USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=14 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 Single : A 96 TYR OH : rot 165:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 105 CYS SG : rot 180:sc= -4.04! USER MOD Single : A 107 ASN : amide:sc= -5.61! C(o=-5.6!,f=-6.1!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl -135:sc= -1.13 (180deg=-3.27!) USER MOD Single : A 132 LYS NZ :NH3+ 156:sc= -0.0826 (180deg=-0.938) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0.0138 USER MOD Single : A 144 SER OG : rot -106:sc= 0.355 USER MOD Single : A 146 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0577) USER MOD Single : A 149 LYS NZ :NH3+ -170:sc= 0.414 (180deg=0.3) USER MOD Single : A 150 ASN : amide:sc= -1.15 K(o=-1.1,f=-0.1) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= -0.0745 K(o=-0.075,f=-2.1!) USER MOD Single : A 157 SER OG : rot -89:sc= 0.618 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 78:sc= 0.919 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=-0.029) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 90 8.401 9.645 10.004 1.00 0.96 N ATOM 12 CA ALA A 90 7.417 8.804 9.253 1.00 0.72 C ATOM 13 C ALA A 90 6.315 8.373 10.221 1.00 0.58 C ATOM 14 O ALA A 90 6.352 8.755 11.375 1.00 1.23 O ATOM 15 CB ALA A 90 8.222 7.597 8.749 1.00 1.03 C ATOM 0 HA ALA A 90 6.942 9.325 8.422 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.567 6.932 8.187 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.029 7.942 8.103 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.642 7.059 9.599 1.00 1.03 H new ATOM 21 N PRO A 91 5.359 7.599 9.751 1.00 0.79 N ATOM 22 CA PRO A 91 4.267 7.161 10.652 1.00 1.10 C ATOM 23 C PRO A 91 4.854 6.332 11.805 1.00 0.60 C ATOM 24 O PRO A 91 5.323 5.233 11.591 1.00 0.91 O ATOM 25 CB PRO A 91 3.359 6.331 9.744 1.00 1.98 C ATOM 26 CG PRO A 91 4.245 5.899 8.627 1.00 2.18 C ATOM 27 CD PRO A 91 5.188 7.047 8.396 1.00 1.62 C ATOM 0 HA PRO A 91 3.721 7.979 11.122 1.00 1.10 H new ATOM 0 HB2 PRO A 91 2.943 5.475 10.274 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.518 6.920 9.379 1.00 1.98 H new ATOM 0 HG2 PRO A 91 4.789 4.990 8.886 1.00 2.18 H new ATOM 0 HG3 PRO A 91 3.667 5.679 7.730 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.135 6.715 7.971 1.00 1.62 H new ATOM 0 HD3 PRO A 91 4.771 7.782 7.708 1.00 1.62 H new ATOM 35 N PRO A 92 4.830 6.893 12.999 1.00 0.59 N ATOM 36 CA PRO A 92 5.396 6.182 14.172 1.00 0.84 C ATOM 37 C PRO A 92 4.655 4.864 14.411 1.00 0.71 C ATOM 38 O PRO A 92 5.258 3.867 14.761 1.00 0.83 O ATOM 39 CB PRO A 92 5.221 7.178 15.321 1.00 1.49 C ATOM 40 CG PRO A 92 4.119 8.077 14.873 1.00 1.64 C ATOM 41 CD PRO A 92 4.280 8.204 13.382 1.00 1.21 C ATOM 0 HA PRO A 92 6.440 5.895 14.048 1.00 0.84 H new ATOM 0 HB2 PRO A 92 4.965 6.670 16.251 1.00 1.49 H new ATOM 0 HB3 PRO A 92 6.139 7.737 15.505 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.145 7.660 15.128 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.186 9.051 15.359 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.329 8.403 12.888 1.00 1.21 H new ATOM 0 HD3 PRO A 92 4.954 9.018 13.116 1.00 1.21 H new ATOM 49 N GLY A 93 3.362 4.840 14.201 1.00 0.65 N ATOM 50 CA GLY A 93 2.598 3.567 14.392 1.00 0.71 C ATOM 51 C GLY A 93 2.611 2.723 13.111 1.00 0.58 C ATOM 52 O GLY A 93 1.586 2.217 12.692 1.00 0.58 O ATOM 0 H GLY A 93 2.804 5.642 13.907 1.00 0.65 H new ATOM 0 HA2 GLY A 93 3.033 2.997 15.212 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.569 3.794 14.672 1.00 0.71 H new ATOM 56 N GLU A 94 3.754 2.560 12.490 1.00 0.56 N ATOM 57 CA GLU A 94 3.818 1.740 11.239 1.00 0.55 C ATOM 58 C GLU A 94 3.486 0.278 11.540 1.00 0.49 C ATOM 59 O GLU A 94 3.141 -0.473 10.649 1.00 0.53 O ATOM 60 CB GLU A 94 5.251 1.875 10.727 1.00 0.66 C ATOM 61 CG GLU A 94 5.378 1.151 9.381 1.00 1.09 C ATOM 62 CD GLU A 94 6.793 1.330 8.809 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.543 2.131 9.347 1.00 1.62 O ATOM 64 OE2 GLU A 94 7.104 0.654 7.843 1.00 1.44 O ATOM 0 H GLU A 94 4.643 2.958 12.794 1.00 0.56 H new ATOM 0 HA GLU A 94 3.096 2.081 10.497 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.511 2.927 10.613 1.00 0.66 H new ATOM 0 HB3 GLU A 94 5.949 1.451 11.449 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.162 0.090 9.509 1.00 1.09 H new ATOM 0 HG3 GLU A 94 4.642 1.543 8.679 1.00 1.09 H new ATOM 71 N ALA A 95 3.579 -0.137 12.784 1.00 0.49 N ATOM 72 CA ALA A 95 3.256 -1.559 13.118 1.00 0.50 C ATOM 73 C ALA A 95 1.809 -1.862 12.724 1.00 0.38 C ATOM 74 O ALA A 95 1.534 -2.838 12.052 1.00 0.36 O ATOM 75 CB ALA A 95 3.440 -1.679 14.633 1.00 0.61 C ATOM 0 H ALA A 95 3.862 0.443 13.574 1.00 0.49 H new ATOM 0 HA ALA A 95 3.894 -2.264 12.586 1.00 0.50 H new ATOM 0 HB1 ALA A 95 3.219 -2.699 14.947 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.469 -1.434 14.895 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.763 -0.989 15.137 1.00 0.61 H new ATOM 81 N TYR A 96 0.887 -1.011 13.107 1.00 0.38 N ATOM 82 CA TYR A 96 -0.540 -1.231 12.718 1.00 0.35 C ATOM 83 C TYR A 96 -0.650 -1.127 11.199 1.00 0.28 C ATOM 84 O TYR A 96 -1.329 -1.896 10.546 1.00 0.29 O ATOM 85 CB TYR A 96 -1.325 -0.114 13.409 1.00 0.42 C ATOM 86 CG TYR A 96 -2.798 -0.272 13.118 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.495 -1.376 13.621 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.469 0.690 12.352 1.00 1.54 C ATOM 89 CE1 TYR A 96 -4.863 -1.520 13.359 1.00 1.85 C ATOM 90 CE2 TYR A 96 -4.837 0.545 12.089 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.533 -0.560 12.593 1.00 1.77 C ATOM 92 OH TYR A 96 -6.881 -0.702 12.335 1.00 2.32 O ATOM 0 H TYR A 96 1.061 -0.178 13.669 1.00 0.38 H new ATOM 0 HA TYR A 96 -0.922 -2.209 13.011 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.151 -0.146 14.485 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -0.978 0.858 13.059 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -2.978 -2.118 14.212 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.932 1.543 11.964 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.401 -2.372 13.748 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -5.355 1.286 11.497 1.00 1.93 H new ATOM 0 HH TYR A 96 -7.242 0.147 12.006 1.00 2.32 H new ATOM 102 N LEU A 97 0.040 -0.169 10.646 1.00 0.42 N ATOM 103 CA LEU A 97 0.033 0.036 9.167 1.00 0.55 C ATOM 104 C LEU A 97 0.557 -1.208 8.454 1.00 0.43 C ATOM 105 O LEU A 97 -0.031 -1.680 7.498 1.00 0.35 O ATOM 106 CB LEU A 97 0.976 1.229 8.944 1.00 0.90 C ATOM 107 CG LEU A 97 1.112 1.539 7.452 1.00 0.94 C ATOM 108 CD1 LEU A 97 1.454 3.018 7.270 1.00 1.33 C ATOM 109 CD2 LEU A 97 2.233 0.686 6.852 1.00 1.75 C ATOM 0 H LEU A 97 0.619 0.492 11.164 1.00 0.42 H new ATOM 0 HA LEU A 97 -0.967 0.219 8.774 1.00 0.55 H new ATOM 0 HB2 LEU A 97 0.594 2.104 9.469 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.957 1.008 9.365 1.00 0.90 H new ATOM 0 HG LEU A 97 0.172 1.314 6.948 1.00 0.94 H new ATOM 0 HD11 LEU A 97 1.551 3.241 6.207 1.00 1.33 H new ATOM 0 HD12 LEU A 97 0.660 3.630 7.698 1.00 1.33 H new ATOM 0 HD13 LEU A 97 2.395 3.239 7.775 1.00 1.33 H new ATOM 0 HD21 LEU A 97 2.329 0.907 5.789 1.00 1.75 H new ATOM 0 HD22 LEU A 97 3.172 0.913 7.356 1.00 1.75 H new ATOM 0 HD23 LEU A 97 1.996 -0.370 6.983 1.00 1.75 H new ATOM 121 N GLN A 98 1.665 -1.730 8.905 1.00 0.47 N ATOM 122 CA GLN A 98 2.247 -2.937 8.246 1.00 0.49 C ATOM 123 C GLN A 98 1.259 -4.106 8.306 1.00 0.38 C ATOM 124 O GLN A 98 1.137 -4.870 7.366 1.00 0.39 O ATOM 125 CB GLN A 98 3.516 -3.267 9.032 1.00 0.63 C ATOM 126 CG GLN A 98 4.369 -4.247 8.221 1.00 0.57 C ATOM 127 CD GLN A 98 5.638 -4.611 9.000 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.856 -4.136 10.098 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.494 -5.441 8.470 1.00 2.04 N ATOM 0 H GLN A 98 2.193 -1.374 9.701 1.00 0.47 H new ATOM 0 HA GLN A 98 2.464 -2.756 7.193 1.00 0.49 H new ATOM 0 HB2 GLN A 98 4.080 -2.356 9.235 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.258 -3.703 9.997 1.00 0.63 H new ATOM 0 HG2 GLN A 98 3.795 -5.148 8.005 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.636 -3.802 7.263 1.00 0.57 H new ATOM 0 HE21 GLN A 98 6.314 -5.841 7.549 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.344 -5.690 8.977 1.00 2.04 H new ATOM 138 N VAL A 99 0.560 -4.258 9.406 1.00 0.33 N ATOM 139 CA VAL A 99 -0.412 -5.390 9.526 1.00 0.31 C ATOM 140 C VAL A 99 -1.484 -5.287 8.432 1.00 0.24 C ATOM 141 O VAL A 99 -1.745 -6.248 7.725 1.00 0.30 O ATOM 142 CB VAL A 99 -1.032 -5.242 10.923 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.122 -6.300 11.133 1.00 0.43 C ATOM 144 CG2 VAL A 99 0.058 -5.420 11.982 1.00 0.43 C ATOM 0 H VAL A 99 0.620 -3.650 10.222 1.00 0.33 H new ATOM 0 HA VAL A 99 0.066 -6.362 9.402 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.477 -4.251 11.012 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.554 -6.185 12.127 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.901 -6.173 10.382 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.686 -7.295 11.040 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.379 -5.315 12.975 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.503 -6.410 11.884 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.828 -4.661 11.843 1.00 0.43 H new ATOM 154 N ALA A 100 -2.096 -4.135 8.271 1.00 0.18 N ATOM 155 CA ALA A 100 -3.132 -4.003 7.203 1.00 0.18 C ATOM 156 C ALA A 100 -2.442 -4.057 5.846 1.00 0.14 C ATOM 157 O ALA A 100 -2.896 -4.712 4.936 1.00 0.14 O ATOM 158 CB ALA A 100 -3.787 -2.640 7.432 1.00 0.24 C ATOM 0 H ALA A 100 -1.925 -3.296 8.824 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.877 -4.799 7.230 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.560 -2.477 6.681 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.235 -2.614 8.425 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -3.033 -1.856 7.353 1.00 0.24 H new ATOM 164 N PHE A 101 -1.323 -3.396 5.733 1.00 0.15 N ATOM 165 CA PHE A 101 -0.545 -3.414 4.456 1.00 0.16 C ATOM 166 C PHE A 101 -0.111 -4.843 4.133 1.00 0.17 C ATOM 167 O PHE A 101 0.249 -5.131 3.024 1.00 0.20 O ATOM 168 CB PHE A 101 0.686 -2.537 4.730 1.00 0.19 C ATOM 169 CG PHE A 101 0.370 -1.048 4.609 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.873 -0.520 5.013 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.352 -0.183 4.107 1.00 1.10 C ATOM 172 CE1 PHE A 101 -1.119 0.852 4.911 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.103 1.189 4.014 1.00 1.10 C ATOM 174 CZ PHE A 101 -0.130 1.706 4.417 1.00 0.43 C ATOM 0 H PHE A 101 -0.908 -2.837 6.478 1.00 0.15 H new ATOM 0 HA PHE A 101 -1.128 -3.051 3.610 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.064 -2.747 5.731 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.479 -2.797 4.029 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.637 -1.177 5.402 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.306 -0.579 3.791 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -2.075 1.253 5.214 1.00 1.26 H new ATOM 0 HE2 PHE A 101 1.865 1.850 3.630 1.00 1.10 H new ATOM 0 HZ PHE A 101 -0.319 2.767 4.347 1.00 0.43 H new ATOM 184 N ASP A 102 -0.128 -5.737 5.090 1.00 0.18 N ATOM 185 CA ASP A 102 0.305 -7.138 4.810 1.00 0.21 C ATOM 186 C ASP A 102 -0.835 -7.956 4.217 1.00 0.20 C ATOM 187 O ASP A 102 -0.686 -8.567 3.174 1.00 0.22 O ATOM 188 CB ASP A 