USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 452 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 150 THR OG1 : rot -140:sc= -0.135 USER MOD Set 1.2: A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 GLN : amide:sc= -0.0194 X(o=-0.019,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0.00658 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.0146) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 THR OG1 : rot 180:sc= 0.0386 USER MOD Single : A 172 THR OG1 : rot 75:sc= -5.01! USER MOD Single : A 179 SER OG : rot 180:sc= 0.00269 USER MOD Single : A 180 GLN : amide:sc= -0.971 X(o=-0.97,f=-0.97) USER MOD Single : A 183 LYS NZ :NH3+ -139:sc= -1.2 (180deg=-4.26!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 127 -1.023 -17.040 -0.949 1.00 0.00 N ATOM 2 CA ALA A 127 -1.986 -15.944 -0.664 1.00 0.00 C ATOM 3 C ALA A 127 -2.471 -15.292 -1.955 1.00 0.00 C ATOM 4 O ALA A 127 -3.634 -15.428 -2.331 1.00 0.00 O ATOM 5 CB ALA A 127 -1.346 -14.903 0.244 1.00 0.00 C ATOM 0 HA ALA A 127 -2.849 -16.374 -0.156 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.062 -14.106 0.445 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -1.051 -15.371 1.183 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -0.466 -14.485 -0.245 1.00 0.00 H new ATOM 13 N GLN A 128 -1.570 -14.584 -2.628 1.00 0.00 N ATOM 14 CA GLN A 128 -1.906 -13.911 -3.878 1.00 0.00 C ATOM 15 C GLN A 128 -3.020 -12.893 -3.664 1.00 0.00 C ATOM 16 O GLN A 128 -4.169 -13.122 -4.048 1.00 0.00 O ATOM 17 CB GLN A 128 -2.326 -14.933 -4.935 1.00 0.00 C ATOM 18 CG GLN A 128 -2.651 -14.314 -6.285 1.00 0.00 C ATOM 19 CD GLN A 128 -3.691 -15.104 -7.055 1.00 0.00 C ATOM 20 OE1 GLN A 128 -4.892 -14.949 -6.837 1.00 0.00 O ATOM 21 NE2 GLN A 128 -3.232 -15.959 -7.961 1.00 0.00 N ATOM 0 H GLN A 128 -0.602 -14.461 -2.329 1.00 0.00 H new ATOM 0 HA GLN A 128 -1.019 -13.383 -4.228 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -1.525 -15.662 -5.062 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -3.199 -15.478 -4.575 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -3.011 -13.296 -6.136 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -1.739 -14.246 -6.878 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -2.227 -16.055 -8.109 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -3.884 -16.520 -8.509 1.00 0.00 H new ATOM 30 N VAL A 129 -2.676 -11.766 -3.048 1.00 0.00 N ATOM 31 CA VAL A 129 -3.648 -10.711 -2.784 1.00 0.00 C ATOM 32 C VAL A 129 -3.311 -9.445 -3.567 1.00 0.00 C ATOM 33 O VAL A 129 -2.150 -9.192 -3.887 1.00 0.00 O ATOM 34 CB VAL A 129 -3.717 -10.376 -1.281 1.00 0.00 C ATOM 35 CG1 VAL A 129 -2.377 -9.855 -0.783 1.00 0.00 C ATOM 36 CG2 VAL A 129 -4.824 -9.369 -1.007 1.00 0.00 C ATOM 0 H VAL A 129 -1.732 -11.560 -2.722 1.00 0.00 H new ATOM 0 HA VAL A 129 -4.620 -11.084 -3.108 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.947 -11.292 -0.737 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -2.448 -9.625 0.280 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -1.611 -10.614 -0.939 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -2.111 -8.952 -1.333 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -4.857 -9.145 0.059 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -4.628 -8.453 -1.564 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -5.781 -9.786 -1.320 1.00 0.00 H new ATOM 46 N ALA A 130 -4.335 -8.655 -3.872 1.00 0.00 N ATOM 47 CA ALA A 130 -4.149 -7.416 -4.618 1.00 0.00 C ATOM 48 C ALA A 130 -3.355 -6.400 -3.805 1.00 0.00 C ATOM 49 O ALA A 130 -2.395 -5.806 -4.300 1.00 0.00 O ATOM 50 CB ALA A 130 -5.497 -6.835 -5.019 1.00 0.00 C ATOM 0 H ALA A 130 -5.302 -8.851 -3.614 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.581 -7.645 -5.519 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -5.344 -5.910 -5.575 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -6.030 -7.551 -5.645 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -6.084 -6.627 -4.125 1.00 0.00 H new ATOM 56 N PHE A 131 -3.758 -6.203 -2.554 1.00 0.00 N ATOM 57 CA PHE A 131 -3.084 -5.258 -1.672 1.00 0.00 C ATOM 58 C PHE A 131 -2.647 -5.936 -0.378 1.00 0.00 C ATOM 59 O PHE A 131 -3.293 -6.871 0.093 1.00 0.00 O ATOM 60 CB PHE A 131 -4.004 -4.079 -1.357 1.00 0.00 C ATOM 61 CG PHE A 131 -3.267 -2.805 -1.055 1.00 0.00 C ATOM 62 CD1 PHE A 131 -2.922 -1.931 -2.073 1.00 0.00 C ATOM 63 CD2 PHE A 131 -2.919 -2.483 0.248 1.00 0.00 C ATOM 64 CE1 PHE A 131 -2.244 -0.758 -1.797 1.00 0.00 C ATOM 65 CE2 PHE A 131 -2.241 -1.313 0.528 1.00 0.00 C ATOM 66 CZ PHE A 131 -1.903 -0.448 -0.495 1.00 0.00 C ATOM 0 H PHE A 131 -4.549 -6.686 -2.128 1.00 0.00 H new ATOM 0 HA PHE A 131 -2.196 -4.891 -2.186 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -4.670 -3.912 -2.204 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -4.632 -4.337 -0.504 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -3.185 -2.168 -3.093 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -3.181 -3.154 1.052 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -1.981 -0.084 -2.599 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -1.975 -1.074 1.547 1.00 0.00 H new ATOM 0 HZ PHE A 131 -1.374 0.468 -0.277 1.00 0.00 H new ATOM 76 N ARG A 132 -1.546 -5.456 0.193 1.00 0.00 N ATOM 77 CA ARG A 132 -1.022 -6.015 1.433 1.00 0.00 C ATOM 78 C ARG A 132 -0.091 -5.025 2.125 1.00 0.00 C ATOM 79 O ARG A 132 0.635 -4.277 1.467 1.00 0.00 O ATOM 80 CB ARG A 132 -0.280 -7.323 1.154 1.00 0.00 C ATOM 81 CG ARG A 132 -0.531 -8.401 2.199 1.00 0.00 C ATOM 82 CD ARG A 132 0.752 -9.124 2.579 1.00 0.00 C ATOM 83 NE ARG A 132 1.223 -8.742 3.908 1.00 0.00 N ATOM 84 CZ ARG A 132 0.592 -9.060 5.037 1.00 0.00 C ATOM 85 NH1 ARG A 132 -0.535 -9.761 5.001 1.00 0.00 N ATOM 86 NH2 ARG A 132 1.088 -8.674 6.204 1.00 0.00 N ATOM 0 H ARG A 132 -1.000 -4.681 -0.184 1.00 0.00 H new ATOM 0 HA ARG A 132 -1.864 -6.218 2.095 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -0.580 -7.700 0.176 1.00 0.00 H new ATOM 0 HB3 ARG A 132 0.790 -7.120 1.103 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -0.972 -7.951 3.088 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -1.254 -9.120 1.814 1.00 0.00 H new ATOM 0 HD2 ARG A 132 0.584 -10.201 2.550 1.00 0.00 H new ATOM 0 HD3 ARG A 132 1.525 -8.902 1.843 1.00 0.00 H new ATOM 0 HE ARG A 132 2.085 -8.201 3.975 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -0.922 -10.059 4.105 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -1.014 -10.002 5.869 1.00 0.00 H new ATOM 0 HH21 ARG A 132 1.953 -8.134 6.237 1.00 0.00 H new ATOM 0 HH22 ARG A 132 0.605 -8.917 7.069 1.00 0.00 H new ATOM 100 N GLU A 133 -0.114 -5.026 