USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 741 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 126 MET CE :methyl -153:sc= -2.33 (180deg=-0.163) USER MOD Set 1.2: A 144 SER OG : rot 110:sc= -1.52 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.0947 K(o=-0.095,f=-3.3!) USER MOD Single : A 105 CYS SG : rot 180:sc= -4.26! USER MOD Single : A 107 ASN : amide:sc= -5.72! C(o=-5.7!,f=-8.4!) USER MOD Single : A 113 LYS NZ :NH3+ -132:sc= -0.167 (180deg=-0.656) USER MOD Single : A 120 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.177) USER MOD Single : A 122 SER OG : rot 26:sc= -0.883 USER MOD Single : A 125 LYS NZ :NH3+ -154:sc= 1.23 (180deg=0.79) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot -73:sc= 0.379 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0.946 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 ASN : amide:sc= -2.36! K(o=-2.4!,f=0) USER MOD Single : A 153 LYS NZ :NH3+ -121:sc= -0.0414 (180deg=-0.421) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= -2 K(o=-2,f=-5.1!) USER MOD Single : A 157 SER OG : rot -97:sc= 1.24 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 125:sc= 1.05 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= -0.828 K(o=-0.83,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 90 8.585 9.214 9.668 1.00 0.96 N ATOM 12 CA ALA A 90 7.395 8.546 9.059 1.00 0.72 C ATOM 13 C ALA A 90 6.369 8.269 10.157 1.00 0.58 C ATOM 14 O ALA A 90 6.604 8.615 11.299 1.00 1.23 O ATOM 15 CB ALA A 90 7.932 7.237 8.458 1.00 1.03 C ATOM 0 HA ALA A 90 6.904 9.152 8.298 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.114 6.689 7.991 1.00 1.03 H new ATOM 0 HB2 ALA A 90 8.691 7.465 7.709 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.373 6.628 9.247 1.00 1.03 H new ATOM 21 N PRO A 91 5.256 7.655 9.807 1.00 0.79 N ATOM 22 CA PRO A 91 4.230 7.359 10.833 1.00 1.10 C ATOM 23 C PRO A 91 4.832 6.431 11.901 1.00 0.60 C ATOM 24 O PRO A 91 5.115 5.282 11.623 1.00 0.91 O ATOM 25 CB PRO A 91 3.103 6.692 10.041 1.00 1.98 C ATOM 26 CG PRO A 91 3.770 6.168 8.817 1.00 2.18 C ATOM 27 CD PRO A 91 4.841 7.169 8.480 1.00 1.62 C ATOM 0 HA PRO A 91 3.867 8.235 11.371 1.00 1.10 H new ATOM 0 HB2 PRO A 91 2.636 5.890 10.613 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.317 7.405 9.791 1.00 1.98 H new ATOM 0 HG2 PRO A 91 4.198 5.181 8.996 1.00 2.18 H new ATOM 0 HG3 PRO A 91 3.059 6.064 7.997 1.00 2.18 H new ATOM 0 HD2 PRO A 91 5.669 6.710 7.939 1.00 1.62 H new ATOM 0 HD3 PRO A 91 4.459 7.976 7.854 1.00 1.62 H new ATOM 35 N PRO A 92 5.038 6.964 13.090 1.00 0.59 N ATOM 36 CA PRO A 92 5.645 6.158 14.180 1.00 0.84 C ATOM 37 C PRO A 92 4.775 4.931 14.486 1.00 0.71 C ATOM 38 O PRO A 92 5.275 3.888 14.867 1.00 0.83 O ATOM 39 CB PRO A 92 5.729 7.143 15.352 1.00 1.49 C ATOM 40 CG PRO A 92 4.703 8.180 15.044 1.00 1.64 C ATOM 41 CD PRO A 92 4.721 8.328 13.547 1.00 1.21 C ATOM 0 HA PRO A 92 6.625 5.748 13.935 1.00 0.84 H new ATOM 0 HB2 PRO A 92 5.521 6.649 16.301 1.00 1.49 H new ATOM 0 HB3 PRO A 92 6.724 7.581 15.432 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.718 7.875 15.397 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.939 9.124 15.535 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.760 8.671 13.163 1.00 1.21 H new ATOM 0 HD3 PRO A 92 5.471 9.049 13.220 1.00 1.21 H new ATOM 49 N GLY A 93 3.482 5.039 14.296 1.00 0.65 N ATOM 50 CA GLY A 93 2.589 3.866 14.544 1.00 0.71 C ATOM 51 C GLY A 93 2.402 3.043 13.263 1.00 0.58 C ATOM 52 O GLY A 93 1.318 2.560 12.991 1.00 0.58 O ATOM 0 H GLY A 93 3.009 5.886 13.981 1.00 0.65 H new ATOM 0 HA2 GLY A 93 3.015 3.238 15.326 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.620 4.211 14.905 1.00 0.71 H new ATOM 56 N GLU A 94 3.434 2.883 12.472 1.00 0.56 N ATOM 57 CA GLU A 94 3.293 2.095 11.206 1.00 0.55 C ATOM 58 C GLU A 94 2.955 0.635 11.500 1.00 0.49 C ATOM 59 O GLU A 94 2.477 -0.069 10.639 1.00 0.53 O ATOM 60 CB GLU A 94 4.642 2.219 10.486 1.00 0.66 C ATOM 61 CG GLU A 94 5.734 1.473 11.263 1.00 1.09 C ATOM 62 CD GLU A 94 7.080 1.599 10.537 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.082 1.963 9.370 1.00 1.62 O ATOM 64 OE2 GLU A 94 8.090 1.330 11.165 1.00 1.44 O ATOM 0 H GLU A 94 4.365 3.262 12.646 1.00 0.56 H new ATOM 0 HA GLU A 94 2.478 2.474 10.590 1.00 0.55 H new ATOM 0 HB2 GLU A 94 4.562 1.812 9.478 1.00 0.66 H new ATOM 0 HB3 GLU A 94 4.912 3.270 10.385 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.816 1.880 12.271 1.00 1.09 H new ATOM 0 HG3 GLU A 94 5.464 0.422 11.365 1.00 1.09 H new ATOM 71 N ALA A 95 3.196 0.173 12.699 1.00 0.49 N ATOM 72 CA ALA A 95 2.890 -1.254 13.022 1.00 0.50 C ATOM 73 C ALA A 95 1.421 -1.573 12.727 1.00 0.38 C ATOM 74 O ALA A 95 1.102 -2.661 12.282 1.00 0.36 O ATOM 75 CB ALA A 95 3.198 -1.405 14.515 1.00 0.61 C ATOM 0 H ALA A 95 3.590 0.718 13.466 1.00 0.49 H new ATOM 0 HA ALA A 95 3.480 -1.944 12.419 1.00 0.50 H new ATOM 0 HB1 ALA A 95 2.997 -2.430 14.826 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.247 -1.170 14.696 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.570 -0.722 15.087 1.00 0.61 H new ATOM 81 N TYR A 96 0.526 -0.642 12.956 1.00 0.38 N ATOM 82 CA TYR A 96 -0.912 -0.919 12.663 1.00 0.35 C ATOM 83 C TYR A 96 -1.134 -1.044 11.154 1.00 0.28 C ATOM 84 O TYR A 96 -1.496 -2.098 10.663 1.00 0.29 O ATOM 85 CB TYR A 96 -1.693 0.267 13.226 1.00 0.42 C ATOM 86 CG TYR A 96 -2.990 -0.226 13.830 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.850 -1.048 13.085 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.331 0.137 15.138 1.00 1.54 C ATOM 89 CE1 TYR A 96 -5.045 -1.504 13.651 1.00 1.85 C ATOM 90 CE2 TYR A 96 -4.528 -0.319 15.702 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.384 -1.140 14.958 1.00 1.77 C ATOM 92 OH TYR A 96 -6.561 -1.592 15.516 1.00 2.32 O ATOM 0 H TYR A 96 0.727 0.286 13.329 1.00 0.38 H new ATOM 0 HA TYR A 96 -1.239 -1.857 13.112 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.100 0.781 13.982 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -1.898 0.989 12.436 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -3.589 -1.328 12.075 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.670 0.769 15.712 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.706 -2.138 13.078 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -4.791 -0.038 16.711 1.00 1.93 H new ATOM 0 HH TYR A 96 -6.643 -1.248 16.430 1.00 2.32 H new ATOM 102 N LEU A 97 -0.906 0.017 10.406 1.00 0.42 N ATOM 103 CA LEU A 97 -1.096 -0.071 8.925 1.00 0.55 C ATOM 104 C LEU A 97 -0.137 -1.108 8.350 1.00 0.43 C ATOM 105 O LEU A 97 -0.402 -1.680 7.320 1.00 0.35 O ATOM 106 CB LEU A 97 -0.833 1.322 8.341 1.00 0.90 C ATOM 107 CG LEU A 97 0.519 1.858 8.826 1.00 0.94 C ATOM 108 CD1 LEU A 97 1.331 2.381 7.635 1.00 1.33 C ATOM 109 CD2 LEU A 97 0.286 3.003 9.827 1.00 1.75 C ATOM 0 H LEU A 97 -0.601 0.926 10.755 1.00 0.42 H new ATOM 0 HA LEU A 97 -2.109 -0.385 8.671 1.00 0.55 H new ATOM 0 HB2 LEU A 97 -0.843 1.275 7.252 1.00 0.90 H new ATOM 0 HB3 LEU A 97 -1.630 2.004 8.638 1.00 0.90 H new ATOM 0 HG LEU A 97 1.071 1.052 9.311 1.00 0.94 H new ATOM 0 HD11 LEU A 97 2.290 2.760 7.987 1.00 1.33 H new ATOM 0 HD12 LEU A 97 1.499 1.571 6.926 1.00 1.33 H new ATOM 0 HD13 LEU A 97 0.781 3.184 7.144 1.00 1.33 H new ATOM 0 HD21 LEU A 97 1.246 3.385 10.173 1.00 1.75 H new ATOM 0 HD22 LEU A 97 -0.269 3.805 9.340 1.00 1.75 H new ATOM 0 HD23 LEU A 97 -0.284 2.632 10.678 1.00 1.75 H new ATOM 121 N GLN A 98 0.968 -1.379 9.017 1.00 0.47 N ATOM 122 CA GLN A 98 1.902 -2.425 8.491 1.00 0.49 C ATOM 123 C GLN A 98 1.170 -3.772 8.476 1.00 0.38 C ATOM 124 O GLN A 98 1.266 -4.530 7.528 1.00 0.39 O ATOM 125 CB GLN A 98 3.088 -2.459 9.462 1.00 0.63 C ATOM 126 CG GLN A 98 4.078 -3.543 9.032 1.00 0.57 C ATOM 127 CD GLN A 98 5.286 -3.532 9.969 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.163 -3.220 11.137 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.458 -3.865 9.502 1.00 2.04 N ATOM 0 H GLN A 98 1.256 -0.929 9.886 1.00 0.47 H new ATOM 0 HA GLN A 98 2.243 -2.215 7.477 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.583 -1.488 9.480 1.00 0.63 H new ATOM 0 HB3 GLN A 98 2.736 -2.656 10.474 1.00 0.63 H new ATOM 0 HG2 GLN A 98 3.596 -4.520 9.055 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.400 -3.370 8.005 1.00 0.57 H new ATOM 0 HE21 GLN A 98 6.561 -4.127 8.522 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.271 -3.864 10.117 1.00 2.04 H new ATOM 138 N VAL A 99 0.409 -4.059 9.512 1.00 0.33 N ATOM 139 CA VAL A 99 -0.358 -5.343 9.542 1.00 0.31 C ATOM 140 C VAL A 99 -1.363 -5.335 8.386 1.00 0.24 C ATOM 141 O VAL A 99 -1.441 -6.269 7.607 1.00 0.30 O ATOM 142 CB VAL A 99 -1.074 -5.360 10.899 1.00 0.32 C ATOM 143 CG1 VAL A 99 -1.960 -6.606 11.005 1.00 0.43 C ATOM 144 CG2 VAL A 99 -0.033 -5.379 12.024 1.00 0.43 C ATOM 0 H VAL A 99 0.289 -3.462 10.330 1.00 0.33 H new ATOM 0 HA VAL A 99 0.273 -6.225 9.429 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.695 -4.469 10.988 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.465 -6.612 11.971 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.702 -6.594 10.207 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.343 -7.500 10.913 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.540 -5.391 12.989 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.589 -6.269 11.930 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.594 -4.490 11.955 1.00 0.43 H new ATOM 154 N ALA A 100 -2.107 -4.262 8.254 1.00 0.18 N ATOM 155 CA ALA A 100 -3.085 -4.158 7.127 1.00 0.18 C ATOM 156 C ALA A 100 -2.313 -4.196 5.811 1.00 0.14 C ATOM 157 O ALA A 100 -2.660 -4.911 4.900 1.00 0.14 O ATOM 158 CB ALA A 100 -3.774 -2.804 7.313 1.00 0.24 C ATOM 0 H ALA A 100 -2.078 -3.455 8.878 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.813 -4.969 7.114 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.508 -2.657 6.520 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.276 -2.781 8.280 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -3.030 -2.008 7.271 1.00 0.24 H new ATOM 164 N PHE A 101 -1.235 -3.455 5.737 1.00 0.15 N ATOM 165 CA PHE A 101 -0.378 -3.450 4.507 1.00 0.16 C ATOM 166 C PHE A 101 0.079 -4.873 4.178 1.00 0.17 C ATOM 167 O PHE A 101 0.456 -5.153 3.072 1.00 0.20 O ATOM 168 CB PHE A 101 0.851 -2.599 4.880 1.00 0.19 C ATOM 169 CG PHE A 101 0.599 -1.096 4.750 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.700 -0.548 4.768 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.704 -0.240 4.630 1.00 1.10 C ATOM 172 CE1 PHE A 101 -0.877 0.839 4.664 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.521 1.143 4.529 1.00 1.10 C ATOM 174 CZ PHE A 101 0.234 1.682 4.546 1.00 0.43 C ATOM 0 H PHE A 101 -0.907 -2.845 6.486 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.914 -3.061 3.641 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.145 -2.825 5.905 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.687 -2.878 4.239 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.559 -1.196 4.862 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.702 -0.652 4.616 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -1.872 1.258 4.675 1.00 1.26 H new ATOM 0 HE2 PHE A 101 2.377 1.795 4.438 1.00 1.10 H new ATOM 0 HZ PHE A 101 0.095 2.750 4.468 1.00 0.43 H new ATOM 184 N ASP A 102 0.061 -5.766 5.133 1.00 0.18 N