USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=8 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 Single : A 128 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.2!) USER MOD Single : A 136 GLN : amide:sc= -0.0067 X(o=-0.0067,f=-0.29) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0.024 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot -140:sc= 0.0351 USER MOD Single : A 155 ASN : amide:sc= -0.29 K(o=-0.29,f=-1.6!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 166 THR OG1 : rot 47:sc= 0.354 USER MOD Single : A 172 THR OG1 : rot -38:sc= 0.114! USER MOD Single : A 179 SER OG : rot 180:sc= 0 USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 LYS NZ :NH3+ -151:sc= -0.208 (180deg=-0.864) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 127 0.374 -10.102 -13.206 1.00 0.00 N ATOM 2 CA ALA A 127 -0.720 -9.206 -12.753 1.00 0.00 C ATOM 3 C ALA A 127 -0.463 -8.700 -11.336 1.00 0.00 C ATOM 4 O ALA A 127 0.401 -9.220 -10.630 1.00 0.00 O ATOM 5 CB ALA A 127 -2.055 -9.931 -12.820 1.00 0.00 C ATOM 0 HA ALA A 127 -0.751 -8.344 -13.420 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.849 -9.263 -12.485 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -2.250 -10.240 -13.847 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -2.024 -10.810 -12.176 1.00 0.00 H new ATOM 13 N GLN A 128 -1.217 -7.684 -10.929 1.00 0.00 N ATOM 14 CA GLN A 128 -1.069 -7.110 -9.597 1.00 0.00 C ATOM 15 C GLN A 128 -2.426 -6.956 -8.916 1.00 0.00 C ATOM 16 O GLN A 128 -2.976 -5.858 -8.847 1.00 0.00 O ATOM 17 CB GLN A 128 -0.369 -5.752 -9.679 1.00 0.00 C ATOM 18 CG GLN A 128 0.932 -5.786 -10.463 1.00 0.00 C ATOM 19 CD GLN A 128 1.874 -4.661 -10.078 1.00 0.00 C ATOM 20 OE1 GLN A 128 2.607 -4.759 -9.095 1.00 0.00 O ATOM 21 NE2 GLN A 128 1.857 -3.584 -10.856 1.00 0.00 N ATOM 0 H GLN A 128 -1.936 -7.242 -11.502 1.00 0.00 H new ATOM 0 HA GLN A 128 -0.460 -7.790 -9.002 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -1.044 -5.032 -10.142 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -0.166 -5.395 -8.669 1.00 0.00 H new ATOM 0 HG2 GLN A 128 1.427 -6.743 -10.297 1.00 0.00 H new ATOM 0 HG3 GLN A 128 0.712 -5.722 -11.529 1.00 0.00 H new ATOM 0 HE21 GLN A 128 1.232 -3.547 -11.661 1.00 0.00 H new ATOM 0 HE22 GLN A 128 2.469 -2.795 -10.648 1.00 0.00 H new ATOM 30 N VAL A 129 -2.958 -8.065 -8.413 1.00 0.00 N ATOM 31 CA VAL A 129 -4.249 -8.053 -7.735 1.00 0.00 C ATOM 32 C VAL A 129 -4.092 -8.350 -6.247 1.00 0.00 C ATOM 33 O VAL A 129 -4.845 -7.839 -5.419 1.00 0.00 O ATOM 34 CB VAL A 129 -5.218 -9.080 -8.352 1.00 0.00 C ATOM 35 CG1 VAL A 129 -5.727 -8.592 -9.699 1.00 0.00 C ATOM 36 CG2 VAL A 129 -4.543 -10.436 -8.488 1.00 0.00 C ATOM 0 H VAL A 129 -2.515 -8.983 -8.462 