102 0.711 -7.699 6.161 1.00 0.25 C ATOM 189 CG ASP A 102 1.377 -9.063 5.974 1.00 0.32 C ATOM 190 OD1 ASP A 102 0.661 -10.050 5.938 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.592 -9.097 5.865 1.00 1.13 O ATOM 0 H ASP A 102 -0.422 -5.557 6.050 1.00 0.18 H new ATOM 0 HA ASP A 102 1.118 -7.172 4.085 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.397 -7.014 6.659 1.00 0.25 H new ATOM 0 HB3 ASP A 102 -0.164 -7.796 6.803 1.00 0.25 H new ATOM 196 N ILE A 103 -1.974 -7.982 4.869 1.00 0.18 N ATOM 197 CA ILE A 103 -3.114 -8.777 4.324 1.00 0.18 C ATOM 198 C ILE A 103 -3.509 -8.237 2.950 1.00 0.17 C ATOM 199 O ILE A 103 -3.758 -8.986 2.017 1.00 0.18 O ATOM 200 CB ILE A 103 -4.267 -8.631 5.336 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.639 -7.151 5.554 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.855 -9.260 6.666 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.810 -7.042 6.541 1.00 0.87 C ATOM 0 H ILE A 103 -2.160 -7.492 5.744 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.854 -9.827 4.193 1.00 0.18 H new ATOM 0 HB ILE A 103 -5.142 -9.142 4.936 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.778 -6.604 5.938 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.910 -6.692 4.603 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.669 -9.158 7.384 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.634 -10.317 6.516 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.968 -8.754 7.048 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -6.065 -5.993 6.688 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.674 -7.573 6.141 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.523 -7.483 7.496 1.00 0.87 H new ATOM 215 N VAL A 104 -3.552 -6.942 2.819 1.00 0.16 N ATOM 216 CA VAL A 104 -3.929 -6.342 1.507 1.00 0.16 C ATOM 217 C VAL A 104 -2.834 -6.586 0.462 1.00 0.17 C ATOM 218 O VAL A 104 -3.112 -6.858 -0.691 1.00 0.18 O ATOM 219 CB VAL A 104 -4.105 -4.844 1.772 1.00 0.16 C ATOM 220 CG1 VAL A 104 -5.174 -4.621 2.847 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.778 -4.220 2.223 1.00 0.14 C ATOM 0 H VAL A 104 -3.343 -6.273 3.560 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.841 -6.788 1.110 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.423 -4.365 0.846 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.291 -3.552 3.028 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -6.123 -5.038 2.509 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.870 -5.114 3.770 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.921 -3.155 2.407 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.441 -4.705 3.139 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -2.028 -4.356 1.444 1.00 0.14 H new ATOM 231 N CYS A 105 -1.591 -6.477 0.861 1.00 0.18 N ATOM 232 CA CYS A 105 -0.465 -6.687 -0.106 1.00 0.19 C ATOM 233 C CYS A 105 -0.495 -8.095 -0.663 1.00 0.20 C ATOM 234 O CYS A 105 -0.443 -8.295 -1.861 1.00 0.21 O ATOM 235 CB CYS A 105 0.802 -6.434 0.706 1.00 0.22 C ATOM 236 SG CYS A 105 2.270 -6.650 -0.328 1.00 0.29 S ATOM 0 H CYS A 105 -1.306 -6.252 1.814 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.528 -6.023 -0.968 1.00 0.19 H new ATOM 0 HB2 CYS A 105 0.783 -5.424 1.115 1.00 0.22 H new ATOM 0 HB3 CYS A 105 0.842 -7.120 1.552 1.00 0.22 H new ATOM 0 HG CYS A 105 3.337 -6.428 0.381 1.00 0.29 H new ATOM 242 N ASP A 106 -0.591 -9.067 0.190 1.00 0.21 N ATOM 243 CA ASP A 106 -0.638 -10.468 -0.306 1.00 0.24 C ATOM 244 C ASP A 106 -1.931 -10.677 -1.114 1.00 0.25 C ATOM 245 O ASP A 106 -2.064 -11.645 -1.840 1.00 0.28 O ATOM 246 CB ASP A 106 -0.624 -11.341 0.944 1.00 0.25 C ATOM 247 CG ASP A 106 0.721 -11.198 1.665 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.706 -10.913 1.002 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.744 -11.379 2.872 1.00 1.05 O ATOM 0 H ASP A 106 -0.639 -8.957 1.203 1.00 0.21 H new ATOM 0 HA ASP A 106 0.197 -10.712 -0.962 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.436 -11.050 1.610 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.792 -12.383 0.672 1.00 0.25 H new ATOM 254 N ASN A 107 -2.883 -9.770 -0.997 1.00 0.24 N ATOM 255 CA ASN A 107 -4.157 -9.910 -1.759 1.00 0.26 C ATOM 256 C ASN A 107 -4.049 -9.228 -3.126 1.00 0.26 C ATOM 257 O ASN A 107 -4.537 -9.734 -4.120 1.00 0.29 O ATOM 258 CB ASN A 107 -5.187 -9.163 -0.918 1.00 0.25 C ATOM 259 CG ASN A 107 -6.559 -9.810 -1.109 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.437 -9.230 -1.717 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.784 -10.993 -0.608 1.00 1.23 N ATOM 0 H ASN A 107 -2.824 -8.942 -0.404 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.411 -10.956 -1.932 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.903 -9.189 0.134 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.222 -8.114 -1.212 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.697 -11.432 -0.726 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -6.047 -11.479 -0.098 1.00 1.23 H new ATOM 268 N VAL A 108 -3.431 -8.074 -3.178 1.00 0.23 N ATOM 269 CA VAL A 108 -3.312 -7.346 -4.476 1.00 0.24 C ATOM 270 C VAL A 108 -2.185 -6.311 -4.407 1.00 0.25 C ATOM 271 O VAL A 108 -2.301 -5.219 -4.923 1.00 0.42 O ATOM 272 CB VAL A 108 -4.687 -6.688 -4.657 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.890 -5.528 -3.672 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.824 -6.178 -6.093 1.00 0.27 C ATOM 0 H VAL A 108 -3.005 -7.606 -2.378 1.00 0.23 H new ATOM 0 HA VAL A 108 -3.060 -7.995 -5.314 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.452 -7.437 -4.454 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.874 -5.086 -3.829 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.818 -5.901 -2.650 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.122 -4.772 -3.837 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.800 -5.711 -6.222 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.042 -5.446 -6.295 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.727 -7.013 -6.787 1.00 0.27 H new ATOM 284 N GLY A 109 -1.123 -6.653 -3.726 1.00 0.24 N ATOM 285 CA GLY A 109 0.044 -5.731 -3.526 1.00 0.22 C ATOM 286 C GLY A 109 0.305 -4.836 -4.763 1.00 0.23 C ATOM 287 O GLY A 109 0.570 -3.657 -4.636 1.00 0.21 O ATOM 0 H GLY A 109 -1.010 -7.565 -3.283 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.139 -5.100 -2.656 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.936 -6.319 -3.311 1.00 0.22 H new ATOM 291 N ARG A 110 0.235 -5.393 -5.949 1.00 0.27 N ATOM 292 CA ARG A 110 0.495 -4.584 -7.190 1.00 0.28 C ATOM 293 C ARG A 110 -0.426 -3.355 -7.271 1.00 0.27 C ATOM 294 O ARG A 110 -0.140 -2.399 -7.987 1.00 0.27 O ATOM 295 CB ARG A 110 0.233 -5.535 -8.363 1.00 0.36 C ATOM 296 CG ARG A 110 1.564 -6.098 -8.879 1.00 0.55 C ATOM 297 CD ARG A 110 1.820 -7.478 -8.261 1.00 0.72 C ATOM 298 NE ARG A 110 1.669 -8.442 -9.386 1.00 1.08 N ATOM 299 CZ ARG A 110 1.062 -9.580 -9.190 1.00 1.39 C ATOM 300 NH1 ARG A 110 1.473 -10.386 -8.249 1.00 2.06 N ATOM 301 NH2 ARG A 110 0.043 -9.913 -9.935 1.00 1.68 N ATOM 0 H ARG A 110 0.009 -6.374 -6.115 1.00 0.27 H new ATOM 0 HA ARG A 110 1.514 -4.196 -7.198 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -0.419 -6.349 -8.045 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.284 -5.007 -9.164 1.00 0.36 H new ATOM 0 HG2 ARG A 110 1.539 -6.175 -9.966 1.00 0.55 H new ATOM 0 HG3 ARG A 110 2.379 -5.419 -8.626 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.817 -7.535 -7.824 1.00 0.72 H new ATOM 0 HD3 ARG A 110 1.109 -7.690 -7.462 1.00 0.72 H new ATOM 0 HE ARG A 110 2.040 -8.213 -10.308 1.00 1.08 H new ATOM 0 HH11 ARG A 110 2.269 -10.126 -7.667 1.00 2.06 H new ATOM 0 HH12 ARG A 110 0.998 -11.276 -8.096 1.00 2.06 H new ATOM 0 HH21 ARG A 110 -0.279 -9.283 -10.670 1.00 1.68 H new ATOM 0 HH22 ARG A 110 -0.432 -10.803 -9.782 1.00 1.68 H new ATOM 315 N ASP A 111 -1.512 -3.349 -6.539 1.00 0.27 N ATOM 316 CA ASP A 111 -2.417 -2.164 -6.581 1.00 0.30 C ATOM 317 C ASP A 111 -1.694 -0.970 -5.944 1.00 0.31 C ATOM 318 O ASP A 111 -2.013 0.172 -6.214 1.00 0.39 O ATOM 319 CB ASP A 111 -3.659 -2.568 -5.768 1.00 0.30 C ATOM 320 CG ASP A 111 -4.691 -3.240 -6.685 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.322 -3.652 -7.775 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.836 -3.335 -6.276 1.00 0.82 O ATOM 0 H ASP A 111 -1.807 -4.105 -5.921 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.699 -1.874 -7.593 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.373 -3.250 -4.967 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.097 -1.688 -5.297 1.00 0.30 H new ATOM 327 N TRP A 112 -0.696 -1.229 -5.128 1.00 0.27 N ATOM 328 CA TRP A 112 0.079 -0.115 -4.506 1.00 0.29 C ATOM 329 C TRP A 112 0.930 0.551 -5.580 1.00 0.32 C ATOM 330 O TRP A 112 1.172 1.735 -5.527 1.00 0.31 O ATOM 331 CB TRP A 112 0.945 -0.747 -3.411 1.00 0.29 C ATOM 332 CG TRP A 112 0.082 -1.592 -2.528 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.448 -2.785 -2.021 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.290 -1.357 -2.076 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.593 -3.289 -1.273 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.685 -2.454 -1.282 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.225 -0.315 -2.264 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -2.945 -2.526 -0.705 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.500 -0.388 -1.680 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.859 -1.497 -0.903 1.00 0.27 C ATOM 0 H TRP A 112 -0.388 -2.166 -4.869 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.564 0.652 -4.073 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.732 -1.354 -3.858 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.435 0.030 -2.825 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.402 -3.267 -2.176 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.558 -4.177 -0.772 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -1.957 0.544 -2.861 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.215 -3.381 -0.103 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.207 0.414 -1.831 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.842 -1.553 -0.459 1.00 0.27 H new ATOM 351 N LYS A 113 1.357 -0.193 -6.577 1.00 0.37 N ATOM 352 CA LYS A 113 2.153 0.433 -7.676 1.00 0.40 C ATOM 353 C LYS A 113 1.229 1.392 -8.424 1.00 0.34 C ATOM 354 O LYS A 113 1.607 2.492 -8.781 1.00 0.30 O ATOM 355 CB LYS A 113 2.612 -0.711 -8.581 1.00 0.50 C ATOM 356 CG LYS A 113 3.664 -1.548 -7.850 1.00 0.72 C ATOM 357 CD LYS A 113 4.152 -2.672 -8.766 1.00 0.89 C ATOM 358 CE LYS A 113 5.072 -2.087 -9.842 1.00 1.51 C ATOM 359 NZ LYS A 113 6.444 -2.170 -9.265 1.00 1.66 N ATOM 0 H LYS A 113 1.189 -1.194 -6.674 1.00 0.37 H new ATOM 0 HA LYS A 113 3.019 0.990 -7.318 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.762 -1.335 -8.856 1.00 0.50 H new ATOM 0 HB3 LYS A 113 3.027 -0.313 -9.507 1.00 0.50 H new ATOM 0 HG2 LYS A 113 4.502 -0.918 -7.552 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.240 -1.967 -6.937 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.686 -3.424 -8.185 1.00 0.89 H new ATOM 0 HD3 LYS A 113 3.302 -3.172 -9.231 1.00 0.89 H new ATOM 0 HE2 LYS A 113 5.000 -2.651 -10.772 1.00 1.51 H new ATOM 0 HE3 LYS A 113 4.803 -1.056 -10.073 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 7.131 -1.787 -9.946 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 6.484 -1.618 -8.385 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 6.676 -3.163 -9.062 1.00 1.66 H new ATOM 373 N ARG A 114 -0.003 0.986 -8.623 1.00 0.35 N ATOM 374 CA ARG A 114 -0.994 1.884 -9.305 1.00 0.33 C ATOM 375 C ARG A 114 -1.174 3.154 -8.462 1.00 0.28 C ATOM 376 O ARG A 114 -1.114 4.268 -8.957 1.00 0.29 O ATOM 377 CB ARG A 114 -2.301 1.074 -9.334 1.00 0.37 C ATOM 378 CG ARG A 114 -3.448 1.915 -9.915 1.00 0.38 C ATOM 379 CD ARG A 114 -4.757 1.575 -9.188 1.00 0.43 C ATOM 380 NE ARG A 114 -5.702 2.654 -9.586 1.00 0.57 N ATOM 381 CZ ARG A 114 -6.303 2.598 -10.743 1.00 1.04 C ATOM 382 NH1 ARG A 114 -7.423 1.941 -10.864 1.00 1.77 N ATOM 383 NH2 ARG A 114 -5.783 3.200 -11.777 1.00 1.62 N ATOM 0 H ARG A 114 -0.366 0.074 -8.344 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.682 2.186 -10.305 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.164 0.174 -9.933 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.556 0.750 -8.325 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.225 2.976 -9.806 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.552 1.719 -10.982 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -5.130 0.594 -9.482 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.615 1.551 -8.108 1.00 0.43 H new ATOM 0 HE ARG A 114 -5.880 3.436 -8.955 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -7.829 1.471 -10.055 1.00 1.77 H new ATOM 0 HH12 ARG A 114 -7.893 1.897 -11.768 1.00 1.77 H new ATOM 0 HH21 ARG A 114 -4.907 3.714 -11.681 1.00 1.62 H new ATOM 0 HH22 ARG A 114 -6.252 3.157 -12.682 1.00 1.62 H new ATOM 397 N LEU A 115 -1.391 2.978 -7.186 1.00 0.26 N ATOM 398 CA LEU A 115 -1.580 4.147 -6.279 1.00 0.25 C ATOM 399 C LEU A 115 -0.240 4.857 -6.066 1.00 0.25 C ATOM 400 O LEU A 115 -0.194 6.045 -5.815 1.00 0.26 O ATOM 401 CB LEU A 115 -2.108 3.554 -4.970 1.00 0.26 C ATOM 402 CG LEU A 115 -3.455 2.871 -5.230 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.891 2.081 -3.986 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.505 3.936 -5.563 1.00 0.23 C ATOM 0 H LEU A 115 -1.446 2.067 -6.730 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.269 4.889 -6.684 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.394 2.835 -4.569 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.224 4.339 -4.222 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.356 2.181 -6.068 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.849 1.599 -4.179 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.143 1.323 -3.756 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.991 2.761 -3.140 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.465 3.455 -5.749 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.601 4.626 -4.725 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.196 4.486 -6.452 1.00 0.23 H new ATOM 416 N ALA A 116 0.853 4.137 -6.177 1.00 0.26 N ATOM 417 CA ALA A 116 2.199 4.767 -5.999 1.00 0.28 C ATOM 418 C ALA A 116 2.370 5.871 -7.044 1.00 0.26 C ATOM 419 O ALA A 116 2.704 7.006 -6.732 1.00 0.27 O ATOM 420 CB ALA A 116 3.211 3.639 -6.230 1.00 0.31 C ATOM 0 H ALA A 116 0.869 3.138 -6.384 1.00 0.26 H new ATOM 0 HA ALA A 116 2.331 5.216 -5.015 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.223 4.029 -6.115 1.00 0.31 H new ATOM 0 HB2 ALA A 116 3.043 2.845 -5.502 1.00 0.31 H new ATOM 0 HB3 ALA A 116 3.088 3.240 -7.237 1.00 0.31 H new ATOM 426 N ARG A 117 2.096 5.551 -8.287 1.00 0.27 N ATOM 427 CA ARG A 117 2.194 6.578 -9.366 1.00 0.30 C ATOM 428 C ARG A 117 1.221 7.715 -9.037 1.00 0.32 C ATOM 429 O ARG A 117 1.531 8.881 -9.191 1.00 0.33 O ATOM 430 CB ARG A 117 1.779 5.856 -10.653 1.00 0.35 C ATOM 431 CG ARG A 117 2.861 4.847 -11.045 1.00 0.37 C ATOM 432 CD ARG A 117 4.069 5.584 -11.629 1.00 1.31 C ATOM 433 NE ARG A 117 4.985 4.506 -12.095 1.00 1.53 N ATOM 434 CZ ARG A 117 5.471 4.538 -13.307 1.00 1.93 C ATOM 435 NH1 ARG A 117 4.761 4.093 -14.307 1.00 2.24 N ATOM 436 NH2 ARG A 117 6.668 5.013 -13.517 1.00 2.61 N ATOM 0 H ARG A 117 1.809 4.623 -8.598 1.00 0.27 H new ATOM 0 HA ARG A 117 3.191 7.006 -9.467 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.827 5.346 -10.505 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.632 6.578 -11.456 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.164 4.267 -10.173 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.466 4.141 -11.776 1.00 0.37 H new ATOM 0 HD2 ARG A 117 3.775 6.236 -12.452 1.00 1.31 H new ATOM 0 HD3 ARG A 117 4.548 6.214 -10.879 1.00 1.31 H new ATOM 0 HE ARG A 117 5.233 3.742 -11.467 1.00 1.53 H new ATOM 0 HH11 ARG A 117 3.826 3.720 -14.143 1.00 2.24 H new ATOM 0 HH12 ARG A 117 5.141 4.118 -15.253 1.00 2.24 H new ATOM 0 HH21 ARG A 117 7.224 5.359 -12.735 1.00 2.61 H new ATOM 0 HH22 ARG A 117 7.048 5.038 -14.463 1.00 2.61 H new ATOM 450 N GLU A 118 0.052 7.368 -8.548 1.00 0.34 N ATOM 451 CA GLU A 118 -0.944 8.413 -8.161 1.00 0.39 C ATOM 452 C GLU A 118 -0.387 9.224 -6.986 1.00 0.39 C ATOM 453 O GLU A 118 -0.566 10.424 -6.903 1.00 0.41 O ATOM 454 CB GLU A 118 -2.206 7.651 -7.748 1.00 0.43 C ATOM 455 CG GLU A 118 -2.847 7.017 -8.987 1.00 0.47 C ATOM 456 CD GLU A 118 -4.119 6.254 -8.593 1.00 0.53 C ATOM 457 OE1 GLU A 118 -4.658 6.532 -7.533 1.00 1.45 O ATOM 458 OE2 GLU A 118 -4.540 5.412 -9.369 1.00 0.76 O ATOM 0 H GLU A 118 -0.253 6.406 -8.401 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.158 9.109 -8.972 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -1.956 6.880 -7.019 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -2.911 8.328 -7.266 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -3.089 7.790 -9.716 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -2.140 6.338 -9.464 1.00 0.47 H new ATOM 465 N LEU A 119 0.305 8.567 -6.086 1.00 0.37 N ATOM 466 CA LEU A 119 0.905 9.277 -4.911 1.00 0.38 C ATOM 467 C LEU A 119 2.135 10.092 -5.345 1.00 0.36 C ATOM 468 O LEU A 119 2.724 10.793 -4.547 1.00 0.39 O ATOM 469 CB LEU A 119 1.318 8.169 -3.945 1.00 0.38 C ATOM 470 CG LEU A 119 0.065 7.507 -3.365 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.407 6.100 -2.857 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.460 8.357 -2.204 1.00 0.58 C ATOM 0 H LEU A 119 0.481 7.563 -6.115 1.00 0.37 H new ATOM 0 HA LEU A 119 0.204 9.978 -4.457 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.927 7.428 -4.463 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.930 8.581 -3.142 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.697 7.430 -4.140 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.488 5.634 -2.446 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.783 5.496 -3.683 1.00 1.33 H new ATOM 0 HD13 LEU A 119 1.169 6.169 -2.081 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.353 7.891 -1.786 1.00 0.58 H new ATOM 0 HD22 LEU A 119 0.306 8.431 -1.432 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -0.707 9.355 -2.566 1.00 0.58 H new ATOM 484 N LYS A 120 2.535 9.994 -6.599 1.00 0.34 N ATOM 485 CA LYS A 120 3.731 10.752 -7.093 1.00 0.35 C ATOM 486 C LYS A 120 4.973 10.348 -6.307 1.00 0.30 C ATOM 487 O LYS A 120 5.725 11.181 -5.836 1.00 0.33 O ATOM 488 CB LYS A 120 3.420 12.247 -6.902 1.00 0.48 C ATOM 489 CG LYS A 120 2.201 12.636 -7.743 1.00 1.05 C ATOM 490 CD LYS A 120 2.577 12.620 -9.228 1.00 1.11 C ATOM 491 CE LYS A 120 1.368 13.043 -10.070 1.00 2.02 C ATOM 492 NZ LYS A 120 1.612 14.475 -10.403 1.00 2.16 N ATOM 0 H LYS A 120 2.077 9.415 -7.303 1.00 0.34 H new ATOM 0 HA LYS A 120 3.931 10.534 -8.142 1.00 0.35 H new ATOM 0 HB2 LYS A 120 3.229 12.456 -5.850 1.00 0.48 H new ATOM 0 HB3 LYS A 120 4.282 12.847 -7.195 1.00 0.48 H new ATOM 0 HG2 LYS A 120 1.381 11.942 -7.557 1.00 1.05 H new ATOM 0 HG3 LYS A 120 1.850 13.627 -7.457 1.00 1.05 H new ATOM 0 HD2 LYS A 120 3.413 13.296 -9.409 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.905 11.622 -9.520 1.00 1.11 H new ATOM 0 HE2 LYS A 120 1.284 12.437 -10.972 1.00 2.02 H new ATOM 0 HE3 LYS A 120 0.438 12.920 -9.515 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 0.825 14.836 -10.979 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 1.681 15.029 -9.525 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 2.500 14.561 -10.937 1.00 2.16 H new ATOM 506 N VAL A 121 5.197 9.067 -6.179 1.00 0.29 N ATOM 507 CA VAL A 121 6.401 8.581 -5.441 1.00 0.33 C ATOM 508 C VAL A 121 7.646 8.795 -6.305 1.00 0.37 C ATOM 509 O VAL A 121 7.554 8.934 -7.510 1.00 0.42 O ATOM 510 CB VAL A 121 6.161 7.086 -5.193 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.925 6.910 -4.308 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.945 6.354 -6.528 1.00 1.29 C ATOM 0 H VAL A 121 4.596 8.333 -6.555 1.00 0.29 H new ATOM 0 HA VAL A 121 6.557 9.113 -4.503 1.00 0.33 H new ATOM 0 HB VAL A 121 7.034 6.663 -4.695 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.753 5.848 -4.131 1.00 1.65 H new ATOM 0 HG12 VAL A 121 5.084 7.416 -3.356 1.00 1.65 H new ATOM 0 HG13 VAL A 121 4.056 7.340 -4.806 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.776 5.294 -6.339 1.00 1.29 H new ATOM 0 HG22 VAL A 121 5.078 6.775 -7.037 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.828 6.474 -7.156 1.00 1.29 H new ATOM 522 N SER A 122 8.807 8.836 -5.700 1.00 0.45 N ATOM 523 CA SER A 122 10.062 9.057 -6.490 1.00 0.52 C ATOM 524 C SER A 122 10.190 8.019 -7.606 1.00 0.44 C ATOM 525 O SER A 122 10.199 6.826 -7.366 1.00 0.35 O ATOM 526 CB SER A 122 11.200 8.898 -5.482 1.00 0.63 C ATOM 527 OG SER A 122 11.213 10.020 -4.609 1.00 1.10 O ATOM 0 H SER A 122 8.942 8.726 -4.695 1.00 0.45 H new ATOM 0 HA SER A 122 10.071 10.035 -6.970 1.00 0.52 H new ATOM 0 HB2 SER A 122 11.069 7.979 -4.910 1.00 0.63 H new ATOM 0 HB3 SER A 122 12.154 8.817 -6.003 1.00 0.63 H new ATOM 0 HG SER A 122 11.940 9.921 -3.960 1.00 1.10 H new ATOM 533 N GLU A 123 10.302 8.478 -8.826 1.00 0.55 N ATOM 534 CA GLU A 123 10.447 7.542 -9.982 1.00 0.58 C ATOM 535 C GLU A 123 11.707 6.697 -9.796 1.00 0.52 C ATOM 536 O GLU A 123 11.777 5.563 -10.232 1.00 0.53 O ATOM 537 CB GLU A 123 10.584 8.438 -11.218 1.00 0.77 C ATOM 538 CG GLU A 123 10.738 7.567 -12.472 1.00 1.44 C ATOM 539 CD GLU A 123 10.894 8.450 -13.719 1.00 1.61 C ATOM 540 OE1 GLU A 123 10.689 9.650 -13.615 1.00 2.15 O ATOM 541 OE2 GLU A 123 11.232 7.908 -14.759 1.00 1.75 O ATOM 0 H GLU A 123 10.299 9.468 -9.073 1.00 0.55 H new ATOM 0 HA GLU A 123 9.601 6.861 -10.074 1.00 0.58 H new ATOM 0 HB2 GLU A 123 9.708 9.079 -11.314 1.00 0.77 H new ATOM 0 HB3 GLU A 123 11.448 9.094 -11.110 1.00 0.77 H new ATOM 0 HG2 GLU A 123 11.607 6.917 -12.367 1.00 1.44 H new ATOM 0 HG3 GLU A 123 9.868 6.920 -12.583 1.00 1.44 H new ATOM 548 N ALA A 124 12.706 7.250 -9.153 1.00 0.50 N ATOM 549 CA ALA A 124 13.978 6.490 -8.934 1.00 0.50 C ATOM 550 C ALA A 124 13.688 5.166 -8.220 1.00 0.39 C ATOM 551 O ALA A 124 14.144 4.117 -8.634 1.00 0.45 O ATOM 552 CB ALA A 124 14.842 7.397 -8.055 1.00 0.56 C ATOM 0 H ALA A 124 12.696 8.195 -8.770 1.00 0.50 H new ATOM 0 HA ALA A 124 14.475 6.243 -9.872 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.794 6.907 -7.851 1.00 0.56 H new ATOM 0 HB2 ALA A 124 15.023 8.339 -8.572 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.326 7.592 -7.115 1.00 0.56 H new ATOM 558 N LYS A 125 12.923 5.208 -7.158 1.00 0.31 N ATOM 559 CA LYS A 125 12.589 3.949 -6.422 1.00 0.34 C ATOM 560 C LYS A 