USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=11 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 -110:sc= -0.834 USER MOD Set 1.2: A 164 MET CE :methyl -113:sc= -0.893 (180deg=-0.096) USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 136 GLN : amide:sc= -0.0676 X(o=-0.068,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot 95:sc= 1.04 USER MOD Single : A 155 ASN : amide:sc= -0.814 K(o=-0.81,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0632) USER MOD Single : A 162 LYS NZ :NH3+ -156:sc= -1.34 (180deg=-1.45) USER MOD Single : A 166 THR OG1 : rot 25:sc= 1.01 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 179 SER OG : rot -23:sc= 0.656 USER MOD Single : A 180 GLN : amide:sc= -0.0574 X(o=-0.057,f=0) USER MOD Single : A 183 LYS NZ :NH3+ 146:sc= -0.118 (180deg=-0.496) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 127 -6.520 -17.784 1.002 1.00 0.00 N ATOM 2 CA ALA A 127 -6.272 -18.387 -0.334 1.00 0.00 C ATOM 3 C ALA A 127 -5.561 -17.401 -1.256 1.00 0.00 C ATOM 4 O ALA A 127 -6.192 -16.533 -1.856 1.00 0.00 O ATOM 5 CB ALA A 127 -7.583 -18.841 -0.957 1.00 0.00 C ATOM 0 HA ALA A 127 -5.624 -19.254 -0.201 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -7.388 -19.281 -1.935 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -8.054 -19.583 -0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.248 -17.985 -1.070 1.00 0.00 H new ATOM 13 N GLN A 128 -4.245 -17.545 -1.362 1.00 0.00 N ATOM 14 CA GLN A 128 -3.447 -16.669 -2.213 1.00 0.00 C ATOM 15 C GLN A 128 -3.560 -15.218 -1.754 1.00 0.00 C ATOM 16 O GLN A 128 -4.548 -14.541 -2.036 1.00 0.00 O ATOM 17 CB GLN A 128 -3.893 -16.795 -3.671 1.00 0.00 C ATOM 18 CG GLN A 128 -2.749 -17.060 -4.636 1.00 0.00 C ATOM 19 CD GLN A 128 -2.444 -18.539 -4.786 1.00 0.00 C ATOM 20 OE1 GLN A 128 -2.670 -19.327 -3.868 1.00 0.00 O ATOM 21 NE2 GLN A 128 -1.929 -18.921 -5.949 1.00 0.00 N ATOM 0 H GLN A 128 -3.708 -18.259 -0.870 1.00 0.00 H new ATOM 0 HA GLN A 128 -2.404 -16.975 -2.134 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -4.620 -17.603 -3.751 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -4.402 -15.878 -3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -2.998 -16.643 -5.612 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -1.856 -16.542 -4.286 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -1.758 -18.232 -6.682 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -1.704 -19.903 -6.109 1.00 0.00 H new ATOM 30 N VAL A 129 -2.541 -14.746 -1.043 1.00 0.00 N ATOM 31 CA VAL A 129 -2.525 -13.375 -0.546 1.00 0.00 C ATOM 32 C VAL A 129 -2.114 -12.398 -1.639 1.00 0.00 C ATOM 33 O VAL A 129 -0.929 -12.125 -1.831 1.00 0.00 O ATOM 34 CB VAL A 129 -1.567 -13.222 0.650 1.00 0.00 C ATOM 35 CG1 VAL A 129 -2.150 -13.882 1.891 1.00 0.00 C ATOM 36 CG2 VAL A 129 -0.200 -13.805 0.321 1.00 0.00 C ATOM 0 H VAL A 129 -1.716 -15.293 -0.798 1.00 0.00 H new ATOM 0 HA VAL A 129 -3.540 -13.146 -0.221 1.00 0.00 H new ATOM 0 HB VAL A 129 -1.443 -12.159 0.856 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -1.459 -13.763 2.725 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -3.102 -13.413 2.139 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -2.308 -14.943 1.699 1.00 0.00 H new ATOM 0 HG21 VAL A 129 0.462 -13.687 1.179 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -0.303 -14.864 0.085 1.00 0.00 H new ATOM 0 HG23 VAL A 129 0.222 -13.282 -0.537 1.00 0.00 H new ATOM 46 N ALA A 130 -3.102 -11.872 -2.357 1.00 0.00 N ATOM 47 CA ALA A 130 -2.843 -10.922 -3.432 1.00 0.00 C ATOM 48 C ALA A 130 -2.170 -9.661 -2.901 1.00 0.00 C ATOM 49 O ALA A 130 -1.239 -9.137 -3.513 1.00 0.00 O ATOM 50 CB ALA A 130 -4.139 -10.572 -4.149 1.00 0.00 C ATOM 0 H ALA A 130 -4.088 -12.088 -2.213 1.00 0.00 H new ATOM 0 HA ALA A 130 -2.163 -11.391 -4.143 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.932 -9.862 -4.949 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.577 -11.477 -4.571 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.838 -10.127 -3.441 1.00 0.00 H new ATOM 56 N PHE A 131 -2.647 -9.177 -1.759 1.00 0.00 N ATOM 57 CA PHE A 131 -2.092 -7.976 -1.145 1.00 0.00 C ATOM 58 C PHE A 131 -1.643 -8.254 0.286 1.00 0.00 C ATOM 59 O PHE A 131 -2.141 -9.173 0.937 1.00 0.00 O ATOM 60 CB PHE A 131 -3.124 -6.848 -1.158 1.00 0.00 C ATOM 61 CG PHE A 131 -2.610 -5.556 -0.588 1.00 0.00 C ATOM 62 CD1 PHE A 131 -1.480 -4.951 -1.117 1.00 0.00 C ATOM 63 CD2 PHE A 131 -3.254 -4.948 0.477 1.00 0.00 C ATOM 64 CE1 PHE A 131 -1.005 -3.763 -0.595 1.00 0.00 C ATOM 65 CE2 PHE A 131 -2.784 -3.761 1.004 1.00 0.00 C ATOM 66 CZ PHE A 131 -1.657 -3.168 0.467 1.00 0.00 C ATOM 0 H PHE A 131 -3.417 -9.598 -1.240 1.00 0.00 H new ATOM 0 HA PHE A 131 -1.222 -7.670 -1.726 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -3.451 -6.678 -2.184 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -4.001 -7.162 -0.591 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -0.965 -5.413 -1.946 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -4.135 -5.408 0.901 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -0.125 -3.300 -1.017 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -3.296 -3.297 1.834 1.00 0.00 H new ATOM 0 HZ PHE A 131 -1.287 -2.240 0.878 1.00 0.00 H new ATOM 76 N ARG A 132 -0.697 -7.454 0.770 1.00 0.00 N ATOM 77 CA ARG A 132 -0.181 -7.614 2.124 1.00 0.00 C ATOM 78 C ARG A 132 0.393 -6.300 2.645 1.00 0.00 C ATOM 79 O ARG A 132 0.906 -5.486 1.876 1.00 0.00 O ATOM 80 CB ARG A 132 0.896 -8.701 2.156 1.00 0.00 C ATOM 81 CG ARG A 132 1.366 -9.052 3.559 1.00 0.00 C ATOM 82 CD ARG A 132 1.763 -10.515 3.664 1.00 0.00 C ATOM 83 NE ARG A 132 1.641 -11.019 5.030 1.00 0.00 N ATOM 84 CZ ARG A 132 0.485 -11.357 5.596 1.00 0.00 C ATOM 85 NH1 ARG A 132 -0.651 -11.247 4.917 1.00 0.00 N ATOM 86 NH2 ARG A 132 0.462 -11.805 6.843 1.00 0.00 N ATOM 0 H ARG A 132 -0.273 -6.689 0.244 1.00 0.00 H new ATOM 0 HA ARG A 132 -1.008 -7.911 2.769 1.00 0.00 H new ATOM 0 HB2 ARG A 132 0.508 -9.600 1.677 1.00 0.00 H new ATOM 0 HB3 ARG A 132 1.752 -8.370 1.567 1.00 0.00 H new ATOM 0 HG2 ARG A 132 2.215 -8.423 3.827 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.572 -8.837 4.274 1.00 0.00 H new ATOM 0 HD2 ARG A 132 1.135 -11.110 3.001 1.00 0.00 H new ATOM 0 HD3 ARG A 132 2.791 -10.637 3.323 1.00 0.00 H new ATOM 0 HE ARG A 132 2.493 -11.118 5.583 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -0.640 -10.902 3.957 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -1.534 -11.507 5.355 1.00 0.00 H new ATOM 0 HH21 ARG A 132 1.331 -11.891 7.370 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -0.425 -12.064 7.276 1.00 0.00 H new ATOM 100 