3.454 1.00 0.00 N ATOM 101 CA GLU A 133 0.730 -4.127 4.233 1.00 0.00 C ATOM 102 C GLU A 133 2.206 -4.370 3.932 1.00 0.00 C ATOM 103 O GLU A 133 2.658 -5.513 3.871 1.00 0.00 O ATOM 104 CB GLU A 133 0.463 -4.312 5.728 1.00 0.00 C ATOM 105 CG GLU A 133 0.676 -5.737 6.213 1.00 0.00 C ATOM 106 CD GLU A 133 -0.099 -6.042 7.480 1.00 0.00 C ATOM 107 OE1 GLU A 133 -1.290 -6.405 7.375 1.00 0.00 O ATOM 108 OE2 GLU A 133 0.485 -5.919 8.578 1.00 0.00 O ATOM 0 H GLU A 133 -0.707 -5.639 4.014 1.00 0.00 H new ATOM 0 HA GLU A 133 0.485 -3.103 3.952 1.00 0.00 H new ATOM 0 HB2 GLU A 133 1.116 -3.644 6.290 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -0.562 -4.013 5.945 1.00 0.00 H new ATOM 0 HG2 GLU A 133 0.374 -6.433 5.430 1.00 0.00 H new ATOM 0 HG3 GLU A 133 1.739 -5.901 6.393 1.00 0.00 H new ATOM 115 N GLY A 134 2.951 -3.287 3.743 1.00 0.00 N ATOM 116 CA GLY A 134 4.367 -3.404 3.450 1.00 0.00 C ATOM 117 C GLY A 134 4.685 -3.107 1.998 1.00 0.00 C ATOM 118 O GLY A 134 5.788 -2.668 1.673 1.00 0.00 O ATOM 0 H GLY A 134 2.600 -2.330 3.787 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.925 -2.719 4.088 1.00 0.00 H new ATOM 0 HA3 GLY A 134 4.703 -4.412 3.694 1.00 0.00 H new ATOM 122 N ASP A 135 3.715 -3.349 1.121 1.00 0.00 N ATOM 123 CA ASP A 135 3.897 -3.105 -0.306 1.00 0.00 C ATOM 124 C ASP A 135 4.130 -1.624 -0.581 1.00 0.00 C ATOM 125 O ASP A 135 4.122 -0.804 0.338 1.00 0.00 O ATOM 126 CB ASP A 135 2.676 -3.595 -1.087 1.00 0.00 C ATOM 127 CG ASP A 135 2.735 -5.081 -1.382 1.00 0.00 C ATOM 128 OD1 ASP A 135 3.635 -5.500 -2.141 1.00 0.00 O ATOM 129 OD2 ASP A 135 1.883 -5.826 -0.855 1.00 0.00 O ATOM 0 H ASP A 135 2.796 -3.713 1.373 1.00 0.00 H new ATOM 0 HA ASP A 135 4.777 -3.658 -0.634 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.773 -3.376 -0.518 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.603 -3.044 -2.025 1.00 0.00 H new ATOM 134 N GLN A 136 4.342 -1.287 -1.849 1.00 0.00 N ATOM 135 CA GLN A 136 4.580 0.097 -2.242 1.00 0.00 C ATOM 136 C GLN A 136 3.647 0.515 -3.374 1.00 0.00 C ATOM 137 O GLN A 136 3.524 -0.179 -4.384 1.00 0.00 O ATOM 138 CB GLN A 136 6.039 0.282 -2.670 1.00 0.00 C ATOM 139 CG GLN A 136 6.915 0.894 -1.591 1.00 0.00 C ATOM 140 CD GLN A 136 8.352 0.411 -1.663 1.00 0.00 C ATOM 141 OE1 GLN A 136 9.261 1.179 -1.979 1.00 0.00 O ATOM 142 NE2 GLN A 136 8.560 -0.867 -1.370 1.00 0.00 N ATOM 0 H GLN A 136 4.354 -1.953 -2.621 1.00 0.00 H new ATOM 0 HA GLN A 136 4.376 0.732 -1.380 1.00 0.00 H new ATOM 0 HB2 GLN A 136 6.451 -0.686 -2.955 1.00 0.00 H new ATOM 0 HB3 GLN A 136 6.072 0.916 -3.556 1.00 0.00 H new ATOM 0 HG2 GLN A 136 6.895 1.980 -1.685 1.00 0.00 H new ATOM 0 HG3 GLN A 136 6.502 0.651 -0.612 1.00 0.00 H new ATOM 0 HE21 GLN A 136 7.775 -1.466 -1.113 1.00 0.00 H new ATOM 0 HE22 GLN A 136 9.505 -1.250 -1.402 1.00 0.00 H new ATOM 151 N VAL A 137 2.993 1.659 -3.198 1.00 0.00 N ATOM 152 CA VAL A 137 2.072 2.181 -4.202 1.00 0.00 C ATOM 153 C VAL A 137 2.380 3.643 -4.508 1.00 0.00 C ATOM 154 O VAL A 137 2.740 4.406 -3.612 1.00 0.00 O ATOM 155 CB VAL A 137 0.609 2.062 -3.736 1.00 0.00 C ATOM 156 CG1 VAL A 137 0.196 0.601 -3.627 1.00 0.00 C ATOM 157 CG2 VAL A 137 0.414 2.779 -2.408 1.00 0.00 C ATOM 0 H VAL A 137 3.084 2.244 -2.367 1.00 0.00 H new ATOM 0 HA VAL A 137 2.205 1.583 -5.104 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.029 2.539 -4.480 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.841 0.540 -3.296 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.295 0.121 -4.601 1.00 0.00 H new ATOM 0 HG13 VAL A 137 0.837 0.094 -2.906 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.625 2.685 -2.093 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.063 2.333 -1.655 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.664 3.834 -2.524 1.00 0.00 H new ATOM 167 N ARG A 138 2.239 4.030 -5.771 1.00 0.00 N ATOM 168 CA ARG A 138 2.510 5.405 -6.177 1.00 0.00 C ATOM 169 C ARG A 138 1.338 6.317 -5.837 1.00 0.00 C ATOM 170 O ARG A 138 0.235 5.852 -5.548 1.00 0.00 O ATOM 171 CB ARG A 138 2.816 5.479 -7.677 1.00 0.00 C ATOM 172 CG ARG A 138 4.114 6.211 -7.997 1.00 0.00 C ATOM 173 CD ARG A 138 4.912 5.496 -9.077 1.00 0.00 C ATOM 174 NE ARG A 138 5.151 6.351 -10.237 1.00 0.00 N ATOM 175 CZ ARG A 138 6.110 6.135 -11.134 1.00 0.00 C ATOM 176 NH1 ARG A 138 6.923 5.092 -11.010 1.00 0.00 N ATOM 177 NH2 ARG A 138 6.259 6.962 -12.158 1.00 0.00 N ATOM 0 H ARG A 138 1.940 3.415 -6.528 1.00 0.00 H new ATOM 0 HA ARG A 138 3.385 5.747 -5.624 1.00 0.00 H new ATOM 0 HB2 ARG A 138 2.870 4.467 -8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 138 1.991 5.980 -8.184 1.00 0.00 H new ATOM 0 HG2 ARG A 138 3.888 7.226 -8.323 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.718 6.294 -7.093 1.00 0.00 H new ATOM 0 HD2 ARG A 138 5.867 5.168 -8.665 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.376 4.600 -9.391 1.00 0.00 H new ATOM 0 HE ARG A 138 4.547 7.162 -10.367 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.814 4.451 -10.224 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.656 4.932 -11.701 1.00 0.00 H new ATOM 0 HH21 ARG A 138 5.638 7.765 -12.259 1.00 0.00 H new ATOM 0 HH22 ARG A 138 6.994 6.796 -12.845 1.00 0.00 H new ATOM 191 N VAL A 139 1.593 7.619 -5.864 1.00 0.00 N ATOM 192 CA VAL A 139 0.573 8.613 -5.551 1.00 0.00 C ATOM 193 C VAL A 139 -0.360 8.857 -6.738 1.00 0.00 C ATOM 194 O VAL A 139 0.049 8.767 -7.895 1.00 0.00 O ATOM 195 CB VAL A 139 1.222 9.945 -5.130 1.00 0.00 C ATOM 196 CG1 VAL A 139 0.163 10.965 -4.741 1.00 0.00 C ATOM 197 CG2 VAL A 139 2.201 9.722 -3.987 1.00 0.00 C ATOM 0 H VAL A 139 2.503 8.013 -6.101 1.00 0.00 H new ATOM 0 HA VAL A 139 -0.016 8.218 -4.723 1.00 0.00 H new ATOM 0 HB VAL A 139 1.773 10.341 -5.983 1.00 0.00 H new ATOM 0 HG11 VAL A 139 0.646 11.897 -4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -0.495 11.149 -5.591 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -0.422 10.581 -3.906 1.00 0.00 H new ATOM 0 HG21 VAL A 139 2.650 10.673 -3.702 1.00 0.00 H new ATOM 0 HG22 VAL A 139 1.672 9.300 -3.132 1.00 0.00 H new ATOM 0 HG23 VAL A 139 2.983 9.033 -4.307 1.00 0.00 H new ATOM 207 N VAL A 140 -1.624 9.155 -6.434 1.00 0.00 N ATOM 208 CA VAL A 140 -2.634 9.403 -7.463 1.00 0.00 C ATOM 209 C VAL A 140 -2.641 10.858 -7.935 1.00 0.00 C ATOM 210 O VAL A 140 -3.127 11.158 -9.025 1.00 0.00 O ATOM 211 CB VAL A 140 -4.040 9.057 -6.941 1.00 0.00 C ATOM 212 CG1 VAL A 140 -4.403 9.945 -5.757 1.00 0.00 C ATOM 213 CG2 VAL A 140 -5.073 9.187 -8.051 1.00 0.00 C ATOM 0 H VAL A 140 -1.974 9.231 -5.479 1.00 0.00 H new ATOM 0 HA VAL A 140 -2.372 8.763 -8.306 1.00 0.00 H new ATOM 0 HB VAL A 140 -4.036 8.021 -6.603 