125 11.835 2.981 -7.334 1.00 0.34 C ATOM 561 O LYS A 125 12.152 1.808 -7.401 1.00 0.39 O ATOM 562 CB LYS A 125 11.696 4.379 -5.260 1.00 0.42 C ATOM 563 CG LYS A 125 12.562 4.750 -4.055 1.00 0.54 C ATOM 564 CD LYS A 125 13.290 6.067 -4.329 1.00 0.75 C ATOM 565 CE LYS A 125 13.837 6.626 -3.014 1.00 0.75 C ATOM 566 NZ LYS A 125 14.333 7.988 -3.353 1.00 1.56 N ATOM 0 H LYS A 125 12.516 6.058 -6.769 1.00 0.31 H new ATOM 0 HA LYS A 125 13.486 3.435 -6.078 1.00 0.34 H new ATOM 0 HB2 LYS A 125 11.083 5.230 -5.555 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.014 3.572 -4.995 1.00 0.42 H new ATOM 0 HG2 LYS A 125 11.941 4.845 -3.164 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.285 3.958 -3.857 1.00 0.54 H new ATOM 0 HD2 LYS A 125 14.104 5.905 -5.035 1.00 0.75 H new ATOM 0 HD3 LYS A 125 12.609 6.784 -4.787 1.00 0.75 H new ATOM 0 HE2 LYS A 125 13.061 6.667 -2.249 1.00 0.75 H new ATOM 0 HE3 LYS A 125 14.638 6.000 -2.622 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 14.724 8.437 -2.500 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 15.075 7.917 -4.078 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 13.547 8.563 -3.717 1.00 1.56 H new ATOM 580 N MET A 126 10.840 3.462 -8.042 1.00 0.42 N ATOM 581 CA MET A 126 10.067 2.560 -8.951 1.00 0.56 C ATOM 582 C MET A 126 10.999 1.954 -10.001 1.00 0.57 C ATOM 583 O MET A 126 10.904 0.786 -10.328 1.00 0.66 O ATOM 584 CB MET A 126 9.010 3.451 -9.618 1.00 0.70 C ATOM 585 CG MET A 126 7.953 3.869 -8.591 1.00 1.10 C ATOM 586 SD MET A 126 7.015 2.412 -8.065 1.00 1.90 S ATOM 587 CE MET A 126 6.320 1.994 -9.684 1.00 2.03 C ATOM 0 H MET A 126 10.532 4.434 -8.029 1.00 0.42 H new ATOM 0 HA MET A 126 9.607 1.732 -8.411 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.484 4.335 -10.044 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.537 2.915 -10.441 1.00 0.70 H new ATOM 0 HG2 MET A 126 8.431 4.337 -7.731 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.282 4.610 -9.025 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.260 1.763 -9.576 1.00 2.03 H new ATOM 0 HE2 MET A 126 6.440 2.840 -10.361 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.841 1.127 -10.091 1.00 2.03 H new ATOM 597 N ASP A 127 11.905 2.741 -10.522 1.00 0.55 N ATOM 598 CA ASP A 127 12.860 2.213 -11.545 1.00 0.62 C ATOM 599 C ASP A 127 13.691 1.064 -10.965 1.00 0.54 C ATOM 600 O ASP A 127 13.925 0.065 -11.623 1.00 0.59 O ATOM 601 CB ASP A 127 13.760 3.396 -11.912 1.00 0.71 C ATOM 602 CG ASP A 127 12.960 4.438 -12.705 1.00 1.04 C ATOM 603 OD1 ASP A 127 11.947 4.076 -13.283 1.00 1.71 O ATOM 604 OD2 ASP A 127 13.379 5.584 -12.723 1.00 1.60 O ATOM 0 H ASP A 127 12.026 3.726 -10.284 1.00 0.55 H new ATOM 0 HA ASP A 127 12.339 1.815 -12.416 1.00 0.62 H new ATOM 0 HB2 ASP A 127 14.166 3.849 -11.008 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.607 3.049 -12.503 1.00 0.71 H new ATOM 609 N GLY A 128 14.130 1.192 -9.734 1.00 0.46 N ATOM 610 CA GLY A 128 14.941 0.101 -9.115 1.00 0.46 C ATOM 611 C GLY A 128 14.062 -1.045 -8.625 1.00 0.48 C ATOM 612 O GLY A 128 14.391 -2.202 -8.816 1.00 0.51 O ATOM 0 H GLY A 128 13.961 2.001 -9.136 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.659 -0.277 -9.843 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.515 0.503 -8.280 1.00 0.46 H new ATOM 616 N ILE A 129 12.956 -0.751 -7.986 1.00 0.54 N ATOM 617 CA ILE A 129 12.083 -1.853 -7.480 1.00 0.68 C ATOM 618 C ILE A 129 11.613 -2.728 -8.660 1.00 0.68 C ATOM 619 O ILE A 129 11.682 -3.939 -8.609 1.00 0.72 O ATOM 620 CB ILE A 129 10.919 -1.146 -6.728 1.00 0.86 C ATOM 621 CG1 ILE A 129 10.429 -2.059 -5.605 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.740 -0.800 -7.652 1.00 1.77 C ATOM 623 CD1 ILE A 129 11.370 -1.944 -4.403 1.00 2.01 C ATOM 0 H ILE A 129 12.623 0.194 -7.795 1.00 0.54 H new ATOM 0 HA ILE A 129 12.595 -2.536 -6.802 1.00 0.68 H new ATOM 0 HB ILE A 129 11.304 -0.207 -6.331 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.415 -1.783 -5.314 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.391 -3.091 -5.952 1.00 1.04 H new ATOM 0 HG21 ILE A 129 8.957 -0.309 -7.074 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.081 -0.132 -8.443 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.345 -1.714 -8.095 1.00 1.77 H new ATOM 0 HD11 ILE A 129 11.019 -2.596 -3.603 1.00 2.01 H new ATOM 0 HD12 ILE A 129 12.376 -2.242 -4.699 1.00 2.01 H new ATOM 0 HD13 ILE A 129 11.386 -0.913 -4.050 1.00 2.01 H new ATOM 635 N GLU A 130 11.143 -2.113 -9.714 1.00 0.70 N ATOM 636 CA GLU A 130 10.669 -2.894 -10.899 1.00 0.77 C ATOM 637 C GLU A 130 11.805 -3.714 -11.533 1.00 0.65 C ATOM 638 O GLU A 130 11.663 -4.899 -11.770 1.00 0.68 O ATOM 639 CB GLU A 130 10.160 -1.843 -11.889 1.00 0.85 C ATOM 640 CG GLU A 130 9.574 -2.542 -13.120 1.00 1.41 C ATOM 641 CD GLU A 130 9.056 -1.505 -14.128 1.00 1.66 C ATOM 642 OE1 GLU A 130 8.987 -0.335 -13.780 1.00 2.01 O ATOM 643 OE2 GLU A 130 8.732 -1.903 -15.235 1.00 2.14 O ATOM 0 H GLU A 130 11.066 -1.100 -9.807 1.00 0.70 H new ATOM 0 HA GLU A 130 9.900 -3.612 -10.615 1.00 0.77 H new ATOM 0 HB2 GLU A 130 9.401 -1.220 -11.416 1.00 0.85 H new ATOM 0 HB3 GLU A 130 10.975 -1.183 -12.186 1.00 0.85 H new ATOM 0 HG2 GLU A 130 10.335 -3.166 -13.589 1.00 1.41 H new ATOM 0 HG3 GLU A 130 8.761 -3.203 -12.818 1.00 1.41 H new ATOM 650 N GLU A 131 12.917 -3.084 -11.838 1.00 0.59 N ATOM 651 CA GLU A 131 14.046 -3.824 -12.495 1.00 0.55 C ATOM 652 C GLU A 131 14.575 -4.950 -11.601 1.00 0.47 C ATOM 653 O GLU A 131 14.738 -6.075 -12.036 1.00 0.45 O ATOM 654 CB GLU A 131 15.141 -2.775 -12.713 1.00 0.63 C ATOM 655 CG GLU A 131 16.320 -3.409 -13.462 1.00 1.38 C ATOM 656 CD GLU A 131 17.449 -2.385 -13.644 1.00 1.89 C ATOM 657 OE1 GLU A 131 17.197 -1.202 -13.471 1.00 2.50 O ATOM 658 OE2 GLU A 131 18.550 -2.804 -13.962 1.00 2.30 O ATOM 0 H GLU A 131 13.092 -2.095 -11.662 1.00 0.59 H new ATOM 0 HA GLU A 131 13.720 -4.292 -13.424 1.00 0.55 H new ATOM 0 HB2 GLU A 131 14.745 -1.934 -13.283 1.00 0.63 H new ATOM 0 HB3 GLU A 131 15.476 -2.380 -11.754 1.00 0.63 H new ATOM 0 HG2 GLU A 131 16.689 -4.273 -12.909 1.00 1.38 H new ATOM 0 HG3 GLU A 131 15.989 -3.772 -14.435 1.00 1.38 H new ATOM 665 N LYS A 132 14.862 -4.647 -10.366 1.00 0.51 N ATOM 666 CA LYS A 132 15.404 -5.686 -9.436 1.00 0.53 C ATOM 667 C LYS A 132 14.333 -6.716 -9.062 1.00 0.54 C ATOM 668 O LYS A 132 14.641 -7.855 -8.763 1.00 0.63 O ATOM 669 CB LYS A 132 15.881 -4.917 -8.200 1.00 0.68 C ATOM 670 CG LYS A 132 17.244 -4.276 -8.490 1.00 1.39 C ATOM 671 CD LYS A 132 17.053 -2.819 -8.922 1.00 1.91 C ATOM 672 CE LYS A 132 18.418 -2.180 -9.196 1.00 2.62 C ATOM 673 NZ LYS A 132 18.934 -2.869 -10.413 1.00 2.69 N ATOM 0 H LYS A 132 14.745 -3.721 -9.955 1.00 0.51 H new ATOM 0 HA LYS A 132 16.213 -6.251 -9.899 1.00 0.53 H new ATOM 0 HB2 LYS A 132 15.155 -4.149 -7.934 1.00 0.68 H new ATOM 0 HB3 LYS A 132 15.958 -5.591 -7.347 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.874 -4.321 -7.601 1.00 1.39 H new ATOM 0 HG3 LYS A 132 17.758 -4.832 -9.274 1.00 1.39 H new ATOM 0 HD2 LYS A 132 16.433 -2.773 -9.817 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.530 -2.264 -8.143 1.00 1.91 H new ATOM 0 HE2 LYS A 132 18.324 -1.107 -9.361 1.00 2.62 H new ATOM 0 HE3 LYS A 132 19.093 -2.315 -8.351 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 19.622 -2.255 -10.894 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 19.397 -3.759 -10.138 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 18.144 -3.074 -11.057 1.00 2.69 H new ATOM 687 N TYR A 133 13.085 -6.322 -9.046 1.00 0.55 N ATOM 688 CA TYR A 133 12.000 -7.273 -8.656 1.00 0.65 C ATOM 689 C TYR A 133 10.895 -7.302 -9.722 1.00 0.54 C ATOM 690 O TYR A 133 9.916 -6.593 -9.604 1.00 0.66 O ATOM 691 CB TYR A 133 11.454 -6.719 -7.342 1.00 0.89 C ATOM 692 CG TYR A 133 12.573 -6.590 -6.335 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.147 -7.734 -5.769 1.00 0.98 C ATOM 694 CD2 TYR A 133 13.038 -5.321 -5.975 1.00 2.20 C ATOM 695 CE1 TYR A 133 14.186 -7.607 -4.840 1.00 1.14 C ATOM 696 CE2 TYR A 133 14.076 -5.194 -5.047 1.00 2.44 C ATOM 697 CZ TYR A 133 14.651 -6.337 -4.479 1.00 1.67 C ATOM 698 OH TYR A 133 15.676 -6.211 -3.564 1.00 1.95 O ATOM 0 H TYR A 133 12.770 -5.382 -9.286 1.00 0.55 H new ATOM 0 HA TYR A 133 12.366 -8.295 -8.557 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.991 -5.747 -7.511 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.678 -7.378 -6.954 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.789 -8.714 -6.049 1.00 0.98 H new ATOM 0 HD2 TYR A 133 12.595 -4.439 -6.414 1.00 2.20 H new ATOM 0 HE1 TYR A 133 14.629 -8.489 -4.402 1.00 1.14 H new ATOM 0 HE2 TYR A 133 14.434 -4.214 -4.768 1.00 2.44 H new ATOM 0 HH TYR A 133 15.877 -5.262 -3.427 1.00 1.95 H new ATOM 708 N PRO A 134 11.085 -8.110 -10.742 1.00 0.51 N ATOM 709 CA PRO A 134 10.079 -8.195 -11.824 1.00 0.53 C ATOM 710 C PRO A 134 8.877 -9.065 -11.419 1.00 0.47 C ATOM 711 O PRO A 134 7.899 -9.131 -12.142 1.00 0.54 O ATOM 712 CB PRO A 134 10.843 -8.841 -12.975 1.00 0.70 C ATOM 713 CG PRO A 134 11.949 -9.621 -12.334 1.00 0.76 C ATOM 714 CD PRO A 134 12.230 -9.004 -10.987 1.00 0.66 C ATOM 0 HA PRO A 134 9.661 -7.220 -12.075 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.193 -9.491 -13.561 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.238 -8.087 -13.656 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.663 -10.667 -12.223 1.00 0.76 H new ATOM 0 HG3 PRO A 134 12.843 -9.599 -12.958 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.312 -9.765 -10.211 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.170 -8.452 -10.992 1.00 0.66 H new ATOM 722 N ARG A 135 8.933 -9.748 -10.292 1.00 0.43 N ATOM 723 CA ARG A 135 7.772 -10.616 -9.902 1.00 0.48 C ATOM 724 C ARG A 135 7.561 -10.693 -8.375 1.00 0.43 C ATOM 725 O ARG A 135 6.711 -11.431 -7.913 1.00 0.60 O ATOM 726 CB ARG A 135 8.130 -11.999 -10.449 1.00 0.70 C ATOM 727 CG ARG A 135 6.849 -12.800 -10.697 1.00 0.91 C ATOM 728 CD ARG A 135 6.521 -13.650 -9.462 1.00 1.17 C ATOM 729 NE ARG A 135 6.629 -15.064 -9.917 1.00 1.44 N ATOM 730 CZ ARG A 135 5.566 -15.700 -10.323 1.00 2.17 C ATOM 731 NH1 ARG A 135 4.553 -15.862 -9.515 1.00 2.61 N ATOM 732 NH2 ARG A 135 5.515 -16.175 -11.537 1.00 3.07 N ATOM 0 H ARG A 135 9.717 -9.742 -9.639 1.00 0.43 H new ATOM 0 HA ARG A 135 6.840 -10.214 -10.300 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.694 -11.900 -11.376 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.770 -12.527 -9.742 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.022 -12.124 -10.914 1.00 0.91 H new ATOM 0 HG3 ARG A 135 6.973 -13.442 -11.569 1.00 0.91 H new ATOM 0 HD2 ARG A 135 7.216 -13.445 -8.648 1.00 1.17 H new ATOM 0 HD3 ARG A 135 5.520 -13.432 -9.089 1.00 1.17 H new ATOM 0 HE ARG A 135 7.534 -15.534 -9.911 1.00 1.44 H new ATOM 0 HH11 ARG A 135 4.593 -15.491 -8.566 1.00 2.61 H new ATOM 0 HH12 ARG A 135 3.721 -16.360 -9.833 1.00 2.61 H new ATOM 0 HH21 ARG A 135 6.307 -16.049 -12.168 1.00 3.07 H new ATOM 0 HH22 ARG A 135 4.684 -16.673 -11.855 1.00 3.07 H new ATOM 746 N SER A 136 8.303 -9.954 -7.584 1.00 0.51 N ATOM 747 CA SER A 136 8.105 -10.031 -6.100 1.00 0.44 C ATOM 748 C SER A 136 7.071 -9.014 -5.641 1.00 0.33 C ATOM 749 O SER A 136 7.306 -7.821 -5.643 1.00 0.30 O ATOM 750 CB SER A 136 9.471 -9.728 -5.492 1.00 0.50 C ATOM 751 OG SER A 136 10.254 -10.914 -5.485 1.00 0.90 O ATOM 0 H SER A 136 9.028 -9.308 -7.896 1.00 0.51 H new ATOM 0 HA SER A 136 7.735 -11.009 -5.792 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.973 -8.950 -6.067 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.354 -9.349 -4.477 1.00 0.50 H new ATOM 0 HG SER A 136 11.133 -10.723 -5.097 1.00 0.90 H new ATOM 757 N LEU A 137 5.924 -9.495 -5.232 1.00 0.31 N ATOM 758 CA LEU A 137 4.850 -8.581 -4.747 1.00 0.24 C ATOM 759 C LEU A 137 5.372 -7.815 -3.534 1.00 0.20 C ATOM 760 O LEU A 137 5.191 -6.623 -3.407 1.00 0.21 O ATOM 761 CB LEU A 137 3.691 -9.508 -4.339 1.00 0.23 C ATOM 762 CG LEU A 137 2.493 -8.682 -3.864 1.00 0.21 C ATOM 763 CD1 LEU A 137 1.971 -7.823 -5.024 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.385 -9.632 -3.389 1.00 0.27 C ATOM 0 H LEU A 137 5.686 -10.487 -5.214 1.00 0.31 H new ATOM 0 HA LEU A 137 4.535 -7.854 -5.496 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.400 -10.131 -5.185 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.016 -10.180 -3.545 1.00 0.23 H new ATOM 0 HG LEU A 137 2.796 -8.032 -3.043 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.118 -7.235 -4.686 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.761 -7.154 -5.365 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.663 -8.470 -5.846 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.528 -9.050 -3.049 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.081 -10.278 -4.213 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.758 -10.243 -2.567 1.00 0.27 H new ATOM 776 N SER A 138 6.031 -8.514 -2.651 1.00 0.24 N ATOM 777 CA SER A 138 6.595 -7.868 -1.424 1.00 0.26 C ATOM 778 C SER A 138 7.660 -6.816 -1.772 1.00 0.20 C ATOM 779 O SER A 138 7.652 -5.718 -1.251 1.00 0.22 O ATOM 780 CB SER A 138 7.223 -9.014 -0.632 1.00 0.38 C ATOM 781 OG SER A 138 7.954 -8.483 0.466 1.00 1.01 O ATOM 0 H SER A 138 6.206 -9.516 -2.725 1.00 0.24 H new ATOM 0 HA SER A 138 5.823 -7.340 -0.864 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.448 -9.691 -0.274 1.00 0.38 H new ATOM 0 HB3 SER A 138 7.883 -9.597 -1.275 1.00 0.38 H new ATOM 0 HG SER A 138 8.356 -9.216 0.976 1.00 1.01 H new ATOM 787 N GLU A 139 8.593 -7.163 -2.622 1.00 0.24 N ATOM 788 CA GLU A 139 9.692 -6.206 -2.982 1.00 0.25 C ATOM 789 C GLU A 139 9.165 -4.996 -3.753 1.00 0.21 C ATOM 790 O GLU A 139 9.627 -3.886 -3.566 1.00 0.21 O ATOM 791 CB GLU A 139 10.647 -6.993 -3.878 1.00 0.39 C ATOM 792 CG GLU A 139 11.200 -8.205 -3.127 1.00 1.09 C ATOM 793 CD GLU A 139 12.334 -7.766 -2.196 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.241 -6.680 -1.648 1.00 2.24 O ATOM 795 OE2 GLU A 139 13.276 -8.526 -2.046 1.00 2.92 O ATOM 0 H GLU A 139 8.644 -8.070 -3.085 1.00 0.24 H new ATOM 0 HA GLU A 139 10.171 -5.824 -2.080 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.126 -7.321 -4.778 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.467 -6.351 -4.200 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.407 -8.680 -2.550 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.566 -8.948 -3.836 1.00 1.09 H new ATOM 802 N ARG A 140 8.237 -5.207 -4.646 1.00 0.26 N ATOM 803 CA ARG A 140 7.716 -4.072 -5.470 1.00 0.33 C ATOM 804 C ARG A 140 6.961 -3.051 -4.615 1.00 0.29 C ATOM 805 O ARG A 140 7.273 -1.876 -4.613 1.00 0.35 O ATOM 806 CB ARG A 140 6.745 -4.725 -6.462 1.00 0.42 C ATOM 807 CG ARG A 140 7.516 -5.403 -7.597 1.00 1.07 C ATOM 808 CD ARG A 140 6.512 -6.041 -8.564 1.00 1.17 C ATOM 809 NE ARG A 140 7.334 -6.675 -9.631 1.00 0.98 N ATOM 810 CZ ARG A 140 6.769 -7.056 -10.745 1.00 1.13 C ATOM 811 NH1 ARG A 140 5.843 -7.975 -10.726 1.00 1.60 N ATOM 812 NH2 ARG A 140 7.132 -6.519 -11.879 1.00 1.55 N ATOM 0 H ARG A 140 7.815 -6.115 -4.843 1.00 0.26 H new ATOM 0 HA ARG A 140 8.529 -3.531 -5.954 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.126 -5.459 -5.945 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.072 -3.972 -6.871 1.00 0.42 H new ATOM 0 HG2 ARG A 140 8.134 -4.674 -8.121 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.188 -6.162 -7.196 1.00 1.07 H new ATOM 0 HD2 ARG A 140 5.892 -6.779 -8.055 1.00 1.17 H new ATOM 0 HD3 ARG A 140 5.838 -5.292 -8.981 1.00 1.17 H new ATOM 0 HE ARG A 140 8.335 -6.811 -9.492 1.00 0.98 H new ATOM 0 HH11 ARG A 140 5.560 -8.396 -9.841 1.00 1.60 H new ATOM 0 HH12 ARG A 140 5.402 -8.272 -11.596 1.00 1.60 H new ATOM 0 HH21 ARG A 140 7.857 -5.802 -11.895 1.00 1.55 H new ATOM 0 HH22 ARG A 140 6.690 -6.817 -12.749 1.00 1.55 H new ATOM 826 N VAL A 141 5.956 -3.491 -3.922 1.00 0.24 N ATOM 827 CA VAL A 141 5.133 -2.558 -3.085 1.00 0.27 C ATOM 828 C VAL A 141 5.887 -1.966 -1.884 1.00 0.25 C ATOM 829 O VAL A 141 5.660 -0.834 -1.521 1.00 0.29 O ATOM 830 CB VAL A 141 3.947 -3.385 -2.606 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.154 -3.880 -3.815 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.434 -4.585 -1.795 1.00 0.23 C ATOM 0 H VAL A 141 5.659 -4.466 -3.893 1.00 0.24 H new ATOM 0 HA VAL A 141 4.844 -1.693 -3.682 1.00 0.27 H new ATOM 0 HB VAL A 141 3.312 -2.763 -1.975 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.304 -4.472 -3.475 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.795 -3.026 -4.389 1.00 0.33 H new ATOM 0 HG13 VAL A 141 3.797 -4.495 -4.445 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.577 -5.168 -1.458 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.075 -5.209 -2.418 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.997 -4.235 -0.930 1.00 0.23 H new ATOM 842 N ARG A 142 6.731 -2.726 -1.231 1.00 0.21 N ATOM 843 CA ARG A 142 7.435 -2.202 -0.008 1.00 0.22 C ATOM 844 C ARG A 142 8.061 -0.817 -0.225 1.00 0.24 C ATOM 845 O ARG A 142 7.787 0.104 0.523 1.00 0.25 O ATOM 846 CB ARG A 142 8.525 -3.226 0.309 1.00 0.27 C ATOM 847 CG ARG A 142 7.971 -4.305 1.242 1.00 0.28 C ATOM 848 CD ARG A 142 9.092 -5.284 1.601 1.00 1.02 C ATOM 849 NE ARG A 142 8.501 -6.192 2.622 1.00 0.94 N ATOM 850 CZ ARG A 142 8.456 -5.822 3.873 1.00 1.48 C ATOM 851 NH1 ARG A 142 9.555 -5.751 4.574 1.00 2.10 N ATOM 852 NH2 ARG A 142 7.312 -5.521 4.423 1.00 2.24 N ATOM 0 H ARG A 142 6.966 -3.685 -1.487 1.00 0.21 H new ATOM 0 HA ARG A 142 6.722 -2.076 0.807 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.888 -3.681 -0.613 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.376 -2.731 0.776 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.567 -3.849 2.146 1.00 0.28 H new ATOM 0 HG3 ARG A 142 7.150 -4.835 0.758 1.00 0.28 H new ATOM 0 HD2 ARG A 142 9.426 -5.840 0.725 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.962 -4.760 1.996 1.00 1.02 H new ATOM 0 HE ARG A 142 8.132 -7.102 2.345 1.00 0.94 H new ATOM 0 HH11 ARG A 142 10.450 -5.985 4.144 1.00 2.10 H new ATOM 0 HH12 ARG A 142 9.519 -5.462 5.551 1.00 2.10 H new ATOM 0 HH21 ARG A 142 6.453 -5.575 3.876 1.00 2.24 H new ATOM 0 HH22 ARG A 142 7.276 -5.232 5.401 1.00 2.24 H new ATOM 866 N GLU A 143 8.896 -0.653 -1.220 1.00 0.26 N ATOM 867 CA GLU A 143 9.523 0.689 -1.444 1.00 0.31 C ATOM 868 C GLU A 143 8.440 1.727 -1.753 1.00 0.30 C ATOM 869 O GLU A 143 8.428 2.813 -1.203 1.00 0.31 O ATOM 870 CB GLU A 143 10.466 0.507 -2.632 1.00 0.36 C ATOM 871 CG GLU A 143 11.282 1.785 -2.829 1.00 0.44 C ATOM 872 CD GLU A 143 12.456 1.501 -3.767 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.227 1.415 -4.960 1.00 1.84 O ATOM 874 OE2 GLU A 143 13.564 1.371 -3.273 1.00 1.62 O ATOM 0 H GLU A 143 9.170 -1.380 -1.881 1.00 0.26 H new ATOM 0 HA GLU A 143 10.061 1.046 -0.566 1.00 0.31 H new ATOM 0 HB2 GLU A 143 11.130 -0.339 -2.457 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.895 0.284 -3.533 1.00 0.36 H new ATOM 0 HG2 GLU A 143 10.652 2.571 -3.245 1.00 0.44 H new ATOM 0 HG3 GLU A 143 11.649 2.146 -1.868 1.00 0.44 H new ATOM 881 N SER A 144 7.521 1.383 -2.614 1.00 0.29 N ATOM 882 CA SER A 144 6.410 2.324 -2.960 1.00 0.29 C ATOM 883 C SER A 144 5.578 2.629 -1.707 1.00 0.28 C ATOM 884 O SER A 144 5.149 3.745 -1.485 1.00 0.28 O ATOM 885 CB SER A 144 5.577 1.589 -4.012 1.00 0.29 C ATOM 886 OG SER A 144 6.318 1.506 -5.222 1.00 1.34 O ATOM 0 H SER A 144 7.490 0.485 -3.097 1.00 0.29 H new ATOM 0 HA SER A 144 6.771 3.280 -3.338 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.323 0.590 -3.658 1.00 0.29 H new ATOM 0 HB3 SER A 144 4.638 2.116 -4.182 1.00 0.29 H new ATOM 0 HG SER A 144 5.952 2.140 -5.874 1.00 1.34 H new ATOM 892 N LEU A 145 5.348 1.635 -0.892 1.00 0.27 N ATOM 893 CA LEU A 145 4.551 1.837 0.359 1.00 0.28 C ATOM 894 C LEU A 145 5.333 2.674 1.376 1.00 0.30 C ATOM 895 O LEU A 145 4.768 3.489 2.081 1.00 0.30 O ATOM 896 CB LEU A 145 4.311 0.433 0.915 1.00 0.29 C ATOM 897 CG LEU A 145 3.313 -0.314 0.028 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.284 -1.790 0.427 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.921 0.291 0.222 1.00 0.67 C ATOM 0 H LEU A 145 5.680 0.682 -1.038 1.00 0.27 H new ATOM 0 HA LEU A 145 3.621 2.369 0.158 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.252 -0.115 0.961 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.929 0.496 1.934 1.00 0.29 H new ATOM 0 HG LEU A 145 3.611 -0.226 -1.017 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.573 -2.324 -0.204 1.00 0.73 H new ATOM 0 HD12 LEU A 145 4.277 -2.221 0.300 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.981 -1.879 1.470 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.204 -0.236 -0.407 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.625 0.196 1.267 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.940 1.345 -0.055 1.00 0.67 H new ATOM 911 N LYS A 146 6.623 2.464 1.472 1.00 0.33 N ATOM 912 CA LYS A 146 7.439 3.232 2.466 1.00 0.35 C ATOM 913 C LYS A 146 7.344 4.734 2.182 1.00 0.34 C ATOM 914 O LYS A 146 7.149 5.528 3.083 1.00 0.35 O ATOM 915 CB LYS A 146 8.874 2.728 2.282 1.00 0.41 C ATOM 916 CG LYS A 146 9.778 3.337 3.356 1.00 1.01 C ATOM 917 CD LYS A 146 11.209 2.828 3.164 1.00 1.15 C ATOM 918 CE LYS A 146 12.120 3.433 4.235 1.00 1.96 C ATOM 919 NZ LYS A 146 11.913 2.584 5.442 1.00 2.32 N ATOM 0 H LYS A 146 7.146 1.795 0.907 1.00 0.33 H new ATOM 0 HA LYS A 146 7.091 3.085 3.488 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.898 1.640 2.347 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.239 2.996 1.291 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.755 4.425 3.292 1.00 1.01 H new ATOM 0 HG3 LYS A 146 9.415 3.068 4.348 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.230 1.740 3.227 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.571 3.096 2.171 1.00 1.15 H new ATOM 0 HE2 LYS A 146 13.163 3.421 3.918 1.00 1.96 H new ATOM 0 HE3 LYS A 146 11.859 4.472 4.434 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 11.836 3.190 6.284 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 11.039 2.031 5.332 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 12.720 1.937 5.554 1.00 2.32 H new ATOM 933 N VAL A 147 7.475 5.133 0.944 1.00 0.32 N ATOM 934 CA VAL A 147 7.372 6.590 0.621 1.00 0.33 C ATOM 935 C VAL A 147 5.933 7.091 0.819 1.00 0.31 C ATOM 936 O VAL A 147 5.714 8.166 1.346 1.00 0.31 O ATOM 937 CB VAL A 147 7.828 6.740 -0.836 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.272 6.252 -0.964 1.00 0.40 C ATOM 939 CG2 VAL A 147 6.940 5.920 -1.778 1.00 0.36 C ATOM 0 H VAL A 147 7.648 4.520 0.147 1.00 0.32 H new ATOM 0 HA VAL A 147 7.996 7.191 1.282 1.00 0.33 H new ATOM 0 HB VAL A 