1.00 0.00 H new ATOM 0 HA VAL A 129 -4.663 -7.052 -7.862 1.00 0.00 H new ATOM 0 HB VAL A 129 -6.073 -9.191 -7.686 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -6.410 -9.330 -10.119 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -6.252 -7.645 -9.569 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.885 -8.450 -10.376 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -5.242 -11.148 -8.925 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -3.668 -10.344 -9.132 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -4.234 -10.789 -7.504 1.00 0.00 H new ATOM 46 N ALA A 130 -3.107 -9.178 -5.915 1.00 0.00 N ATOM 47 CA ALA A 130 -2.850 -9.543 -4.528 1.00 0.00 C ATOM 48 C ALA A 130 -2.015 -8.479 -3.826 1.00 0.00 C ATOM 49 O ALA A 130 -0.850 -8.266 -4.165 1.00 0.00 O ATOM 50 CB ALA A 130 -2.153 -10.894 -4.458 1.00 0.00 C ATOM 0 H ALA A 130 -2.474 -9.609 -6.589 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.808 -9.613 -4.014 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -1.967 -11.154 -3.416 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -2.787 -11.654 -4.914 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -1.205 -10.843 -4.994 1.00 0.00 H new ATOM 56 N PHE A 131 -2.616 -7.815 -2.845 1.00 0.00 N ATOM 57 CA PHE A 131 -1.926 -6.772 -2.093 1.00 0.00 C ATOM 58 C PHE A 131 -1.367 -7.326 -0.788 1.00 0.00 C ATOM 59 O PHE A 131 -1.833 -8.349 -0.286 1.00 0.00 O ATOM 60 CB PHE A 131 -2.878 -5.610 -1.803 1.00 0.00 C ATOM 61 CG PHE A 131 -2.173 -4.322 -1.489 1.00 0.00 C ATOM 62 CD1 PHE A 131 -1.510 -3.619 -2.483 1.00 0.00 C ATOM 63 CD2 PHE A 131 -2.173 -3.814 -0.199 1.00 0.00 C ATOM 64 CE1 PHE A 131 -0.860 -2.435 -2.196 1.00 0.00 C ATOM 65 CE2 PHE A 131 -1.524 -2.630 0.093 1.00 0.00 C ATOM 66 CZ PHE A 131 -0.867 -1.938 -0.907 1.00 0.00 C ATOM 0 H PHE A 131 -3.579 -7.980 -2.552 1.00 0.00 H new ATOM 0 HA PHE A 131 -1.095 -6.408 -2.698 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -3.527 -5.459 -2.665 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -3.520 -5.878 -0.964 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -1.502 -4.002 -3.493 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -2.686 -4.350 0.586 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -0.346 -1.897 -2.979 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -1.530 -2.245 1.102 1.00 0.00 H new ATOM 0 HZ PHE A 131 -0.360 -1.011 -0.681 1.00 0.00 H new ATOM 76 N ARG A 132 -0.363 -6.647 -0.242 1.00 0.00 N ATOM 77 CA ARG A 132 0.260 -7.075 1.006 1.00 0.00 C ATOM 78 C ARG A 132 0.621 -5.876 1.878 1.00 0.00 C ATOM 79 O ARG A 132 0.944 -4.801 1.372 1.00 0.00 O ATOM 80 CB ARG A 132 1.514 -7.905 0.714 1.00 0.00 C ATOM 81 CG ARG A 132 1.220 -9.242 0.056 1.00 0.00 C