ATOM 185 CA ASP A 102 0.515 -7.164 4.862 1.00 0.21 C ATOM 186 C ASP A 102 -0.593 -7.990 4.217 1.00 0.20 C ATOM 187 O ASP A 102 -0.395 -8.595 3.179 1.00 0.22 O ATOM 188 CB ASP A 102 0.860 -7.728 6.228 1.00 0.25 C ATOM 189 CG ASP A 102 1.739 -8.969 6.066 1.00 0.32 C ATOM 190 OD1 ASP A 102 1.244 -9.958 5.551 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.892 -8.910 6.458 1.00 1.13 O ATOM 0 H ASP A 102 -0.248 -5.589 6.089 1.00 0.18 H new ATOM 0 HA ASP A 102 1.358 -7.187 4.171 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.381 -6.977 6.821 1.00 0.25 H new ATOM 0 HB3 ASP A 102 -0.052 -7.984 6.767 1.00 0.25 H new ATOM 196 N ILE A 103 -1.756 -8.033 4.824 1.00 0.18 N ATOM 197 CA ILE A 103 -2.866 -8.840 4.233 1.00 0.18 C ATOM 198 C ILE A 103 -3.244 -8.256 2.874 1.00 0.17 C ATOM 199 O ILE A 103 -3.478 -8.967 1.908 1.00 0.18 O ATOM 200 CB ILE A 103 -4.048 -8.759 5.235 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.662 -7.341 5.275 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.568 -9.153 6.638 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.818 -7.286 6.285 1.00 0.87 C ATOM 0 H ILE A 103 -1.981 -7.549 5.693 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.582 -9.880 4.072 1.00 0.18 H new ATOM 0 HB ILE A 103 -4.820 -9.452 4.899 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.897 -6.614 5.548 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -5.023 -7.066 4.284 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.402 -9.094 7.338 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.182 -10.172 6.618 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.778 -8.473 6.957 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -6.240 -6.281 6.301 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.590 -7.999 5.994 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.446 -7.539 7.278 1.00 0.87 H new ATOM 215 N VAL A 104 -3.306 -6.959 2.805 1.00 0.16 N ATOM 216 CA VAL A 104 -3.681 -6.299 1.527 1.00 0.16 C ATOM 217 C VAL A 104 -2.580 -6.476 0.473 1.00 0.17 C ATOM 218 O VAL A 104 -2.858 -6.690 -0.692 1.00 0.18 O ATOM 219 CB VAL A 104 -3.922 -4.823 1.863 1.00 0.16 C ATOM 220 CG1 VAL A 104 -4.974 -4.697 2.972 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.626 -4.141 2.307 1.00 0.14 C ATOM 0 H VAL A 104 -3.113 -6.325 3.580 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.577 -6.744 1.095 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.283 -4.329 0.961 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.136 -3.644 3.202 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -5.910 -5.144 2.638 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.624 -5.213 3.866 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.826 -3.095 2.539 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.237 -4.641 3.194 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.890 -4.200 1.505 1.00 0.14 H new ATOM 231 N CYS A 105 -1.336 -6.392 0.875 1.00 0.18 N ATOM 232 CA CYS A 105 -0.209 -6.567 -0.105 1.00 0.19 C ATOM 233 C CYS A 105 -0.290 -7.942 -0.743 1.00 0.20 C ATOM 234 O CYS A 105 -0.224 -8.085 -1.949 1.00 0.21 O ATOM 235 CB CYS A 105 1.063 -6.415 0.723 1.00 0.22 C ATOM 236 SG CYS A 105 2.528 -6.632 -0.316 1.00 0.29 S ATOM 0 H CYS A 105 -1.048 -6.210 1.837 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.242 -5.842 -0.918 1.00 0.19 H new ATOM 0 HB2 CYS A 105 1.084 -5.430 1.190 1.00 0.22 H new ATOM 0 HB3 CYS A 105 1.069 -7.150 1.528 1.00 0.22 H new ATOM 0 HG CYS A 105 3.598 -6.496 0.409 1.00 0.29 H new ATOM 242 N ASP A 106 -0.452 -8.947 0.060 1.00 0.21 N ATOM 243 CA ASP A 106 -0.566 -10.321 -0.499 1.00 0.24 C ATOM 244 C ASP A 106 -1.880 -10.436 -1.293 1.00 0.25 C ATOM 245 O ASP A 106 -2.070 -11.363 -2.057 1.00 0.28 O ATOM 246 CB ASP A 106 -0.579 -11.248 0.712 1.00 0.25 C ATOM 247 CG ASP A 106 0.738 -11.119 1.490 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.708 -10.647 0.917 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.750 -11.492 2.651 1.00 1.05 O ATOM 0 H ASP A 106 -0.511 -8.881 1.076 1.00 0.21 H new ATOM 0 HA ASP A 106 0.249 -10.571 -1.178 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.419 -11.000 1.361 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.720 -12.279 0.389 1.00 0.25 H new ATOM 254 N ASN A 107 -2.786 -9.493 -1.121 1.00 0.24 N ATOM 255 CA ASN A 107 -4.075 -9.535 -1.861 1.00 0.26 C ATOM 256 C ASN A 107 -3.959 -8.741 -3.170 1.00 0.26 C ATOM 257 O ASN A 107 -3.819 -9.312 -4.235 1.00 0.29 O ATOM 258 CB ASN A 107 -5.085 -8.883 -0.912 1.00 0.25 C ATOM 259 CG ASN A 107 -6.500 -9.105 -1.450 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.082 -8.219 -2.044 1.00 1.02 O ATOM 261 ND2 ASN A 107 -7.083 -10.258 -1.265 1.00 1.23 N ATOM 0 H ASN A 107 -2.677 -8.696 -0.494 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.370 -10.547 -2.137 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.992 -9.310 0.086 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -4.881 -7.816 -0.822 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -8.027 -10.415 -1.619 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -6.595 -11.002 -0.766 1.00 1.23 H new ATOM 268 N VAL A 108 -4.016 -7.433 -3.100 1.00 0.23 N ATOM 269 CA VAL A 108 -3.906 -6.603 -4.327 1.00 0.24 C ATOM 270 C VAL A 108 -2.511 -5.969 -4.387 1.00 0.25 C ATOM 271 O VAL A 108 -2.340 -4.820 -4.730 1.00 0.42 O ATOM 272 CB VAL A 108 -5.063 -5.590 -4.197 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.649 -4.312 -3.445 1.00 0.27 C ATOM 274 CG2 VAL A 108 -5.580 -5.232 -5.592 1.00 0.27 C ATOM 0 H VAL A 108 -4.135 -6.906 -2.235 1.00 0.23 H new ATOM 0 HA VAL A 108 -3.998 -7.153 -5.264 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.851 -6.062 -3.610 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.501 -3.635 -3.383 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.318 -4.572 -2.440 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -3.835 -3.823 -3.980 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -6.398 -4.516 -5.504 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.773 -4.791 -6.177 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -5.938 -6.133 -6.090 1.00 0.27 H new ATOM 284 N GLY A 109 -1.526 -6.719 -3.992 1.00 0.24 N ATOM 285 CA GLY A 109 -0.118 -6.226 -3.939 1.00 0.22 C ATOM 286 C GLY A 109 0.239 -5.325 -5.156 1.00 0.23 C ATOM 287 O GLY A 109 0.646 -4.193 -4.995 1.00 0.21 O ATOM 0 H GLY A 109 -1.639 -7.687 -3.693 1.00 0.24 H new ATOM 0 HA2 GLY A 109 0.033 -5.664 -3.017 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.562 -7.078 -3.909 1.00 0.22 H new ATOM 291 N ARG A 110 0.102 -5.829 -6.361 1.00 0.27 N ATOM 292 CA ARG A 110 0.455 -5.017 -7.582 1.00 0.28 C ATOM 293 C ARG A 110 -0.403 -3.743 -7.709 1.00 0.27 C ATOM 294 O ARG A 110 0.009 -2.762 -8.326 1.00 0.27 O ATOM 295 CB ARG A 110 0.211 -5.953 -8.770 1.00 0.36 C ATOM 296 CG ARG A 110 1.538 -6.577 -9.222 1.00 0.55 C ATOM 297 CD ARG A 110 1.681 -7.988 -8.636 1.00 0.72 C ATOM 298 NE ARG A 110 1.187 -8.903 -9.706 1.00 1.08 N ATOM 299 CZ ARG A 110 1.368 -10.189 -9.596 1.00 1.39 C ATOM 300 NH1 ARG A 110 2.465 -10.734 -10.043 1.00 1.68 N ATOM 301 NH2 ARG A 110 0.450 -10.930 -9.038 1.00 2.06 N ATOM 0 H ARG A 110 -0.240 -6.770 -6.557 1.00 0.27 H new ATOM 0 HA ARG A 110 1.486 -4.667 -7.530 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -0.493 -6.737 -8.489 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.240 -5.400 -9.594 1.00 0.36 H new ATOM 0 HG2 ARG A 110 1.577 -6.621 -10.310 1.00 0.55 H new ATOM 0 HG3 ARG A 110 2.371 -5.954 -8.898 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.718 -8.205 -8.379 1.00 0.72 H new ATOM 0 HD3 ARG A 110 1.096 -8.097 -7.723 1.00 0.72 H new ATOM 0 HE ARG A 110 0.708 -8.523 -10.522 1.00 1.08 H new ATOM 0 HH11 ARG A 110 3.182 -10.154 -10.479 1.00 1.68 H new ATOM 0 HH12 ARG A 110 2.606 -11.740 -9.957 1.00 1.68 H new ATOM 0 HH21 ARG A 110 -0.408 -10.503 -8.689 1.00 2.06 H new ATOM 0 HH22 ARG A 110 0.590 -11.937 -8.951 1.00 2.06 H new ATOM 315 N ASP A 111 -1.579 -3.732 -7.134 1.00 0.27 N ATOM 316 CA ASP A 111 -2.435 -2.511 -7.239 1.00 0.30 C ATOM 317 C ASP A 111 -1.803 -1.364 -6.440 1.00 0.31 C ATOM 318 O ASP A 111 -2.159 -0.216 -6.618 1.00 0.39 O ATOM 319 CB ASP A 111 -3.808 -2.912 -6.679 1.00 0.30 C ATOM 320 CG ASP A 111 -4.705 -3.409 -7.816 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.177 -3.971 -8.761 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.907 -3.218 -7.721 1.00 0.82 O ATOM 0 H ASP A 111 -1.980 -4.505 -6.603 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.532 -2.156 -8.265 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.691 -3.693 -5.928 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.272 -2.060 -6.183 1.00 0.30 H new ATOM 327 N TRP A 112 -0.833 -1.652 -5.596 1.00 0.27 N ATOM 328 CA TRP A 112 -0.154 -0.549 -4.853 1.00 0.29 C ATOM 329 C TRP A 112 0.763 0.169 -5.833 1.00 0.32 C ATOM 330 O TRP A 112 0.920 1.371 -5.783 1.00 0.31 O ATOM 331 CB TRP A 112 0.642 -1.200 -3.723 1.00 0.29 C ATOM 332 CG TRP A 112 -0.304 -1.948 -2.855 1.00 0.25 C ATOM 333 CD1 TRP A 112 -0.166 -3.241 -2.508 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.543 -1.486 -2.241 1.00 0.25 C ATOM 335 NE1 TRP A 112 -1.248 -3.610 -1.737 1.00 0.20 N ATOM 336 CE2 TRP A 112 -2.115 -2.566 -1.541 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.224 -0.253 -2.222 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -3.308 -2.441 -0.855 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.437 -0.125 -1.520 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.975 -1.227 -0.838 1.00 0.27 C ATOM 0 H TRP A 112 -0.490 -2.592 -5.395 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.852 0.175 -4.433 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.397 -1.873 -4.129 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.169 -0.442 -3.144 1.00 0.29 H new ATOM 0 HD1 TRP A 112 0.656 -3.883 -2.787 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -1.387 -4.547 -1.358 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -1.814 0.597 -2.748 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.721 -3.291 -0.332 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -3.955 0.823 -1.506 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.907 -1.129 -0.301 1.00 0.27 H new ATOM 351 N LYS A 113 1.347 -0.567 -6.761 1.00 0.37 N ATOM 352 CA LYS A 113 2.224 0.078 -7.786 1.00 0.40 C ATOM 353 C LYS A 113 1.366 1.071 -8.566 1.00 0.34 C ATOM 354 O LYS A 113 1.773 2.178 -8.863 1.00 0.30 O ATOM 355 CB LYS A 113 2.714 -1.049 -8.702 1.00 0.50 C ATOM 356 CG LYS A 113 3.663 -1.971 -7.930 1.00 0.72 C ATOM 357 CD LYS A 113 4.417 -2.882 -8.907 1.00 0.89 C ATOM 358 CE LYS A 113 3.432 -3.795 -9.646 1.00 1.51 C ATOM 359 NZ LYS A 113 3.235 -3.155 -10.977 1.00 1.66 N ATOM 0 H LYS A 113 1.251 -1.579 -6.847 1.00 0.37 H new ATOM 0 HA LYS A 113 3.073 0.607 -7.353 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.865 -1.619 -9.078 1.00 0.50 H new ATOM 0 HB3 LYS A 113 3.225 -0.629 -9.568 1.00 0.50 H new ATOM 0 HG2 LYS A 113 4.372 -1.377 -7.353 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.099 -2.574 -7.219 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.972 -2.278 -9.624 1.00 0.89 H new ATOM 0 HD3 LYS A 113 5.146 -3.484 -8.365 1.00 0.89 H new ATOM 0 HE2 LYS A 113 3.831 -4.804 -9.749 1.00 