147 7.754 7.791 -1.114 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.601 6.356 -1.998 1.00 0.40 H new ATOM 0 HG12 VAL A 147 9.916 6.847 -0.316 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.329 5.204 -0.669 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.286 6.045 -2.804 1.00 0.36 H new ATOM 0 HG22 VAL A 147 6.993 4.867 -1.503 1.00 0.36 H new ATOM 0 HG23 VAL A 147 5.909 6.265 -1.698 1.00 0.36 H new ATOM 949 N TRP A 148 4.954 6.323 0.406 1.00 0.32 N ATOM 950 CA TRP A 148 3.529 6.759 0.578 1.00 0.33 C ATOM 951 C TRP A 148 3.188 6.874 2.076 1.00 0.32 C ATOM 952 O TRP A 148 2.718 7.900 2.531 1.00 0.32 O ATOM 953 CB TRP A 148 2.679 5.668 -0.131 1.00 0.36 C ATOM 954 CG TRP A 148 1.268 5.652 0.400 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.469 6.738 0.537 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.497 4.514 0.883 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.734 6.339 1.101 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.766 4.974 1.329 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.773 3.139 0.982 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.717 4.095 1.861 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.184 2.259 1.508 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.422 2.738 1.949 1.00 0.27 C ATOM 0 H TRP A 148 5.078 5.415 -0.042 1.00 0.32 H new ATOM 0 HA TRP A 148 3.335 7.742 0.148 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.665 5.854 -1.205 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.138 4.691 0.017 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.726 7.748 0.254 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.501 6.974 1.321 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.728 2.758 0.651 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.672 4.467 2.200 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.037 1.204 1.573 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.150 2.053 2.358 1.00 0.27 H new ATOM 973 N LYS A 149 3.399 5.824 2.832 1.00 0.36 N ATOM 974 CA LYS A 149 3.062 5.873 4.288 1.00 0.38 C ATOM 975 C LYS A 149 3.861 6.982 4.996 1.00 0.34 C ATOM 976 O LYS A 149 3.383 7.584 5.940 1.00 0.33 O ATOM 977 CB LYS A 149 3.385 4.474 4.841 1.00 0.52 C ATOM 978 CG LYS A 149 4.891 4.210 4.807 1.00 1.36 C ATOM 979 CD LYS A 149 5.505 4.564 6.164 1.00 2.07 C ATOM 980 CE LYS A 149 6.921 3.990 6.251 1.00 2.80 C ATOM 981 NZ LYS A 149 7.789 5.005 5.593 1.00 3.70 N ATOM 0 H LYS A 149 3.788 4.940 2.505 1.00 0.36 H new ATOM 0 HA LYS A 149 2.013 6.117 4.458 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.020 4.390 5.864 1.00 0.52 H new ATOM 0 HB3 LYS A 149 2.865 3.717 4.254 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.082 3.163 4.572 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.357 4.803 4.020 1.00 1.36 H new ATOM 0 HD2 LYS A 149 5.532 5.646 6.291 1.00 2.07 H new ATOM 0 HD3 LYS A 149 4.889 4.163 6.969 1.00 2.07 H new ATOM 0 HE2 LYS A 149 7.218 3.828 7.287 1.00 2.80 H new ATOM 0 HE3 LYS A 149 6.988 3.026 5.746 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 8.743 4.613 5.461 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 7.387 5.258 4.668 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 7.844 5.855 6.190 1.00 3.70 H new ATOM 995 N ASN A 150 5.061 7.267 4.543 1.00 0.37 N ATOM 996 CA ASN A 150 5.871 8.351 5.191 1.00 0.41 C ATOM 997 C ASN A 150 5.193 9.713 4.974 1.00 0.39 C ATOM 998 O ASN A 150 5.158 10.542 5.864 1.00 0.46 O ATOM 999 CB ASN A 150 7.251 8.272 4.507 1.00 0.50 C ATOM 1000 CG ASN A 150 8.079 9.545 4.752 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.834 9.964 3.896 1.00 1.86 O ATOM 1002 ND2 ASN A 150 7.965 10.181 5.883 1.00 1.27 N ATOM 0 H ASN A 150 5.512 6.799 3.757 1.00 0.37 H new ATOM 0 HA ASN A 150 5.963 8.232 6.271 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.795 7.406 4.883 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.118 8.124 3.435 1.00 0.50 H new ATOM 0 HD21 ASN A 150 8.508 11.028 6.049 1.00 1.27 H new ATOM 0 HD22 ASN A 150 7.332 9.832 6.603 1.00 1.27 H new ATOM 1009 N ALA A 151 4.663 9.948 3.801 1.00 0.38 N ATOM 1010 CA ALA A 151 3.996 11.258 3.530 1.00 0.49 C ATOM 1011 C ALA A 151 2.706 11.389 4.348 1.00 0.53 C ATOM 1012 O ALA A 151 2.476 12.395 4.993 1.00 0.72 O ATOM 1013 CB ALA A 151 3.680 11.250 2.033 1.00 0.57 C ATOM 0 H ALA A 151 4.663 9.291 3.020 1.00 0.38 H new ATOM 0 HA ALA A 151 4.631 12.099 3.808 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.188 12.183 1.760 1.00 0.57 H new ATOM 0 HB2 ALA A 151 4.606 11.149 1.466 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.021 10.412 1.805 1.00 0.57 H new ATOM 1019 N GLU A 152 1.864 10.384 4.325 1.00 0.40 N ATOM 1020 CA GLU A 152 0.587 10.457 5.101 1.00 0.50 C ATOM 1021 C GLU A 152 0.839 10.285 6.601 1.00 0.60 C ATOM 1022 O GLU A 152 1.427 9.313 7.036 1.00 1.48 O ATOM 1023 CB GLU A 152 -0.277 9.313 4.570 1.00 0.44 C ATOM 1024 CG GLU A 152 -1.256 9.850 3.523 1.00 0.77 C ATOM 1025 CD GLU A 152 -0.589 9.852 2.147 1.00 1.10 C ATOM 1026 OE1 GLU A 152 0.527 10.336 2.052 1.00 1.66 O ATOM 1027 OE2 GLU A 152 -1.204 9.366 1.213 1.00 1.81 O ATOM 0 H GLU A 152 2.006 9.519 3.804 1.00 0.40 H new ATOM 0 HA GLU A 152 0.104 11.427 4.980 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.355 8.541 4.130 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.825 8.847 5.389 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -2.155 9.233 3.501 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -1.569 10.860 3.788 1.00 0.77 H new ATOM 1034 N LYS A 153 0.373 11.217 7.389 1.00 0.76 N ATOM 1035 CA LYS A 153 0.547 11.120 8.868 1.00 0.67 C ATOM 1036 C LYS A 153 -0.654 10.375 9.467 1.00 0.64 C ATOM 1037 O LYS A 153 -0.577 9.197 9.757 1.00 0.57 O ATOM 1038 CB LYS A 153 0.614 12.573 9.343 1.00 0.86 C ATOM 1039 CG LYS A 153 1.896 13.210 8.799 1.00 1.17 C ATOM 1040 CD LYS A 153 1.993 14.667 9.257 1.00 1.57 C ATOM 1041 CE LYS A 153 3.280 15.285 8.703 1.00 2.22 C ATOM 1042 NZ LYS A 153 3.220 16.721 9.093 1.00 2.51 N ATOM 0 H LYS A 153 -0.125 12.048 7.069 1.00 0.76 H new ATOM 0 HA LYS A 153 1.437 10.569 9.170 1.00 0.67 H new ATOM 0 HB2 LYS A 153 -0.259 13.125 8.995 1.00 0.86 H new ATOM 0 HB3 LYS A 153 0.604 12.615 10.432 1.00 0.86 H new ATOM 0 HG2 LYS A 153 2.765 12.652 9.148 1.00 1.17 H new ATOM 0 HG3 LYS A 153 1.902 13.162 7.710 1.00 1.17 H new ATOM 0 HD2 LYS A 153 1.126 15.229 8.908 1.00 1.57 H new ATOM 0 HD3 LYS A 153 1.990 14.719 10.346 1.00 1.57 H new ATOM 0 HE2 LYS A 153 4.162 14.800 9.121 1.00 2.22 H new ATOM 0 HE3 LYS A 153 3.337 15.173 7.620 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 4.070 17.210 8.747 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 2.374 17.159 8.675 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 3.174 16.798 10.129 1.00 2.51 H new ATOM 1056 N LYS A 154 -1.769 11.046 9.628 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.987 10.370 10.179 1.00 0.77 C ATOM 1058 C LYS A 154 -3.488 9.332 9.169 1.00 0.62 C ATOM 1059 O LYS A 154 -4.007 8.286 9.528 1.00 0.60 O ATOM 1060 CB LYS A 154 -4.020 11.484 10.367 1.00 0.95 C ATOM 1061 CG LYS A 154 -3.575 12.409 11.503 1.00 1.29 C ATOM 1062 CD LYS A 154 -3.778 11.707 12.848 1.00 1.34 C ATOM 1063 CE LYS A 154 -3.220 12.584 13.971 1.00 2.02 C ATOM 1064 NZ LYS A 154 -3.062 11.665 15.132 1.00 2.51 N ATOM 0 H LYS A 154 -1.889 12.033 9.402 1.00 0.73 H new ATOM 0 HA LYS A 154 -2.791 9.850 11.117 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -4.130 12.052 9.443 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -4.996 11.055 10.595 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -2.526 12.678 11.377 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -4.147 13.336 11.476 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -4.838 11.516 13.014 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -3.276 10.739 12.845 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -2.267 13.030 13.687 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -3.898 13.404 14.206 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -2.683 12.193 15.944 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -3.987 11.261 15.383 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -2.406 10.898 14.881 1.00 2.51 H new ATOM 1078 N ASN A 155 -3.313 9.612 7.901 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.765 8.656 6.848 1.00 0.47 C ATOM 1080 C ASN A 155 -2.819 7.454 6.759 1.00 0.37 C ATOM 1081 O ASN A 155 -3.056 6.542 5.988 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.745 9.444 5.538 1.00 0.51 C ATOM 1083 CG ASN A 155 -5.007 10.303 5.430 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -6.010 10.013 6.050 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.000 11.351 4.655 1.00 1.03 N ATOM 0 H ASN A 155 -2.875 10.464 7.551 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.756 8.261 7.070 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -2.859 10.077 5.497 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.687 8.759 4.692 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -5.837 11.928 4.569 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -4.157 11.595 4.134 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.772 7.416 7.559 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.861 6.235 7.517 1.00 0.33 C ATOM 1094 C ALA A 156 -1.626 5.002 8.005 1.00 0.28 C ATOM 1095 O ALA A 156 -1.207 3.881 7.787 1.00 0.28 O ATOM 1096 CB ALA A 156 0.275 6.542 8.494 1.00 0.41 C ATOM 0 H ALA A 156 -1.517 8.143 8.227 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.486 6.044 6.511 1.00 0.33 H new ATOM 0 HB1 ALA A 156 0.978 5.709 8.507 1.00 0.41 H new ATOM 0 HB2 ALA A 156 0.792 7.448 8.178 1.00 0.41 H new ATOM 0 HB3 ALA A 156 -0.134 6.687 9.494 1.00 0.41 H new ATOM 1102 N SER A 157 -2.753 5.201 8.660 1.00 0.28 N ATOM 1103 CA SER A 157 -3.537 4.041 9.150 1.00 0.28 C ATOM 1104 C SER A 157 -4.512 3.578 8.070 1.00 0.22 C ATOM 1105 O SER A 157 -4.618 4.168 6.997 1.00 0.21 O ATOM 1106 CB SER A 157 -4.295 4.551 10.372 1.00 0.34 C ATOM 1107 OG SER A 157 -4.854 5.825 10.081 1.00 1.05 O ATOM 0 H SER A 157 -3.152 6.116 8.870 1.00 0.28 H new ATOM 0 HA SER A 157 -2.902 3.190 9.398 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.083 3.849 10.644 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.623 4.623 11.227 1.00 0.34 H new ATOM 0 HG SER A 157 -4.209 6.526 10.312 1.00 1.05 H new ATOM 1113 N VAL A 158 -5.205 2.510 8.337 1.00 0.23 N ATOM 1114 CA VAL A 158 -6.157 1.973 7.332 1.00 0.22 C ATOM 1115 C VAL A 158 -7.231 3.000 6.971 1.00 0.18 C ATOM 1116 O VAL A 158 -7.469 3.229 5.810 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.793 0.727 7.954 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.731 -0.361 8.109 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.408 1.035 9.329 1.00 0.27 C ATOM 0 H VAL A 158 -5.153 1.985 9.210 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.636 1.733 6.405 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.590 0.388 7.292 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -6.182 -1.249 8.552 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -5.321 -0.612 7.131 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.931 0.001 8.755 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.850 0.128 9.741 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.631 1.398 10.002 