 145 6.099 10.719 1.527 1.00 0.00 N ATOM 1756 CA ARG A 145 4.982 11.457 2.117 1.00 0.00 C ATOM 1757 C ARG A 145 4.838 12.844 1.500 1.00 0.00 C ATOM 1758 O ARG A 145 5.814 13.576 1.324 1.00 0.00 O ATOM 1759 CB ARG A 145 5.141 11.568 3.631 1.00 0.00 C ATOM 1760 CG ARG A 145 3.911 12.136 4.333 1.00 0.00 C ATOM 1761 CD ARG A 145 4.036 11.999 5.845 1.00 0.00 C ATOM 1762 NE ARG A 145 5.300 12.548 6.341 1.00 0.00 N ATOM 1763 CZ ARG A 145 6.133 11.900 7.157 1.00 0.00 C ATOM 1764 NH1 ARG A 145 5.821 10.692 7.617 1.00 0.00 N ATOM 1765 NH2 ARG A 145 7.276 12.469 7.528 1.00 0.00 N ATOM 0 H ARG A 145 6.935 10.667 2.109 1.00 0.00 H new ATOM 0 HA ARG A 145 4.073 10.895 1.901 1.00 0.00 H new ATOM 0 HB2 ARG A 145 5.359 10.581 4.039 1.00 0.00 H new ATOM 0 HB3 ARG A 145 6.000 12.201 3.853 1.00 0.00 H new ATOM 0 HG2 ARG A 145 3.789 13.186 4.068 1.00 0.00 H new ATOM 0 HG3 ARG A 145 3.018 11.614 3.989 1.00 0.00 H new ATOM 0 HD2 ARG A 145 3.204 12.513 6.326 1.00 0.00 H new ATOM 0 HD3 ARG A 145 3.964 10.947 6.121 1.00 0.00 H new ATOM 0 HE ARG A 145 5.561 13.488 6.043 1.00 0.00 H new ATOM 0 HH11 ARG A 145 4.940 10.255 7.346 1.00 0.00 H new ATOM 0 HH12 ARG A 145 6.463 10.202 8.241 1.00 0.00 H new ATOM 0 HH21 ARG A 145 7.516 13.401 7.189 1.00 0.00 H new ATOM 0 HH22 ARG A 145 7.913 11.974 8.152 1.00 0.00 H new ATOM 1779 N THR A 146 3.593 13.178 1.181 1.00 0.00 N ATOM 1780 CA THR A 146 3.238 14.431 0.545 1.00 0.00 C ATOM 1781 C THR A 146 3.349 15.598 1.535 1.00 0.00 C ATOM 1782 O THR A 146 3.949 16.617 1.224 1.00 0.00 O ATOM 1783 CB THR A 146 1.796 14.359 -0.054 1.00 0.00 C ATOM 1784 OG1 THR A 146 1.595 15.410 -1.003 1.00 0.00 O ATOM 1785 CG2 THR A 146 0.733 14.475 1.016 1.00 0.00 C ATOM 0 H THR A 146 2.792 12.573 1.362 1.00 0.00 H new ATOM 0 HA THR A 146 3.941 14.605 -0.269 1.00 0.00 H new ATOM 0 HB THR A 146 1.706 13.387 -0.538 1.00 0.00 H new ATOM 0 HG1 THR A 146 1.938 15.131 -1.878 1.00 0.00 H new ATOM 0 HG21 THR A 146 -0.254 14.420 0.556 1.00 0.00 H new ATOM 0 HG22 THR A 146 0.846 13.660 1.731 1.00 0.00 H new ATOM 0 HG23 THR A 146 0.840 15.429 1.533 1.00 0.00 H new ATOM 1793 N ASN A 147 2.791 15.418 2.733 1.00 0.00 N ATOM 1794 CA ASN A 147 2.675 16.482 3.728 1.00 0.00 C ATOM 1795 C ASN A 147 2.037 17.743 3.120 1.00 0.00 C ATOM 1796 O ASN A 147 1.503 17.704 2.006 1.00 0.00 O ATOM 1797 CB ASN A 147 4.026 16.769 4.379 1.00 0.00 C ATOM 1798 CG ASN A 147 3.896 17.444 5.738 1.00 0.00 C ATOM 1799 OD1 ASN A 147 4.830 18.099 6.195 1.00 0.00 O ATOM 1800 ND2 ASN A 147 2.733 17.321 6.388 1.00 0.00 N ATOM 0 H ASN A 147 2.405 14.525 3.041 1.00 0.00 H new ATOM 0 HA ASN A 147 2.006 16.142 4.519 1.00 0.00 H new ATOM 0 HB2 ASN A 