1.51 H new ATOM 0 HE3 LYS A 113 2.489 -3.878 -9.105 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 2.218 -3.101 -11.189 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 3.637 -2.196 -10.964 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 3.712 -3.720 -11.708 1.00 1.66 H new ATOM 373 N ARG A 114 0.148 0.677 -8.855 1.00 0.35 N ATOM 374 CA ARG A 114 -0.800 1.595 -9.572 1.00 0.33 C ATOM 375 C ARG A 114 -1.009 2.848 -8.706 1.00 0.28 C ATOM 376 O ARG A 114 -0.951 3.974 -9.179 1.00 0.29 O ATOM 377 CB ARG A 114 -2.099 0.779 -9.685 1.00 0.37 C ATOM 378 CG ARG A 114 -3.266 1.642 -10.188 1.00 0.38 C ATOM 379 CD ARG A 114 -4.562 1.166 -9.522 1.00 0.43 C ATOM 380 NE ARG A 114 -5.631 2.015 -10.114 1.00 0.57 N ATOM 381 CZ ARG A 114 -5.994 3.117 -9.519 1.00 1.04 C ATOM 382 NH1 ARG A 114 -6.385 3.089 -8.274 1.00 1.62 N ATOM 383 NH2 ARG A 114 -5.965 4.249 -10.167 1.00 1.77 N ATOM 0 H ARG A 114 -0.233 -0.241 -8.626 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.447 1.925 -10.549 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -1.945 -0.059 -10.365 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.350 0.357 -8.712 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.086 2.691 -9.955 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.350 1.567 -11.272 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -4.742 0.109 -9.719 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.517 1.285 -8.439 1.00 0.43 H new ATOM 0 HE ARG A 114 -6.080 1.735 -10.986 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -6.407 2.205 -7.766 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -6.669 3.951 -7.809 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -5.658 4.272 -11.140 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -6.249 5.111 -9.701 1.00 1.77 H new ATOM 397 N LEU A 115 -1.228 2.646 -7.433 1.00 0.26 N ATOM 398 CA LEU A 115 -1.422 3.800 -6.511 1.00 0.25 C ATOM 399 C LEU A 115 -0.093 4.534 -6.345 1.00 0.25 C ATOM 400 O LEU A 115 -0.060 5.721 -6.083 1.00 0.26 O ATOM 401 CB LEU A 115 -1.885 3.200 -5.180 1.00 0.26 C ATOM 402 CG LEU A 115 -3.304 2.649 -5.332 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.694 1.893 -4.060 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.283 3.806 -5.554 1.00 0.23 C ATOM 0 H LEU A 115 -1.281 1.728 -6.992 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.152 4.517 -6.886 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.206 2.405 -4.872 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -1.861 3.960 -4.399 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.341 1.973 -6.186 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.705 1.499 -4.166 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -2.999 1.069 -3.899 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.656 2.571 -3.208 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.293 3.412 -5.662 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.247 4.482 -4.700 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.006 4.348 -6.458 1.00 0.23 H new ATOM 416 N ALA A 116 1.009 3.838 -6.517 1.00 0.26 N ATOM 417 CA ALA A 116 2.345 4.498 -6.393 1.00 0.28 C ATOM 418 C ALA A 116 2.425 5.634 -7.413 1.00 0.26 C ATOM 419 O ALA A 116 2.793 6.755 -7.094 1.00 0.27 O ATOM 420 CB ALA A 116 3.366 3.406 -6.723 1.00 0.31 C ATOM 0 H ALA A 116 1.038 2.843 -6.738 1.00 0.26 H new ATOM 0 HA ALA A 116 2.523 4.920 -5.404 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.373 3.816 -6.653 1.00 0.31 H new ATOM 0 HB2 ALA A 116 3.259 2.583 -6.017 1.00 0.31 H new ATOM 0 HB3 ALA A 116 3.193 3.040 -7.735 1.00 0.31 H new ATOM 426 N ARG A 117 2.033 5.360 -8.635 1.00 0.27 N ATOM 427 CA ARG A 117 2.036 6.427 -9.677 1.00 0.30 C ATOM 428 C ARG A 117 1.092 7.546 -9.226 1.00 0.32 C ATOM 429 O ARG A 117 1.390 8.717 -9.360 1.00 0.33 O ATOM 430 CB ARG A 117 1.524 5.758 -10.957 1.00 0.35 C ATOM 431 CG ARG A 117 2.579 4.776 -11.476 1.00 0.37 C ATOM 432 CD ARG A 117 2.129 4.200 -12.822 1.00 1.31 C ATOM 433 NE ARG A 117 3.179 3.207 -13.185 1.00 1.53 N ATOM 434 CZ ARG A 117 3.484 3.006 -14.439 1.00 1.93 C ATOM 435 NH1 ARG A 117 4.401 3.737 -15.012 1.00 2.61 N ATOM 436 NH2 ARG A 117 2.873 2.075 -15.119 1.00 2.24 N ATOM 0 H ARG A 117 1.713 4.445 -8.952 1.00 0.27 H new ATOM 0 HA ARG A 117 3.021 6.863 -9.840 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.590 5.233 -10.757 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.310 6.512 -11.714 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.538 5.283 -11.588 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.726 3.971 -10.756 1.00 0.37 H new ATOM 0 HD2 ARG A 117 1.150 3.728 -12.742 1.00 1.31 H new ATOM 0 HD3 ARG A 117 2.046 4.981 -13.578 1.00 1.31 H new ATOM 0 HE ARG A 117 3.660 2.684 -12.453 1.00 1.53 H new ATOM 0 HH11 ARG A 117 4.879 4.465 -14.481 1.00 2.61 H new ATOM 0 HH12 ARG A 117 4.640 3.581 -15.991 1.00 2.61 H new ATOM 0 HH21 ARG A 117 2.157 1.503 -14.671 1.00 2.24 H new ATOM 0 HH22 ARG A 117 3.112 1.919 -16.098 1.00 2.24 H new ATOM 450 N GLU A 118 -0.032 7.178 -8.656 1.00 0.34 N ATOM 451 CA GLU A 118 -0.992 8.209 -8.152 1.00 0.39 C ATOM 452 C GLU A 118 -0.334 8.991 -7.007 1.00 0.39 C ATOM 453 O GLU A 118 -0.495 10.190 -6.886 1.00 0.41 O ATOM 454 CB GLU A 118 -2.210 7.427 -7.652 1.00 0.43 C ATOM 455 CG GLU A 118 -2.896 6.733 -8.834 1.00 0.47 C ATOM 456 CD GLU A 118 -3.428 7.777 -9.823 1.00 0.53 C ATOM 457 OE1 GLU A 118 -3.720 8.882 -9.394 1.00 0.76 O ATOM 458 OE2 GLU A 118 -3.534 7.452 -10.994 1.00 1.45 O ATOM 0 H GLU A 118 -0.324 6.210 -8.519 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.279 8.929 -8.919 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -1.902 6.688 -6.912 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -2.909 8.101 -7.157 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -2.190 6.071 -9.336 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.716 6.111 -8.474 1.00 0.47 H new ATOM 465 N LEU A 119 0.424 8.311 -6.177 1.00 0.37 N ATOM 466 CA LEU A 119 1.121 9.000 -5.043 1.00 0.38 C ATOM 467 C LEU A 119 2.308 9.825 -5.565 1.00 0.36 C ATOM 468 O LEU A 119 2.934 10.557 -4.823 1.00 0.39 O ATOM 469 CB LEU A 119 1.616 7.874 -4.135 1.00 0.38 C ATOM 470 CG LEU A 119 0.418 7.137 -3.532 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.863 5.765 -3.010 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.154 7.965 -2.377 1.00 0.58 C ATOM 0 H LEU A 119 0.590 7.306 -6.237 1.00 0.37 H new ATOM 0 HA LEU A 119 0.461 9.690 -4.517 1.00 0.38 H new ATOM 0 HB2 LEU A 119 2.234 7.180 -4.704 1.00 0.38 H new ATOM 0 HB3 LEU A 119 2.242 8.282 -3.341 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.346 6.998 -4.297 1.00 0.56 H new ATOM 0 HD11 LEU A 119 0.007 5.244 -2.581 1.00 1.33 H new ATOM 0 HD12 LEU A 119 1.271 5.178 -3.833 1.00 1.33 H new ATOM 0 HD13 LEU A 119 1.628 5.897 -2.244 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.008 7.444 -1.944 1.00 0.58 H new ATOM 0 HD22 LEU A 119 0.612 8.103 -1.614 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -0.474 8.938 -2.750 1.00 0.58 H new ATOM 484 N LYS A 120 2.623 9.721 -6.842 1.00 0.34 N ATOM 485 CA LYS A 120 3.764 10.501 -7.427 1.00 0.35 C ATOM 486 C LYS A 120 5.087 10.076 -6.794 1.00 0.30 C ATOM 487 O LYS A 120 5.889 10.901 -6.398 1.00 0.33 O ATOM 488 CB LYS A 120 3.473 11.980 -7.128 1.00 0.48 C ATOM 489 CG LYS A 120 3.841 12.835 -8.342 1.00 1.05 C ATOM 490 CD LYS A 120 2.981 14.100 -8.343 1.00 1.11 C ATOM 491 CE LYS A 120 3.567 15.118 -7.362 1.00 2.02 C ATOM 492 NZ LYS A 120 4.677 15.775 -8.106 1.00 2.16 N ATOM 0 H LYS A 120 2.132 9.123 -7.507 1.00 0.34 H new ATOM 0 HA LYS A 120 3.853 10.325 -8.499 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.418 12.111 -6.885 1.00 0.48 H new ATOM 0 HB3 LYS A 120 4.043 12.304 -6.257 1.00 0.48 H new ATOM 0 HG2 LYS A 120 4.898 13.099 -8.309 1.00 1.05 H new ATOM 0 HG3 LYS A 120 3.682 12.271 -9.261 1.00 1.05 H new ATOM 0 HD2 LYS A 120 2.943 14.526 -9.346 1.00 1.11 H new ATOM 0 HD3 LYS A 120 1.957 13.856 -8.061 1.00 1.11 H new ATOM 0 HE2 LYS A 120 2.816 15.844 -7.051 1.00 2.02 H new ATOM 0 HE3 LYS A 120 3.932 14.630 -6.458 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 5.519 15.828 -7.498 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 4.900 15.221 -8.958 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 4.389 16.735 -8.383 1.00 2.16 H new ATOM 506 N VAL A 121 5.327 8.793 -6.718 1.00 0.29 N ATOM 507 CA VAL A 121 6.611 8.305 -6.133 1.00 0.33 C ATOM 508 C VAL A 121 7.746 8.562 -7.130 1.00 0.37 C ATOM 509 O VAL A 121 7.545 8.539 -8.330 1.00 0.42 O ATOM 510 CB VAL A 121 6.423 6.800 -5.910 1.00 0.36 C ATOM 511 CG1 VAL A 121 7.699 6.205 -5.309 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.253 6.567 -4.950 1.00 1.29 C ATOM 0 H VAL A 121 4.690 8.062 -7.035 1.00 0.29 H new ATOM 0 HA VAL A 121 6.862 8.811 -5.201 1.00 0.33 H new ATOM 0 HB VAL A 121 6.213 6.318 -6.865 1.00 0.36 H new ATOM 0 HG11 VAL A 121 7.562 5.135 -5.152 1.00 1.65 H new ATOM 0 HG12 VAL A 121 8.533 6.368 -5.992 1.00 1.65 H new ATOM 0 HG13 VAL A 121 7.911 6.688 -4.355 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.120 5.497 -4.792 1.00 1.29 H new ATOM 0 HG22 VAL A 121 5.463 7.051 -3.996 1.00 1.29 H new ATOM 0 HG23 VAL A 121 4.342 6.987 -5.378 1.00 1.29 H new ATOM 522 N SER A 122 8.932 8.821 -6.641 1.00 0.45 N ATOM 523 CA SER A 122 10.088 9.099 -7.555 1.00 0.52 C ATOM 524 C SER A 122 10.264 7.975 -8.577 1.00 0.44 C ATOM 525 O SER A 122 10.273 6.807 -8.237 1.00 0.35 O ATOM 526 CB SER A 122 11.308 9.169 -6.635 1.00 0.63 C ATOM 527 OG SER A 122 11.451 7.932 -5.949 1.00 1.10 O ATOM 0 H SER A 122 9.153 8.853 -5.646 1.00 0.45 H new ATOM 0 HA SER A 122 9.939 10.017 -8.124 1.00 0.52 H new ATOM 0 HB2 SER A 122 12.205 9.381 -7.217 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.192 9.983 -5.920 1.00 0.63 H new ATOM 0 HG SER A 122 11.044 7.215 -6.479 1.00 1.10 H new ATOM 533 N GLU A 123 10.423 8.331 -9.829 1.00 0.55 N ATOM 534 CA GLU A 123 10.622 7.296 -10.889 1.00 0.58 C ATOM 535 C GLU A 123 11.852 6.452 -10.553 1.00 0.52 C ATOM 536 O GLU A 123 11.940 5.295 -10.920 1.00 0.53 O ATOM 537 CB GLU A 123 10.840 8.067 -12.195 1.00 0.77 C ATOM 538 CG GLU A 123 9.489 8.522 -12.760 1.00 1.44 C ATOM 539 CD GLU A 123 9.019 9.799 -12.055 1.00 1.61 C ATOM 540 OE1 GLU A 123 9.859 10.516 -11.534 1.00 2.15 O ATOM 541 OE2 GLU A 123 7.822 10.038 -12.048 1.00 1.75 O ATOM 0 H GLU A 123 10.423 9.295 -10.162 1.00 0.55 H new ATOM 0 HA GLU A 123 9.769 6.622 -10.969 1.00 0.58 H new ATOM 0 HB2 GLU A 123 11.479 8.931 -12.016 1.00 0.77 H new ATOM 0 HB3 GLU A 123 11.354 7.435 -12.920 1.00 0.77 H new ATOM 0 HG2 GLU A 123 9.577 8.702 -13.831 1.00 1.44 H new ATOM 0 HG3 GLU A 123 8.748 7.733 -12.629 1.00 1.44 H new ATOM 548 N ALA A 124 12.796 7.025 -9.844 1.00 0.50 N ATOM 549 CA ALA A 124 14.022 6.255 -9.466 1.00 0.50 C ATOM 550 C ALA A 124 13.626 5.019 -8.649 1.00 0.39 C ATOM 551 O ALA A 124 14.057 3.916 -8.928 1.00 0.45 O ATOM 552 CB ALA A 124 14.861 7.216 -8.621 1.00 0.56 C ATOM 0 H ALA A 124 12.770 7.989 -9.512 1.00 0.50 H new ATOM 0 HA ALA A 124 14.576 5.903 -10.336 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.779 6.718 -8.307 1.00 0.56 H new ATOM 0 HB2 ALA A 124 15.110 8.097 -9.212 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.293 7.518 -7.741 1.00 0.56 H new ATOM 558 N LYS A 