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.400 9.687 -5.401 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -3.681 9.795 -4.955 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -4.388 10.990 -6.068 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -6.060 8.938 -7.661 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -5.078 10.211 -8.425 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -4.822 8.505 -8.864 1.00 0.00 H new ATOM 223 N SER A 141 -2.125 11.759 -7.106 1.00 0.00 N ATOM 224 CA SER A 141 -2.104 13.179 -7.445 1.00 0.00 C ATOM 225 C SER A 141 -0.968 13.505 -8.408 1.00 0.00 C ATOM 226 O SER A 141 0.049 12.814 -8.442 1.00 0.00 O ATOM 227 CB SER A 141 -1.969 14.022 -6.176 1.00 0.00 C ATOM 228 OG SER A 141 -2.567 15.296 -6.344 1.00 0.00 O ATOM 0 H SER A 141 -1.717 11.534 -6.199 1.00 0.00 H new ATOM 0 HA SER A 141 -3.046 13.418 -7.940 1.00 0.00 H new ATOM 0 HB2 SER A 141 -2.438 13.504 -5.340 1.00 0.00 H new ATOM 0 HB3 SER A 141 -0.915 14.142 -5.926 1.00 0.00 H new ATOM 0 HG SER A 141 -2.469 15.815 -5.518 1.00 0.00 H new ATOM 234 N GLY A 142 -1.156 14.564 -9.191 1.00 0.00 N ATOM 235 CA GLY A 142 -0.147 14.975 -10.151 1.00 0.00 C ATOM 236 C GLY A 142 1.121 15.479 -9.489 1.00 0.00 C ATOM 237 O GLY A 142 2.189 14.892 -9.668 1.00 0.00 O ATOM 0 H GLY A 142 -1.993 15.147 -9.177 1.00 0.00 H new ATOM 0 HA2 GLY A 142 0.096 14.133 -10.799 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -0.556 15.759 -10.788 1.00 0.00 H new ATOM 241 N PRO A 143 1.042 16.571 -8.707 1.00 0.00 N ATOM 242 CA PRO A 143 2.206 17.135 -8.020 1.00 0.00 C ATOM 243 C PRO A 143 2.936 16.095 -7.177 1.00 0.00 C ATOM 244 O PRO A 143 4.124 16.240 -6.885 1.00 0.00 O ATOM 245 CB PRO A 143 1.614 18.234 -7.124 1.00 0.00 C ATOM 246 CG PRO A 143 0.139 17.997 -7.118 1.00 0.00 C ATOM 247 CD PRO A 143 -0.180 17.337 -8.427 1.00 0.00 C ATOM 0 HA PRO A 143 2.948 17.507 -8.726 1.00 0.00 H new ATOM 0 HB2 PRO A 143 2.024 18.180 -6.115 1.00 0.00 H new ATOM 0 HB3 PRO A 143 1.850 19.225 -7.512 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -0.151 17.362 -6.280 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -0.406 18.935 -7.011 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -1.055 16.691 -8.353 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -0.389 18.067 -9.209 1.00 0.00 H new ATOM 255 N PHE A 144 2.220 15.043 -6.792 1.00 0.00 N ATOM 256 CA PHE A 144 2.799 13.975 -5.985 1.00 0.00 C ATOM 257 C PHE A 144 2.952 12.686 -6.793 1.00 0.00 C ATOM 258 O PHE A 144 3.401 11.670 -6.264 1.00 0.00 O ATOM 259 CB PHE A 144 1.919 13.695 -4.765 1.00 0.00 C ATOM 260 CG PHE A 144 1.556 14.918 -3.975 1.00 0.00 C ATOM 261 CD1 PHE A 144 2.496 15.899 -3.709 1.00 0.00 C ATOM 262 CD2 PHE A 144 0.268 15.080 -3.492 1.00 0.00 C ATOM 263 CE1 PHE A 144 2.156 17.021 -2.977 1.00 0.00 C ATOM 264 CE2 PHE A 144 -0.080 16.196 -2.761 1.00 0.00 C ATOM 265 CZ PHE A 144 0.866 17.170 -2.502 1.00 0.00 C ATOM 0 H PHE A 144 1.237 14.907 -7.026 1.00 0.00 H new ATOM 0 HA PHE A 144 3.786 14.307 -5.663 1.00 0.00 H new ATOM 0 HB2 PHE A 144 1.003 13.205 -5.096 1.00 0.00 H new ATOM 0 HB3 PHE A 144 2.437 12.994 -4.111 1.00 0.00 H new ATOM 0 HD1 PHE A 144 3.505 15.786 -4.077 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -0.474 14.321 -3.691 1.00 0.00 H new ATOM 0 HE1 PHE A 144 2.897 17.781 -2.776 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -1.089 16.309 -2.392 1.00 0.00 H new ATOM 0 HZ PHE A 144 0.598 18.046 -1.930 1.00 0.00 H new ATOM 275 N ALA A 145 2.564 12.723 -8.067 1.00 0.00 N ATOM 276 CA ALA A 145 2.644 11.546 -8.931 1.00 0.00 C ATOM 277 C ALA A 145 4.088 11.168 -9.263 1.00 0.00 C ATOM 278 O ALA A 145 4.433 10.967 -10.427 1.00 0.00 O ATOM 279 CB ALA A 145 1.854 11.781 -10.210 1.00 0.00 C ATOM 0 H ALA A 145 2.191 13.555 -8.524 1.00 0.00 H new ATOM 0 HA ALA A 145 2.209 10.710 -8.383 1.00 0.00 H new ATOM 0 HB1 ALA A 145 1.920 10.898 -10.846 1.00 0.00 H new ATOM 0 HB2 ALA A 145 0.810 11.972 -9.963 1.00 0.00 H new ATOM 0 HB3 ALA A 145 2.265 12.641 -10.739 1.00 0.00 H new ATOM 285 N ASP A 146 4.923 11.057 -8.237 1.00 0.00 N ATOM 286 CA ASP A 146 6.317 10.682 -8.426 1.00 0.00 C ATOM 287 C ASP A 146 6.913 10.169 -7.123 1.00 0.00 C ATOM 288 O ASP A 146 8.105 10.329 -6.863 1.00 0.00 O ATOM 289 CB ASP A 146 7.128 11.866 -8.957 1.00 0.00 C ATOM 290 CG ASP A 146 7.958 11.501 -10.172 1.00 0.00 C ATOM 291 OD1 ASP A 146 7.548 10.587 -10.918 1.00 0.00 O ATOM 292 OD2 ASP A 146 9.017 12.130 -10.378 1.00 0.00 O ATOM 0 H ASP A 146 4.658 11.222 -7.266 1.00 0.00 H new ATOM 0 HA ASP A 146 6.358 9.881 -9.164 1.00 0.00 H new ATOM 0 HB2 ASP A 146 6.451 12.680 -9.215 1.00 0.00 H new ATOM 0 HB3 ASP A 146 7.785 12.235 -8.169 1.00 0.00 H new ATOM 297 N PHE A 147 6.067 9.551 -6.315 1.00 0.00 N ATOM 298 CA PHE A 147 6.489 9.003 -5.033 1.00 0.00 C ATOM 299 C PHE A 147 5.559 7.876 -4.606 1.00 0.00 C ATOM 300 O PHE A 147 4.361 7.908 -4.889 1.00 0.00 O ATOM 301 CB PHE A 147 6.509 10.095 -3.961 1.00 0.00 C ATOM 302 CG PHE A 147 7.141 11.379 -4.418 1.00 0.00 C ATOM 303 CD1 PHE A 147 8.519 11.525 -4.425 1.00 0.00 C ATOM 304 CD2 PHE A 147 6.357 12.441 -4.840 1.00 0.00 C ATOM 305 CE1 PHE A 147 9.103 12.705 -4.845 1.00 0.00 C ATOM 306 CE2 PHE A 147 6.935 13.623 -5.262 1.00 0.00 C ATOM 307 CZ PHE A 147 8.310 13.755 -5.264 1.00 0.00 C ATOM 0 H PHE A 147 5.078 9.415 -6.525 1.00 0.00 H new ATOM 0 HA PHE A 147 7.498 8.606 -5.148 1.00 0.00 H new ATOM 0 HB2 PHE A 147 5.487 10.297 -3.642 1.00 0.00 H new ATOM 0 HB3 PHE A 147 7.048 9.725 -3.089 1.00 0.00 H new ATOM 0 HD1 PHE A 147 9.144 10.707 -4.098 1.00 0.00 H new ATOM 0 HD2 PHE A 147 5.281 12.344 -4.839 1.00 0.00 H new ATOM 0 HE1 PHE A 147 10.178 12.806 -4.846 1.00 0.00 H new ATOM 0 HE2 PHE A 147 6.313 14.442 -5.590 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.764 14.678 -5.593 1.00 0.00 H new ATOM 317 N THR A 148 6.112 6.882 -3.927 1.00 0.00 N ATOM 318 CA THR A 148 5.321 5.749 -3.469 1.00 0.00 C ATOM 319 C THR A 148 5.055 5.840 -1.971 1.00 0.00 C ATOM 320 O THR A 148 5.647 6.664 -1.275 1.00 0.00 O ATOM 321 CB THR A 148 6.033 4.434 -3.796 1.00 0.00 C ATOM 322 OG1 THR A 148 7.412 4.523 -3.487 1.00 0.00 O ATOM 323 CG2 THR A 148 5.911 4.034 -5.250 1.00 0.00 C ATOM 0 H THR A 148 7.101 6.836 -3.682 1.00 0.00 H new ATOM 0 HA THR A 148 4.364 5.773 -3.991 1.00 0.00 H new ATOM 0 HB THR A 148 5.540 3.677 -3.187 1.00 0.00 H new ATOM 0 HG1 THR A 148 7.851 3.673 -3.701 1.00 0.00 H new ATOM 0 HG21 THR A 148 6.438 3.094 -5.414 1.00 0.00 H new ATOM 0 HG22 THR A 148 4.859 3.910 -5.506 1.00 0.00 H new ATOM 0 HG23 THR A 148 6.349 4.809 -5.879 1.00 0.00 H new ATOM 331 N GLY A 149 4.160 4.989 -1.482 1.00 0.00 N ATOM 332 CA GLY A 