147 4.574 15.834 4.494 1.00 0.00 H new ATOM 0 HB3 ASN A 147 4.615 17.405 3.718 1.00 0.00 H new ATOM 0 HD21 ASN A 147 2.602 17.778 7.290 1.00 0.00 H new ATOM 0 HD22 ASN A 147 1.977 16.770 5.981 1.00 0.00 H new ATOM 1807 N LEU A 148 2.049 18.841 3.864 1.00 0.00 N ATOM 1808 CA LEU A 148 1.365 20.068 3.449 1.00 0.00 C ATOM 1809 C LEU A 148 2.130 20.814 2.343 1.00 0.00 C ATOM 1810 O LEU A 148 2.375 22.018 2.421 1.00 0.00 O ATOM 1811 CB LEU A 148 1.120 20.987 4.662 1.00 0.00 C ATOM 1812 CG LEU A 148 2.336 21.743 5.224 1.00 0.00 C ATOM 1813 CD1 LEU A 148 1.908 22.634 6.378 1.00 0.00 C ATOM 1814 CD2 LEU A 148 3.431 20.792 5.680 1.00 0.00 C ATOM 0 H LEU A 148 2.526 18.911 4.763 1.00 0.00 H new ATOM 0 HA LEU A 148 0.402 19.777 3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 148 0.364 21.721 4.383 1.00 0.00 H new ATOM 0 HB3 LEU A 148 0.697 20.383 5.464 1.00 0.00 H new ATOM 0 HG LEU A 148 2.743 22.357 4.421 1.00 0.00 H new ATOM 0 HD11 LEU A 148 2.776 23.165 6.769 1.00 0.00 H new ATOM 0 HD12 LEU A 148 1.170 23.355 6.027 1.00 0.00 H new ATOM 0 HD13 LEU A 148 1.471 22.022 7.167 1.00 0.00 H new ATOM 0 HD21 LEU A 148 4.272 21.366 6.070 1.00 0.00 H new ATOM 0 HD22 LEU A 148 3.043 20.139 6.462 1.00 0.00 H new ATOM 0 HD23 LEU A 148 3.764 20.189 4.835 1.00 0.00 H new ATOM 1826 N ARG A 149 2.475 20.082 1.303 1.00 0.00 N ATOM 1827 CA ARG A 149 3.040 20.655 0.095 1.00 0.00 C ATOM 1828 C ARG A 149 2.381 19.983 -1.104 1.00 0.00 C ATOM 1829 O ARG A 149 2.634 20.325 -2.258 1.00 0.00 O ATOM 1830 CB ARG A 149 4.561 20.468 0.072 1.00 0.00 C ATOM 1831 CG ARG A 149 4.996 19.022 -0.043 1.00 0.00 C ATOM 1832 CD ARG A 149 6.424 18.825 0.435 1.00 0.00 C ATOM 1833 NE ARG A 149 6.565 19.097 1.867 1.00 0.00 N ATOM 1834 CZ ARG A 149 7.081 18.241 2.752 1.00 0.00 C ATOM 1835 NH1 ARG A 149 7.483 17.033 2.371 1.00 0.00 N ATOM 1836 NH2 ARG A 149 7.185 18.592 4.026 1.00 0.00 N ATOM 0 H ARG A 149 2.371 19.068 1.271 1.00 0.00 H new ATOM 0 HA ARG A 149 2.849 21.728 0.061 1.00 0.00 H new ATOM 0 HB2 ARG A 149 4.974 21.030 -0.765 1.00 0.00 H new ATOM 0 HB3 ARG A 149 4.984 20.894 0.982 1.00 0.00 H new ATOM 0 HG2 ARG A 149 4.326 18.393 0.543 1.00 0.00 H new ATOM 0 HG3 ARG A 149 4.912 18.698 -1.080 1.00 0.00 H new ATOM 0 HD2 ARG A 149 6.738 17.802 0.228 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.088 19.482 -0.126 1.00 0.00 H new ATOM 0 HE ARG A 149 6.247 20.003 2.212 1.00 0.00 H new ATOM 0 HH11 ARG A 149 7.399 16.752 1.394 1.00 0.00 H new ATOM 0 HH12 ARG A 149 7.876 16.387 3.055 1.00 0.00 H new ATOM 0 HH21 ARG A 149 6.871 19.514 4.328 1.00 0.00 H new ATOM 0 HH22 ARG A 149 7.579 17.940 4.704 1.00 0.00 H new ATOM 1850 N GLY A 150 