N GLU A 133 0.303 -6.099 3.955 1.00 0.00 N ATOM 101 CA GLU A 133 0.812 -4.884 4.579 1.00 0.00 C ATOM 102 C GLU A 133 2.317 -4.752 4.365 1.00 0.00 C ATOM 103 O GLU A 133 3.055 -5.732 4.462 1.00 0.00 O ATOM 104 CB GLU A 133 0.498 -4.883 6.077 1.00 0.00 C ATOM 105 CG GLU A 133 1.176 -6.006 6.842 1.00 0.00 C ATOM 106 CD GLU A 133 0.861 -5.973 8.326 1.00 0.00 C ATOM 107 OE1 GLU A 133 -0.141 -6.597 8.732 1.00 0.00 O ATOM 108 OE2 GLU A 133 1.617 -5.325 9.078 1.00 0.00 O ATOM 0 H GLU A 133 -0.118 -6.762 4.605 1.00 0.00 H new ATOM 0 HA GLU A 133 0.319 -4.032 4.111 1.00 0.00 H new ATOM 0 HB2 GLU A 133 0.805 -3.928 6.503 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -0.581 -4.961 6.214 1.00 0.00 H new ATOM 0 HG2 GLU A 133 0.861 -6.964 6.429 1.00 0.00 H new ATOM 0 HG3 GLU A 133 2.255 -5.937 6.701 1.00 0.00 H new ATOM 115 N GLY A 134 2.764 -3.536 4.072 1.00 0.00 N ATOM 116 CA GLY A 134 4.177 -3.300 3.847 1.00 0.00 C ATOM 117 C GLY A 134 4.499 -3.020 2.390 1.00 0.00 C ATOM 118 O GLY A 134 5.521 -2.408 2.081 1.00 0.00 O ATOM 0 H GLY A 134 2.173 -2.709 3.986 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.502 -2.456 4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 134 4.744 -4.169 4.180 1.00 0.00 H new ATOM 122 N ASP A 135 3.626 -3.470 1.493 1.00 0.00 N ATOM 123 CA ASP A 135 3.823 -3.265 0.063 1.00 0.00 C ATOM 124 C ASP A 135 3.959 -1.779 -0.262 1.00 0.00 C ATOM 125 O ASP A 135 3.633 -0.922 0.558 1.00 0.00 O ATOM 126 CB ASP A 135 2.658 -3.868 -0.724 1.00 0.00 C ATOM 127 CG ASP A 135 2.999 -5.221 -1.315 1.00 0.00 C ATOM 128 OD1 ASP A 135 4.185 -5.447 -1.637 1.00 0.00 O ATOM 129 OD2 ASP A 135 2.081 -6.058 -1.456 1.00 0.00 O ATOM 0 H ASP A 135 2.775 -3.979 1.732 1.00 0.00 H new ATOM 0 HA ASP A 135 4.747 -3.766 -0.227 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.793 -3.969 -0.068 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.373 -3.186 -1.525 1.00 0.00 H new ATOM 134 N GLN A 136 4.444 -1.486 -1.465 1.00 0.00 N ATOM 135 CA GLN A 136 4.625 -0.104 -1.899 1.00 0.00 C ATOM 136 C GLN A 136 3.587 0.276 -2.951 1.00 0.00 C ATOM 137 O GLN A 136 3.210 -0.541 -3.791 1.00 0.00 O ATOM 138 CB GLN A 136 6.034 0.095 -2.461 1.00 0.00 C ATOM 139 CG GLN A 136 6.340 -0.785 -3.661 1.00 0.00 C ATOM 140 CD GLN A 136 7.702 -1.445 -3.568 1.00 0.00 C ATOM 141 OE1 GLN A 136 8.575 -1.215 -4.405 1.00 0.00 O ATOM 142 NE2 GLN A 136 7.892 -2.270 -2.544 1.00 0.00 N ATOM 0 H GLN A 136 4.718 -2.185 -2.155 1.00 0.00 H new ATOM 0 HA GLN A 136 4.492 0.544 -1.032 1.00 0.00 H new ATOM 0 HB2 GLN A 136 6.158 1.140 -2.746 1.00 0.00 H new ATOM 0 HB3 GLN A 136 6.762 -0.110 -1.676 1.00 0.00 H new ATOM 0 HG2 GLN A 136 5.573 -1.554 -3.748 1.00 0.00 H new ATOM 0 HG3 GLN A 136 6.293 -0.184 -4.569 1.00 0.00 H new ATOM 0 HE21 GLN A 136 7.141 -2.432 -1.873 1.00 0.00 H new ATOM 0 HE22 GLN A 136 8.789 -2.741 -2.429 1.00 0.00 H new ATOM 151 N VAL A 137 3.129 1.523 -2.896 1.00 0.00 N ATOM 152 CA VAL A 137 2.135 2.015 -3.842 1.00 0.00 C ATOM 153 C VAL A 137 2.446 3.444 -4.274 1.00 0.00 C ATOM 154 O VAL A 137 2.910 4.256 -3.474 1.00 0.00 O ATOM 155 CB VAL A 137 0.718 1.974 -3.238 1.00 0.00 C ATOM 156 CG1 VAL A 137 0.276 0.536 -3.003 1.00 0.00 C ATOM 157 CG2 VAL A 137 0.666 2.777 -1.947 1.00 0.00 C ATOM 0 H VAL A 137 3.431 2.211 -2.206 1.00 0.00 H new ATOM 0 HA VAL A 137 2.174 1.358 -4.711 1.00 0.00 H new ATOM 0 HB VAL A 137 0.026 2.427 -3.948 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.727 0.529 -2.576 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.271 -0.003 -3.951 1.00 0.00 H new ATOM 0 HG13 VAL A 137 0.967 0.051 -2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.342 2.737 -1.534 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.369 2.356 -1.228 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.933 3.814 -2.152 1.00 0.00 H new ATOM 167 N ARG A 138 2.188 3.747 -5.543 1.00 0.00 N ATOM 168 CA ARG A 138 2.442 5.080 -6.072 1.00 0.00 C ATOM 169 C ARG A 138 1.214 5.971 -5.918 1.00 0.00 C ATOM 170 O ARG A 138 0.113 5.493 -5.650 1.00 0.00 O ATOM 171 CB ARG A 138 2.852 5.006 -7.547 1.00 0.00 C ATOM 172 CG ARG A 138 4.126 5.778 -7.864 1.00 0.00 C ATOM 173 CD ARG A 138 5.127 4.925 -8.632 1.00 0.00 C ATOM 174 NE ARG A 138 5.419 5.480 -9.951 1.00 0.00 N ATOM 175 CZ ARG A 138 6.279 6.475 -10.163 1.00 0.00 C ATOM 176 NH1 ARG A 138 6.932 7.025 -9.145 1.00 0.00 N ATOM 177 NH2 ARG A 138 6.486 6.920 -11.393 1.00 0.00 N ATOM 0 H ARG A 138 1.804 3.089 -6.221 1.00 0.00 H new ATOM 0 HA ARG A 138 3.261 5.516 -5.499 1.00 0.00 H new ATOM 0 HB2 ARG A 138 2.991 3.961 -7.825 1.00 0.00 H new ATOM 0 HB3 ARG A 138 2.039 5.394 -8.161 1.00 0.00 H new ATOM 0 HG2 ARG A 138 3.878 6.664 -8.449 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.581 6.126 -6.936 1.00 0.00 H new ATOM 0 HD2 ARG A 138 6.051 4.846 -8.059 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.733 3.915 -8.743 1.00 0.00 H new ATOM 0 HE ARG A 138 4.936 5.083 -10.757 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.776 6.686 -8.196 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.589 7.787 -9.313 1.00 0.00 H new ATOM 0 HH21 ARG A 138 5.987 6.501 -12.178 1.00 0.00 H new ATOM 0 HH22 ARG A 138 7.144 7.682 -11.556 1.00 0.00 H new ATOM 191 N VAL A 139 1.418 7.271 -6.088 1.00 0.00 N ATOM 192 CA VAL A 139 0.339 8.245 -5.970 1.00 0.00 C ATOM 193 C VAL A 139 -0.495 8.294 -7.248 1.00 0.00 C ATOM 194 O VAL A 139 -0.116 7.720 -8.270 1.00 0.00 O ATOM 195 CB VAL A 139 0.896 9.652 -5.679 1.00 0.00 C ATOM 196 CG1 VAL A 139 -0.204 10.579 -5.185 1.00 0.00 C ATOM 197 CG2 VAL A 139 2.038 9.586 -4.673 1.00 0.00 C ATOM 0 H VAL A 139 2.327 7.678 -6.309 1.00 0.00 H new ATOM 0 HA VAL A 139 -0.293 7.929 -5.140 1.00 0.00 H new ATOM 0 HB VAL A 139 1.288 10.058 -6.611 1.00 0.00 H new ATOM 0 HG11 VAL A 139 0.214 11.566 -4.986 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -0.980 10.660 -5.946 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -0.635 10.176 -4.268 1.00 0.00 H new ATOM 0 HG21 VAL A 139 2.415 10.591 -4.484 1.00 0.00 H new ATOM 0 HG22 VAL A 139 1.677 9.152 -3.741 1.00 0.00 H new ATOM 0 HG23 VAL A 139 2.841 8.967 -5.074 1.00 0.00 H new ATOM 207 N VAL A 140 -1.634 8.982 -7.189 1.00 0.00 N ATOM 208 CA VAL A 140 -2.516 9.099 -8.347 1.00 0.00 C ATOM 209 C VAL A 140 -2.018 10.164 -9.321 1.00 0.00 C ATOM 210 O VAL A 140 -1.536 9.845 -10.409 1.00 0.00 O ATOM 211 CB VAL A 140 -3.974 9.427 -7.948 1.00 0.00 C ATOM 212 CG1 VAL A 140 -4.761 8.146 -7.721 1.00 0.00 C ATOM 213 CG2 VAL A 140 -4.037 10.324 -6.713 1.00 0.00 C ATOM 0 H VAL A 140 -1.966 9.465 -6.354 1.00 0.00 H new ATOM 0 HA VAL A 140 -2.501 8.123 -8.833 1.00 0.00 H new ATOM 0 HB VAL A 140 -4.426 9.978 -8.773 