149 3.831 4.991 -0.069 1.00 0.00 C ATOM 333 C GLY A 149 3.917 3.610 0.551 1.00 0.00 C ATOM 334 O GLY A 149 3.407 2.638 -0.006 1.00 0.00 O ATOM 0 H GLY A 149 3.657 4.298 -2.039 1.00 0.00 H new ATOM 0 HA2 GLY A 149 4.508 5.664 0.457 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.823 5.383 0.065 1.00 0.00 H new ATOM 338 N THR A 150 4.563 3.528 1.710 1.00 0.00 N ATOM 339 CA THR A 150 4.714 2.259 2.412 1.00 0.00 C ATOM 340 C THR A 150 3.508 1.989 3.306 1.00 0.00 C ATOM 341 O THR A 150 3.309 2.662 4.316 1.00 0.00 O ATOM 342 CB THR A 150 5.991 2.266 3.254 1.00 0.00 C ATOM 343 OG1 THR A 150 7.025 2.968 2.590 1.00 0.00 O ATOM 344 CG2 THR A 150 6.507 0.878 3.569 1.00 0.00 C ATOM 0 H THR A 150 4.990 4.325 2.182 1.00 0.00 H new ATOM 0 HA THR A 150 4.781 1.466 1.667 1.00 0.00 H new ATOM 0 HB THR A 150 5.718 2.756 4.189 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.875 2.498 2.719 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.414 0.954 4.168 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.750 0.326 4.126 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.729 0.353 2.640 1.00 0.00 H new ATOM 352 N VAL A 151 2.708 0.998 2.928 1.00 0.00 N ATOM 353 CA VAL A 151 1.522 0.642 3.697 1.00 0.00 C ATOM 354 C VAL A 151 1.906 0.046 5.048 1.00 0.00 C ATOM 355 O VAL A 151 2.545 -1.004 5.116 1.00 0.00 O ATOM 356 CB VAL A 151 0.636 -0.364 2.936 1.00 0.00 C ATOM 357 CG1 VAL A 151 -0.665 -0.606 3.685 1.00 0.00 C ATOM 358 CG2 VAL A 151 0.363 0.127 1.523 1.00 0.00 C ATOM 0 H VAL A 151 2.859 0.428 2.096 1.00 0.00 H new ATOM 0 HA VAL A 151 0.958 1.561 3.853 1.00 0.00 H new ATOM 0 HB VAL A 151 1.170 -1.312 2.870 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -1.276 -1.319 3.132 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -0.446 -1.007 4.675 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -1.207 0.334 3.787 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.264 -0.596 1.001 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -0.149 1.088 1.564 1.00 0.00 H new ATOM 0 HG23 VAL A 151 1.306 0.241 0.989 1.00 0.00 H new ATOM 368 N THR A 152 1.510 0.723 6.121 1.00 0.00 N ATOM 369 CA THR A 152 1.810 0.262 7.471 1.00 0.00 C ATOM 370 C THR A 152 0.591 -0.400 8.103 1.00 0.00 C ATOM 371 O THR A 152 0.721 -1.305 8.928 1.00 0.00 O ATOM 372 CB THR A 152 2.283 1.430 8.340 1.00 0.00 C ATOM 373 OG1 THR A 152 2.283 1.068 9.709 1.00 0.00 O ATOM 374 CG2 THR A 152 1.427 2.671 8.193 1.00 0.00 C ATOM 0 H THR A 152 0.980 1.594 6.081 1.00 0.00 H new ATOM 0 HA THR A 152 2.608 -0.477 7.407 1.00 0.00 H new ATOM 0 HB THR A 152 3.290 1.660 7.992 1.00 0.00 H new ATOM 0 HG1 THR A 152 2.590 1.827 10.248 1.00 0.00 H new ATOM 0 HG21 THR A 152 1.817 3.460 8.836 1.00 0.00 H new ATOM 0 HG22 THR A 152 1.446 3.005 7.156 1.00 0.00 H new ATOM 0 HG23 THR A 152 0.401 2.442 8.482 1.00 0.00 H new ATOM 382 N GLU A 153 -0.594 0.055 7.711 1.00 0.00 N ATOM 383 CA GLU A 153 -1.836 -0.495 8.240 1.00 0.00 C ATOM 384 C GLU A 153 -2.938 -0.461 7.184 1.00 0.00 C ATOM 385 O GLU A 153 -2.810 0.212 6.160 1.00 0.00 O ATOM 386 CB GLU A 153 -2.276 0.282 9.484 1.00 0.00 C ATOM 387 CG GLU A 153 -2.550 -0.603 10.689 1.00 0.00 C ATOM 388 CD GLU A 153 -3.918 -0.360 11.294 1.00 0.00 C ATOM 389 OE1 GLU A 153 -4.927 -0.643 10.615 1.00 0.00 O ATOM 390 OE2 GLU A 153 -3.981 0.114 12.448 1.00 0.00 O ATOM 0 H GLU A 153 -0.720 0.803 7.029 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.656 -1.534 8.517 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -1.502 1.005 9.743 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -3.176 0.849 9.248 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -2.469 -1.649 10.393 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -1.786 -0.426 11.446 1.00 0.00 H new ATOM 397 N ILE A 154 -4.019 -1.191 7.439 1.00 0.00 N ATOM 398 CA ILE A 154 -5.142 -1.243 6.512 1.00 0.00 C ATOM 399 C ILE A 154 -6.446 -1.533 7.244 1.00 0.00 C ATOM 400 O ILE A 154 -6.480 -2.329 8.182 1.00 0.00 O ATOM 401 CB ILE A 154 -4.925 -2.317 5.427 1.00 0.00 C ATOM 402 CG1 ILE A 154 -4.586 -3.663 6.071 1.00 0.00 C ATOM 403 CG2 ILE A 154 -3.823 -1.886 4.469 1.00 0.00 C ATOM 404 CD1 ILE A 154 -5.760 -4.616 6.133 1.00 0.00 C ATOM 0 H ILE A 154 -4.140 -1.755 8.280 1.00 0.00 H new ATOM 0 HA ILE A 154 -5.206 -0.264 6.037 1.00 0.00 H new ATOM 0 HB ILE A 154 -5.848 -2.432 4.859 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -3.777 -4.132 5.510 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -4.215 -3.490 7.081 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -3.681 -2.654 3.709 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -4.104 -0.948 3.990 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -2.894 -1.747 5.022 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -5.447 -5.549 6.601 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -6.562 -4.167 6.719 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -6.118 -4.819 5.124 1.00 0.00 H new ATOM 416 N ASN A 155 -7.520 -0.881 6.808 1.00 0.00 N ATOM 417 CA ASN A 155 -8.828 -1.068 7.423 1.00 0.00 C ATOM 418 C ASN A 155 -9.844 -1.570 6.399 1.00 0.00 C ATOM 419 O ASN A 155 -10.478 -0.777 5.702 1.00 0.00 O ATOM 420 CB ASN A 155 -9.316 0.245 8.044 1.00 0.00 C ATOM 421 CG ASN A 155 -9.236 0.232 9.556 1.00 0.00 C ATOM 422 OD1 ASN A 155 -8.223 0.615 10.141 1.00 0.00 O ATOM 423 ND2 ASN A 155 -10.309 -0.212 10.201 1.00 0.00 N ATOM 0 H ASN A 155 -7.509 -0.219 6.032 1.00 0.00 H new ATOM 0 HA ASN A 155 -8.730 -1.818 8.208 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -8.718 1.071 7.658 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -10.346 0.428 7.739 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -10.314 -0.245 11.220 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -11.128 -0.520 9.677 1.00 0.00 H new ATOM 430 N PRO A 156 -10.013 -2.900 6.292 1.00 0.00 N ATOM 431 CA PRO A 156 -10.959 -3.502 5.346 1.00 0.00 C ATOM 432 C PRO A 156 -12.412 -3.245 5.733 1.00 0.00 C ATOM 433 O PRO A 156 -13.307 -3.300 4.889 1.00 0.00 O ATOM 434 CB PRO A 156 -10.641 -4.998 5.425 1.00 0.00 C ATOM 435 CG PRO A 156 -10.049 -5.186 6.779 1.00 0.00 C ATOM 436 CD PRO A 156 -9.299 -3.921 7.083 1.00 0.00 C ATOM 0 HA PRO A 156 -10.854 -3.083 4.345 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -11.540 -5.601 5.298 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -9.943 -5.297 4.643 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -10.825 -5.367 7.522 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -9.383 -6.048 6.797 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -9.317 -3.689 8.148 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -8.251 -3.995 6.791 