125 12.797 5.199 -7.648 1.00 0.31 N ATOM 559 CA LYS A 125 12.354 4.035 -6.817 1.00 0.34 C ATOM 560 C LYS A 125 11.564 3.050 -7.680 1.00 0.34 C ATOM 561 O LYS A 125 11.806 1.859 -7.659 1.00 0.39 O ATOM 562 CB LYS A 125 11.457 4.633 -5.735 1.00 0.42 C ATOM 563 CG LYS A 125 12.294 5.521 -4.814 1.00 0.54 C ATOM 564 CD LYS A 125 13.075 4.649 -3.830 1.00 0.75 C ATOM 565 CE LYS A 125 13.913 5.544 -2.913 1.00 0.75 C ATOM 566 NZ LYS A 125 14.543 4.612 -1.937 1.00 1.56 N ATOM 0 H LYS A 125 12.409 6.101 -7.371 1.00 0.31 H new ATOM 0 HA LYS A 125 13.195 3.489 -6.389 1.00 0.34 H new ATOM 0 HB2 LYS A 125 10.657 5.216 -6.192 1.00 0.42 H new ATOM 0 HB3 LYS A 125 10.983 3.838 -5.159 1.00 0.42 H new ATOM 0 HG2 LYS A 125 12.982 6.127 -5.403 1.00 0.54 H new ATOM 0 HG3 LYS A 125 11.647 6.210 -4.271 1.00 0.54 H new ATOM 0 HD2 LYS A 125 12.388 4.045 -3.238 1.00 0.75 H new ATOM 0 HD3 LYS A 125 13.721 3.958 -4.372 1.00 0.75 H new ATOM 0 HE2 LYS A 125 14.667 6.093 -3.478 1.00 0.75 H new ATOM 0 HE3 LYS A 125 13.292 6.284 -2.408 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 14.752 5.122 -1.055 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 13.891 3.827 -1.736 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 15.426 4.235 -2.337 1.00 1.56 H new ATOM 580 N MET A 126 10.626 3.546 -8.447 1.00 0.42 N ATOM 581 CA MET A 126 9.823 2.650 -9.334 1.00 0.56 C ATOM 582 C MET A 126 10.742 1.923 -10.317 1.00 0.57 C ATOM 583 O MET A 126 10.556 0.758 -10.608 1.00 0.66 O ATOM 584 CB MET A 126 8.845 3.570 -10.070 1.00 0.70 C ATOM 585 CG MET A 126 7.555 3.707 -9.251 1.00 1.10 C ATOM 586 SD MET A 126 6.317 2.534 -9.865 1.00 1.90 S ATOM 587 CE MET A 126 6.100 1.601 -8.330 1.00 2.03 C ATOM 0 H MET A 126 10.381 4.535 -8.497 1.00 0.42 H new ATOM 0 HA MET A 126 9.293 1.881 -8.772 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.297 4.550 -10.223 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.620 3.165 -11.057 1.00 0.70 H new ATOM 0 HG2 MET A 126 7.759 3.517 -8.197 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.173 4.725 -9.323 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.781 0.585 -8.564 1.00 2.03 H new ATOM 0 HE2 MET A 126 7.045 1.568 -7.787 1.00 2.03 H new ATOM 0 HE3 MET A 126 5.344 2.086 -7.713 1.00 2.03 H new ATOM 597 N ASP A 127 11.727 2.613 -10.834 1.00 0.55 N ATOM 598 CA ASP A 127 12.666 1.977 -11.809 1.00 0.62 C ATOM 599 C ASP A 127 13.384 0.779 -11.179 1.00 0.54 C ATOM 600 O ASP A 127 13.566 -0.242 -11.817 1.00 0.59 O ATOM 601 CB ASP A 127 13.682 3.067 -12.158 1.00 0.71 C ATOM 602 CG ASP A 127 13.067 4.061 -13.147 1.00 1.04 C ATOM 603 OD1 ASP A 127 12.224 3.650 -13.929 1.00 1.60 O ATOM 604 OD2 ASP A 127 13.459 5.216 -13.113 1.00 1.71 O ATOM 0 H ASP A 127 11.922 3.592 -10.623 1.00 0.55 H new ATOM 0 HA ASP A 127 12.136 1.604 -12.685 1.00 0.62 H new ATOM 0 HB2 ASP A 127 13.994 3.588 -11.253 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.576 2.617 -12.591 1.00 0.71 H new ATOM 609 N GLY A 128 13.787 0.886 -9.933 1.00 0.46 N ATOM 610 CA GLY A 128 14.489 -0.263 -9.283 1.00 0.46 C ATOM 611 C GLY A 128 13.505 -1.354 -8.869 1.00 0.48 C ATOM 612 O GLY A 128 13.796 -2.527 -8.990 1.00 0.51 O ATOM 0 H GLY A 128 13.661 1.710 -9.346 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.226 -0.677 -9.971 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.033 0.090 -8.407 1.00 0.46 H new ATOM 616 N ILE A 129 12.353 -0.988 -8.369 1.00 0.54 N ATOM 617 CA ILE A 129 11.367 -2.025 -7.931 1.00 0.68 C ATOM 618 C ILE A 129 10.979 -2.929 -9.120 1.00 0.68 C ATOM 619 O ILE A 129 11.139 -4.134 -9.058 1.00 0.72 O ATOM 620 CB ILE A 129 10.178 -1.208 -7.337 1.00 0.86 C ATOM 621 CG1 ILE A 129 10.342 -1.151 -5.816 1.00 1.04 C ATOM 622 CG2 ILE A 129 8.811 -1.826 -7.670 1.00 1.77 C ATOM 623 CD1 ILE A 129 11.604 -0.358 -5.466 1.00 2.01 C ATOM 0 H ILE A 129 12.052 -0.021 -8.245 1.00 0.54 H new ATOM 0 HA ILE A 129 11.756 -2.716 -7.183 1.00 0.68 H new ATOM 0 HB ILE A 129 10.201 -0.213 -7.781 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.468 -0.682 -5.363 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.410 -2.160 -5.409 1.00 1.04 H new ATOM 0 HG21 ILE A 129 8.020 -1.217 -7.232 1.00 1.77 H new ATOM 0 HG22 ILE A 129 8.683 -1.864 -8.752 1.00 1.77 H new ATOM 0 HG23 ILE A 129 8.759 -2.836 -7.263 1.00 1.77 H new ATOM 0 HD11 ILE A 129 11.720 -0.318 -4.383 1.00 2.01 H new ATOM 0 HD12 ILE A 129 12.474 -0.846 -5.906 1.00 2.01 H new ATOM 0 HD13 ILE A 129 11.518 0.655 -5.859 1.00 2.01 H new ATOM 635 N GLU A 130 10.472 -2.366 -10.186 1.00 0.70 N ATOM 636 CA GLU A 130 10.080 -3.209 -11.360 1.00 0.77 C ATOM 637 C GLU A 130 11.301 -3.925 -11.974 1.00 0.65 C ATOM 638 O GLU A 130 11.227 -5.085 -12.335 1.00 0.68 O ATOM 639 CB GLU A 130 9.424 -2.237 -12.357 1.00 0.85 C ATOM 640 CG GLU A 130 10.456 -1.254 -12.921 1.00 1.41 C ATOM 641 CD GLU A 130 9.731 -0.155 -13.701 1.00 1.66 C ATOM 642 OE1 GLU A 130 8.799 -0.482 -14.418 1.00 2.14 O ATOM 643 OE2 GLU A 130 10.117 0.995 -13.567 1.00 2.01 O ATOM 0 H GLU A 130 10.312 -1.365 -10.297 1.00 0.70 H new ATOM 0 HA GLU A 130 9.395 -4.007 -11.074 1.00 0.77 H new ATOM 0 HB2 GLU A 130 8.967 -2.799 -13.172 1.00 0.85 H new ATOM 0 HB3 GLU A 130 8.624 -1.687 -11.862 1.00 0.85 H new ATOM 0 HG2 GLU A 130 11.040 -0.817 -12.111 1.00 1.41 H new ATOM 0 HG3 GLU A 130 11.156 -1.777 -13.572 1.00 1.41 H new ATOM 650 N GLU A 131 12.410 -3.237 -12.117 1.00 0.59 N ATOM 651 CA GLU A 131 13.626 -3.871 -12.735 1.00 0.55 C ATOM 652 C GLU A 131 14.256 -4.944 -11.836 1.00 0.47 C ATOM 653 O GLU A 131 14.529 -6.045 -12.277 1.00 0.45 O ATOM 654 CB GLU A 131 14.611 -2.721 -12.942 1.00 0.63 C ATOM 655 CG GLU A 131 14.093 -1.806 -14.056 1.00 1.38 C ATOM 656 CD GLU A 131 14.971 -0.552 -14.176 1.00 1.89 C ATOM 657 OE1 GLU A 131 15.927 -0.430 -13.424 1.00 2.50 O ATOM 658 OE2 GLU A 131 14.671 0.268 -15.028 1.00 2.30 O ATOM 0 H GLU A 131 12.528 -2.264 -11.834 1.00 0.59 H new ATOM 0 HA GLU A 131 13.361 -4.382 -13.661 1.00 0.55 H new ATOM 0 HB2 GLU A 131 14.728 -2.156 -12.017 1.00 0.63 H new ATOM 0 HB3 GLU A 131 15.594 -3.112 -13.204 1.00 0.63 H new ATOM 0 HG2 GLU A 131 14.087 -2.345 -15.004 1.00 1.38 H new ATOM 0 HG3 GLU A 131 13.063 -1.517 -13.847 1.00 1.38 H new ATOM 665 N LYS A 132 14.513 -4.626 -10.594 1.00 0.51 N ATOM 666 CA LYS A 132 15.160 -5.621 -9.678 1.00 0.53 C ATOM 667 C LYS A 132 14.202 -6.764 -9.336 1.00 0.54 C ATOM 668 O LYS A 132 14.601 -7.911 -9.238 1.00 0.63 O ATOM 669 CB LYS A 132 15.528 -4.835 -8.418 1.00 0.68 C ATOM 670 CG LYS A 132 16.616 -3.812 -8.760 1.00 1.39 C ATOM 671 CD LYS A 132 16.989 -3.019 -7.506 1.00 1.91 C ATOM 672 CE LYS A 132 18.076 -1.997 -7.850 1.00 2.62 C ATOM 673 NZ LYS A 132 18.080 -1.042 -6.706 1.00 2.69 N ATOM 0 H LYS A 132 14.304 -3.721 -10.171 1.00 0.51 H new ATOM 0 HA LYS A 132 16.032 -6.080 -10.143 1.00 0.53 H new ATOM 0 HB2 LYS A 132 14.648 -4.329 -8.021 1.00 0.68 H new ATOM 0 HB3 LYS A 132 15.882 -5.514 -7.642 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.495 -4.320 -9.156 1.00 1.39 H new ATOM 0 HG3 LYS A 132 16.262 -3.136 -9.538 1.00 1.39 H new ATOM 0 HD2 LYS A 132 16.110 -2.511 -7.110 1.00 1.91 H new ATOM 0 HD3 LYS A 132 17.344 -3.695 -6.728 1.00 1.91 H new ATOM 0 HE2 LYS A 132 19.047 -2.478 -7.967 1.00 2.62 H new ATOM 0 HE3 LYS A 132 17.857 -1.488 -8.789 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 18.800 -0.310 -6.868 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 17.144 -0.595 -6.623 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 18.298 -1.554 -5.827 1.00 2.69 H new ATOM 687 N TYR A 133 12.950 -6.459 -9.133 1.00 0.55 N ATOM 688 CA TYR A 133 11.964 -7.520 -8.771 1.00 0.65 C ATOM 689 C TYR A 133 11.028 -7.807 -9.956 1.00 0.54 C ATOM 690 O TYR A 133 10.154 -7.015 -10.246 1.00 0.66 O ATOM 691 CB TYR A 133 11.181 -6.930 -7.597 1.00 0.89 C ATOM 692 CG TYR A 133 12.134 -6.576 -6.477 1.00 1.14 C ATOM 693 CD1 TYR A 133 12.903 -7.573 -5.865 1.00 0.98 C ATOM 694 CD2 TYR A 133 12.254 -5.245 -6.062 1.00 2.20 C ATOM 695 CE1 TYR A 133 13.791 -7.239 -4.836 1.00 1.14 C ATOM 696 CE2 TYR A 133 13.143 -4.910 -5.033 1.00 2.44 C ATOM 697 CZ TYR A 133 13.911 -5.907 -4.420 1.00 1.67 C ATOM 698 OH TYR A 133 14.787 -5.577 -3.406 1.00 1.95 O ATOM 0 H TYR A 133 12.564 -5.517 -9.202 1.00 0.55 H new ATOM 0 HA TYR A 133 12.443 -8.465 -8.515 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.637 -6.042 -7.919 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.440 -7.647 -7.244 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.811 -8.600 -6.187 1.00 0.98 H new ATOM 0 HD2 TYR A 133 11.661 -4.476 -6.535 1.00 2.20 H new ATOM 0 HE1 TYR A 133 14.383 -8.008 -4.363 1.00 1.14 H new ATOM 0 HE2 TYR A 133 13.236 -3.883 -4.713 1.00 2.44 H new ATOM 0 HH TYR A 133 14.429 -5.890 -2.549 1.00 1.95 H new ATOM 708 N PRO A 134 11.238 -8.930 -10.614 1.00 0.51 N ATOM 709 CA PRO A 134 10.390 -9.285 -11.769 1.00 0.53 C ATOM 710 C PRO A 134 9.107 -10.001 -11.325 1.00 0.47 C ATOM 711 O PRO A 134 8.144 -10.058 -12.068 1.00 0.54 O ATOM 712 CB PRO A 134 11.272 -10.233 -12.576 1.00 0.70 C ATOM 713 CG PRO A 134 12.234 -10.832 -11.592 1.00 0.76 C ATOM 714 CD PRO A 134 12.265 -9.953 -10.364 1.00 0.66 C ATOM 0 HA PRO A 134 10.063 -8.409 -12.330 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.675 -11.006 -13.060 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.801 -9.699 -13.365 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.926 -11.843 -11.327 1.00 0.76 H new ATOM 0 HG3 PRO A 134 13.229 -10.907 -12.031 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.044 -10.524 -9.462 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.248 -9.502 -10.224 1.00 0.66 H new ATOM 722 N ARG A 135 9.084 -10.564 -10.136 1.00 0.43 N ATOM 723 CA ARG A 135 7.850 -11.289 -9.687 1.00 0.48 C ATOM 724 C ARG A 135 7.648 -11.210 -8.163 1.00 0.43 C ATOM 725 O ARG A 135 6.808 -11.901 -7.617 1.00 0.60 O ATOM 726 CB ARG A 135 8.082 -12.738 -10.130 1.00 0.70 C ATOM 727 CG ARG A 135 6.788 -13.557 -10.004 1.00 0.91 C ATOM 728 CD ARG A 135 5.681 -12.922 -10.853 1.00 1.17 C ATOM 729 NE ARG A 135 4.689 -14.012 -11.070 1.00 1.44 N ATOM 730 CZ ARG A 135 4.155 -14.181 -12.248 1.00 2.17 C ATOM 731 NH1 ARG A 135 3.154 -13.433 -12.624 1.00 2.61 N ATOM 732 NH2 ARG A 135 4.624 -15.095 -13.053 1.00 3.07 N ATOM 0 H ARG A 135 9.854 -10.553 -9.467 1.00 0.43 H new ATOM 0 HA ARG A 135 6.949 -10.850 -10.116 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.431 -12.757 -11.162 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.865 -13.189 -9.520 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.964 -14.582 -10.329 1.00 0.91 H new ATOM 0 HG3 ARG A 135 6.477 -13.602 -8.960 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.229 -12.073 -10.341 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.073 -12.551 -11.800 1.00 1.17 H new ATOM 0 HE ARG A 135 4.428 -14.626 -10.298 1.00 1.44 H new ATOM 0 HH11 ARG A 135 2.789 -12.716 -11.997 1.00 2.61 H new ATOM 0 HH12 ARG A 135 2.736 -13.565 -13.545 1.00 2.61 H new ATOM 0 HH21 ARG A 135 5.409 -15.678 -12.761 1.00 3.07 H new ATOM 0 HH22 ARG A 135 4.206 -15.227 -13.974 1.00 3.07 H new ATOM 746 N SER A 136 8.386 -10.376 -7.469 1.00 0.51 N ATOM 747 CA SER A 136 8.194 -10.279 -5.990 1.00 0.44 C ATOM 748 C SER A 136 7.178 -9.199 -5.667 1.00 0.33 C ATOM 749 O SER A 136 7.447 -8.016 -5.763 1.00 0.30 O ATOM 750 CB SER