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.785 8.393 -7.441 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -4.768 7.556 -8.637 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -4.295 7.570 -6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.078 10.531 -6.466 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -3.558 9.821 -5.873 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -3.520 11.261 -6.917 1.00 0.00 H new ATOM 223 N SER A 141 -2.141 11.425 -8.927 1.00 0.00 N ATOM 224 CA SER A 141 -1.708 12.535 -9.771 1.00 0.00 C ATOM 225 C SER A 141 -1.504 13.803 -8.944 1.00 0.00 C ATOM 226 O SER A 141 -1.403 13.747 -7.719 1.00 0.00 O ATOM 227 CB SER A 141 -2.738 12.786 -10.877 1.00 0.00 C ATOM 228 OG SER A 141 -2.117 12.829 -12.151 1.00 0.00 O ATOM 0 H SER A 141 -2.536 11.706 -8.030 1.00 0.00 H new ATOM 0 HA SER A 141 -0.754 12.268 -10.225 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.491 11.998 -10.862 1.00 0.00 H new ATOM 0 HB3 SER A 141 -3.256 13.726 -10.689 1.00 0.00 H new ATOM 0 HG SER A 141 -2.795 12.989 -12.840 1.00 0.00 H new ATOM 234 N GLY A 142 -1.444 14.945 -9.626 1.00 0.00 N ATOM 235 CA GLY A 142 -1.256 16.210 -8.940 1.00 0.00 C ATOM 236 C GLY A 142 0.200 16.479 -8.609 1.00 0.00 C ATOM 237 O GLY A 142 1.094 15.878 -9.205 1.00 0.00 O ATOM 0 H GLY A 142 -1.522 15.015 -10.641 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.639 17.018 -9.563 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -1.841 16.212 -8.020 1.00 0.00 H new ATOM 241 N PRO A 143 0.474 17.382 -7.652 1.00 0.00 N ATOM 242 CA PRO A 143 1.845 17.714 -7.251 1.00 0.00 C ATOM 243 C PRO A 143 2.612 16.487 -6.771 1.00 0.00 C ATOM 244 O PRO A 143 3.844 16.476 -6.759 1.00 0.00 O ATOM 245 CB PRO A 143 1.663 18.718 -6.105 1.00 0.00 C ATOM 246 CG PRO A 143 0.247 18.559 -5.664 1.00 0.00 C ATOM 247 CD PRO A 143 -0.522 18.142 -6.883 1.00 0.00 C ATOM 0 HA PRO A 143 2.426 18.112 -8.083 1.00 0.00 H new ATOM 0 HB2 PRO A 143 2.355 18.512 -5.288 1.00 0.00 H new ATOM 0 HB3 PRO A 143 1.859 19.737 -6.440 1.00 0.00 H new ATOM 0 HG2 PRO A 143 0.166 17.810 -4.876 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -0.142 19.493 -5.258 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -1.387 17.531 -6.626 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -0.894 19.002 -7.441 1.00 0.00 H new ATOM 255 N PHE A 144 1.874 15.453 -6.377 1.00 0.00 N ATOM 256 CA PHE A 144 2.481 14.217 -5.898 1.00 0.00 C ATOM 257 C PHE A 144 2.252 13.085 -6.892 1.00 0.00 C ATOM 258 O PHE A 144 1.947 11.964 -6.498 1.00 0.00 O ATOM 259 CB PHE A 144 1.896 13.817 -4.537 1.00 0.00 C ATOM 260 CG PHE A 144 1.446 14.976 -3.694 1.00 0.00 C ATOM 261 CD1 PHE A 144 2.368 15.841 -3.128 1.00 0.00 C ATOM 262 CD2 PHE A 144 0.098 15.197 -3.467 1.00 0.00 C ATOM 263 CE1 PHE A 144 1.953 16.906 -2.351 1.00 0.00 C ATOM 264 CE2 PHE A 144 -0.324 16.258 -2.692 1.00 0.00 C ATOM 265 CZ PHE A 144 0.605 17.115 -2.133 1.00 0.00 C ATOM 0 H PHE A 144 0.854 15.448 -6.380 1.00 0.00 H new ATOM 0 HA PHE A 144 3.551 14.393 -5.792 1.00 0.00 H new ATOM 0 HB2 PHE A 144 1.049 13.151 -4.700 1.00 0.00 H new ATOM 0 HB3 PHE A 144 2.646 13.250 -3.985 1.00 0.00 H new ATOM 0 HD1 PHE A 144 3.423 15.681 -3.296 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -0.632 14.531 -3.902 1.00 0.00 H new ATOM 0 HE1 PHE A 144 2.681 17.574 -1.915 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -1.379 16.418 -2.523 1.00 0.00 H new ATOM 0 HZ PHE A 144 0.278 17.947 -1.527 1.00 0.00 H new ATOM 275 N ALA A 145 2.387 13.378 -8.182 1.00 0.00 N ATOM 276 CA ALA A 145 2.176 12.365 -9.212 1.00 0.00 C ATOM 277 C ALA A 145 3.460 11.620 -9.556 1.00 0.00 C ATOM 278 O ALA A 145 3.649 11.181 -10.690 1.00 0.00 O ATOM 279 CB ALA A 145 1.580 12.999 -10.459 1.00 0.00 C ATOM 0 H ALA A 145 2.639 14.300 -8.537 1.00 0.00 H new ATOM 0 HA ALA A 145 1.475 11.633 -8.811 1.00 0.00 H new ATOM 0 HB1 ALA A 145 1.428 12.233 -11.219 1.00 0.00 H new ATOM 0 HB2 ALA A 145 0.624 13.460 -10.211 1.00 0.00 H new ATOM 0 HB3 ALA A 145 2.261 13.759 -10.841 1.00 0.00 H new ATOM 285 N ASP A 146 4.331 11.471 -8.571 1.00 0.00 N ATOM 286 CA ASP A 146 5.593 10.767 -8.769 1.00 0.00 C ATOM 287 C ASP A 146 6.196 10.328 -7.440 1.00 0.00 C ATOM 288 O ASP A 146 7.410 10.388 -7.250 1.00 0.00 O ATOM 289 CB ASP A 146 6.582 11.649 -9.533 1.00 0.00 C ATOM 290 CG ASP A 146 7.309 10.893 -10.626 1.00 0.00 C ATOM 291 OD1 ASP A 146 7.374 9.648 -10.543 1.00 0.00 O ATOM 292 OD2 ASP A 146 7.815 11.545 -11.563 1.00 0.00 O ATOM 0 H ASP A 146 4.190 11.827 -7.626 1.00 0.00 H new ATOM 0 HA ASP A 146 5.388 9.873 -9.358 1.00 0.00 H new ATOM 0 HB2 ASP A 146 6.048 12.492 -9.972 1.00 0.00 H new ATOM 0 HB3 ASP A 146 7.310 12.062 -8.835 1.00 0.00 H new ATOM 297 N PHE A 147 5.346 9.890 -6.521 1.00 0.00 N ATOM 298 CA PHE A 147 5.809 9.449 -5.211 1.00 0.00 C ATOM 299 C PHE A 147 5.144 8.139 -4.804 1.00 0.00 C ATOM 300 O PHE A 147 4.040 7.823 -5.249 1.00 0.00 O ATOM 301 CB PHE A 147 5.528 10.524 -4.158 1.00 0.00 C ATOM 302 CG PHE A 147 6.237 11.825 -4.418 1.00 0.00 C ATOM 303 CD1 PHE A 147 7.530 11.840 -4.917 1.00 0.00 C ATOM 304 CD2 PHE A 147 5.608 13.033 -4.163 1.00 0.00 C ATOM 305 CE1 PHE A 147 8.182 13.035 -5.156 1.00 0.00 C ATOM 306 CE2 PHE A 147 6.255 14.231 -4.401 1.00 0.00 C ATOM 307 CZ PHE A 147 7.543 14.232 -4.898 1.00 0.00 C ATOM 0 H PHE A 147 4.337 9.830 -6.657 1.00 0.00 H new ATOM 0 HA PHE A 147 6.884 9.282 -5.275 1.00 0.00 H new ATOM 0 HB2 PHE A 147 4.454 10.707 -4.116 1.00 0.00 H new ATOM 0 HB3 PHE A 147 5.825 10.148 -3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 147 8.034 10.907 -5.121 1.00 0.00 H new ATOM 0 HD2 PHE A 147 4.601 13.039 -3.774 1.00 0.00 H new ATOM 0 HE1 PHE A 147 9.190 13.033 -5.544 1.00 0.00 H new ATOM 0 HE2 PHE A 147 5.753 15.166 -4.198 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.050 15.167 -5.085 1.00 0.00 H new ATOM 317 N THR A 148 5.824 7.383 -3.950 1.00 0.00 N ATOM 318 CA THR A 148 5.305 6.109 -3.472 1.00 0.00 C ATOM 319 C THR A 148 5.115 6.145 -1.959 1.00 0.00 C ATOM 320 O THR A 148 5.523 7.101 -1.298 1.00 0.00 O ATOM 321 CB THR A 148 6.255 4.972 -3.852 1.00 0.00 C ATOM 322 OG1 THR A 148 7.461 5.058 -3.113 1.00 0.00 O ATOM 323 CG2 THR A 148 6.616 4.961 -5.321 1.00 0.00 C ATOM 0 H THR A 148 6.739 7.632 -3.574 1.00 0.00 H new ATOM 0 HA THR A 148 4.338 5.933 -3.943 1.00 0.00 H new ATOM 0 HB THR A 148 5.715 4.054 -3.620 1.00 0.00 H new ATOM 0 HG1 THR A 148 8.055 4.321 -3.369 1.00 0.00 H new ATOM 0 HG21 THR A 148 7.292 4.130 -5.523 1.00 0.00 H new ATOM 0 HG22 THR A 148 5.711 4.846 -5.917 1.00 0.00 H new ATOM 0 HG23 THR A 148 7.106 5.899 -5.582 1.00 0.00 H new ATOM 331 N GLY A 149 4.491 5.106 -1.416 