1.00 0.00 H new ATOM 444 N GLU A 157 -12.640 -2.967 7.012 1.00 0.00 N ATOM 445 CA GLU A 157 -13.986 -2.701 7.512 1.00 0.00 C ATOM 446 C GLU A 157 -14.324 -1.212 7.437 1.00 0.00 C ATOM 447 O GLU A 157 -15.146 -0.717 8.208 1.00 0.00 O ATOM 448 CB GLU A 157 -14.123 -3.195 8.954 1.00 0.00 C ATOM 449 CG GLU A 157 -14.732 -4.583 9.065 1.00 0.00 C ATOM 450 CD GLU A 157 -13.687 -5.664 9.259 1.00 0.00 C ATOM 451 OE1 GLU A 157 -13.054 -5.692 10.337 1.00 0.00 O ATOM 452 OE2 GLU A 157 -13.500 -6.483 8.335 1.00 0.00 O ATOM 0 H GLU A 157 -11.910 -2.920 7.723 1.00 0.00 H new ATOM 0 HA GLU A 157 -14.689 -3.241 6.878 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -13.139 -3.200 9.423 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -14.739 -2.491 9.514 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -15.430 -4.604 9.902 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -15.307 -4.796 8.164 1.00 0.00 H new ATOM 459 N ARG A 158 -13.688 -0.503 6.510 1.00 0.00 N ATOM 460 CA ARG A 158 -13.928 0.927 6.345 1.00 0.00 C ATOM 461 C ARG A 158 -13.487 1.395 4.961 1.00 0.00 C ATOM 462 O ARG A 158 -14.203 2.135 4.288 1.00 0.00 O ATOM 463 CB ARG A 158 -13.189 1.719 7.425 1.00 0.00 C ATOM 464 CG ARG A 158 -13.861 1.662 8.787 1.00 0.00 C ATOM 465 CD ARG A 158 -13.538 2.892 9.623 1.00 0.00 C ATOM 466 NE ARG A 158 -14.695 3.770 9.773 1.00 0.00 N ATOM 467 CZ ARG A 158 -15.686 3.549 10.635 1.00 0.00 C ATOM 468 NH1 ARG A 158 -15.664 2.482 11.423 1.00 0.00 N ATOM 469 NH2 ARG A 158 -16.702 4.399 10.707 1.00 0.00 N ATOM 0 H ARG A 158 -13.004 -0.894 5.862 1.00 0.00 H new ATOM 0 HA ARG A 158 -14.999 1.105 6.445 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -12.173 1.335 7.514 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -13.110 2.760 7.111 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -14.940 1.582 8.658 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -13.536 0.766 9.316 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -13.189 2.580 10.608 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -12.722 3.444 9.156 1.00 0.00 H new ATOM 0 HE ARG A 158 -14.747 4.601 9.183 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -14.885 1.825 11.371 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -16.426 2.318 12.081 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -16.724 5.220 10.103 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -17.462 4.231 11.367 1.00 0.00 H new ATOM 483 N GLY A 159 -12.303 0.956 4.545 1.00 0.00 N ATOM 484 CA GLY A 159 -11.786 1.338 3.244 1.00 0.00 C ATOM 485 C GLY A 159 -10.728 2.421 3.337 1.00 0.00 C ATOM 486 O GLY A 159 -10.851 3.472 2.705 1.00 0.00 O ATOM 0 H GLY A 159 -11.693 0.343 5.086 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -11.363 0.462 2.753 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -12.607 1.689 2.619 1.00 0.00 H new ATOM 490 N LYS A 160 -9.690 2.166 4.123 1.00 0.00 N ATOM 491 CA LYS A 160 -8.608 3.128 4.294 1.00 0.00 C ATOM 492 C LYS A 160 -7.249 2.437 4.273 1.00 0.00 C ATOM 493 O LYS A 160 -7.116 1.292 4.711 1.00 0.00 O ATOM 494 CB LYS A 160 -8.779 3.896 5.604 1.00 0.00 C ATOM 495 CG LYS A 160 -10.002 4.799 5.626 1.00 0.00 C ATOM 496 CD LYS A 160 -10.764 4.678 6.935 1.00 0.00 C ATOM 497 CE LYS A 160 -11.212 6.038 7.448 1.00 0.00 C ATOM 498 NZ LYS A 160 -11.214 6.098 8.936 1.00 0.00 N ATOM 0 H LYS A 160 -9.574 1.302 4.652 1.00 0.00 H new ATOM 0 HA LYS A 160 -8.651 3.829 3.460 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -8.849 3.184 6.426 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -7.889 4.500 5.780 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -9.693 5.834 5.478 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -10.660 4.541 4.796 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -11.634 4.037 6.793 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -10.132 4.197 7.682 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -10.551 6.810 7.055 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -12.213 6.255 7.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -11.960 6.748 9.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -11.393 5.149 9.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -10.290 6.439 9.271 1.00 0.00 H new ATOM 512 N VAL A 161 -6.244 3.139 3.763 1.00 0.00 N ATOM 513 CA VAL A 161 -4.891 2.598 3.687 1.00 0.00 C ATOM 514 C VAL A 161 -3.859 3.657 4.053 1.00 0.00 C ATOM 515 O VAL A 161 -3.727 4.671 3.366 1.00 0.00 O ATOM 516 CB VAL A 161 -4.579 2.059 2.278 1.00 0.00 C ATOM 517 CG1 VAL A 161 -5.459 0.862 1.952 1.00 0.00 C ATOM 518 CG2 VAL A 161 -4.751 3.155 1.237 1.00 0.00 C ATOM 0 H VAL A 161 -6.340 4.086 3.395 1.00 0.00 H new ATOM 0 HA VAL A 161 -4.837 1.776 4.401 1.00 0.00 H new ATOM 0 HB VAL A 161 -3.540 1.730 2.259 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -5.222 0.498 0.952 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -5.280 0.070 2.679 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -6.507 1.160 1.990 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -4.526 2.756 0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -5.779 3.518 1.257 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.071 3.978 1.459 1.00 0.00 H new ATOM 528 N LYS A 162 -3.131 3.419 5.139 1.00 0.00 N ATOM 529 CA LYS A 162 -2.112 4.357 5.593 1.00 0.00 C ATOM 530 C LYS A 162 -0.761 4.042 4.958 1.00 0.00 C ATOM 531 O LYS A 162 -0.209 2.959 5.156 1.00 0.00 O ATOM 532 CB LYS A 162 -1.996 4.318 7.118 1.00 0.00 C ATOM 533 CG LYS A 162 -1.116 5.418 7.689 1.00 0.00 C ATOM 534 CD LYS A 162 -1.004 5.313 9.201 1.00 0.00 C ATOM 535 CE LYS A 162 0.242 6.013 9.716 1.00 0.00 C ATOM 536 NZ LYS A 162 0.297 6.028 11.205 1.00 0.00 N ATOM 0 H LYS A 162 -3.228 2.586 5.720 1.00 0.00 H new ATOM 0 HA LYS A 162 -2.412 5.359 5.285 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -2.993 4.399 7.552 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -1.595 3.350 7.419 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -0.123 5.358 7.244 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -1.527 6.391 7.420 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -1.887 5.753 9.664 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -0.980 4.263 9.493 1.00 0.00 H new ATOM 0 HE2 LYS A 162 1.127 5.512 9.325 1.00 0.00 H new ATOM 0 HE3 LYS A 162 0.264 7.037 9.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 1.162 6.515 11.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -0.535 6.529 11.