A 136 9.568 -9.927 -5.424 1.00 0.50 C ATOM 751 OG SER A 136 10.436 -11.043 -5.573 1.00 0.90 O ATOM 0 H SER A 136 9.104 -9.766 -7.859 1.00 0.51 H new ATOM 0 HA SER A 136 7.815 -11.206 -5.561 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.977 -9.061 -5.944 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.482 -9.656 -4.372 1.00 0.50 H new ATOM 0 HG SER A 136 11.320 -10.821 -5.212 1.00 0.90 H new ATOM 757 N LEU A 137 6.004 -9.614 -5.280 1.00 0.31 N ATOM 758 CA LEU A 137 4.936 -8.639 -4.934 1.00 0.24 C ATOM 759 C LEU A 137 5.383 -7.806 -3.736 1.00 0.20 C ATOM 760 O LEU A 137 5.219 -6.604 -3.699 1.00 0.21 O ATOM 761 CB LEU A 137 3.717 -9.503 -4.566 1.00 0.23 C ATOM 762 CG LEU A 137 2.510 -8.610 -4.270 1.00 0.21 C ATOM 763 CD1 LEU A 137 2.166 -7.790 -5.527 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.315 -9.495 -3.890 1.00 0.27 C ATOM 0 H LEU A 137 5.738 -10.594 -5.188 1.00 0.31 H new ATOM 0 HA LEU A 137 4.711 -7.949 -5.747 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.484 -10.184 -5.385 1.00 0.23 H new ATOM 0 HB3 LEU A 137 3.947 -10.118 -3.696 1.00 0.23 H new ATOM 0 HG LEU A 137 2.740 -7.933 -3.448 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.307 -7.152 -5.321 1.00 0.23 H new ATOM 0 HD12 LEU A 137 3.020 -7.171 -5.802 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.928 -8.466 -6.348 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.450 -8.867 -3.677 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.082 -10.166 -4.717 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.563 -10.082 -3.006 1.00 0.27 H new ATOM 776 N SER A 138 5.945 -8.458 -2.756 1.00 0.24 N ATOM 777 CA SER A 138 6.415 -7.743 -1.527 1.00 0.26 C ATOM 778 C SER A 138 7.558 -6.758 -1.825 1.00 0.20 C ATOM 779 O SER A 138 7.593 -5.664 -1.296 1.00 0.22 O ATOM 780 CB SER A 138 6.906 -8.849 -0.595 1.00 0.38 C ATOM 781 OG SER A 138 7.503 -8.264 0.555 1.00 1.01 O ATOM 0 H SER A 138 6.102 -9.466 -2.751 1.00 0.24 H new ATOM 0 HA SER A 138 5.613 -7.144 -1.095 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.074 -9.489 -0.301 1.00 0.38 H new ATOM 0 HB3 SER A 138 7.628 -9.482 -1.111 1.00 0.38 H new ATOM 0 HG SER A 138 7.818 -8.971 1.156 1.00 1.01 H new ATOM 787 N GLU A 139 8.510 -7.155 -2.631 1.00 0.24 N ATOM 788 CA GLU A 139 9.679 -6.258 -2.923 1.00 0.25 C ATOM 789 C GLU A 139 9.266 -4.998 -3.685 1.00 0.21 C ATOM 790 O GLU A 139 9.790 -3.925 -3.447 1.00 0.21 O ATOM 791 CB GLU A 139 10.616 -7.084 -3.805 1.00 0.39 C ATOM 792 CG GLU A 139 11.088 -8.328 -3.054 1.00 1.09 C ATOM 793 CD GLU A 139 12.028 -7.922 -1.915 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.726 -6.932 -2.070 1.00 2.92 O ATOM 795 OE2 GLU A 139 12.036 -8.610 -0.908 1.00 2.24 O ATOM 0 H GLU A 139 8.532 -8.060 -3.101 1.00 0.24 H new ATOM 0 HA GLU A 139 10.139 -5.927 -1.992 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.102 -7.376 -4.720 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.475 -6.481 -4.100 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.231 -8.870 -2.654 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.601 -9.004 -3.738 1.00 1.09 H new ATOM 802 N ARG A 140 8.372 -5.128 -4.627 1.00 0.26 N ATOM 803 CA ARG A 140 7.967 -3.942 -5.441 1.00 0.33 C ATOM 804 C ARG A 140 7.073 -2.970 -4.660 1.00 0.29 C ATOM 805 O ARG A 140 7.329 -1.782 -4.615 1.00 0.35 O ATOM 806 CB ARG A 140 7.207 -4.526 -6.638 1.00 0.42 C ATOM 807 CG ARG A 140 8.157 -5.384 -7.481 1.00 1.07 C ATOM 808 CD ARG A 140 7.512 -5.684 -8.837 1.00 1.17 C ATOM 809 NE ARG A 140 6.383 -6.608 -8.542 1.00 0.98 N ATOM 810 CZ ARG A 140 5.889 -7.353 -9.493 1.00 1.13 C ATOM 811 NH1 ARG A 140 5.567 -6.817 -10.639 1.00 1.60 N ATOM 812 NH2 ARG A 140 5.719 -8.633 -9.301 1.00 1.55 N ATOM 0 H ARG A 140 7.904 -6.001 -4.869 1.00 0.26 H new ATOM 0 HA ARG A 140 8.839 -3.358 -5.736 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.368 -5.129 -6.290 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.791 -3.722 -7.245 1.00 0.42 H new ATOM 0 HG2 ARG A 140 9.103 -4.863 -7.625 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.382 -6.315 -6.960 1.00 1.07 H new ATOM 0 HD2 ARG A 140 7.157 -4.770 -9.314 1.00 1.17 H new ATOM 0 HD3 ARG A 140 8.227 -6.143 -9.519 1.00 1.17 H new ATOM 0 HE ARG A 140 5.997 -6.659 -7.599 1.00 0.98 H new ATOM 0 HH11 ARG A 140 5.702 -5.817 -10.790 1.00 1.60 H new ATOM 0 HH12 ARG A 140 5.181 -7.398 -11.383 1.00 1.60 H new ATOM 0 HH21 ARG A 140 5.972 -9.053 -8.406 1.00 1.55 H new ATOM 0 HH22 ARG A 140 5.333 -9.214 -10.045 1.00 1.55 H new ATOM 826 N VAL A 141 6.014 -3.460 -4.081 1.00 0.24 N ATOM 827 CA VAL A 141 5.068 -2.565 -3.334 1.00 0.27 C ATOM 828 C VAL A 141 5.703 -1.906 -2.101 1.00 0.25 C ATOM 829 O VAL A 141 5.396 -0.776 -1.776 1.00 0.29 O ATOM 830 CB VAL A 141 3.904 -3.457 -2.917 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.226 -4.027 -4.165 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.405 -4.607 -2.043 1.00 0.23 C ATOM 0 H VAL A 141 5.756 -4.447 -4.089 1.00 0.24 H new ATOM 0 HA VAL A 141 4.759 -1.737 -3.972 1.00 0.27 H new ATOM 0 HB VAL A 141 3.190 -2.863 -2.347 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.394 -4.665 -3.868 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.854 -3.209 -4.783 1.00 0.33 H new ATOM 0 HG13 VAL A 141 3.947 -4.613 -4.735 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.564 -5.236 -1.752 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.127 -5.202 -2.603 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.882 -4.204 -1.150 1.00 0.23 H new ATOM 842 N ARG A 142 6.552 -2.604 -1.394 1.00 0.21 N ATOM 843 CA ARG A 142 7.165 -2.019 -0.155 1.00 0.22 C ATOM 844 C ARG A 142 7.793 -0.642 -0.413 1.00 0.24 C ATOM 845 O ARG A 142 7.564 0.287 0.338 1.00 0.25 O ATOM 846 CB ARG A 142 8.232 -3.026 0.280 1.00 0.27 C ATOM 847 CG ARG A 142 7.572 -4.149 1.086 1.00 0.28 C ATOM 848 CD ARG A 142 8.621 -5.195 1.468 1.00 1.02 C ATOM 849 NE ARG A 142 7.871 -6.226 2.240 1.00 0.94 N ATOM 850 CZ ARG A 142 7.817 -6.156 3.543 1.00 1.48 C ATOM 851 NH1 ARG A 142 8.906 -6.289 4.251 1.00 2.24 N ATOM 852 NH2 ARG A 142 6.673 -5.952 4.138 1.00 2.10 N ATOM 0 H ARG A 142 6.850 -3.554 -1.617 1.00 0.21 H new ATOM 0 HA ARG A 142 6.409 -1.856 0.613 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.737 -3.438 -0.594 1.00 0.27 H new ATOM 0 HB3 ARG A 142 8.993 -2.529 0.882 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.108 -3.741 1.984 1.00 0.28 H new ATOM 0 HG3 ARG A 142 6.779 -4.613 0.500 1.00 0.28 H new ATOM 0 HD2 ARG A 142 9.089 -5.627 0.583 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.418 -4.755 2.067 1.00 1.02 H new ATOM 0 HE ARG A 142 7.400 -6.987 1.750 1.00 0.94 H new ATOM 0 HH11 ARG A 142 9.800 -6.448 3.786 1.00 2.24 H new ATOM 0 HH12 ARG A 142 8.863 -6.234 5.269 1.00 2.24 H new ATOM 0 HH21 ARG A 142 5.822 -5.847 3.585 1.00 2.10 H new ATOM 0 HH22 ARG A 142 6.630 -5.897 5.156 1.00 2.10 H new ATOM 866 N GLU A 143 8.575 -0.496 -1.454 1.00 0.26 N ATOM 867 CA GLU A 143 9.205 0.836 -1.726 1.00 0.31 C ATOM 868 C GLU A 143 8.127 1.880 -2.019 1.00 0.30 C ATOM 869 O GLU A 143 8.087 2.934 -1.409 1.00 0.31 O ATOM 870 CB GLU A 143 10.083 0.625 -2.956 1.00 0.36 C ATOM 871 CG GLU A 143 11.099 1.764 -3.048 1.00 0.44 C ATOM 872 CD GLU A 143 12.195 1.557 -1.998 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.507 0.412 -1.710 1.00 1.84 O ATOM 874 OE2 GLU A 143 12.702 2.547 -1.498 1.00 1.62 O ATOM 0 H GLU A 143 8.804 -1.232 -2.122 1.00 0.26 H new ATOM 0 HA GLU A 143 9.780 1.196 -0.873 1.00 0.31 H new ATOM 0 HB2 GLU A 143 10.598 -0.333 -2.890 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.469 0.596 -3.856 1.00 0.36 H new ATOM 0 HG2 GLU A 143 11.537 1.795 -4.045 1.00 0.44 H new ATOM 0 HG3 GLU A 143 10.603 2.722 -2.888 1.00 0.44 H new ATOM 881 N SER A 144 7.251 1.590 -2.945 1.00 0.29 N ATOM 882 CA SER A 144 6.160 2.559 -3.284 1.00 0.29 C ATOM 883 C SER A 144 5.275 2.803 -2.058 1.00 0.28 C ATOM 884 O SER A 144 4.854 3.918 -1.786 1.00 0.28 O ATOM 885 CB SER A 144 5.358 1.891 -4.399 1.00 0.29 C ATOM 886 OG SER A 144 6.174 1.779 -5.557 1.00 1.34 O ATOM 0 H SER A 144 7.242 0.724 -3.483 1.00 0.29 H new ATOM 0 HA SER A 144 6.552 3.527 -3.595 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.021 0.905 -4.080 1.00 0.29 H new ATOM 0 HB3 SER A 144 4.466 2.476 -4.623 1.00 0.29 H new ATOM 0 HG SER A 144 6.399 0.837 -5.709 1.00 1.34 H new ATOM 892 N LEU A 145 4.992 1.767 -1.314 1.00 0.27 N ATOM 893 CA LEU A 145 4.144 1.931 -0.099 1.00 0.28 C ATOM 894 C LEU A 145 4.914 2.703 0.975 1.00 0.30 C ATOM 895 O LEU A 145 4.350 3.501 1.699 1.00 0.30 O ATOM 896 CB LEU A 145 3.818 0.511 0.381 1.00 0.29 C ATOM 897 CG LEU A 145 2.837 -0.164 -0.587 1.00 0.37 C ATOM 898 CD1 LEU A 145 2.580 -1.602 -0.130 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.512 0.616 -0.606 1.00 0.67 C ATOM 0 H LEU A 145 5.311 0.815 -1.495 1.00 0.27 H new ATOM 0 HA LEU A 145 3.234 2.493 -0.310 1.00 0.28 H new ATOM 0 HB2 LEU A 145 4.734 -0.076 0.451 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.386 0.548 1.381 1.00 0.29 H new ATOM 0 HG LEU A 145 3.264 -0.172 -1.590 1.00 0.37 H new ATOM 0 HD11 LEU A 145 1.883 -2.083 -0.817 1.00 0.73 H new ATOM 0 HD12 LEU A 145 3.520 -2.154 -0.121 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.154 -1.594 0.873 1.00 0.73 H new ATOM 0 HD21 LEU A 145 0.817 0.135 -1.294 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.082 0.627 0.396 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.697 1.639 -0.933 1.00 0.67 H new ATOM 911 N LYS A 146 6.196 2.458 1.090 1.00 0.33 N ATOM 912 CA LYS A 146 7.008 3.166 2.128 1.00 0.35 C ATOM 913 C LYS A 146 6.976 4.686 1.923 1.00 0.34 C ATOM 914 O LYS A 146 6.721 5.432 2.851 1.00 0.35 O ATOM 915 CB LYS A 146 8.434 2.634 1.959 1.00 0.41 C ATOM 916 CG LYS A 146 9.294 3.113 3.128 1.00 1.01 C ATOM 917 CD LYS A 146 10.640 2.387 3.101 1.00 1.15 C ATOM 918 CE LYS A 146 11.447 2.828 1.872 1.00 1.96 C ATOM 919 NZ LYS A 146 12.772 3.251 2.409 1.00 2.32 N ATOM 0 H LYS A 146 6.715 1.799 0.510 1.00 0.33 H new ATOM 0 HA LYS A 146 6.616 2.984 3.129 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.426 1.545 1.921 1.00 0.41 H new ATOM 0 HB3 LYS A 146 8.855 2.983 1.016 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.448 4.190 3.063 1.00 1.01 H new ATOM 0 HG3 LYS A 146 8.784 2.921 4.072 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.199 2.605 4.011 1.00 1.15 H new ATOM 0 HD3 LYS A 146 10.481 1.309 3.075 1.00 1.15 H new ATOM 0 HE2 LYS A 146 11.554 2.012 1.157 1.00 1.96 H new ATOM 0 HE3 LYS A 146 10.953 3.647 1.350 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 13.379 3.566 1.626 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 12.640 4.033 3.082 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 13.222 2.449 2.895 1.00 2.32 H new ATOM 933 N VAL A 147 7.238 5.154 0.724 1.00 0.32 N ATOM 934 CA VAL A 147 7.225 6.634 0.484 1.00 0.33 C ATOM 935 C VAL A 147 5.839 7.214 0.786 1.00 0.31 C ATOM 936 O VAL A 147 5.723 8.240 1.431 1.00 0.31 O ATOM 937 CB VAL A 147 7.611 6.850 -0.987 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.044 6.368 -1.218 1.00 0.40 C ATOM 939 CG2 VAL A 147 6.673 6.080 -1.916 1.00 0.36 C ATOM 0 H VAL A 147 7.458 4.582 -0.091 1.00 0.32 H new ATOM 0 HA VAL A 147 7.929 7.145 1.140 1.00 0.33 H new ATOM 0 HB VAL A 147 7.531 7.914 -1.207 