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -8.179 1.798 9.220 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.870 3.627 7.942 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.945 4.645 7.638 1.00 0.13 C ATOM 1131 C ALA A 159 -8.535 5.562 6.488 1.00 0.13 C ATOM 1132 O ALA A 159 -9.343 5.916 5.644 1.00 0.15 O ATOM 1133 CB ALA A 159 -9.109 5.449 8.927 1.00 0.12 C ATOM 0 H ALA A 159 -7.693 3.478 8.935 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.872 4.163 7.328 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.875 6.211 8.785 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.406 4.782 9.737 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -8.163 5.928 9.180 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.280 5.905 6.426 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.811 6.760 5.307 1.00 0.15 C ATOM 1141 C GLY A 160 -6.875 5.952 4.018 1.00 0.16 C ATOM 1142 O GLY A 160 -7.629 6.267 3.109 1.00 0.18 O ATOM 0 H GLY A 160 -6.564 5.631 7.099 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.433 7.652 5.226 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.791 7.098 5.491 1.00 0.15 H new ATOM 1146 N LEU A 161 -6.082 4.913 3.925 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.091 4.095 2.681 1.00 0.18 C ATOM 1148 C LEU A 161 -7.472 3.467 2.417 1.00 0.20 C ATOM 1149 O LEU A 161 -8.011 3.621 1.343 1.00 0.28 O ATOM 1150 CB LEU A 161 -5.053 2.992 2.904 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.959 2.118 1.644 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.198 2.867 0.540 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.249 0.796 1.980 1.00 0.27 C ATOM 0 H LEU A 161 -5.436 4.601 4.650 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.863 4.715 1.814 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -4.081 3.432 3.128 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.333 2.382 3.763 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.964 1.897 1.285 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -4.136 2.240 -0.349 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.724 3.790 0.297 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.192 3.104 0.888 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.185 0.179 1.083 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.245 1.006 2.349 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.813 0.264 2.746 1.00 0.27 H new ATOM 1165 N VAL A 162 -8.040 2.742 3.369 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.361 2.062 3.116 1.00 0.26 C ATOM 1167 C VAL A 162 -10.379 3.020 2.522 1.00 0.29 C ATOM 1168 O VAL A 162 -11.110 2.663 1.614 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.848 1.521 4.464 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.803 0.569 5.042 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -10.113 2.658 5.456 1.00 0.31 C ATOM 0 H VAL A 162 -7.648 2.595 4.299 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.238 1.257 2.391 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.784 0.988 4.299 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -9.151 0.185 6.001 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.647 -0.262 4.354 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.864 1.103 5.185 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.457 2.242 6.403 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.193 3.220 5.620 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.877 3.322 5.052 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.409 4.239 2.984 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.361 5.218 2.386 1.00 0.34 C ATOM 1183 C LYS A 163 -11.034 5.361 0.897 1.00 0.36 C ATOM 1184 O LYS A 163 -11.883 5.218 0.045 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.114 6.532 3.127 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.050 7.611 2.582 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.871 8.896 3.391 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.657 10.028 2.727 1.00 1.51 C ATOM 1189 NZ LYS A 163 -11.692 10.659 1.784 1.00 2.30 N ATOM 0 H LYS A 163 -9.824 4.597 3.739 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.404 4.913 2.475 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.282 6.396 4.195 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.076 6.841 3.004 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.834 7.798 1.530 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.085 7.273 2.640 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -12.220 8.747 4.413 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -10.815 9.158 3.450 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -13.532 9.646 2.201 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -13.016 10.746 3.464 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -12.156 11.447 1.288 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -10.873 11.018 2.314 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.373 9.953 1.090 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.790 5.609 0.594 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.368 5.741 -0.835 1.00 0.39 C ATOM 1205 C ALA A 164 -9.557 4.426 -1.614 1.00 0.39 C ATOM 1206 O ALA A 164 -9.903 4.441 -2.781 1.00 0.33 O ATOM 1207 CB ALA A 164 -7.886 6.118 -0.784 1.00 0.44 C ATOM 0 H ALA A 164 -9.041 5.727 1.276 1.00 0.36 H new ATOM 0 HA ALA A 164 -9.972 6.486 -1.352 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.505 6.233 -1.799 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -7.768 7.057 -0.244 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.328 5.333 -0.273 1.00 0.44 H new ATOM 1213 N LEU A 165 -9.281 3.295 -1.000 1.00 0.50 N ATOM 1214 CA LEU A 165 -9.391 1.989 -1.744 1.00 0.55 C ATOM 1215 C LEU A 165 -10.777 1.741 -2.304 1.00 0.45 C ATOM 1216 O LEU A 165 -10.970 1.645 -3.500 1.00 0.42 O ATOM 1217 CB LEU A 165 -9.113 0.871 -0.735 1.00 0.80 C ATOM 1218 CG LEU A 165 -7.732 1.028 -0.167 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -7.541 0.066 1.020 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -6.684 0.751 -1.250 1.00 1.24 C ATOM 0 H LEU A 165 -8.987 3.217 -0.026 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.689 2.018 -2.577 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -9.851 0.901 0.067 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -9.208 -0.101 -1.220 1.00 0.80 H new ATOM 0 HG LEU A 165 -7.606 2.051 0.186 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.537 0.185 1.427 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -8.275 0.292 1.793 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -7.675 -0.961 0.681 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -5.686 0.867 -0.828 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -6.805 -0.267 -1.621 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -6.815 1.455 -2.072 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.731 1.589 -1.436 1.00 0.47 N ATOM 1233 CA ARG A 166 -13.109 1.278 -1.899 1.00 0.45 C ATOM 1234 C ARG A 166 -13.722 2.474 -2.614 1.00 0.41 C ATOM 1235 O ARG A 166 -14.625 2.317 -3.416 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.890 0.884 -0.635 1.00 0.52 C ATOM 1237 CG ARG A 166 -14.043 2.089 0.302 1.00 1.19 C ATOM 1238 CD ARG A 166 -14.653 1.629 1.629 1.00 1.53 C ATOM 1239 NE ARG A 166 -14.988 2.884 2.358 1.00 2.29 N ATOM 1240 CZ ARG A 166 -16.007 2.910 3.176 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -16.178 1.944 4.036 1.00 3.60 N ATOM 1242 NH2 ARG A 166 -16.856 3.901 3.132 1.00 3.25 N ATOM 0 H ARG A 166 -11.618 1.666 -0.425 1.00 0.47 H new ATOM 0 HA ARG A 166 -13.127 0.468 -2.628 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -14.874 0.505 -0.912 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -13.371 0.077 -0.117 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -13.072 2.553 0.477 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.678 2.844 -0.160 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -15.542 1.020 1.464 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -13.949 1.020 2.196 1.00 1.53 H new ATOM 0 HE ARG A 166 -14.423 3.722 2.219 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -15.516 1.168 4.070 1.00 3.60 H new ATOM 0 HH12 ARG A 166 -16.973 1.964 4.674 1.00 3.60 H new ATOM 0 HH21 ARG A 166 -16.724 4.656 2.459 1.00 3.25 H new ATOM 0 HH22 ARG A 166 -17.651 3.920 3.771 1.00 3.25 H new ATOM 1256 N THR A 167 -13.231 3.662 -2.361 1.00 0.33 N ATOM 1257 CA THR A 167 -13.800 4.844 -3.078 1.00 0.36 C ATOM 1258 C THR A 167 -13.531 4.704 -4.577 1.00 0.35 C ATOM 1259 O THR A 167 -14.410 4.907 -5.395 1.00 0.41 O ATOM 1260 CB THR A 167 -13.106 6.072 -2.469 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.638 6.303 -1.173 1.00 0.44 O ATOM 1262 CG2 THR A 167 -13.340 7.323 -3.326 1.00 0.47 C ATOM 0 H THR A 167 -12.477 3.863 -1.704 1.00 0.33 H new ATOM 0 HA THR A 167 -14.881 4.933 -2.966 1.00 0.36 H new ATOM 0 HB THR A 167 -12.035 5.876 -2.423 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.242 5.670 -0.539 1.00 0.44 H new ATOM 0 HG21 THR A 167 -12.837 8.176 -2.870 1.00 0.47 H new ATOM 0 HG22 THR A 167 -12.940 7.159 -4.327 1.00 0.47 H new ATOM 0 HG23 THR A 167 -14.409 7.525 -3.391 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.328 4.351 -4.936 1.00 0.32 N ATOM 1271 CA CYS A 168 -12.002 4.186 -6.376 1.00 0.36 C ATOM 1272 C CYS A 168 -12.434 2.802 -6.867 1.00 0.31 C ATOM 1273 O CYS A 168 -13.237 2.683 -7.769 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.484 4.342 -6.465 1.00 0.40 C ATOM 1275 SG CYS A 168 -10.066 6.097 -6.618 1.00 1.38 S ATOM 0 H CYS A 168 -11.558 4.170 -4.292 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.520 4.915 -6.999 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -10.012 3.921 -5.578 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -10.101 3.790 -7.323 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.775 6.231 -6.691 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.905 1.749 -6.275 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.288 0.341 -6.711 1.00 0.31 C ATOM 1283 C ARG A 169 -11.473 -0.762 -6.001 1.00 0.26 C ATOM 1284 O ARG A 169 -11.485 -1.901 -6.430 1.00 0.34 O ATOM 1285 CB ARG A 169 -12.033 0.272 -8.232 1.00 0.44 C ATOM 1286 CG ARG A 169 -13.360 0.058 -8.964 1.00 0.69 C ATOM 1287 CD ARG A 169 -13.117 0.020 -10.476 1.00 0.84 C ATOM 1288 NE ARG A 169 -14.465 -0.173 -11.085 1.00 1.56 N ATOM 1289 CZ ARG A 169 -14.572 -0.450 -12.356 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -13.992 0.313 -13.242 1.00 2.74 N ATOM 1291 NH2 ARG A 169 -15.259 -1.491 -12.741 1.00 2.73 N ATOM 0 H ARG A 169 -11.228 1.794 -5.513 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.330 0.158 -6.447 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.561 1.193 -8.574 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -11.345 -0.542 -8.459 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -13.820 -0.874 -8.637 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -14.055 0.861 -8.718 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -12.657 0.945 -10.824 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -12.443 -0.793 -10.746 1.00 0.84 H new ATOM 0 HE ARG A 169 -15.302 -0.089 -10.509 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -13.455 1.126 -12.941 1.00 2.74 H new ATOM 0 HH12 ARG A 169 -14.076 0.096 -14.235 1.00 2.74 H new ATOM 0 HH21 ARG A 169 -15.712 -2.088 -12.049 1.00 2.73 H new ATOM 0 HH22 ARG A 169 -15.343 -1.708 -13.734 1.00 2.73 H new ATOM 1305 N LEU A 170 -10.754 -0.449 -4.958 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.933 -1.489 -4.266 1.00 0.17 C ATOM 1307 C LEU A 170 -10.710 -2.135 -3.113 1.00 0.19 C ATOM 1308 O LEU A 170 -10.199 -2.300 -2.020 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.714 -0.726 -3.757 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.810 -0.338 -4.938 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.769 1.188 -5.086 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.390 -0.849 -4.679 1.00 0.25 C ATOM 0 H LEU A 170 -10.698 0.485 -4.552 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.660 -2.311 -4.927 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -9.032 0.169 -3.221 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.158 -1.341 -3.049 1.00 0.18 H new ATOM 0 HG LEU A 170 -8.207 -0.782 -5.851 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.126 1.455 -5.925 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.776 1.563 -5.267 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.375 1.632 -4.172 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.747 -0.575 -5.515 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -6.004 -0.402 -3.763 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.407 -1.934 -4.574 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.943 -2.502 -3.352 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.773 -3.144 -2.283 1.00 0.30 C ATOM 1326 C ASN A 171 -12.054 -4.373 -1.710 1.00 0.24 C ATOM 1327 O ASN A 171 -12.255 -4.749 -0.571 1.00 0.25 O ATOM 1328 CB ASN A 171 -14.054 -3.577 -2.995 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.227 -3.496 -2.023 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.754 -4.503 -1.593 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.661 -2.321 -1.664 1.00 0.59 N ATOM 0 H ASN A 171 -12.416 -2.384 -4.248 1.00 0.24 H new ATOM 0 HA ASN A 171 -12.963 -2.467 -1.450 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.238 -2.937 -3.858 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.948 -4.595 -3.370 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.447 -2.243 -1.019 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.215 -1.479 -2.028 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.233 -5.009 -2.509 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.506 -6.236 -2.040 1.00 0.21 C ATOM 1340 C LEU A 172 -9.718 -5.956 -0.758 1.00 0.17 C ATOM 1341 O LEU A 172 -9.943 -6.568 0.269 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.522 -6.558 -3.170 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.288 -7.019 -4.409 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -9.352 -6.991 -5.618 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -10.793 -8.448 -4.196 1.00 0.85 C ATOM 0 H LEU A 172 -11.032 -4.732 -3.470 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.198 -7.049 -1.822 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -8.926 -5.677 -3.407 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.829 -7.336 -2.850 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.135 -6.355 -4.582 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -9.894 -7.319 -6.505 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -8.986 -5.976 -5.771 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -8.508 -7.658 -5.441 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -11.339 -8.776 -5.080 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -9.945 -9.112 -4.026 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -11.454 -8.475 -3.330 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.799 -5.034 -0.815 1.00 0.16 N ATOM 1358 CA VAL A 173 -7.985 -4.709 0.393 1.00 0.21 C ATOM 1359 C VAL A 173 -8.874 -4.125 1.488 1.00 0.22 C ATOM 1360 O VAL A 173 -8.681 -4.386 2.660 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.932 -3.692 -0.065 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.987 -4.357 -1.064 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.589 -2.475 -0.731 1.00 0.34 C ATOM 0 H VAL A 173 -8.574 -4.489 -1.647 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.512 -5.597 0.812 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.381 -3.352 0.812 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.238 -3.636 -1.391 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.493 -5.204 -0.589 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.556 -4.706 -1.926 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.818 -1.772 -1.045 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -8.160 -2.800 -1.601 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.257 -1.988 -0.021 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.849 -3.343 1.113 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.767 -2.738 2.129 1.00 0.34 C ATOM 1375 C ALA A 174 -11.470 -3.840 2.934 1.00 0.29 C ATOM 1376 O ALA A 174 -11.550 -3.784 4.145 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.785 -1.935 1.316 1.00 0.43 C ATOM 0 H ALA A 174 -10.053 -3.094 0.145 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.234 -2.113 2.846 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.496 -1.459 1.991 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.267 -1.171 0.737 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.319 -2.603 0.640 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.988 -4.835 2.264 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.688 -5.945 2.983 1.00 0.23 C ATOM 1385 C ASP A 175 -11.746 -6.668 3.951 1.00 0.17 C ATOM 1386 O ASP A 175 -12.138 -7.031 5.045 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.161 -6.902 1.884 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.293 -6.252 1.081 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -15.011 -5.442 1.646 1.00 0.80 O ATOM 1390 OD2 ASP A 175 -14.422 -6.576 -0.088 1.00 0.99 O ATOM 0 H ASP A 175 -11.958 -4.929 1.249 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.513 -5.567 3.586 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.330 -7.151 1.223 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.507 -7.836 2.327 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.518 -6.903 3.555 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.570 -7.634 4.461 1.00 0.20 C ATOM 1397 C LEU A 176 -9.302 -6.825 5.726 1.00 0.25 C ATOM 1398 O LEU A 176 -9.476 -7.309 6.829 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.269 -7.804 3.660 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.361 -8.901 2.558 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.804 -9.155 2.069 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -7.496 -8.468 1.365 1.00 1.09 C ATOM 0 H LEU A 176 -10.132 -6.624 2.653 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.983 -8.593 4.773 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -8.010 -6.853 3.195 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.459 -8.054 4.345 1.00 0.28 H new ATOM 0 HG LEU A 176 -8.007 -9.834 2.996 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -9.797 -9.930 1.302 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.420 -9.479 2.907 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -10.214 -8.235 1.652 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -7.549 -9.226 0.583 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -7.863 -7.518 0.975 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -6.462 -8.352 1.689 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.885 -5.592 5.576 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.612 -4.744 6.775 1.00 0.41 C ATOM 1416 C VAL A 177 -9.901 -4.593 7.582 1.00 0.37 C ATOM 1417 O VAL A 177 -9.895 -4.653 8.797 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.124 -3.394 6.234 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.835 -3.601 5.436 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.182 -2.774 5.321 1.00 0.52 C ATOM 0 H VAL A 177 -8.723 -5.138 4.677 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.864 -5.178 7.438 1.00 0.41 H new ATOM 0 HB VAL A 177 -7.940 -2.725 7.075 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.487 -2.642 5.051 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.071 -4.030 6.084 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -7.027 -4.278 4.604 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.822 -1.817 4.945 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.377 -3.443 4.483 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.103 -2.620 5.884 1.00 0.52 H new ATOM 1430 N GLU A 178 -11.015 -4.438 6.906 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.323 -4.332 7.624 1.00 0.39 C ATOM 1432 C GLU A 178 -12.560 -5.607 8.439 1.00 0.31 C ATOM 1433 O GLU A 178 -12.853 -5.565 9.619 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.363 -4.206 6.507 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.775 -4.174 7.098 1.00 0.51 C ATOM 1436 CD GLU A 178 -14.975 -2.914 7.952 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -14.128 -2.034 7.904 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -15.980 -2.850 8.641 1.00 1.85 O ATOM 0 H GLU A 178 -11.074 -4.381 5.889 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.365 -3.492 8.317 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.181 -3.298 5.932 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.269 -5.044 5.817 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -15.512 -4.196 6.295 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.940 -5.063 7.707 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.410 -6.741 7.804 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.605 -8.042 8.511 1.00 0.24 C ATOM 1447 C GLU A 179 -11.608 -8.159 9.664 1.00 0.25 C ATOM 1448 O GLU A 179 -11.921 -8.685 10.715 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.351 -9.114 7.446 1.00 0.31 C ATOM 1450 CG GLU A 179 -13.685 -9.556 6.835 1.00 1.03 C ATOM 1451 CD GLU A 179 -14.336 -10.623 7.723 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -13.613 -11.313 8.424 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -15.551 -10.735 7.683 1.00 1.92 O ATOM 0 H GLU A 179 -12.159 -6.822 6.819 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.600 -8.142 8.945 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.696 -8.721 6.669 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -11.842 -9.969 7.890 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -14.351 -8.699 6.734 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -13.522 -9.954 5.833 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.414 -7.662 9.473 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.389 -7.727 10.557 1.00 0.38 C ATOM 1462 C ALA A 180 -9.829 -6.864 11.745 1.00 0.44 C ATOM 1463 O ALA A 180 -9.611 -7.213 12.889 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.105 -7.174 9.934 1.00 0.50 C ATOM 0 H ALA A 180 -10.104 -7.213 8.611 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.248 -8.741 10.932 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.305 -7.191 10.674 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -7.822 -7.788 9.079 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.273 -6.149 9.604 1.00 0.50 H new