1.00 0.00 N ATOM 332 CA GLY A 149 4.261 5.055 0.015 1.00 0.00 C ATOM 333 C GLY A 149 4.362 3.652 0.579 1.00 0.00 C ATOM 334 O GLY A 149 4.173 2.670 -0.140 1.00 0.00 O ATOM 0 H GLY A 149 4.142 4.302 -1.938 1.00 0.00 H new ATOM 0 HA2 GLY A 149 4.985 5.696 0.517 1.00 0.00 H new ATOM 0 HA3 GLY A 149 3.272 5.459 0.234 1.00 0.00 H new ATOM 338 N THR A 150 4.659 3.561 1.870 1.00 0.00 N ATOM 339 CA THR A 150 4.781 2.272 2.539 1.00 0.00 C ATOM 340 C THR A 150 3.544 1.981 3.383 1.00 0.00 C ATOM 341 O THR A 150 3.358 2.565 4.450 1.00 0.00 O ATOM 342 CB THR A 150 6.030 2.248 3.422 1.00 0.00 C ATOM 343 OG1 THR A 150 7.157 2.730 2.712 1.00 0.00 O ATOM 344 CG2 THR A 150 6.371 0.867 3.938 1.00 0.00 C ATOM 0 H THR A 150 4.820 4.366 2.475 1.00 0.00 H new ATOM 0 HA THR A 150 4.870 1.500 1.775 1.00 0.00 H new ATOM 0 HB THR A 150 5.794 2.889 4.271 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.774 1.989 2.535 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.267 0.921 4.557 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.541 0.486 4.533 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.551 0.198 3.096 1.00 0.00 H new ATOM 352 N VAL A 151 2.700 1.077 2.896 1.00 0.00 N ATOM 353 CA VAL A 151 1.479 0.711 3.607 1.00 0.00 C ATOM 354 C VAL A 151 1.794 0.176 5.000 1.00 0.00 C ATOM 355 O VAL A 151 2.468 -0.842 5.146 1.00 0.00 O ATOM 356 CB VAL A 151 0.671 -0.348 2.829 1.00 0.00 C ATOM 357 CG1 VAL A 151 -0.630 -0.671 3.552 1.00 0.00 C ATOM 358 CG2 VAL A 151 0.392 0.125 1.410 1.00 0.00 C ATOM 0 H VAL A 151 2.838 0.585 2.013 1.00 0.00 H new ATOM 0 HA VAL A 151 0.880 1.618 3.697 1.00 0.00 H new ATOM 0 HB VAL A 151 1.267 -1.259 2.775 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -1.184 -1.420 2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -0.407 -1.059 4.546 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -1.231 0.234 3.642 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.179 -0.636 0.878 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -0.181 1.052 1.441 1.00 0.00 H new ATOM 0 HG23 VAL A 151 1.335 0.299 0.892 1.00 0.00 H new ATOM 368 N THR A 152 1.300 0.871 6.019 1.00 0.00 N ATOM 369 CA THR A 152 1.528 0.466 7.402 1.00 0.00 C ATOM 370 C THR A 152 0.294 -0.220 7.977 1.00 0.00 C ATOM 371 O THR A 152 0.392 -1.274 8.604 1.00 0.00 O ATOM 372 CB THR A 152 1.895 1.680 8.257 1.00 0.00 C ATOM 373 OG1 THR A 152 0.785 2.549 8.398 1.00 0.00 O ATOM 374 CG2 THR A 152 3.041 2.489 7.687 1.00 0.00 C ATOM 0 H THR A 152 0.740 1.717 5.914 1.00 0.00 H new ATOM 0 HA THR A 152 2.356 -0.243 7.415 1.00 0.00 H new ATOM 0 HB THR A 152 2.202 1.272 9.220 1.00 0.00 H new ATOM 0 HG1 THR A 152 0.317 2.349 9.235 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.250 3.335 8.342 1.00 0.00 H new ATOM 0 HG22 THR A 152 3.928 1.860 7.612 1.00 0.00 H new ATOM 0 HG23 THR A 152 2.771 2.855 6.696 1.00 0.00 H new ATOM 382 N GLU A 153 -0.869 0.387 7.759 1.00 0.00 N ATOM 383 CA GLU A 153 -2.125 -0.163 8.254 1.00 0.00 C ATOM 384 C GLU A 153 -3.135 -0.318 7.122 1.00 0.00 C ATOM 385 O GLU A 153 -3.032 0.346 6.089 1.00 0.00 O ATOM 386 CB GLU A 153 -2.703 0.733 9.350 1.00 0.00 C ATOM 387 CG GLU A 153 -2.195 0.397 10.743 1.00 0.00 C ATOM 388 CD GLU A 153 -1.231 1.436 11.280 1.00 0.00 C ATOM 389 OE1 GLU A 153 -0.348 1.879 10.514 1.00 0.00 O ATOM 390 OE2 GLU A 153 -1.357 1.807 12.465 1.00 0.00 O ATOM 0 H GLU A 153 -0.967 1.261 7.242 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.921 -1.149 8.672 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -2.460 1.771 9.124 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -3.790 0.651 9.339 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -3.042 0.308 11.423 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -1.701 -0.574 10.721 1.00 0.00 H new ATOM 397 N ILE A 154 -4.111 -1.196 7.323 1.00 0.00 N ATOM 398 CA ILE A 154 -5.141 -1.435 6.319 1.00 0.00 C ATOM 399 C ILE A 154 -6.512 -1.603 6.967 1.00 0.00 C ATOM 400 O ILE A 154 -6.641 -2.247 8.009 1.00 0.00 O ATOM 401 CB ILE A 154 -4.827 -2.689 5.479 1.00 0.00 C ATOM 402 CG1 ILE A 154 -3.380 -2.648 4.986 1.00 0.00 C ATOM 403 CG2 ILE A 154 -5.790 -2.796 4.307 1.00 0.00 C ATOM 404 CD1 ILE A 154 -2.399 -3.301 5.937 1.00 0.00 C ATOM 0 H ILE A 154 -4.211 -1.754 8.171 1.00 0.00 H new ATOM 0 HA ILE A 154 -5.154 -0.562 5.666 1.00 0.00 H new ATOM 0 HB ILE A 154 -4.952 -3.571 6.107 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -3.320 -3.145 4.018 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -3.087 -1.610 4.830 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -5.555 -3.686 3.723 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -6.812 -2.866 4.681 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -5.694 -1.913 3.676 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -1.393 -3.235 5.523 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -2.430 -2.790 6.899 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -2.667 -4.349 6.074 1.00 0.00 H new ATOM 416 N ASN A 155 -7.531 -1.020 6.346 1.00 0.00 N ATOM 417 CA ASN A 155 -8.891 -1.106 6.863 1.00 0.00 C ATOM 418 C ASN A 155 -9.828 -1.737 5.832 1.00 0.00 C ATOM 419 O ASN A 155 -10.489 -1.033 5.070 1.00 0.00 O ATOM 420 CB ASN A 155 -9.400 0.285 7.253 1.00 0.00 C ATOM 421 CG ASN A 155 -9.836 0.356 8.703 1.00 0.00 C ATOM 422 OD1 ASN A 155 -9.024 0.588 9.597 1.00 0.00 O ATOM 423 ND2 ASN A 155 -11.128 0.155 8.943 1.00 0.00 N ATOM 0 H ASN A 155 -7.441 -0.483 5.484 1.00 0.00 H new ATOM 0 HA ASN A 155 -8.877 -1.741 7.749 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -8.614 1.019 7.077 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -10.238 0.555 6.611 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -11.481 0.190 9.899 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -11.767 -0.034 8.171 1.00 0.00 H new ATOM 430 N PRO A 156 -9.891 -3.079 5.796 1.00 0.00 N ATOM 431 CA PRO A 156 -10.749 -3.803 4.853 1.00 0.00 C ATOM 432 C PRO A 156 -12.226 -3.708 5.221 1.00 0.00 C ATOM 433 O PRO A 156 -13.097 -3.773 4.353 1.00 0.00 O ATOM 434 CB PRO A 156 -10.261 -5.247 4.971 1.00 0.00 C ATOM 435 CG PRO A 156 -9.713 -5.347 6.352 1.00 0.00 C ATOM 436 CD PRO A 156 -9.131 -3.995 6.668 1.00 0.00 C ATOM 0 HA PRO A 156 -10.682 -3.396 3.844 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -11.075 -5.955 4.816 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -9.498 -5.470 4.225 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -10.495 -5.611 7.064 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -8.951 -6.124 6.414 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -9.254 -3.741 7.721 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -8.063 -3.958 6.454 1.00 0.00 H new ATOM 444 N GLU A 157 -12.500 -3.552 6.512 1.00 0.00 N ATOM 445 CA GLU A 157 -13.873 -3.449 6.993 1.00 0.00 C ATOM 446 C GLU A 157 -14.504 -2.129 6.562 1.00 0.00 C ATOM 447 O GLU A 157 -15.709 -2.058 6.314 1.00 0.00 O ATOM 448 CB GLU A 157 -13.911 -3.569 8.519 1.00 0.00 C ATOM 449 CG GLU A 157 -13.023 -2.563 9.231 1.00 0.00 C ATOM 450 CD GLU A 157 -13.580 -2.145 10.577 1.00 0.00 C ATOM 451 OE1 GLU A 157 -14.050 -3.028 11.326 1.00 0.00 O ATOM 452 OE2 GLU A 157 -13.545 -0.935 10.886 1.00 0.00 O ATOM 0 H GLU A 157 -11.791 -3.494 7.243 1.00 0.00 H new ATOM 0 HA GLU A 157 -14.446 -4.266 6.555 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -14.938 -3.439 8.860 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -13.606 -4.576 8.804 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -12.031 -2.994 9.370 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -12.902 -1.681 8.602 1.00 0.00 H new ATOM 459 N ARG A 158 -13.685 -1.088 6.472 1.00 0.00 N ATOM 460 CA ARG A 158 -14.164 0.230 6.069 1.00 0.00 C ATOM 461 C ARG A 158 -13.735 0.553 4.643 1.00 0.00 C ATOM 462 O ARG A 158 -14.571 0.783 3.768 1.00 0.00 O ATOM 463 CB ARG A 158 -13.641 1.301 7.027 1.00 0.00 C ATOM 464 CG ARG A 158 -14.572 2.494 7.174 1.00 0.00 C ATOM 465 CD ARG A 158 -15.940 2.075 7.691 1.00 0.00 C ATOM 466 NE ARG A 158 -16.253 2.694 8.978 1.00 0.00 N ATOM 467 CZ ARG A 158 -17.319 2.384 9.711 1.00 0.00 C ATOM 468 NH1 ARG A 158 -18.178 1.464 9.289 1.00 0.00 N ATOM 469 NH2 ARG A 158 -17.529 2.995 10.869 1.00 0.00 N ATOM 0 H ARG A 158 -12.686 -1.130 6.673 1.00 0.00 H new ATOM 0 HA ARG A 158 -15.253 0.220 6.107 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -13.481 0.853 8.008 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -12.670 1.650 6.674 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -14.130 3.219 7.858 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -14.683 2.991 6.210 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -16.703 2.349 6.962 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -15.972 0.990 7.793 1.00 0.00 H new ATOM 0 HE ARG A 158 -15.616 3.406 9.335 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -18.022 0.991 8.399 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -18.994 1.230 9.855 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -16.873 3.703 11.198 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -18.347 2.757 11.430 1.00 0.00 H new ATOM 483 N GLY A 159 -12.425 0.566 4.413 1.00 0.00 N ATOM 484 CA GLY A 159 -11.906 0.862 3.090 1.00 0.00 C ATOM 485 C GLY A 159 -10.950 2.037 3.091 1.00 0.00 C ATOM 486 O GLY A 159 -11.245 3.090 2.524 1.00 0.00 O ATOM 0 H GLY A 159 -11.714 0.377 5.119 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -11.395 -0.018 2.699 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -12.736 1.074 2.417 1.00 0.00 H new ATOM 490 N LYS A 160 -9.797 1.860 3.730 1.00 0.00 N ATOM 491 CA LYS A 160 -8.792 2.914 3.803 1.00 0.00 C ATOM 492 C LYS A 160 -7.387 2.323 3.849 1.00 0.00 C ATOM 493 O LYS A 160 -7.211 1.138 4.127 1.00 0.00 O ATOM 494 CB LYS A 160 -9.031 3.791 5.033 1.00 0.00 C ATOM 495 CG LYS A 160 -10.083 4.866 4.818 1.00 0.00 C ATOM 496 CD LYS A 160 -10.467 5.537 6.126 1.00 0.00 C ATOM 497 CE LYS A 160 -11.547 6.587 5.918 1.00 0.00 C ATOM 498 NZ LYS A 160 -12.858 5.974 5.566 1.00 0.00 N ATOM 0 H LYS A 160 -9.536 0.996 4.205 1.00 0.00 H new ATOM 0 HA LYS A 160 -8.879 3.528 2.906 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -9.335 3.158 5.867 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -8.092 4.265 5.319 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -9.704 5.614 4.122 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -10.968 4.424 4.361 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -10.820 4.785 6.832 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -9.587 6.002 6.570 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -11.656 7.180 6.826 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -11.241 7.270 5.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -13.595 6.708 5.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -12.797 5.543 4.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -13.098 5.242 6.265 1.00 0.00 H new ATOM 512 N VAL A 161 -6.390 3.159 3.576 1.00 0.00 N ATOM 513 CA VAL A 161 -5.002 2.718 3.589 1.00 0.00 C ATOM 514 C VAL A 161 -4.065 3.864 3.955 1.00 0.00 C ATOM 515 O VAL A 161 -4.242 4.993 3.497 1.00 0.00 O ATOM 516 CB VAL A 161 -4.581 2.145 2.222 1.00 0.00 C ATOM 517 CG1 VAL A 161 -5.270 0.813 1.966 1.00 0.00 C ATOM 518 CG2 VAL A 161 -4.889 3.136 1.110 1.00 0.00 C ATOM 0 H VAL A 161 -6.518 4.144 3.344 1.00 0.00 H new ATOM 0 HA VAL A 161 -4.927 1.934 4.343 1.00 0.00 H new ATOM 0 HB VAL A 161 -3.505 1.974 2.236 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -4.960 0.424 0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -4.993 0.104 2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -6.351 0.955 1.972 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -4.585 2.714 0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -5.959 3.342 1.092 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.344 4.063 1.288 1.00 0.00 H new ATOM 528 N LYS A 162 -3.072 3.568 4.784 1.00 0.00 N ATOM 529 CA LYS A 162 -2.106 4.574 5.213 1.00 0.00 C ATOM 530 C LYS A 162 -0.698 4.201 4.764 1.00 0.00 C ATOM 531 O LYS A 162 -0.218 3.102 5.040 1.00 0.00 O ATOM 532 CB LYS A 162 -2.145 4.734 6.734 1.00 0.00 C ATOM 533 CG LYS A 162 -1.180 5.784 7.259 1.00 0.00 C ATOM 534 CD LYS A 162 -1.523 6.194 8.682 1.00 0.00 C ATOM 535 CE LYS A 162 -0.277 6.313 9.544 1.00 0.00 C ATOM 536 NZ LYS A 162 0.427 7.606 9.327 1.00 0.00 N ATOM 0 H LYS A 162 -2.914 2.639 5.174 1.00 0.00 H new ATOM 0 HA LYS A 162 -2.376 5.523 4.749 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -3.158 4.999 7.037 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -1.914 3.775 7.198 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -0.163 5.393 7.227 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -1.206 6.660 6.611 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -2.050 7.148 8.670 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -2.201 5.461 9.120 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -0.552 6.222 10.595 1.00 0.00 H new ATOM 0 HE3 LYS A 162 0.400 5.489 9.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 1.429 7.503 9.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 0.354 7.877 8.