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.316 6.522 -2.262 1.00 0.40 H new ATOM 0 HG12 VAL A 147 9.725 6.931 -0.579 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.114 5.307 -0.978 1.00 0.40 H new ATOM 0 HG21 VAL A 147 6.967 6.249 -2.952 1.00 0.36 H new ATOM 0 HG22 VAL A 147 6.732 5.015 -1.691 1.00 0.36 H new ATOM 0 HG23 VAL A 147 5.650 6.426 -1.768 1.00 0.36 H new ATOM 949 N TRP A 148 4.788 6.562 0.345 1.00 0.32 N ATOM 950 CA TRP A 148 3.416 7.086 0.637 1.00 0.33 C ATOM 951 C TRP A 148 3.166 7.018 2.157 1.00 0.32 C ATOM 952 O TRP A 148 2.613 7.929 2.745 1.00 0.32 O ATOM 953 CB TRP A 148 2.452 6.177 -0.170 1.00 0.36 C ATOM 954 CG TRP A 148 1.108 6.087 0.499 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.270 7.125 0.723 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.464 4.911 1.057 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.847 6.657 1.399 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.773 5.293 1.626 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.838 3.561 1.122 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.610 4.355 2.246 1.00 0.17 C ATOM 961 CZ3 TRP A 148 0.002 2.621 1.736 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.217 3.017 2.299 1.00 0.27 C ATOM 0 H TRP A 148 4.820 5.699 -0.198 1.00 0.32 H new ATOM 0 HA TRP A 148 3.275 8.128 0.349 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.334 6.572 -1.179 1.00 0.36 H new ATOM 0 HB3 TRP A 148 2.882 5.180 -0.266 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.442 8.149 0.425 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.627 7.245 1.693 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.778 3.244 0.695 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.550 4.665 2.678 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.299 1.584 1.776 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -1.854 2.286 2.775 1.00 0.27 H new ATOM 973 N LYS A 149 3.567 5.941 2.783 1.00 0.36 N ATOM 974 CA LYS A 149 3.356 5.799 4.258 1.00 0.38 C ATOM 975 C LYS A 149 4.073 6.935 5.007 1.00 0.34 C ATOM 976 O LYS A 149 3.539 7.497 5.943 1.00 0.33 O ATOM 977 CB LYS A 149 3.958 4.424 4.606 1.00 0.52 C ATOM 978 CG LYS A 149 3.936 4.189 6.123 1.00 1.36 C ATOM 979 CD LYS A 149 4.897 3.051 6.483 1.00 2.07 C ATOM 980 CE LYS A 149 4.421 1.742 5.846 1.00 2.80 C ATOM 981 NZ LYS A 149 5.342 0.698 6.380 1.00 3.70 N ATOM 0 H LYS A 149 4.033 5.151 2.336 1.00 0.36 H new ATOM 0 HA LYS A 149 2.306 5.861 4.545 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.395 3.638 4.103 1.00 0.52 H new ATOM 0 HB3 LYS A 149 4.983 4.367 4.239 1.00 0.52 H new ATOM 0 HG2 LYS A 149 4.224 5.101 6.646 1.00 1.36 H new ATOM 0 HG3 LYS A 149 2.925 3.941 6.448 1.00 1.36 H new ATOM 0 HD2 LYS A 149 5.902 3.289 6.136 1.00 2.07 H new ATOM 0 HD3 LYS A 149 4.952 2.939 7.566 1.00 2.07 H new ATOM 0 HE2 LYS A 149 3.385 1.528 6.110 1.00 2.80 H new ATOM 0 HE3 LYS A 149 4.469 1.792 4.758 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 5.080 -0.229 5.989 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 6.320 0.925 6.107 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 5.270 0.669 7.417 1.00 3.70 H new ATOM 995 N ASN A 150 5.271 7.273 4.600 1.00 0.37 N ATOM 996 CA ASN A 150 6.027 8.373 5.287 1.00 0.41 C ATOM 997 C ASN A 150 5.313 9.720 5.118 1.00 0.39 C ATOM 998 O ASN A 150 5.274 10.527 6.029 1.00 0.46 O ATOM 999 CB ASN A 150 7.408 8.395 4.604 1.00 0.50 C ATOM 1000 CG ASN A 150 8.216 9.623 5.056 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.259 10.619 4.361 1.00 1.86 O ATOM 1002 ND2 ASN A 150 8.856 9.597 6.191 1.00 1.27 N ATOM 0 H ASN A 150 5.762 6.835 3.820 1.00 0.37 H new ATOM 0 HA ASN A 150 6.104 8.203 6.361 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.954 7.484 4.847 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.284 8.413 3.521 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.391 10.411 6.494 1.00 1.27 H new ATOM 0 HD22 ASN A 150 8.822 8.763 6.777 1.00 1.27 H new ATOM 1009 N ALA A 151 4.779 9.977 3.955 1.00 0.38 N ATOM 1010 CA ALA A 151 4.101 11.288 3.716 1.00 0.49 C ATOM 1011 C ALA A 151 2.890 11.459 4.634 1.00 0.53 C ATOM 1012 O ALA A 151 2.735 12.479 5.280 1.00 0.72 O ATOM 1013 CB ALA A 151 3.652 11.246 2.252 1.00 0.57 C ATOM 0 H ALA A 151 4.782 9.338 3.160 1.00 0.38 H new ATOM 0 HA ALA A 151 4.768 12.125 3.923 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.144 12.177 2.000 1.00 0.57 H new ATOM 0 HB2 ALA A 151 4.523 11.122 1.608 1.00 0.57 H new ATOM 0 HB3 ALA A 151 2.969 10.409 2.105 1.00 0.57 H new ATOM 1019 N GLU A 152 2.025 10.482 4.684 1.00 0.40 N ATOM 1020 CA GLU A 152 0.809 10.597 5.546 1.00 0.50 C ATOM 1021 C GLU A 152 1.147 10.440 7.027 1.00 0.60 C ATOM 1022 O GLU A 152 1.762 9.470 7.431 1.00 1.48 O ATOM 1023 CB GLU A 152 -0.104 9.453 5.104 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.505 9.641 3.643 1.00 0.77 C ATOM 1025 CD GLU A 152 -1.611 10.696 3.534 1.00 1.10 C ATOM 1026 OE1 GLU A 152 -1.609 11.619 4.330 1.00 1.66 O ATOM 1027 OE2 GLU A 152 -2.442 10.561 2.652 1.00 1.81 O ATOM 0 H GLU A 152 2.106 9.608 4.165 1.00 0.40 H new ATOM 0 HA GLU A 152 0.346 11.578 5.436 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.408 8.499 5.230 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.994 9.423 5.733 1.00 0.44 H new ATOM 0 HG2 GLU A 152 0.361 9.948 3.056 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -0.852 8.695 3.228 1.00 0.77 H new ATOM 1034 N LYS A 153 0.705 11.364 7.844 1.00 0.76 N ATOM 1035 CA LYS A 153 0.950 11.241 9.308 1.00 0.67 C ATOM 1036 C LYS A 153 -0.239 10.493 9.933 1.00 0.64 C ATOM 1037 O LYS A 153 -0.185 9.300 10.143 1.00 0.57 O ATOM 1038 CB LYS A 153 1.039 12.678 9.831 1.00 0.86 C ATOM 1039 CG LYS A 153 2.471 13.200 9.693 1.00 1.17 C ATOM 1040 CD LYS A 153 2.596 14.025 8.410 1.00 1.57 C ATOM 1041 CE LYS A 153 3.935 14.765 8.411 1.00 2.22 C ATOM 1042 NZ LYS A 153 3.739 15.916 9.337 1.00 2.51 N ATOM 0 H LYS A 153 0.187 12.195 7.558 1.00 0.76 H new ATOM 0 HA LYS A 153 1.858 10.689 9.551 1.00 0.67 H new ATOM 0 HB2 LYS A 153 0.355 13.319 9.275 1.00 0.86 H new ATOM 0 HB3 LYS A 153 0.730 12.713 10.876 1.00 0.86 H new ATOM 0 HG2 LYS A 153 2.731 13.812 10.557 1.00 1.17 H new ATOM 0 HG3 LYS A 153 3.172 12.366 9.671 1.00 1.17 H new ATOM 0 HD2 LYS A 153 2.528 13.374 7.538 1.00 1.57 H new ATOM 0 HD3 LYS A 153 1.774 14.738 8.341 1.00 1.57 H new ATOM 0 HE2 LYS A 153 4.743 14.118 8.751 1.00 2.22 H new ATOM 0 HE3 LYS A 153 4.199 15.105 7.409 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 3.908 16.806 8.825 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 2.765 15.906 9.702 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 4.407 15.841 10.130 1.00 2.51 H new ATOM 1056 N LYS A 154 -1.328 11.180 10.190 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.536 10.502 10.753 1.00 0.77 C ATOM 1058 C LYS A 154 -3.171 9.605 9.679 1.00 0.62 C ATOM 1059 O LYS A 154 -3.720 8.553 9.965 1.00 0.60 O ATOM 1060 CB LYS A 154 -3.489 11.630 11.145 1.00 0.95 C ATOM 1061 CG LYS A 154 -4.762 11.036 11.752 1.00 1.29 C ATOM 1062 CD LYS A 154 -5.611 12.156 12.349 1.00 1.34 C ATOM 1063 CE LYS A 154 -6.130 13.052 11.222 1.00 2.02 C ATOM 1064 NZ LYS A 154 -6.828 14.169 11.913 1.00 2.51 N ATOM 0 H LYS A 154 -1.430 12.183 10.033 1.00 0.73 H new ATOM 0 HA LYS A 154 -2.297 9.868 11.607 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -3.007 12.294 11.862 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -3.737 12.231 10.270 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -5.328 10.504 10.988 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -4.505 10.309 12.523 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -6.446 11.736 12.909 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -5.019 12.742 13.052 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -5.313 13.420 10.602 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -6.809 12.508 10.565 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -7.213 14.828 11.206 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -7.605 13.789 12.491 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -6.155 14.673 12.526 1.00 2.51 H new ATOM 1078 N ASN A 155 -3.104 10.029 8.441 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.715 9.232 7.330 1.00 0.47 C ATOM 1080 C ASN A 155 -2.883 7.978 7.034 1.00 0.37 C ATOM 1081 O ASN A 155 -3.300 7.126 6.270 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.721 10.168 6.121 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.365 9.459 4.923 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -3.678 8.870 4.111 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.662 9.487 4.780 1.00 1.03 N ATOM 0 H ASN A 155 -2.651 10.895 8.150 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.717 8.886 7.586 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -4.272 11.079 6.356 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -2.702 10.467 5.875 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -6.098 9.015 3.988 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -6.240 9.981 5.460 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.732 7.839 7.650 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.907 6.616 7.414 1.00 0.33 C ATOM 1094 C ALA A 156 -1.632 5.385 7.962 1.00 0.28 C ATOM 1095 O ALA A 156 -1.243 4.265 7.685 1.00 0.28 O ATOM 1096 CB ALA A 156 0.382 6.827 8.207 1.00 0.41 C ATOM 0 H ALA A 156 -1.333 8.515 8.301 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.720 6.460 6.352 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.034 5.964 8.077 1.00 0.41 H new ATOM 0 HB2 ALA A 156 0.889 7.722 7.846 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.144 6.946 9.264 1.00 0.41 H new ATOM 1102 N SER A 157 -2.682 5.574 8.733 1.00 0.28 N ATOM 1103 CA SER A 157 -3.407 4.401 9.286 1.00 0.28 C ATOM 1104 C SER A 157 -4.370 3.847 8.243 1.00 0.22 C ATOM 1105 O SER A 157 -4.576 4.428 7.186 1.00 0.21 O ATOM 1106 CB SER A 157 -4.175 4.927 10.495 1.00 0.34 C ATOM 1107 OG SER A 157 -4.808 6.155 10.157 1.00 1.05 O ATOM 0 H SER A 157 -3.059 6.485 8.996 1.00 0.28 H new ATOM 0 HA SER A 157 -2.729 3.594 9.563 1.00 0.28 H new ATOM 0 HB2 SER A 157 -4.920 4.197 10.812 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.496 5.075 11.335 1.00 0.34 H new ATOM 0 HG SER A 157 -4.249 6.904 10.453 1.00 1.05 H new ATOM 1113 N VAL A 158 -4.935 2.710 8.524 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.862 2.082 7.548 1.00 0.22 C ATOM 1115 C VAL A 158 -7.056 2.985 7.242 1.00 0.18 C ATOM 1116 O VAL A 158 -7.377 3.182 6.095 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.327 0.771 8.179 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.129 -0.160 8.367 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -6.990 1.023 9.538 1.00 0.27 C ATOM 0 H VAL A 158 -4.795 2.188 9.389 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.357 1.912 6.597 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.058 0.310 7.514 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.462 -1.095 8.817 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.673 -0.366 7.399 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.397 0.316 9.019 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.312 0.074 9.967 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.275 1.500 10.209 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.854 