1.523 19.018 -0.790 1.00 0.00 N ATOM 1851 CA GLY A 150 0.717 18.350 -1.784 1.00 0.00 C ATOM 1852 C GLY A 150 -0.691 18.156 -1.264 1.00 0.00 C ATOM 1853 O GLY A 150 -1.526 19.050 -1.386 1.00 0.00 O ATOM 0 H GLY A 150 1.373 18.683 0.162 1.00 0.00 H new ATOM 0 HA2 GLY A 150 0.697 18.937 -2.702 1.00 0.00 H new ATOM 0 HA3 GLY A 150 1.158 17.385 -2.033 1.00 0.00 H new ATOM 1857 N LYS A 151 -0.956 17.000 -0.670 1.00 0.00 N ATOM 1858 CA LYS A 151 -2.202 16.800 0.058 1.00 0.00 C ATOM 1859 C LYS A 151 -2.017 17.274 1.499 1.00 0.00 C ATOM 1860 O LYS A 151 -2.447 18.370 1.861 1.00 0.00 O ATOM 1861 CB LYS A 151 -2.642 15.324 0.021 1.00 0.00 C ATOM 1862 CG LYS A 151 -4.120 15.083 0.331 1.00 0.00 C ATOM 1863 CD LYS A 151 -4.548 15.632 1.689 1.00 0.00 C ATOM 1864 CE LYS A 151 -5.910 15.084 2.091 1.00 0.00 C ATOM 1865 NZ LYS A 151 -6.378 15.635 3.388 1.00 0.00 N ATOM 0 H LYS A 151 -0.332 16.193 -0.677 1.00 0.00 H new ATOM 0 HA LYS A 151 -2.990 17.382 -0.420 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -2.423 14.920 -0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -2.040 14.763 0.736 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -4.728 15.544 -0.448 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -4.321 14.012 0.300 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.807 15.366 2.443 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -4.586 16.721 1.650 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -6.638 15.320 1.315 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -5.857 13.997 2.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -7.309 15.233 3.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.698 15.388 4.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -6.455 16.670 3.318 1.00 0.00 H new ATOM 1879 N GLN A 152 -1.339 16.453 2.303 1.00 0.00 N ATOM 1880 CA GLN A 152 -1.154 16.731 3.719 1.00 0.00 C ATOM 1881 C GLN A 152 -0.345 15.636 4.412 1.00 0.00 C ATOM 1882 O GLN A 152 0.450 15.915 5.309 1.00 0.00 O ATOM 1883 CB GLN A 152 -2.495 16.853 4.427 1.00 0.00 C ATOM 1884 CG GLN A 152 -2.332 17.100 5.903 1.00 0.00 C ATOM 1885 CD GLN A 152 -3.569 16.742 6.702 1.00 0.00 C ATOM 1886 OE1 GLN A 152 -4.471 17.561 6.873 1.00 0.00 O ATOM 1887 NE2 GLN A 152 -3.608 15.526 7.218 1.00 0.00 N ATOM 0 H GLN A 152 -0.907 15.584 1.989 1.00 0.00 H new ATOM 0 HA GLN A 152 -0.609 17.673 3.781 1.00 0.00 H new ATOM 0 HB2 GLN A 152 -3.066 17.669 3.984 1.00 0.00 H new ATOM 0 HB3 GLN A 152 -3.071 15.940 4.273 1.00 0.00 H new ATOM 0 HG2 GLN A 152 -1.487 16.519 6.272 1.00 0.00 H new ATOM 0 HG3 GLN A 152 -2.092 18.151 6.066 1.00 0.00 H new ATOM 0 HE21 GLN A 152 -2.839 14.877 7.052 1.00 