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 0.302 5.051 11.562 1.00 0.00 H new ATOM 550 N VAL A 163 -0.236 4.994 4.194 1.00 0.00 N ATOM 551 CA VAL A 163 1.048 4.816 3.529 1.00 0.00 C ATOM 552 C VAL A 163 1.967 6.008 3.779 1.00 0.00 C ATOM 553 O VAL A 163 1.502 7.137 3.944 1.00 0.00 O ATOM 554 CB VAL A 163 0.873 4.630 2.010 1.00 0.00 C ATOM 555 CG1 VAL A 163 0.115 3.344 1.712 1.00 0.00 C ATOM 556 CG2 VAL A 163 0.162 5.830 1.404 1.00 0.00 C ATOM 0 H VAL A 163 -0.680 5.896 4.021 1.00 0.00 H new ATOM 0 HA VAL A 163 1.499 3.917 3.949 1.00 0.00 H new ATOM 0 HB VAL A 163 1.861 4.555 1.556 1.00 0.00 H new ATOM 0 HG11 VAL A 163 0.001 3.230 0.634 1.00 0.00 H new ATOM 0 HG12 VAL A 163 0.669 2.494 2.110 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -0.869 3.385 2.178 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.047 5.681 0.330 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -0.821 5.940 1.862 1.00 0.00 H new ATOM 0 HG23 VAL A 163 0.749 6.730 1.585 1.00 0.00 H new ATOM 566 N MET A 164 3.271 5.752 3.804 1.00 0.00 N ATOM 567 CA MET A 164 4.250 6.808 4.032 1.00 0.00 C ATOM 568 C MET A 164 4.903 7.236 2.718 1.00 0.00 C ATOM 569 O MET A 164 5.698 6.498 2.135 1.00 0.00 O ATOM 570 CB MET A 164 5.314 6.343 5.037 1.00 0.00 C ATOM 571 CG MET A 164 6.329 5.369 4.464 1.00 0.00 C ATOM 572 SD MET A 164 7.194 4.434 5.740 1.00 0.00 S ATOM 573 CE MET A 164 8.867 4.454 5.100 1.00 0.00 C ATOM 0 H MET A 164 3.673 4.824 3.669 1.00 0.00 H new ATOM 0 HA MET A 164 3.732 7.671 4.450 1.00 0.00 H new ATOM 0 HB2 MET A 164 5.842 7.216 5.420 1.00 0.00 H new ATOM 0 HB3 MET A 164 4.816 5.874 5.885 1.00 0.00 H new ATOM 0 HG2 MET A 164 5.822 4.676 3.792 1.00 0.00 H new ATOM 0 HG3 MET A 164 7.056 5.918 3.866 1.00 0.00 H new ATOM 0 HE1 MET A 164 9.524 3.913 5.781 1.00 0.00 H new ATOM 0 HE2 MET A 164 8.888 3.976 4.121 1.00 0.00 H new ATOM 0 HE3 MET A 164 9.209 5.485 5.008 1.00 0.00 H new ATOM 583 N VAL A 165 4.559 8.433 2.253 1.00 0.00 N ATOM 584 CA VAL A 165 5.111 8.954 1.008 1.00 0.00 C ATOM 585 C VAL A 165 6.271 9.905 1.277 1.00 0.00 C ATOM 586 O VAL A 165 6.253 10.665 2.245 1.00 0.00 O ATOM 587 CB VAL A 165 4.038 9.688 0.181 1.00 0.00 C ATOM 588 CG1 VAL A 165 2.945 8.723 -0.250 1.00 0.00 C ATOM 589 CG2 VAL A 165 3.453 10.850 0.970 1.00 0.00 C ATOM 0 H VAL A 165 3.902 9.059 2.719 1.00 0.00 H new ATOM 0 HA VAL A 165 5.473 8.097 0.439 1.00 0.00 H new ATOM 0 HB VAL A 165 4.510 10.091 -0.715 1.00 0.00 H new ATOM 0 HG11 VAL A 165 2.196 9.259 -0.833 1.00 0.00 H new ATOM 0 HG12 VAL A 165 3.379 7.930 -0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 165 2.475 8.288 0.632 1.00 0.00 H new ATOM 0 HG21 VAL A 165 2.697 11.355 0.368 1.00 0.00 H new ATOM 0 HG22 VAL A 165 2.996 10.475 1.886 1.00 0.00 H new ATOM 0 HG23 VAL A 165 4.246 11.554 1.222 1.00 0.00 H new ATOM 599 N THR A 166 7.281 9.856 0.416 1.00 0.00 N ATOM 600 CA THR A 166 8.453 10.712 0.560 1.00 0.00 C ATOM 601 C THR A 166 8.279 12.011 -0.222 1.00 0.00 C ATOM 602 O THR A 166 8.637 12.092 -1.396 1.00 0.00 O ATOM 603 CB THR A 166 9.713 9.978 0.087 1.00 0.00 C ATOM 604 OG1 THR A 166 9.400 8.663 -0.337 1.00 0.00 O ATOM 605 CG2 THR A 166 10.780 9.874 1.153 1.00 0.00 C ATOM 0 H THR A 166 7.312 9.232 -0.390 1.00 0.00 H new ATOM 0 HA THR A 166 8.563 10.958 1.616 1.00 0.00 H new ATOM 0 HB THR A 166 10.102 10.576 -0.737 1.00 0.00 H new ATOM 0 HG1 THR A 166 10.217 8.213 -0.636 1.00 0.00 H new ATOM 0 HG21 THR A 166 11.644 9.344 0.752 1.00 0.00 H new ATOM 0 HG22 THR A 166 11.081 10.874 1.466 1.00 0.00 H new ATOM 0 HG23 THR A 166 10.386 9.329 2.011 1.00 0.00 H new ATOM 613 N ILE A 167 7.731 13.025 0.440 1.00 0.00 N ATOM 614 CA ILE A 167 7.513 14.320 -0.191 1.00 0.00 C ATOM 615 C ILE A 167 8.731 15.222 -0.013 1.00 0.00 C ATOM 616 O ILE A 167 9.235 15.385 1.097 1.00 0.00 O ATOM 617 CB ILE A 167 6.269 15.026 0.384 1.00 0.00 C ATOM 618 CG1 ILE A 167 5.981 16.315 -0.390 1.00 0.00 C ATOM 619 CG2 ILE A 167 6.456 15.319 1.865 1.00 0.00 C ATOM 620 CD1 ILE A 167 4.774 17.071 0.121 1.00 0.00 C ATOM 0 H ILE A 167 7.430 12.974 1.413 1.00 0.00 H new ATOM 0 HA ILE A 167 7.351 14.136 -1.253 1.00 0.00 H new ATOM 0 HB ILE A 167 5.413 14.360 0.274 1.00 0.00 H new ATOM 0 HG12 ILE A 167 6.855 16.964 -0.337 1.00 0.00 H new ATOM 0 HG13 ILE A 167 5.828 16.071 -1.441 1.00 0.00 H new ATOM 0 HG21 ILE A 167 5.567 15.817 2.252 1.00 0.00 H new ATOM 0 HG22 ILE A 167 6.612 14.384 2.404 1.00 0.00 H new ATOM 0 HG23 ILE A 167 7.323 15.965 2.001 1.00 0.00 H new ATOM 0 HD11 ILE A 167 4.631 17.973 -0.474 1.00 0.00 H new ATOM 0 HD12 ILE A 167 3.889 16.440 0.042 1.00 0.00 H new ATOM 0 HD13 ILE A 167 4.932 17.346 1.164 1.00 0.00 H new ATOM 632 N PHE A 168 9.200 15.800 -1.116 1.00 0.00 N ATOM 633 CA PHE A 168 10.362 16.683 -1.088 1.00 0.00 C ATOM 634 C PHE A 168 11.622 15.913 -0.705 1.00 0.00 C ATOM 635 O PHE A 168 12.488 15.662 -1.543 1.00 0.00 O ATOM 636 CB PHE A 168 10.136 17.841 -0.113 1.00 0.00 C ATOM 637 CG PHE A 168 9.005 18.746 -0.509 1.00 0.00 C ATOM 638 CD1 PHE A 168 8.943 19.285 -1.784 1.00 0.00 C ATOM 639 CD2 PHE A 168 8.001 19.059 0.395 1.00 0.00 C ATOM 640 CE1 PHE A 168 7.903 20.119 -2.152 1.00 0.00 C ATOM 641 CE2 PHE A 168 6.960 19.892 0.034 1.00 0.00 C ATOM 642 CZ PHE A 168 6.911 20.422 -1.241 1.00 0.00 C ATOM 0 H PHE A 168 8.792 15.672 -2.042 1.00 0.00 H new ATOM 0 HA PHE A 168 10.498 17.090 -2.090 1.00 0.00 H new ATOM 0 HB2 PHE A 168 9.937 17.436 0.879 1.00 0.00 H new ATOM 0 HB3 PHE A 168 11.052 18.428 -0.040 1.00 0.00 H new ATOM 0 HD1 PHE A 168 9.717 19.051 -2.500 1.00 0.00 H new ATOM 0 HD2 PHE A 168 8.033 18.647 1.393 1.00 0.00 H new ATOM 0 HE1 PHE A 168 7.867 20.532 -3.149 1.00 0.00 H new ATOM 0 HE2 PHE A 168 6.185 20.129 0.748 1.00 0.00 H new ATOM 0 HZ PHE A 168 6.097 21.073 -1.525 1.00 0.00 H new ATOM 652 N GLY A 169 11.720 15.538 0.567 1.00 0.00 N ATOM 653 CA GLY A 169 12.879 14.799 1.033 1.00 0.00 C ATOM 654 C GLY A 169 12.696 14.248 2.435 1.00 0.00 C ATOM 655 O GLY A 169 13.644 14.201 3.218 1.00 0.00 O ATOM 0 H GLY A 169 11.019 15.732 1.282 1.00 0.00 H new ATOM 0 HA2 GLY A 169 13.080 13.976 0.347 1.00 0.00 H new ATOM 0 HA3 GLY A 169 13.752 15.451 1.014 1.00 0.00 H new ATOM 659 N ARG A 170 11.475 13.829 2.754 1.00 0.00 N ATOM 660 CA ARG A 170 11.177 13.280 4.070 1.00 0.00 C ATOM 661 C ARG A 170 9.902 12.443 4.039 1.00 0.00 C ATOM 662 O ARG A 170 9.115 12.528 3.096 1.00 0.00 O ATOM 663 CB ARG A 170 11.035 14.406 5.096 1.00 0.00 C ATOM 664 CG ARG A 170 10.023 15.468 4.698 1.00 0.00 C ATOM 665 CD ARG A 170 10.477 16.857 5.119 1.00 0.00 C ATOM 666 NE ARG A 170 11.650 17.301 4.370 1.00 0.00 N ATOM 667 CZ ARG A 170 12.464 18.273 4.773 1.00 0.00 C ATOM 668 NH1 ARG A 170 12.236 18.907 5.917 1.00 0.00 N ATOM 669 NH2 ARG A 170 13.509 18.613 4.031 1.00 0.00 N ATOM 0 H ARG A 170 10.677 13.860 2.119 1.00 0.00 H new ATOM 0 HA ARG A 170 12.006 12.634 4.360 1.00 0.00 H new