1.674 9.406 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.714 3.542 8.243 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.901 4.434 7.982 1.00 0.13 C ATOM 1131 C ALA A 159 -8.597 5.437 6.870 1.00 0.13 C ATOM 1132 O ALA A 159 -9.448 5.758 6.056 1.00 0.15 O ATOM 1133 CB ALA A 159 -9.161 5.155 9.305 1.00 0.12 C ATOM 0 H ALA A 159 -7.480 3.417 9.228 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.769 3.864 7.652 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -10.014 5.825 9.193 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.375 4.422 10.083 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -8.280 5.733 9.584 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.378 5.892 6.808 1.00 0.13 N ATOM 1140 CA GLY A 160 -7.005 6.839 5.727 1.00 0.15 C ATOM 1141 C GLY A 160 -7.016 6.088 4.404 1.00 0.16 C ATOM 1142 O GLY A 160 -7.791 6.390 3.509 1.00 0.18 O ATOM 0 H GLY A 160 -6.629 5.650 7.456 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.706 7.673 5.695 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -6.017 7.260 5.916 1.00 0.15 H new ATOM 1146 N LEU A 161 -6.154 5.113 4.271 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.102 4.342 3.004 1.00 0.18 C ATOM 1148 C LEU A 161 -7.424 3.636 2.710 1.00 0.20 C ATOM 1149 O LEU A 161 -7.947 3.789 1.643 1.00 0.28 O ATOM 1150 CB LEU A 161 -5.008 3.299 3.192 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.818 2.532 1.876 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.091 3.426 0.859 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.002 1.255 2.136 1.00 0.27 C ATOM 0 H LEU A 161 -5.487 4.822 4.986 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.907 5.012 2.166 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -4.075 3.780 3.485 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.277 2.611 3.993 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.792 2.254 1.472 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -3.957 2.880 -0.075 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.683 4.322 0.674 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.117 3.711 1.256 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -3.868 0.712 1.200 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.027 1.523 2.543 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.532 0.624 2.849 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.955 2.842 3.621 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.221 2.092 3.307 1.00 0.26 C ATOM 1167 C VAL A 162 -10.292 3.028 2.755 1.00 0.29 C ATOM 1168 O VAL A 162 -11.012 2.678 1.837 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.686 1.450 4.620 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.597 0.523 5.165 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -10.010 2.520 5.664 1.00 0.31 C ATOM 0 H VAL A 162 -7.573 2.683 4.553 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.043 1.337 2.541 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.588 0.874 4.415 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.936 0.072 6.097 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.389 -0.261 4.437 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.689 1.097 5.349 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.338 2.041 6.587 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.120 3.117 5.861 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.804 3.166 5.289 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.381 4.217 3.282 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.389 5.181 2.754 1.00 0.34 C ATOM 1183 C LYS A 163 -11.119 5.455 1.266 1.00 0.36 C ATOM 1184 O LYS A 163 -11.943 5.183 0.414 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.210 6.462 3.575 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.299 7.461 3.181 1.00 0.39 C ATOM 1187 CD LYS A 163 -12.138 8.749 3.989 1.00 1.30 C ATOM 1188 CE LYS A 163 -13.249 9.739 3.608 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.546 10.914 3.020 1.00 2.30 N ATOM 0 H LYS A 163 -9.805 4.562 4.050 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.405 4.795 2.836 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.271 6.238 4.640 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.224 6.890 3.395 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -12.236 7.680 2.115 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.284 7.029 3.360 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -12.183 8.529 5.056 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -11.161 9.192 3.796 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -13.941 9.296 2.892 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -13.835 10.028 4.481 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -13.245 11.631 2.737 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -11.899 11.321 3.726 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -12.003 10.612 2.186 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.954 5.967 0.952 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.610 6.247 -0.484 1.00 0.39 C ATOM 1205 C ALA A 164 -9.480 4.939 -1.273 1.00 0.39 C ATOM 1206 O ALA A 164 -9.821 4.849 -2.435 1.00 0.33 O ATOM 1207 CB ALA A 164 -8.266 6.977 -0.435 1.00 0.44 C ATOM 0 H ALA A 164 -9.225 6.204 1.625 1.00 0.36 H new ATOM 0 HA ALA A 164 -10.380 6.837 -0.980 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.945 7.217 -1.449 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -8.372 7.897 0.140 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.522 6.337 0.039 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.939 3.949 -0.635 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.696 2.620 -1.278 1.00 0.55 C ATOM 1215 C LEU A 165 -9.945 2.046 -1.969 1.00 0.45 C ATOM 1216 O LEU A 165 -9.995 1.959 -3.183 1.00 0.42 O ATOM 1217 CB LEU A 165 -8.274 1.734 -0.101 1.00 0.80 C ATOM 1218 CG LEU A 165 -7.903 0.343 -0.570 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -6.564 0.421 -1.309 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -7.770 -0.578 0.653 1.00 1.24 C ATOM 0 H LEU A 165 -8.642 4.000 0.340 1.00 0.50 H new ATOM 0 HA LEU A 165 -7.954 2.687 -2.073 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.425 2.186 0.412 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -9.088 1.672 0.622 1.00 0.80 H new ATOM 0 HG LEU A 165 -8.669 -0.053 -1.237 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.281 -0.573 -1.654 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -6.659 1.089 -2.165 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -5.798 0.803 -0.634 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -7.503 -1.582 0.325 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -6.994 -0.194 1.315 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -8.719 -0.612 1.188 1.00 1.24 H new ATOM 1232 N ARG A 166 -10.933 1.620 -1.218 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.150 1.018 -1.853 1.00 0.45 C ATOM 1234 C ARG A 166 -12.987 2.065 -2.591 1.00 0.41 C ATOM 1235 O ARG A 166 -13.643 1.756 -3.569 1.00 0.52 O ATOM 1236 CB ARG A 166 -12.941 0.375 -0.708 1.00 0.52 C ATOM 1237 CG ARG A 166 -13.505 1.445 0.235 1.00 1.19 C ATOM 1238 CD ARG A 166 -14.069 0.769 1.487 1.00 1.53 C ATOM 1239 NE ARG A 166 -14.547 1.888 2.344 1.00 2.29 N ATOM 1240 CZ ARG A 166 -14.565 1.752 3.641 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -13.461 1.488 4.285 1.00 3.25 N ATOM 1242 NH2 ARG A 166 -15.687 1.880 4.294 1.00 3.60 N ATOM 0 H ARG A 166 -10.950 1.662 -0.199 1.00 0.47 H new ATOM 0 HA ARG A 166 -11.874 0.285 -2.610 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -13.756 -0.223 -1.115 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -12.295 -0.303 -0.150 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -12.723 2.152 0.511 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.286 2.014 -0.268 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -14.882 0.088 1.236 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -13.306 0.180 1.996 1.00 1.53 H new ATOM 0 HE ARG A 166 -14.860 2.760 1.918 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -12.584 1.388 3.774 1.00 3.25 H new ATOM 0 HH12 ARG A 166 -13.475 1.382 5.299 1.00 3.25 H new ATOM 0 HH21 ARG A 166 -16.550 2.086 3.790 1.00 3.60 H new ATOM 0 HH22 ARG A 166 -15.702 1.774 5.308 1.00 3.60 H new ATOM 1256 N THR A 167 -12.976 3.295 -2.138 1.00 0.33 N ATOM 1257 CA THR A 167 -13.787 4.346 -2.835 1.00 0.36 C ATOM 1258 C THR A 167 -13.322 4.479 -4.284 1.00 0.35 C ATOM 1259 O THR A 167 -14.121 4.632 -5.190 1.00 0.41 O ATOM 1260 CB THR A 167 -13.546 5.639 -2.050 1.00 0.42 C ATOM 1261 OG1 THR A 167 -14.065 5.489 -0.736 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.242 6.822 -2.734 1.00 0.47 C ATOM 0 H THR A 167 -12.448 3.616 -1.326 1.00 0.33 H new ATOM 0 HA THR A 167 -14.849 4.102 -2.866 1.00 0.36 H new ATOM 0 HB THR A 167 -12.474 5.835 -2.013 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.361 5.683 -0.082 1.00 0.44 H new ATOM 0 HG21 THR A 167 -14.060 7.732 -2.162 1.00 0.47 H new ATOM 0 HG22 THR A 167 -13.847 6.942 -3.743 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.314 6.634 -2.784 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.038 4.417 -4.505 1.00 0.32 N ATOM 1271 CA CYS A 168 -11.515 4.533 -5.893 1.00 0.36 C ATOM 1272 C CYS A 168 -11.691 3.207 -6.641 1.00 0.31 C ATOM 1273 O CYS A 168 -12.289 3.164 -7.699 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.031 4.863 -5.733 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.316 5.244 -7.351 1.00 1.38 S ATOM 0 H CYS A 168 -11.329 4.291 -3.783 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.043 5.294 -6.468 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -9.907 5.712 -5.061 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -9.507 4.020 -5.282 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.055 5.526 -7.212 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.180 2.122 -6.096 1.00 0.30 N ATOM 1282 CA ARG A 169 -11.324 0.786 -6.792 1.00 0.31 C ATOM 1283 C ARG A 169 -10.765 -0.392 -5.975 1.00 0.26 C ATOM 1284 O ARG A 169 -11.089 -1.534 -6.243 1.00 0.34 O ATOM 1285 CB ARG A 169 -10.531 0.911 -8.099 1.00 0.44 C ATOM 1286 CG ARG A 169 -10.775 -0.331 -8.963 1.00 0.69 C ATOM 1287 CD ARG A 169 -10.272 -0.075 -10.387 1.00 0.84 C ATOM 1288 NE ARG A 169 -8.796 0.066 -10.260 1.00 1.56 N ATOM 1289 CZ ARG A 169 -8.017 -0.349 -11.221 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -7.578 -1.577 -11.220 1.00 2.73 N ATOM 1291 NH2 ARG A 169 -7.679 0.465 -12.184 1.00 2.74 N ATOM 0 H ARG A 169 -10.675 2.098 -5.210 1.00 0.30 H new ATOM 0 HA ARG A 169 -12.382 0.570 -6.943 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -10.836 1.808 -8.638 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -9.468 1.015 -7.884 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -10.261 -1.191 -8.534 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -11.838 -0.571 -8.980 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -10.533 -0.899 -11.051 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -10.719 0.826 -10.806 1.00 0.84 H new ATOM 0 HE ARG A 169 -8.394 0.487 -9.422 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -7.844 -2.213 -10.468 1.00 2.73 H new ATOM 0 HH12 ARG A 169 -6.969 -1.902 -11.971 