0.00 H new ATOM 0 HE22 GLN A 152 -4.407 15.237 7.782 1.00 0.00 H new ATOM 1896 N SER A 153 -0.548 14.393 4.002 1.00 0.00 N ATOM 1897 CA SER A 153 0.088 13.266 4.674 1.00 0.00 C ATOM 1898 C SER A 153 0.014 11.994 3.836 1.00 0.00 C ATOM 1899 O SER A 153 0.413 10.924 4.286 1.00 0.00 O ATOM 1900 CB SER A 153 -0.564 13.043 6.040 1.00 0.00 C ATOM 1901 OG SER A 153 -1.979 13.063 5.943 1.00 0.00 O ATOM 0 H SER A 153 -1.143 14.138 3.214 1.00 0.00 H new ATOM 0 HA SER A 153 1.143 13.506 4.810 1.00 0.00 H new ATOM 0 HB2 SER A 153 -0.239 12.087 6.449 1.00 0.00 H new ATOM 0 HB3 SER A 153 -0.234 13.816 6.734 1.00 0.00 H new ATOM 0 HG SER A 153 -2.370 12.917 6.830 1.00 0.00 H new ATOM 1907 N GLN A 154 -0.489 12.119 2.614 1.00 0.00 N ATOM 1908 CA GLN A 154 -0.554 10.988 1.701 1.00 0.00 C ATOM 1909 C GLN A 154 0.838 10.653 1.229 1.00 0.00 C ATOM 1910 O GLN A 154 1.754 11.445 1.391 1.00 0.00 O ATOM 1911 CB GLN A 154 -1.472 11.286 0.518 1.00 0.00 C ATOM 1912 CG GLN A 154 -0.818 11.989 -0.653 1.00 0.00 C ATOM 1913 CD GLN A 154 -1.011 11.312 -1.973 1.00 0.00 C ATOM 1914 OE1 GLN A 154 -1.067 10.011 -1.965 1.00 0.00 O flip ATOM 1915 NE2 GLN A 154 -1.071 11.965 -3.009 1.00 0.00 N flip ATOM 0 H GLN A 154 -0.857 12.991 2.234 1.00 0.00 H new ATOM 0 HA GLN A 154 -0.973 10.130 2.227 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -1.897 10.347 0.164 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -2.302 11.899 0.870 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -1.213 13.003 -0.718 1.00 0.00 H new ATOM 0 HG3 GLN A 154 0.251 12.076 -0.457 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -1.024 12.983 -2.973 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -1.168 11.490 -3.906 1.00 0.00 H new ATOM 1924 N TRP A 155 1.003 9.491 0.667 1.00 0.00 N ATOM 1925 CA TRP A 155 2.299 9.049 0.232 1.00 0.00 C ATOM 1926 C TRP A 155 2.294 8.781 -1.261 1.00 0.00 C ATOM 1927 O TRP A 155 1.252 8.602 -1.874 1.00 0.00 O ATOM 1928 CB TRP A 155 2.684 7.802 1.018 1.00 0.00 C ATOM 1929 CG TRP A 155 3.030 8.092 2.453 1.00 0.00 C ATOM 1930 CD1 TRP A 155 2.164 8.499 3.427 1.00 0.00 C ATOM 1931 CD2 TRP A 155 4.320 8.003 3.083 1.00 0.00 C ATOM 1932 NE1 TRP A 155 2.824 8.664 4.614 1.00 0.00 N ATOM 1933 CE2 TRP A 155 4.147 8.370 4.431 1.00 0.00 C ATOM 1934 CE3 TRP A 155 5.606 7.652 2.649 1.00 0.00 C ATOM 1935 CZ2 TRP A 155 5.198 8.397 5.334 1.00 0.00 C ATOM 1936 CZ3 TRP A 155 6.645 7.681 3.553 1.00 0.00 C ATOM 1937 CH2 TRP A 155 6.438 8.052 4.878 1.00 0.00 C ATOM 0 H TRP A 155 0.249 8.825 0.497 1.00 0.00 H new ATOM 0 HA TRP A 155 3.038 9.828 0.420 1.00 0.00 H new ATOM 0 HB2 TRP A 155 1.859 7.091 0.986 1.00 0.00 H new ATOM 0 HB3 