ATOM 0 HB2 ARG A 170 10.742 13.978 6.055 1.00 0.00 H new ATOM 0 HB3 ARG A 170 12.007 14.878 5.242 1.00 0.00 H new ATOM 0 HG2 ARG A 170 9.875 15.444 3.618 1.00 0.00 H new ATOM 0 HG3 ARG A 170 9.060 15.244 5.157 1.00 0.00 H new ATOM 0 HD2 ARG A 170 9.662 17.565 4.969 1.00 0.00 H new ATOM 0 HD3 ARG A 170 10.707 16.856 6.185 1.00 0.00 H new ATOM 0 HE ARG A 170 11.857 16.838 3.485 1.00 0.00 H new ATOM 0 HH11 ARG A 170 11.434 18.650 6.492 1.00 0.00 H new ATOM 0 HH12 ARG A 170 12.863 19.652 6.221 1.00 0.00 H new ATOM 0 HH21 ARG A 170 13.689 18.129 3.151 1.00 0.00 H new ATOM 0 HH22 ARG A 170 14.133 19.358 4.340 1.00 0.00 H new ATOM 683 N GLU A 171 9.704 11.635 5.077 1.00 0.00 N ATOM 684 CA GLU A 171 8.523 10.784 5.168 1.00 0.00 C ATOM 685 C GLU A 171 7.260 11.622 5.334 1.00 0.00 C ATOM 686 O GLU A 171 7.318 12.774 5.765 1.00 0.00 O ATOM 687 CB GLU A 171 8.660 9.809 6.339 1.00 0.00 C ATOM 688 CG GLU A 171 9.868 8.894 6.231 1.00 0.00 C ATOM 689 CD GLU A 171 10.228 8.246 7.554 1.00 0.00 C ATOM 690 OE1 GLU A 171 10.891 8.908 8.380 1.00 0.00 O ATOM 691 OE2 GLU A 171 9.846 7.075 7.765 1.00 0.00 O ATOM 0 H GLU A 171 10.346 11.552 5.866 1.00 0.00 H new ATOM 0 HA GLU A 171 8.442 10.218 4.240 1.00 0.00 H new ATOM 0 HB2 GLU A 171 8.726 10.376 7.267 1.00 0.00 H new ATOM 0 HB3 GLU A 171 7.758 9.200 6.401 1.00 0.00 H new ATOM 0 HG2 GLU A 171 9.666 8.117 5.493 1.00 0.00 H new ATOM 0 HG3 GLU A 171 10.721 9.466 5.867 1.00 0.00 H new ATOM 698 N THR A 172 6.116 11.037 4.989 1.00 0.00 N ATOM 699 CA THR A 172 4.839 11.731 5.100 1.00 0.00 C ATOM 700 C THR A 172 3.679 10.739 5.126 1.00 0.00 C ATOM 701 O THR A 172 3.034 10.500 4.104 1.00 0.00 O ATOM 702 CB THR A 172 4.665 12.709 3.937 1.00 0.00 C ATOM 703 OG1 THR A 172 5.923 13.187 3.493 1.00 0.00 O ATOM 704 CG2 THR A 172 3.814 13.910 4.286 1.00 0.00 C ATOM 0 H THR A 172 6.049 10.084 4.631 1.00 0.00 H new ATOM 0 HA THR A 172 4.836 12.287 6.037 1.00 0.00 H new ATOM 0 HB THR A 172 4.159 12.142 3.156 1.00 0.00 H new ATOM 0 HG1 THR A 172 6.377 12.486 2.980 1.00 0.00 H new ATOM 0 HG21 THR A 172 3.731 14.562 3.417 1.00 0.00 H new ATOM 0 HG22 THR A 172 2.820 13.577 4.586 1.00 0.00 H new ATOM 0 HG23 THR A 172 4.276 14.457 5.108 1.00 0.00 H new ATOM 712 N PRO A 173 3.397 10.145 6.298 1.00 0.00 N ATOM 713 CA PRO A 173 2.309 9.174 6.452 1.00 0.00 C ATOM 714 C PRO A 173 0.934 9.820 6.308 1.00 0.00 C ATOM 715 O PRO A 173 0.446 10.474 7.230 1.00 0.00 O ATOM 716 CB PRO A 173 2.503 8.640 7.872 1.00 0.00 C ATOM 717 CG PRO A 173 3.231 9.723 8.590 1.00 0.00 C ATOM 718 CD PRO A 173 4.117 10.374 7.566 1.00 0.00 C ATOM 0 HA PRO A 173 2.343 8.400 5.685 1.00 0.00 H new ATOM 0 HB2 PRO A 173 1.546 8.424 8.347 1.00 0.00 H new ATOM 0 HB3 PRO A 173 3.075 7.712 7.871 1.00 0.00 H new ATOM 0 HG2 PRO A 173 2.535 10.444 9.019 1.00 0.00 H new ATOM 0 HG3 PRO A 173 3.819 9.319 9.414 1.00 0.00 H new ATOM 0 HD2 PRO A 173 4.250 11.437 7.767 1.00 0.00 H new ATOM 0 HD3 PRO A 173 5.111 9.926 7.551 1.00 0.00 H new ATOM 726 N VAL A 174 0.315 9.629 5.147 1.00 0.00 N ATOM 727 CA VAL A 174 -1.005 10.192 4.884 1.00 0.00 C ATOM 728 C VAL A 174 -2.048 9.093 4.717 1.00 0.00 C ATOM 729 O VAL A 174 -1.809 8.093 4.042 1.00 0.00 O ATOM 730 CB VAL A 174 -1.000 11.071 3.618 1.00 0.00 C ATOM 731 CG1 VAL A 174 -0.159 12.319 3.835 1.00 0.00 C ATOM 732 CG2 VAL A 174 -0.496 10.281 2.420 1.00 0.00 C ATOM 0 H VAL A 174 0.706 9.090 4.374 1.00 0.00 H new ATOM 0 HA VAL A 174 -1.262 10.808 5.746 1.00 0.00 H new ATOM 0 HB VAL A 174 -2.024 11.383 3.413 1.00 0.00 H new ATOM 0 HG11 VAL A 174 -0.168 12.926 2.930 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -0.571 12.896 4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 174 0.866 12.031 4.068 1.00 0.00 H new ATOM 0 HG21 VAL A 174 -0.500 10.919 1.536 1.00 0.00 H new ATOM 0 HG22 VAL A 174 0.519 9.935 2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 174 -1.146 9.422 2.251 1.00 0.00 H new ATOM 742 N GLU A 175 -3.208 9.287 5.337 1.00 0.00 N ATOM 743 CA GLU A 175 -4.289 8.313 5.254 1.00 0.00 C ATOM 744 C GLU A 175 -5.050 8.464 3.941 1.00 0.00 C ATOM 745 O GLU A 175 -5.773 9.440 3.740 1.00 0.00 O ATOM 746 CB GLU A 175 -5.248 8.476 6.435 1.00 0.00 C ATOM 747 CG GLU A 175 -5.694 9.910 6.663 1.00 0.00 C ATOM 748 CD GLU A 175 -4.907 10.599 7.762 1.00 0.00 C ATOM 749 OE1 GLU A 175 -4.435 9.898 8.681 1.00 0.00 O ATOM 750 OE2 GLU A 175 -4.763 11.837 7.703 1.00 0.00 O ATOM 0 H GLU A 175 -3.423 10.109 5.902 1.00 0.00 H new ATOM 0 HA GLU A 175 -3.851 7.316 5.291 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -6.127 7.853 6.267 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -4.764 8.107 7.339 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -5.584 10.472 5.736 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -6.754 9.921 6.919 1.00 0.00 H new ATOM 757 N LEU A 176 -4.875 7.496 3.048 1.00 0.00 N ATOM 758 CA LEU A 176 -5.537 7.522 1.749 1.00 0.00 C ATOM 759 C LEU A 176 -6.347 6.260 1.522 1.00 0.00 C ATOM 760 O LEU A 176 -6.688 5.541 2.461 1.00 0.00 O ATOM 761 CB LEU A 176 -4.513 7.630 0.619 1.00 0.00 C ATOM 762 CG LEU A 176 -3.155 8.220 1.008 1.00 0.00 C ATOM 763 CD1 LEU A 176 -2.107 7.883 -0.043 1.00 0.00 C ATOM 764 CD2 LEU A 176 -3.262 9.726 1.194 1.00 0.00 C ATOM 0 H LEU A 176 -4.279 6.682 3.200 1.00 0.00 H new ATOM 0 HA LEU A 176 -6.195 8.391 1.747 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -4.351 6.635 0.204 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -4.940 8.241 -0.176 1.00 0.00 H new ATOM 0 HG LEU A 176 -2.845 7.779 1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -1.148 8.310 0.250 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -2.011 6.800 -0.128 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -2.410 8.297 -1.005 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -2.287 10.129 1.470 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -3.593 10.185 0.263 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -3.982 9.945 1.983 1.00 0.00 H new ATOM 776 N ASP A 177 -6.618 5.985 0.251 1.00 0.00 N ATOM 777 CA ASP A 177 -7.345 4.800 -0.130 1.00 0.00 C ATOM 778 C ASP A 177 -6.843 4.285 -1.471 1.00 0.00 C ATOM 779 O ASP A 177 -6.287 5.039 -2.268 1.00 0.00 O ATOM 780 CB ASP A 177 -8.850 5.076 -0.193 1.00 0.00 C ATOM 781 CG ASP A 177 -9.331 5.949 0.950 1.00 0.00 C ATOM 782 OD1 ASP A 177 -9.156 5.547 2.120 1.00 0.00 O ATOM 783 OD2 ASP A 177 -9.883 7.036 0.677 1.00 0.00 O ATOM 0 H ASP A 177 -6.339 6.577 -0.531 1.00 0.00 H new ATOM 0 HA ASP A 177 -7.174 4.035 0.628 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -9.087 5.560 -1.140 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -9.390 4.130 -0.175 1.00 0.00 H new ATOM 