1.00 2.73 H new ATOM 0 HH21 ARG A 169 -8.024 1.425 -12.185 1.00 2.74 H new ATOM 0 HH22 ARG A 169 -7.070 0.141 -12.935 1.00 2.74 H new ATOM 1305 N LEU A 170 -9.901 -0.144 -5.027 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.285 -1.271 -4.250 1.00 0.17 C ATOM 1307 C LEU A 170 -10.199 -1.788 -3.123 1.00 0.19 C ATOM 1308 O LEU A 170 -9.786 -1.927 -1.980 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.007 -0.663 -3.683 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.080 -0.256 -4.834 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.175 1.254 -5.066 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -5.638 -0.617 -4.472 1.00 0.25 C ATOM 0 H LEU A 170 -9.592 0.789 -4.753 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.108 -2.144 -4.878 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.246 0.206 -3.070 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -7.506 -1.382 -3.035 1.00 0.18 H new ATOM 0 HG LEU A 170 -7.379 -0.782 -5.741 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -6.514 1.539 -5.885 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.202 1.519 -5.319 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -6.877 1.781 -4.160 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -4.975 -0.329 -5.288 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.347 -0.088 -3.564 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -5.563 -1.692 -4.305 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.428 -2.094 -3.444 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.380 -2.623 -2.422 1.00 0.30 C ATOM 1326 C ASN A 171 -11.862 -3.944 -1.833 1.00 0.24 C ATOM 1327 O ASN A 171 -12.081 -4.248 -0.677 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.672 -2.872 -3.196 1.00 0.40 C ATOM 1329 CG ASN A 171 -14.864 -2.614 -2.288 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.272 -3.468 -1.527 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.437 -1.448 -2.343 1.00 0.59 N ATOM 0 H ASN A 171 -11.818 -1.999 -4.382 1.00 0.24 H new ATOM 0 HA ASN A 171 -12.512 -1.933 -1.589 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -13.718 -2.220 -4.068 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.696 -3.898 -3.564 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.237 -1.244 -1.744 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.087 -0.737 -2.986 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.208 -4.744 -2.642 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.699 -6.076 -2.167 1.00 0.21 C ATOM 1340 C LEU A 172 -9.890 -5.955 -0.868 1.00 0.17 C ATOM 1341 O LEU A 172 -10.227 -6.538 0.153 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.772 -6.554 -3.295 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.580 -7.340 -4.328 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -11.457 -6.385 -5.138 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -9.621 -8.074 -5.268 1.00 0.85 C ATOM 0 H LEU A 172 -11.002 -4.532 -3.618 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.523 -6.757 -1.955 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -9.290 -5.699 -3.770 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.979 -7.180 -2.886 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.216 -8.061 -3.815 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -12.030 -6.951 -5.872 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -12.141 -5.863 -4.469 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -10.827 -5.659 -5.651 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -10.194 -8.636 -6.006 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -8.985 -7.350 -5.777 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -9.000 -8.760 -4.692 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.825 -5.208 -0.908 1.00 0.16 N ATOM 1358 CA VAL A 173 -7.966 -5.048 0.309 1.00 0.21 C ATOM 1359 C VAL A 173 -8.714 -4.329 1.418 1.00 0.22 C ATOM 1360 O VAL A 173 -8.549 -4.655 2.581 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.714 -4.269 -0.111 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.788 -5.223 -0.854 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.059 -3.083 -1.022 1.00 0.34 C ATOM 0 H VAL A 173 -8.506 -4.697 -1.731 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.688 -6.024 0.706 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.235 -3.869 0.782 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -4.889 -4.690 -1.163 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.513 -6.048 -0.197 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.299 -5.614 -1.734 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.145 -2.557 -1.297 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.553 -3.448 -1.923 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -7.725 -2.400 -0.494 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.547 -3.372 1.092 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.309 -2.669 2.174 1.00 0.34 C ATOM 1375 C ALA A 174 -11.129 -3.705 2.956 1.00 0.29 C ATOM 1376 O ALA A 174 -11.204 -3.672 4.168 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.219 -1.686 1.451 1.00 0.43 C ATOM 0 H ALA A 174 -9.732 -3.050 0.142 1.00 0.27 H new ATOM 0 HA ALA A 174 -9.664 -2.154 2.886 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -11.810 -1.133 2.181 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -10.614 -0.989 0.871 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -11.885 -2.231 0.783 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.718 -4.642 2.259 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.501 -5.713 2.945 1.00 0.23 C ATOM 1385 C ASP A 175 -11.603 -6.508 3.902 1.00 0.17 C ATOM 1386 O ASP A 175 -12.015 -6.875 4.986 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.042 -6.606 1.822 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.137 -5.858 1.049 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -14.757 -4.978 1.626 1.00 0.80 O ATOM 1390 OD2 ASP A 175 -14.338 -6.181 -0.110 1.00 0.99 O ATOM 0 H ASP A 175 -11.690 -4.712 1.242 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.309 -5.304 3.551 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.234 -6.887 1.147 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.444 -7.529 2.240 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.385 -6.791 3.501 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.466 -7.585 4.389 1.00 0.20 C ATOM 1397 C LEU A 176 -9.198 -6.847 5.700 1.00 0.25 C ATOM 1398 O LEU A 176 -9.452 -7.361 6.774 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.151 -7.734 3.613 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.399 -8.382 2.247 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -7.072 -8.517 1.492 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -9.037 -9.764 2.432 1.00 1.09 C ATOM 0 H LEU A 176 -9.987 -6.510 2.605 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.911 -8.548 4.640 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.689 -6.756 3.479 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.451 -8.341 4.187 1.00 0.28 H new ATOM 0 HG LEU A 176 -9.078 -7.753 1.670 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -7.251 -8.978 0.521 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -6.632 -7.530 1.349 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -6.387 -9.139 2.068 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -9.210 -10.218 1.456 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -8.369 -10.398 3.014 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -9.986 -9.659 2.957 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.684 -5.645 5.620 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.397 -4.868 6.864 1.00 0.41 C ATOM 1416 C VAL A 177 -9.701 -4.653 7.636 1.00 0.37 C ATOM 1417 O VAL A 177 -9.743 -4.774 8.846 1.00 0.39 O ATOM 1418 CB VAL A 177 -7.797 -3.535 6.396 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.495 -3.803 5.639 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -8.775 -2.807 5.469 1.00 0.52 C ATOM 0 H VAL A 177 -8.451 -5.169 4.748 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.708 -5.384 7.532 1.00 0.41 H new ATOM 0 HB VAL A 177 -7.601 -2.911 7.268 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.067 -2.858 5.305 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -5.789 -4.309 6.297 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.700 -4.434 4.774 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.336 -1.863 5.145 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -8.982 -3.429 4.598 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -9.704 -2.610 6.003 1.00 0.52 H new ATOM 1430 N GLU A 178 -10.773 -4.373 6.934 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.090 -4.194 7.616 1.00 0.39 C ATOM 1432 C GLU A 178 -12.488 -5.503 8.309 1.00 0.31 C ATOM 1433 O GLU A 178 -12.828 -5.523 9.477 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.063 -3.834 6.483 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.515 -3.921 6.968 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.463 -3.327 5.918 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -14.998 -2.583 5.068 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.644 -3.629 5.982 1.00 1.85 O ATOM 0 H GLU A 178 -10.791 -4.261 5.920 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.078 -3.425 8.388 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -12.854 -2.826 6.124 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -12.914 -4.510 5.641 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -14.780 -4.961 7.160 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.624 -3.385 7.911 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.434 -6.594 7.590 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.793 -7.913 8.190 1.00 0.24 C ATOM 1447 C GLU A 179 -11.834 -8.237 9.341 1.00 0.25 C ATOM 1448 O GLU A 179 -12.229 -8.775 10.356 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.666 -8.923 7.044 1.00 0.31 C ATOM 1450 CG GLU A 179 -13.892 -8.815 6.131 1.00 1.03 C ATOM 1451 CD GLU A 179 -15.157 -9.210 6.903 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -15.043 -9.986 7.839 1.00 1.92 O ATOM 1453 OE2 GLU A 179 -16.218 -8.728 6.544 1.00 1.76 O ATOM 0 H GLU A 179 -12.156 -6.628 6.609 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.798 -7.927 8.612 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.757 -8.731 6.474 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.584 -9.934 7.443 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -13.988 -7.796 5.756 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -13.768 -9.463 5.264 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.578 -7.908 9.185 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.579 -8.184 10.268 1.00 0.38 C ATOM 1462 C ALA A 180 -9.824 -7.276 11.485 1.00 0.44 C ATOM 1463 O ALA A 180 -9.375 -7.566 12.579 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.218 -7.867 9.645 1.00 0.50 C ATOM 0 H ALA A 180 -10.197 -7.458 8.352 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.646 -9.213 10.623 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.432 -8.045 10.379 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.057 -8.507 8.778 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.195 -6.823 9.334 1.00 0.50 H new