TRP A 155 3.536 7.324 0.535 1.00 0.00 H new ATOM 0 HD1 TRP A 155 1.107 8.667 3.281 1.00 0.00 H new ATOM 0 HE1 TRP A 155 2.398 8.959 5.493 1.00 0.00 H new ATOM 0 HE3 TRP A 155 5.779 7.364 1.623 1.00 0.00 H new ATOM 0 HZ2 TRP A 155 5.041 8.681 6.364 1.00 0.00 H new ATOM 0 HZ3 TRP A 155 7.639 7.411 3.227 1.00 0.00 H new ATOM 0 HH2 TRP A 155 7.275 8.067 5.560 1.00 0.00 H new ATOM 1948 N PHE A 156 3.463 8.782 -1.836 1.00 0.00 N ATOM 1949 CA PHE A 156 3.622 8.583 -3.255 1.00 0.00 C ATOM 1950 C PHE A 156 4.161 7.196 -3.495 1.00 0.00 C ATOM 1951 O PHE A 156 5.284 6.902 -3.114 1.00 0.00 O ATOM 1952 CB PHE A 156 4.582 9.634 -3.825 1.00 0.00 C ATOM 1953 CG PHE A 156 4.023 11.029 -3.800 1.00 0.00 C ATOM 1954 CD1 PHE A 156 2.880 11.344 -4.520 1.00 0.00 C ATOM 1955 CD2 PHE A 156 4.638 12.025 -3.058 1.00 0.00 C ATOM 1956 CE1 PHE A 156 2.364 12.626 -4.499 1.00 0.00 C ATOM 1957 CE2 PHE A 156 4.125 13.307 -3.033 1.00 0.00 C ATOM 1958 CZ PHE A 156 2.987 13.607 -3.755 1.00 0.00 C ATOM 0 H PHE A 156 4.340 8.921 -1.334 1.00 0.00 H new ATOM 0 HA PHE A 156 2.659 8.690 -3.755 1.00 0.00 H new ATOM 0 HB2 PHE A 156 5.512 9.613 -3.256 1.00 0.00 H new ATOM 0 HB3 PHE A 156 4.831 9.369 -4.852 1.00 0.00 H new ATOM 0 HD1 PHE A 156 2.388 10.579 -5.103 1.00 0.00 H new ATOM 0 HD2 PHE A 156 5.529 11.796 -2.493 1.00 0.00 H new ATOM 0 HE1 PHE A 156 1.474 12.860 -5.064 1.00 0.00 H new ATOM 0 HE2 PHE A 156 4.613 14.074 -2.450 1.00 0.00 H new ATOM 0 HZ PHE A 156 2.585 14.609 -3.737 1.00 0.00 H new ATOM 1968 N LEU A 157 3.355 6.345 -4.103 1.00 0.00 N ATOM 1969 CA LEU A 157 3.762 4.975 -4.338 1.00 0.00 C ATOM 1970 C LEU A 157 4.248 4.824 -5.767 1.00 0.00 C ATOM 1971 O LEU A 157 3.485 4.559 -6.691 1.00 0.00 O ATOM 1972 CB LEU A 157 2.605 4.026 -4.013 1.00 0.00 C ATOM 1973 CG LEU A 157 2.894 2.526 -4.117 1.00 0.00 C ATOM 1974 CD1 LEU A 157 4.308 2.201 -3.673 1.00 0.00 C ATOM 1975 CD2 LEU A 157 1.905 1.772 -3.249 1.00 0.00 C ATOM 0 H LEU A 157 2.421 6.578 -4.441 1.00 0.00 H new ATOM 0 HA LEU A 157 4.591 4.713 -3.681 1.00 0.00 H new ATOM 0 HB2 LEU A 157 2.267 4.237 -2.999 1.00 0.00 H new ATOM 0 HB3 LEU A 157 1.776 4.260 -4.681 1.00 0.00 H new ATOM 0 HG LEU A 157 2.792 2.226 -5.160 1.00 0.00 H new ATOM 0 HD11 LEU A 157 4.479 1.128 -3.760 1.00 0.00 H new ATOM 0 HD12 LEU A 157 5.019 2.734 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 157 4.443 2.507 -2.636 1.00 0.00 H new ATOM 0 HD21 LEU A 157 2.103 0.702 -3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 157 2.009 2.096 -2.213 1.00 0.00 H new ATOM 0 HD23 LEU A 157 0.891 1.976 -3.592 1.00 0.00 H new ATOM 1987 N VAL A 158 5.534 5.003 -5.912 1.00 0.00 N ATOM 1988 CA VAL A 158 