788 N PHE A 178 -7.034 2.994 -1.705 1.00 0.00 N ATOM 789 CA PHE A 178 -6.597 2.353 -2.948 1.00 0.00 C ATOM 790 C PHE A 178 -6.914 3.217 -4.169 1.00 0.00 C ATOM 791 O PHE A 178 -6.197 3.179 -5.170 1.00 0.00 O ATOM 792 CB PHE A 178 -7.263 0.984 -3.105 1.00 0.00 C ATOM 793 CG PHE A 178 -7.286 0.168 -1.843 1.00 0.00 C ATOM 794 CD1 PHE A 178 -6.166 -0.539 -1.438 1.00 0.00 C ATOM 795 CD2 PHE A 178 -8.431 0.105 -1.065 1.00 0.00 C ATOM 796 CE1 PHE A 178 -6.186 -1.291 -0.279 1.00 0.00 C ATOM 797 CE2 PHE A 178 -8.458 -0.645 0.095 1.00 0.00 C ATOM 798 CZ PHE A 178 -7.334 -1.345 0.488 1.00 0.00 C ATOM 0 H PHE A 178 -7.492 2.362 -1.048 1.00 0.00 H new ATOM 0 HA PHE A 178 -5.516 2.229 -2.887 1.00 0.00 H new ATOM 0 HB2 PHE A 178 -8.286 1.127 -3.452 1.00 0.00 H new ATOM 0 HB3 PHE A 178 -6.739 0.423 -3.879 1.00 0.00 H new ATOM 0 HD1 PHE A 178 -5.267 -0.502 -2.035 1.00 0.00 H new ATOM 0 HD2 PHE A 178 -9.313 0.649 -1.369 1.00 0.00 H new ATOM 0 HE1 PHE A 178 -5.305 -1.836 0.027 1.00 0.00 H new ATOM 0 HE2 PHE A 178 -9.356 -0.684 0.693 1.00 0.00 H new ATOM 0 HZ PHE A 178 -7.352 -1.934 1.393 1.00 0.00 H new ATOM 808 N SER A 179 -7.992 3.988 -4.084 1.00 0.00 N ATOM 809 CA SER A 179 -8.405 4.852 -5.185 1.00 0.00 C ATOM 810 C SER A 179 -7.389 5.965 -5.428 1.00 0.00 C ATOM 811 O SER A 179 -7.230 6.437 -6.555 1.00 0.00 O ATOM 812 CB SER A 179 -9.779 5.457 -4.898 1.00 0.00 C ATOM 813 OG SER A 179 -10.629 4.517 -4.262 1.00 0.00 O ATOM 0 H SER A 179 -8.597 4.033 -3.264 1.00 0.00 H new ATOM 0 HA SER A 179 -8.462 4.240 -6.085 1.00 0.00 H new ATOM 0 HB2 SER A 179 -9.667 6.337 -4.265 1.00 0.00 H new ATOM 0 HB3 SER A 179 -10.234 5.791 -5.830 1.00 0.00 H new ATOM 0 HG SER A 179 -11.501 4.930 -4.088 1.00 0.00 H new ATOM 819 N GLN A 180 -6.707 6.387 -4.368 1.00 0.00 N ATOM 820 CA GLN A 180 -5.714 7.451 -4.473 1.00 0.00 C ATOM 821 C GLN A 180 -4.291 6.893 -4.472 1.00 0.00 C ATOM 822 O GLN A 180 -3.337 7.610 -4.169 1.00 0.00 O ATOM 823 CB GLN A 180 -5.881 8.445 -3.321 1.00 0.00 C ATOM 824 CG GLN A 180 -7.295 8.985 -3.184 1.00 0.00 C ATOM 825 CD GLN A 180 -7.588 10.108 -4.160 1.00 0.00 C ATOM 826 OE1 GLN A 180 -7.153 11.242 -3.966 1.00 0.00 O ATOM 827 NE2 GLN A 180 -8.331 9.796 -5.215 1.00 0.00 N ATOM 0 H GLN A 180 -6.823 6.009 -3.428 1.00 0.00 H new ATOM 0 HA GLN A 180 -5.877 7.962 -5.422 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -5.595 7.959 -2.388 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -5.195 9.279 -3.469 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -8.006 8.175 -3.344 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -7.445 9.345 -2.166 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -8.670 8.842 -5.335 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -8.562 10.511 -5.905 1.00 0.00 H new ATOM 836 N VAL A 181 -4.152 5.618 -4.822 1.00 0.00 N ATOM 837 CA VAL A 181 -2.839 4.981 -4.863 1.00 0.00 C ATOM 838 C VAL A 181 -2.844 3.771 -5.790 1.00 0.00 C ATOM 839 O VAL A 181 -3.810 3.007 -5.829 1.00 0.00 O ATOM 840 CB VAL A 181 -2.385 4.536 -3.461 1.00 0.00 C ATOM 841 CG1 VAL A 181 -2.127 5.744 -2.573 1.00 0.00 C ATOM 842 CG2 VAL A 181 -3.417 3.614 -2.831 1.00 0.00 C ATOM 0 H VAL A 181 -4.928 5.008 -5.080 1.00 0.00 H new ATOM 0 HA VAL A 181 -2.139 5.725 -5.244 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.451 3.982 -3.562 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -1.807 5.409 -1.586 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -1.346 6.362 -3.017 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -3.042 6.328 -2.478 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -3.077 3.311 -1.841 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -4.368 4.139 -2.743 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -3.546 2.731 -3.457 1.00 0.00 H new ATOM 852 N VAL A 182 -1.758 3.601 -6.538 1.00 0.00 N ATOM 853 CA VAL A 182 -1.636 2.482 -7.467 1.00 0.00 C ATOM 854 C VAL A 182 -0.483 1.565 -7.075 1.00 0.00 C ATOM 855 O VAL A 182 0.538 2.019 -6.561 1.00 0.00 O ATOM 856 CB VAL A 182 -1.418 2.971 -8.910 1.00 0.00 C ATOM 857 CG1 VAL A 182 -2.642 3.720 -9.413 1.00 0.00 C ATOM 858 CG2 VAL A 182 -0.176 3.845 -8.995 1.00 0.00 C ATOM 0 H VAL A 182 -0.950 4.223 -6.519 1.00 0.00 H new ATOM 0 HA VAL A 182 -2.573 1.927 -7.417 1.00 0.00 H new ATOM 0 HB VAL A 182 -1.267 2.101 -9.549 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.468 4.057 -10.435 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -3.508 3.058 -9.392 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -2.829 4.582 -8.773 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.038 4.182 -10.022 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -0.295 4.710 -8.343 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.695 3.270 -8.681 1.00 0.00 H new ATOM 868 N LYS A 183 -0.653 0.270 -7.324 1.00 0.00 N ATOM 869 CA LYS A 183 0.374 -0.712 -6.998 1.00 0.00 C ATOM 870 C LYS A 183 1.426 -0.785 -8.101 1.00 0.00 C ATOM 871 O LYS A 183 1.098 -0.949 -9.275 1.00 0.00 O ATOM 872 CB LYS A 183 -0.258 -2.089 -6.786 1.00 0.00 C ATOM 873 CG LYS A 183 0.691 -3.105 -6.169 1.00 0.00 C ATOM 874 CD LYS A 183 -0.065 -4.266 -5.541 1.00 0.00 C ATOM 875 CE LYS A 183 0.321 -4.459 -4.082 1.00 0.00 C ATOM 876 NZ LYS A 183 1.342 -5.529 -3.914 1.00 0.00 N ATOM 0 H LYS A 183 -1.492 -0.123 -7.750 1.00 0.00 H new ATOM 0 HA LYS A 183 0.863 -0.399 -6.076 1.00 0.00 H new ATOM 0 HB2 LYS A 183 -1.132 -1.983 -6.143 1.00 0.00 H new ATOM 0 HB3 LYS A 183 -0.611 -2.469 -7.745 1.00 0.00 H new ATOM 0 HG2 LYS A 183 1.369 -3.483 -6.935 1.00 0.00 H new ATOM 0 HG3 LYS A 183 1.305 -2.618 -5.412 1.00 0.00 H new ATOM 0 HD2 LYS A 183 -1.137 -4.085 -5.614 1.00 0.00 H new ATOM 0 HD3 LYS A 183 0.143 -5.180 -6.097 1.00 0.00 H new ATOM 0 HE2 LYS A 183 0.708 -3.522 -3.682 1.00 0.00 H new ATOM 0 HE3 LYS A 183 -0.567 -4.710 -3.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 1.110 -6.102 -3.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 1.350 -6.136 -4.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 2.280 -5.097 -3.789 1.00 0.00 H new ATOM 890 N ALA A 184 2.690 -0.666 -7.713 1.00 0.00 N ATOM 891 CA ALA A 184 3.791 -0.719 -8.668 1.00 0.00 C ATOM 892 C ALA A 184 4.947 -1.555 -8.128 1.00 0.00 C ATOM 893 O ALA A 184 5.107 -1.613 -6.891 1.00 0.00 O ATOM 894 CB ALA A 184 4.266 0.687 -9.004 1.00 0.00 C ATOM 895 OXT ALA A 184 5.681 -2.146 -8.947 1.00 0.00 O ATOM 0 H ALA A 184 2.978 -0.532 -6.744 1.00 0.00 H new ATOM 0 HA ALA A 184 3.427 -1.195 -9.578 1.00 0.00 H new ATOM 0 HB1 ALA A 184 5.088 0.632 -9.718 1.00 0.00 H new ATOM 0 HB2 ALA A 184 3.444 1.254 -9.440 1.00 0.00 H new ATOM 0 HB3 ALA A 184 4.607 1.183 -8.095 1.00 0.00 H new TER 901 ALA A 184