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -0.010 8.342 9.917 1.00 0.00 H new ATOM 550 N VAL A 163 -0.038 5.123 4.069 1.00 0.00 N ATOM 551 CA VAL A 163 1.315 4.888 3.582 1.00 0.00 C ATOM 552 C VAL A 163 2.207 6.101 3.820 1.00 0.00 C ATOM 553 O VAL A 163 1.741 7.239 3.806 1.00 0.00 O ATOM 554 CB VAL A 163 1.321 4.550 2.078 1.00 0.00 C ATOM 555 CG1 VAL A 163 0.560 3.259 1.816 1.00 0.00 C ATOM 556 CG2 VAL A 163 0.737 5.700 1.268 1.00 0.00 C ATOM 0 H VAL A 163 -0.419 6.039 3.831 1.00 0.00 H new ATOM 0 HA VAL A 163 1.706 4.038 4.141 1.00 0.00 H new ATOM 0 HB VAL A 163 2.354 4.404 1.762 1.00 0.00 H new ATOM 0 HG11 VAL A 163 0.576 3.038 0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 163 1.030 2.442 2.363 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -0.472 3.371 2.148 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.750 5.442 0.209 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -0.290 5.883 1.584 1.00 0.00 H new ATOM 0 HG23 VAL A 163 1.332 6.598 1.430 1.00 0.00 H new ATOM 566 N MET A 164 3.495 5.850 4.032 1.00 0.00 N ATOM 567 CA MET A 164 4.454 6.922 4.268 1.00 0.00 C ATOM 568 C MET A 164 5.057 7.404 2.949 1.00 0.00 C ATOM 569 O MET A 164 5.806 6.679 2.297 1.00 0.00 O ATOM 570 CB MET A 164 5.558 6.450 5.220 1.00 0.00 C ATOM 571 CG MET A 164 6.540 5.471 4.593 1.00 0.00 C ATOM 572 SD MET A 164 7.386 4.456 5.820 1.00 0.00 S ATOM 573 CE MET A 164 8.724 3.781 4.837 1.00 0.00 C ATOM 0 H MET A 164 3.898 4.913 4.045 1.00 0.00 H new ATOM 0 HA MET A 164 3.929 7.758 4.731 1.00 0.00 H new ATOM 0 HB2 MET A 164 6.108 7.319 5.581 1.00 0.00 H new ATOM 0 HB3 MET A 164 5.098 5.980 6.089 1.00 0.00 H new ATOM 0 HG2 MET A 164 6.007 4.824 3.896 1.00 0.00 H new ATOM 0 HG3 MET A 164 7.279 6.024 4.013 1.00 0.00 H new ATOM 0 HE1 MET A 164 8.585 2.706 4.723 1.00 0.00 H new ATOM 0 HE2 MET A 164 8.727 4.252 3.854 1.00 0.00 H new ATOM 0 HE3 MET A 164 9.674 3.974 5.335 1.00 0.00 H new ATOM 583 N VAL A 165 4.719 8.629 2.562 1.00 0.00 N ATOM 584 CA VAL A 165 5.224 9.205 1.321 1.00 0.00 C ATOM 585 C VAL A 165 6.127 10.403 1.592 1.00 0.00 C ATOM 586 O VAL A 165 5.822 11.244 2.435 1.00 0.00 O ATOM 587 CB VAL A 165 4.073 9.645 0.394 1.00 0.00 C ATOM 588 CG1 VAL A 165 3.236 8.446 -0.027 1.00 0.00 C ATOM 589 CG2 VAL A 165 3.208 10.698 1.074 1.00 0.00 C ATOM 0 H VAL A 165 4.098 9.242 3.090 1.00 0.00 H new ATOM 0 HA VAL A 165 5.802 8.424 0.827 1.00 0.00 H new ATOM 0 HB VAL A 165 4.505 10.089 -0.503 1.00 0.00 H new ATOM 0 HG11 VAL A 165 2.429 8.777 -0.681 1.00 0.00 H new ATOM 0 HG12 VAL A 165 3.865 7.732 -0.560 1.00 0.00 H new ATOM 0 HG13 VAL A 165 2.814 7.968 0.857 1.00 0.00 H new ATOM 0 HG21 VAL A 165 2.402 10.995 0.403 1.00 0.00 H new ATOM 0 HG22 VAL A 165 2.785 10.285 1.990 1.00 0.00 H new ATOM 0 HG23 VAL A 165 3.818 11.568 1.316 1.00 0.00 H new ATOM 599 N THR A 166 7.237 10.475 0.865 1.00 0.00 N ATOM 600 CA THR A 166 8.183 11.573 1.023 1.00 0.00 C ATOM 601 C THR A 166 7.863 12.701 0.047 1.00 0.00 C ATOM 602 O THR A 166 7.568 12.457 -1.123 1.00 0.00 O ATOM 603 CB THR A 166 9.613 11.079 0.800 1.00 0.00 C ATOM 604 OG1 THR A 166 10.532 12.155 0.878 1.00 0.00 O ATOM 605 CG2 THR A 166 9.811 10.404 -0.538 1.00 0.00 C ATOM 0 H THR A 166 7.503 9.786 0.161 1.00 0.00 H new ATOM 0 HA THR A 166 8.096 11.956 2.040 1.00 0.00 H new ATOM 0 HB THR A 166 9.792 10.347 1.588 1.00 0.00 H new ATOM 0 HG1 THR A 166 10.150 12.872 1.426 1.00 0.00 H new ATOM 0 HG21 THR A 166 10.847 10.078 -0.631 1.00 0.00 H new ATOM 0 HG22 THR A 166 9.151 9.540 -0.611 1.00 0.00 H new ATOM 0 HG23 THR A 166 9.579 11.107 -1.338 1.00 0.00 H new ATOM 613 N ILE A 167 7.923 13.935 0.534 1.00 0.00 N ATOM 614 CA ILE A 167 7.637 15.098 -0.298 1.00 0.00 C ATOM 615 C ILE A 167 8.869 15.520 -1.093 1.00 0.00 C ATOM 616 O ILE A 167 8.755 16.072 -2.187 1.00 0.00 O ATOM 617 CB ILE A 167 7.139 16.288 0.546 1.00 0.00 C ATOM 618 CG1 ILE A 167 6.720 17.447 -0.362 1.00 0.00 C ATOM 619 CG2 ILE A 167 8.214 16.735 1.530 1.00 0.00 C ATOM 620 CD1 ILE A 167 5.876 18.490 0.339 1.00 0.00 C ATOM 0 H ILE A 167 8.167 14.156 1.499 1.00 0.00 H new ATOM 0 HA ILE A 167 6.847 14.807 -0.991 1.00 0.00 H new ATOM 0 HB ILE A 167 6.268 15.967 1.117 1.00 0.00 H new ATOM 0 HG12 ILE A 167 7.614 17.925 -0.764 1.00 0.00 H new ATOM 0 HG13 ILE A 167 6.162 17.050 -1.210 1.00 0.00 H new ATOM 0 HG21 ILE A 167 7.844 17.576 2.116 1.00 0.00 H new ATOM 0 HG22 ILE A 167 8.463 15.909 2.197 1.00 0.00 H new ATOM 0 HG23 ILE A 167 9.105 17.040 0.981 1.00 0.00 H new ATOM 0 HD11 ILE A 167 5.616 19.281 -0.365 1.00 0.00 H new ATOM 0 HD12 ILE A 167 4.965 18.027 0.717 1.00 0.00 H new ATOM 0 HD13 ILE A 167 6.439 18.915 1.170 1.00 0.00 H new ATOM 632 N PHE A 168 10.046 15.256 -0.536 1.00 0.00 N ATOM 633 CA PHE A 168 11.300 15.609 -1.193 1.00 0.00 C ATOM 634 C PHE A 168 12.496 15.156 -0.360 1.00 0.00 C ATOM 635 O PHE A 168 13.502 15.860 -0.266 1.00 0.00 O ATOM 636 CB PHE A 168 11.370 17.118 -1.436 1.00 0.00 C ATOM 637 CG PHE A 168 11.860 17.482 -2.808 1.00 0.00 C ATOM 638 CD1 PHE A 168 11.175 17.062 -3.937 1.00 0.00 C ATOM 639 CD2 PHE A 168 13.006 18.245 -2.969 1.00 0.00 C ATOM 640 CE1 PHE A 168 11.622 17.396 -5.200 1.00 0.00 C ATOM 641 CE2 PHE A 168 13.459 18.581 -4.230 1.00 0.00 C ATOM 642 CZ PHE A 168 12.766 18.157 -5.347 1.00 0.00 C ATOM 0 H PHE A 168 10.158 14.799 0.369 1.00 0.00 H new ATOM 0 HA PHE A 168 11.335 15.095 -2.154 1.00 0.00 H new ATOM 0 HB2 PHE A 168 10.380 17.548 -1.287 1.00 0.00 H new ATOM 0 HB3 PHE A 168 12.028 17.568 -0.693 1.00 0.00 H new ATOM 0 HD1 PHE A 168 10.281 16.466 -3.828 1.00 0.00 H new ATOM 0 HD2 PHE A 168 13.551 18.581 -2.099 1.00 0.00 H new ATOM 0 HE1 PHE A 168 11.078 17.063 -6.072 1.00 0.00 H new ATOM 0 HE2 PHE A 168 14.354 19.175 -4.342 1.00 0.00 H new ATOM 0 HZ PHE A 168 13.118 18.420 -6.334 1.00 0.00 H new ATOM 652 N GLY A 169 12.379 13.978 0.244 1.00 0.00 N ATOM 653 CA GLY A 169 13.457 13.453 1.061 1.00 0.00 C ATOM 654 C GLY A 169 13.008 13.124 2.472 1.00 0.00 C ATOM 655 O GLY A 169 13.600 12.270 3.134 1.00 0.00 O ATOM 0 H GLY A 169 11.557 13.378 0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 169 13.860 12.555 0.592 1.00 0.00 H new ATOM 0 HA3 GLY A 169 14.266 14.182 1.101 1.00 0.00 H new ATOM 659 N ARG A 170 11.962 13.801 2.932 1.00 0.00 N ATOM 660 CA ARG A 170 11.437 13.574 4.275 1.00 0.00 C ATOM 661 C ARG A 170 10.149 12.758 4.223 1.00 0.00 C ATOM 662 O ARG A 170 9.179 13.150 3.575 1.00 0.00 O ATOM 663 CB ARG A 170 11.183 14.910 4.977 1.00 0.00 C ATOM 664 CG ARG A 170 12.312 15.912 4.804 1.00 0.00 C ATOM 665 CD ARG A 170 12.922 16.305 6.141 1.00 0.00 C ATOM 666 NE ARG A 170 13.278 17.721 6.186 1.00 0.00 N ATOM 667 CZ ARG A 170 14.232 18.270 5.436 1.00 0.00 C ATOM 668 NH1 ARG A 170 14.925 17.527 4.583 1.00 0.00 N ATOM 669 NH2 ARG A 170 14.492 19.566 5.540 1.00 0.00 N ATOM 0 H ARG A 170 11.461 14.510 2.397 1.00 0.00 H new ATOM 0 HA