6.212 4.955 -7.180 1.00 0.00 C ATOM 1989 C VAL A 158 7.190 3.772 -7.131 1.00 0.00 C ATOM 1990 O VAL A 158 7.442 3.248 -6.055 1.00 0.00 O ATOM 1991 CB VAL A 158 6.957 6.289 -7.379 1.00 0.00 C ATOM 1992 CG1 VAL A 158 7.907 6.547 -6.225 1.00 0.00 C ATOM 1993 CG2 VAL A 158 7.686 6.312 -8.692 1.00 0.00 C ATOM 0 H VAL A 158 6.157 5.192 -5.127 1.00 0.00 H new ATOM 0 HA VAL A 158 5.522 4.818 -8.013 1.00 0.00 H new ATOM 0 HB VAL A 158 6.218 7.090 -7.398 1.00 0.00 H new ATOM 0 HG11 VAL A 158 8.424 7.493 -6.384 1.00 0.00 H new ATOM 0 HG12 VAL A 158 7.343 6.593 -5.293 1.00 0.00 H new ATOM 0 HG13 VAL A 158 8.637 5.740 -6.168 1.00 0.00 H new ATOM 0 HG21 VAL A 158 8.202 7.265 -8.805 1.00 0.00 H new ATOM 0 HG22 VAL A 158 8.413 5.500 -8.719 1.00 0.00 H new ATOM 0 HG23 VAL A 158 6.973 6.187 -9.507 1.00 0.00 H new ATOM 2003 N LYS A 159 7.712 3.324 -8.262 1.00 0.00 N ATOM 2004 CA LYS A 159 8.713 2.255 -8.262 1.00 0.00 C ATOM 2005 C LYS A 159 9.993 2.718 -7.568 1.00 0.00 C ATOM 2006 O LYS A 159 10.368 3.887 -7.658 1.00 0.00 O ATOM 2007 CB LYS A 159 9.026 1.803 -9.692 1.00 0.00 C ATOM 2008 CG LYS A 159 10.181 0.813 -9.789 1.00 0.00 C ATOM 2009 CD LYS A 159 10.344 0.271 -11.201 1.00 0.00 C ATOM 2010 CE LYS A 159 11.685 -0.427 -11.381 1.00 0.00 C ATOM 2011 NZ LYS A 159 11.844 -1.591 -10.467 1.00 0.00 N ATOM 0 H LYS A 159 7.466 3.677 -9.187 1.00 0.00 H new ATOM 0 HA LYS A 159 8.302 1.408 -7.712 1.00 0.00 H new ATOM 0 HB2 LYS A 159 8.134 1.348 -10.122 1.00 0.00 H new ATOM 0 HB3 LYS A 159 9.260 2.679 -10.296 1.00 0.00 H new ATOM 0 HG2 LYS A 159 11.105 1.301 -9.478 1.00 0.00 H new ATOM 0 HG3 LYS A 159 10.010 -0.014 -9.100 1.00 0.00 H new ATOM 0 HD2 LYS A 159 9.537 -0.428 -11.418 1.00 0.00 H new ATOM 0 HD3 LYS A 159 10.259 1.088 -11.917 1.00 0.00 H new ATOM 0 HE2 LYS A 159 11.781 -0.763 -12.413 1.00 0.00 H new ATOM 0 HE3 LYS A 159 12.490 0.286 -11.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 12.734 -2.084 -10.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 11.864 -1.259 -9.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 11.046 -2.245 -10.596 1.00 0.00 H new ATOM 2025 N ALA A 160 10.644 1.796 -6.857 1.00 0.00 N ATOM 2026 CA ALA A 160 11.908 2.080 -6.189 1.00 0.00 C ATOM 2027 C ALA A 160 12.948 2.484 -7.217 1.00 0.00 C ATOM 2028 O ALA A 160 13.389 1.661 -8.019 1.00 0.00 O ATOM 2029 CB ALA A 160 12.400 0.860 -5.412 1.00 0.00 C ATOM 0 H ALA A 160 10.311 0.840 -6.731 1.00 0.00 H new ATOM 0 HA ALA A 160 11.750 2.897 -5.484 1.00 0.00 H new ATOM 0 HB1 ALA A 160 13.345 1.097 -4.922 1.00 0.00 H new ATOM 0 HB2 ALA A 160 11.660 0.585 -4.660 1.00 0.00 H new ATOM 0 HB3 ALA A 160 12.546 0.026 -6.099 1.00 0.00 H new