ARG A 170 12.179 13.011 4.840 1.00 0.00 H new ATOM 0 HB2 ARG A 170 10.261 15.344 4.591 1.00 0.00 H new ATOM 0 HB3 ARG A 170 11.029 14.729 6.041 1.00 0.00 H new ATOM 0 HG2 ARG A 170 13.083 15.485 4.163 1.00 0.00 H new ATOM 0 HG3 ARG A 170 11.935 16.802 4.300 1.00 0.00 H new ATOM 0 HD2 ARG A 170 12.215 16.083 6.941 1.00 0.00 H new ATOM 0 HD3 ARG A 170 13.811 15.702 6.325 1.00 0.00 H new ATOM 0 HE ARG A 170 12.766 18.325 6.829 1.00 0.00 H new ATOM 0 HH11 ARG A 170 14.728 16.530 4.499 1.00 0.00 H new ATOM 0 HH12 ARG A 170 15.654 17.953 4.011 1.00 0.00 H new ATOM 0 HH21 ARG A 170 13.962 20.142 6.194 1.00 0.00 H new ATOM 0 HH22 ARG A 170 15.222 19.987 4.966 1.00 0.00 H new ATOM 683 N GLU A 171 10.148 11.621 4.911 1.00 0.00 N ATOM 684 CA GLU A 171 8.981 10.749 4.946 1.00 0.00 C ATOM 685 C GLU A 171 7.795 11.450 5.598 1.00 0.00 C ATOM 686 O GLU A 171 7.869 11.873 6.752 1.00 0.00 O ATOM 687 CB GLU A 171 9.304 9.458 5.702 1.00 0.00 C ATOM 688 CG GLU A 171 10.031 9.689 7.015 1.00 0.00 C ATOM 689 CD GLU A 171 9.997 8.472 7.920 1.00 0.00 C ATOM 690 OE1 GLU A 171 9.104 7.619 7.736 1.00 0.00 O ATOM 691 OE2 GLU A 171 10.863 8.374 8.816 1.00 0.00 O ATOM 0 H GLU A 171 10.943 11.282 5.452 1.00 0.00 H new ATOM 0 HA GLU A 171 8.713 10.503 3.918 1.00 0.00 H new ATOM 0 HB2 GLU A 171 8.377 8.920 5.899 1.00 0.00 H new ATOM 0 HB3 GLU A 171 9.915 8.817 5.066 1.00 0.00 H new ATOM 0 HG2 GLU A 171 11.068 9.957 6.810 1.00 0.00 H new ATOM 0 HG3 GLU A 171 9.579 10.535 7.533 1.00 0.00 H new ATOM 698 N THR A 172 6.703 11.572 4.851 1.00 0.00 N ATOM 699 CA THR A 172 5.500 12.224 5.354 1.00 0.00 C ATOM 700 C THR A 172 4.328 11.243 5.398 1.00 0.00 C ATOM 701 O THR A 172 3.700 10.972 4.375 1.00 0.00 O ATOM 702 CB THR A 172 5.141 13.423 4.474 1.00 0.00 C ATOM 703 OG1 THR A 172 6.233 14.319 4.379 1.00 0.00 O ATOM 704 CG2 THR A 172 3.949 14.205 4.984 1.00 0.00 C ATOM 0 H THR A 172 6.627 11.227 3.894 1.00 0.00 H new ATOM 0 HA THR A 172 5.700 12.571 6.368 1.00 0.00 H new ATOM 0 HB THR A 172 4.889 13.002 3.501 1.00 0.00 H new ATOM 0 HG1 THR A 172 5.985 15.078 3.811 1.00 0.00 H new ATOM 0 HG21 THR A 172 3.749 15.041 4.314 1.00 0.00 H new ATOM 0 HG22 THR A 172 3.076 13.554 5.023 1.00 0.00 H new ATOM 0 HG23 THR A 172 4.163 14.584 5.983 1.00 0.00 H new ATOM 712 N PRO A 173 4.015 10.695 6.588 1.00 0.00 N ATOM 713 CA PRO A 173 2.912 9.742 6.747 1.00 0.00 C ATOM 714 C PRO A 173 1.552 10.387 6.498 1.00 0.00 C ATOM 715 O PRO A 173 1.098 11.223 7.280 1.00 0.00 O ATOM 716 CB PRO A 173 3.031 9.290 8.205 1.00 0.00 C ATOM 717 CG PRO A 173 3.765 10.391 8.888 1.00 0.00 C ATOM 718 CD PRO A 173 4.706 10.959 7.864 1.00 0.00 C ATOM 0 HA PRO A 173 2.977 8.923 6.030 1.00 0.00 H new ATOM 0 HB2 PRO A 173 2.049 9.133 8.652 1.00 0.00 H new ATOM 0 HB3 PRO A 173 3.571 8.347 8.283 1.00 0.00 H new ATOM 0 HG2 PRO A 173 3.076 11.154 9.250 1.00 0.00 H new ATOM 0 HG3 PRO A 173 4.311 10.017 9.755 1.00 0.00 H new ATOM 0 HD2 PRO A 173 4.873 12.025 8.018 1.00 0.00 H new ATOM 0 HD3 PRO A 173 5.682 10.475 7.901 1.00 0.00 H new ATOM 726 N VAL A 174 0.909 9.996 5.403 1.00 0.00 N ATOM 727 CA VAL A 174 -0.396 10.539 5.048 1.00 0.00 C ATOM 728 C VAL A 174 -1.407 9.423 4.802 1.00 0.00 C ATOM 729 O VAL A 174 -1.074 8.385 4.229 1.00 0.00 O ATOM 730 CB VAL A 174 -0.311 11.426 3.791 1.00 0.00 C ATOM 731 CG1 VAL A 174 -1.649 12.092 3.510 1.00 0.00 C ATOM 732 CG2 VAL A 174 0.788 12.467 3.945 1.00 0.00 C ATOM 0 H VAL A 174 1.271 9.305 4.746 1.00 0.00 H new ATOM 0 HA VAL A 174 -0.727 11.146 5.891 1.00 0.00 H new ATOM 0 HB VAL A 174 -0.064 10.791 2.940 1.00 0.00 H new ATOM 0 HG11 VAL A 174 -1.566 12.713 2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -2.409 11.328 3.350 1.00 0.00 H new ATOM 0 HG13 VAL A 174 -1.932 12.713 4.360 1.00 0.00 H new ATOM 0 HG21 VAL A 174 0.833 13.084 3.048 1.00 0.00 H new ATOM 0 HG22 VAL A 174 0.574 13.097 4.808 1.00 0.00 H new ATOM 0 HG23 VAL A 174 1.745 11.967 4.090 1.00 0.00 H new ATOM 742 N GLU A 175 -2.643 9.646 5.236 1.00 0.00 N ATOM 743 CA GLU A 175 -3.706 8.663 5.059 1.00 0.00 C ATOM 744 C GLU A 175 -4.378 8.837 3.701 1.00 0.00 C ATOM 745 O GLU A 175 -4.630 9.960 3.265 1.00 0.00 O ATOM 746 CB GLU A 175 -4.742 8.792 6.178 1.00 0.00 C ATOM 747 CG GLU A 175 -5.880 7.790 6.073 1.00 0.00 C ATOM 748 CD GLU A 175 -7.030 8.116 7.004 1.00 0.00 C ATOM 749 OE1 GLU A 175 -6.970 7.710 8.185 1.00 0.00 O ATOM 750 OE2 GLU A 175 -7.990 8.775 6.555 1.00 0.00 O ATOM 0 H GLU A 175 -2.934 10.499 5.713 1.00 0.00 H new ATOM 0 HA GLU A 175 -3.263 7.668 5.102 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -4.244 8.664 7.139 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -5.155 9.801 6.165 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -6.244 7.766 5.046 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -5.504 6.793 6.301 1.00 0.00 H new ATOM 757 N LEU A 176 -4.660 7.722 3.034 1.00 0.00 N ATOM 758 CA LEU A 176 -5.296 7.759 1.721 1.00 0.00 C ATOM 759 C LEU A 176 -6.186 6.548 1.505 1.00 0.00 C ATOM 760 O LEU A 176 -6.544 5.841 2.448 1.00 0.00 O ATOM 761 CB LEU A 176 -4.248 7.775 0.605 1.00 0.00 C ATOM 762 CG LEU A 176 -2.808 8.045 1.047 1.00 0.00 C ATOM 763 CD1 LEU A 176 -2.208 6.803 1.685 1.00 0.00 C ATOM 764 CD2 LEU A 176 -1.964 8.501 -0.135 1.00 0.00 C ATOM 0 H LEU A 176 -4.459 6.784 3.380 1.00 0.00 H new ATOM 0 HA LEU A 176 -5.895 8.669 1.689 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -4.276 6.814 0.092 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -4.533 8.534 -0.124 1.00 0.00 H new ATOM 0 HG LEU A 176 -2.817 8.843 1.789 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -1.184 7.011 1.994 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -2.799 6.520 2.556 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -2.210 5.986 0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -0.943 8.688 0.198 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -1.960 7.725 -0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -2.384 9.417 -0.550 1.00 0.00 H new ATOM 776 N ASP A 177 -6.506 6.304 0.241 1.00 0.00 N ATOM 777 CA ASP A 177 -7.313 5.169 -0.135 1.00 0.00 C ATOM 778 C ASP A 177 -6.868 4.644 -1.493 1.00 0.00 C ATOM 779 O ASP A 177 -6.258 5.366 -2.280 1.00 0.00 O ATOM 780 CB ASP A 177 -8.797 5.537 -0.164 1.00 0.00 C ATOM 781 CG ASP A 177 -9.209 6.389 1.022 1.00 0.00 C ATOM 782 OD1 ASP A 177 -8.849 7.584 1.048 1.00 0.00 O ATOM 783 OD2 ASP A 177 -9.894 5.859 1.923 1.00 0.00 O ATOM 0 H ASP A 177 -6.212 6.888 -0.542 1.00 0.00 H new ATOM 0 HA ASP A 177 -7.177 4.386 0.611 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -9.017 6.074 -1.087 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -9.394 4.625 -0.177 1.00 0.00 H new ATOM 788 N PHE A 178 -7.163 3.380 -1.753 1.00 0.00 N ATOM 789 CA PHE A 178 -6.789 2.739 -3.011 1.00 0.00 C ATOM 790 C PHE A 178 -7.137 3.614 -4.217 1.00 0.00 C ATOM 791 O PHE A 178 -6.485 3.537 -5.258 1.00 0.00 O ATOM 792 CB PHE A 178 -7.486 1.383 -3.140 1.00 0.00 C ATOM 793 CG PHE A 178 -6.962 0.348 -2.183 1.00 0.00 C ATOM 794 CD1 PHE A 178 -5.598 0.182 -1.999 1.00 0.00 C ATOM 795 CD2 PHE A 178 -7.834 -0.459 -1.470 1.00 0.00 C ATOM 796 CE1 PHE A 178 -5.114 -0.768 -1.121 1.00 0.00 C ATOM 797 CE2 PHE A 178 -7.356 -1.411 -0.590 1.00 0.00 C ATOM 798 CZ PHE A 178 -5.994 -1.566 -0.416 1.00 0.00 C ATOM 0 H PHE A 178 -7.664 2.771 -1.106 1.00 0.00 H new ATOM 0 HA PHE A 178 -5.709 2.596 -2.998 1.00 0.00 H new ATOM 0 HB2 PHE A 178 -8.555 1.515 -2.971 1.00 0.00 H new ATOM 0 HB3 PHE A 178 -7.367 1.017 -4.160 1.00 0.00 H new ATOM 0 HD1 PHE A 178 -4.906 0.803 -2.549 1.00 0.00 H new ATOM 0 HD2 PHE A 178 -8.899 -0.343 -1.604 1.00 0.00 H new ATOM 0 HE1 PHE A 178 -4.049 -0.887 -0.986 1.00 0.00 H new ATOM 0 HE2 PHE A 178 -8.046 -2.033 -0.039 1.00 0.00 H new ATOM 0 HZ PHE A 178 -5.618 -2.310 0.270 1.00 0.00 H new ATOM 808 N SER A 179 -8.167 4.441 -4.072 1.00 0.00 N ATOM 809 CA SER A 179 -8.597 5.325 -5.153 1.00 0.00 C ATOM 810 C SER A 179 -7.655 6.521 -5.311 1.00 0.00 C ATOM 811 O SER A 179 -7.800 7.313 -6.242 1.00 0.00 O ATOM 812 CB SER A 179 -10.022 5.817 -4.899 1.00 0.00 C ATOM 813 OG SER A 179 -10.434 6.731 -5.901 1.00 0.00 O ATOM 0 H SER A 179 -8.720 4.519 -3.218 1.00 0.00 H new ATOM 0 HA SER A 179 -8.571 4.750 -6.079 1.00 0.00 H new ATOM 0 HB2 SER A 179 -10.704 4.967 -4.875 1.00 0.00 H new ATOM 0 HB3 SER A 179 -10.075 6.296 -3.921 1.00 0.00 H new ATOM 0 HG SER A 179 -9.645 7.139 -6.316 1.00 0.00 H new ATOM 819 N GLN A 180 -6.695 6.647 -4.400 1.00 0.00 N ATOM 820 CA GLN A 180 -5.737 7.748 -4.444 1.00 0.00 C ATOM 821 C GLN A 180 -4.316 7.243 -4.697 1.00 0.00 C ATOM 822 O GLN A 180 -3.393 8.037 -4.890 1.00 0.00 O ATOM 823 CB GLN A 180 -5.782 8.538 -3.135 1.00 0.00 C ATOM 824 CG GLN A 180 -7.163 9.072 -2.791 1.00 0.00 C ATOM 825 CD GLN A 180 -7.357 10.509 -3.235 1.00 0.00 C ATOM 826 OE1 GLN A 180 -7.402 11.423 -2.413 1.00 0.00 O ATOM 827 NE2 GLN A 180 -7.476 10.714 -4.542 1.00 0.00 N ATOM 0 H GLN A 180 -6.559 6.001 -3.622 1.00 0.00 H new ATOM 0 HA GLN A 180 -6.017 8.400 -5.271 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -5.437 7.898 -2.323 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -5.085 9.373 -3.201 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -7.919 8.444 -3.262 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -7.318 9.004 -1.714 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -7.433 9.926 -5.188 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -7.611 11.660 -4.900 1.00 0.00 H new ATOM 836 N VAL A 181 -4.139 5.924 -4.693 1.00 0.00 N ATOM 837 CA VAL A 181 -2.825 5.333 -4.923 1.00 0.00 C ATOM 838 C VAL A 181 -2.929 4.051 -5.744 1.00 0.00 C ATOM 839 O VAL A 181 -3.985 3.422 -5.800 1.00 0.00 O ATOM 840 CB VAL A 181 -2.112 5.019 -3.594 1.00 0.00 C ATOM 841 CG1 VAL A 181 -1.807 6.301 -2.836 1.00 0.00 C ATOM 842 CG2 VAL A 181 -2.953 4.077 -2.745 1.00 0.00 C ATOM 0 H VAL A 181 -4.886 5.248 -4.534 1.00 0.00 H new ATOM 0 HA VAL A 181 -2.243 6.068 -5.478 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.168 4.523 -3.819 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -1.303 6.059 -1.900 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -1.161 6.937 -3.442 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -2.737 6.827 -2.622 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -2.433 3.867 -1.810 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -3.914 4.543 -2.528 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -3.115 3.145 -3.287 1.00 0.00 H new ATOM 852 N VAL A 182 -1.824 3.672 -6.379 1.00 0.00 N ATOM 853 CA VAL A 182 -1.788 2.466 -7.198 1.00 0.00 C ATOM 854 C VAL A 182 -0.790 1.456 -6.643 1.00 0.00 C ATOM 855 O VAL A 182 0.242 1.830 -6.085 1.00 0.00 O ATOM 856 CB VAL A 182 -1.413 2.788 -8.657 1.00 0.00 C ATOM 857 CG1 VAL A 182 -2.512 3.601 -9.324 1.00 0.00 C ATOM 858 CG2 VAL A 182 -0.083 3.524 -8.717 1.00 0.00 C ATOM 0 H VAL A 182 -0.942 4.183 -6.342 1.00 0.00 H new ATOM 0 HA VAL A 182 -2.790 2.037 -7.173 1.00 0.00 H new ATOM 0 HB VAL A 182 -1.307 1.850 -9.201 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.229 3.819 -10.354 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -3.442 3.032 -9.316 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -2.654 4.536 -8.781 1.00 0.00 H new ATOM 0 HG21 VAL A 182 0.165 3.743 -9.756 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -0.158 4.456 -8.157 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.698 2.901 -8.281 1.00 0.00 H new ATOM 868 N LYS A 183 -1.104 0.174 -6.798 1.00 0.00 N ATOM 869 CA LYS A 183 -0.234 -0.889 -6.311 1.00 0.00 C ATOM 870 C LYS A 183 0.832 -1.237 -7.345 1.00 0.00 C ATOM 871 O LYS A 183 0.525 -1.470 -8.514 1.00 0.00 O ATOM 872 CB LYS A 183 -1.059 -2.132 -5.967 1.00 0.00 C ATOM 873 CG LYS A 183 -0.933 -2.561 -4.513 1.00 0.00 C ATOM 874 CD LYS A 183 -2.280 -2.945 -3.923 1.00 0.00 C ATOM 875 CE LYS A 183 -2.871 -4.156 -4.628 1.00 0.00 C ATOM 876 NZ LYS A 183 -1.910 -5.292 -4.682 1.00 0.00 N ATOM 0 H LYS A 183 -1.954 -0.153 -7.257 1.00 0.00 H new ATOM 0 HA LYS A 183 0.266 -0.534 -5.410 1.00 0.00 H new ATOM 0 HB2 LYS A 183 -2.108 -1.935 -6.190 1.00 0.00 H new ATOM 0 HB3 LYS A 183 -0.746 -2.955 -6.609 1.00 0.00 H new ATOM 0 HG2 LYS A 183 -0.249 -3.407 -4.441 1.00 0.00 H new ATOM 0 HG3 LYS A 183 -0.498 -1.749 -3.930 1.00 0.00 H new ATOM 0 HD2 LYS A 183 -2.165 -3.161 -2.861 1.00 0.00 H new ATOM 0 HD3 LYS A 183 -2.968 -2.103 -4.005 1.00 0.00 H new ATOM 0 HE2 LYS A 183 -3.777 -4.471 -4.110 1.00 0.00 H new ATOM 0 HE3 LYS A 183 -3.163 -3.879 -5.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -2.430 -6.190 -4.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -1.390 -5.264 -5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -1.238 -5.216 -3.892 1.00 0.00 H new ATOM 890 N ALA A 184 2.086 -1.270 -6.907 1.00 0.00 N ATOM 891 CA ALA A 184 3.198 -1.589 -7.793 1.00 0.00 C ATOM 892 C ALA A 184 3.595 -3.056 -7.673 1.00 0.00 C ATOM 893 O ALA A 184 4.102 -3.444 -6.599 1.00 0.00 O ATOM 894 CB ALA A 184 4.388 -0.692 -7.489 1.00 0.00 C ATOM 895 OXT ALA A 184 3.392 -3.806 -8.650 1.00 0.00 O ATOM 0 H ALA A 184 2.357 -1.079 -5.942 1.00 0.00 H new ATOM 0 HA ALA A 184 2.874 -1.411 -8.819 1.00 0.00 H new ATOM 0 HB1 ALA A 184 5.212 -0.941 -8.158 1.00 0.00 H new ATOM 0 HB2 ALA A 184 4.105 0.350 -7.635 1.00 0.00 H new ATOM 0 HB3 ALA A 184 4.702 -0.842 -6.456 1.00 0.00 H new TER 901 ALA A 184