ATOM 82 CD ARG A 132 1.289 -10.385 1.056 1.00 0.00 C ATOM 83 NE ARG A 132 1.825 -11.605 0.457 1.00 0.00 N ATOM 84 CZ ARG A 132 2.321 -12.621 1.160 1.00 0.00 C ATOM 85 NH1 ARG A 132 2.348 -12.567 2.487 1.00 0.00 N ATOM 86 NH2 ARG A 132 2.791 -13.692 0.536 1.00 0.00 N ATOM 0 H ARG A 132 0.036 -5.799 -0.644 1.00 0.00 H new ATOM 0 HA ARG A 132 -0.458 -7.689 1.549 1.00 0.00 H new ATOM 0 HB2 ARG A 132 2.178 -7.330 0.068 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.050 -8.079 1.647 1.00 0.00 H new ATOM 0 HG2 ARG A 132 0.230 -9.215 -0.398 1.00 0.00 H new ATOM 0 HG3 ARG A 132 1.935 -9.418 -0.748 1.00 0.00 H new ATOM 0 HD2 ARG A 132 1.913 -10.091 1.900 1.00 0.00 H new ATOM 0 HD3 ARG A 132 0.292 -10.582 1.450 1.00 0.00 H new ATOM 0 HE ARG A 132 1.819 -11.683 -0.560 1.00 0.00 H new ATOM 0 HH11 ARG A 132 1.988 -11.745 2.971 1.00 0.00 H new ATOM 0 HH12 ARG A 132 2.729 -13.348 3.022 1.00 0.00 H new ATOM 0 HH21 ARG A 132 2.773 -13.738 -0.483 1.00 0.00 H new ATOM 0 HH22 ARG A 132 3.171 -14.470 1.075 1.00 0.00 H new ATOM 100 N GLU A 133 0.564 -6.070 3.192 1.00 0.00 N ATOM 101 CA GLU A 133 0.886 -5.005 4.136 1.00 0.00 C ATOM 102 C GLU A 133 2.350 -4.596 4.012 1.00 0.00 C ATOM 103 O GLU A 133 3.250 -5.423 4.156 1.00 0.00 O ATOM 104 CB GLU A 133 0.587 -5.455 5.567 1.00 0.00 C ATOM 105 CG GLU A 133 1.189 -6.806 5.918 1.00 0.00 C ATOM 106 CD GLU A 133 1.440 -6.963 7.405 1.00 0.00 C ATOM 107 OE1 GLU A 133 0.493 -7.333 8.132 1.00 0.00 O ATOM 108 OE2 GLU A 133 2.584 -6.716 7.843 1.00 0.00 O ATOM 0 H GLU A 133 0.298 -6.954 3.627 1.00 0.00 H new ATOM 0 HA GLU A 133 0.265 -4.141 3.899 1.00 0.00 H new ATOM 0 HB2 GLU A 133 0.967 -4.706 6.262 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -0.493 -5.500 5.707 1.00 0.00 H new ATOM 0 HG2 GLU A 133 0.519 -7.597 5.581 1.00 0.00 H new ATOM 0 HG3 GLU A 133 2.128 -6.932 5.379 1.00 0.00 H new ATOM 115 N GLY A 134 2.580 -3.314 3.744 1.00 0.00 N ATOM 116 CA GLY A 134 3.936 -2.817 3.606 1.00 0.00 C ATOM 117 C GLY A 134 4.391 -2.756 2.159 1.00 0.00 C ATOM 118 O GLY A 134 5.589 -2.681 1.884 1.00 0.00 O ATOM 0 H GLY A 134 1.851 -2.611 3.620 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.001 -1.822 4.046 1.00 0.00 H new ATOM 0 HA3 GLY A 134 4.613 -3.459 4.169 1.00 0.00 H new ATOM 122 N ASP A 135 3.438 -2.784 1.231 1.00 0.00 N ATOM 123 CA ASP A 135 3.756 -2.728 -0.190 1.00 0.00 C ATOM 124 C ASP A 135 4.074 -1.300 -0.620 1.00 0.00 C ATOM 125 O ASP A 135 3.983 -0.367 0.177 1.00 0.00 O ATOM 126 CB ASP A 135 2.593 -3.277 -1.019 1.00 0.00 C ATOM 127 CG ASP A 135 3.064 -4.091 -2.209 1.00 0.00 C ATOM 128 OD1 ASP A 135 3.554 -5.220 -1.999 1.00 0.00 O ATOM 129 OD2 ASP A 135 2.943 -3.597 -3.350 1.00 0.00 O ATOM 0 H ASP A 135 2.441 -2.845 1.439 1.00 0.00 H new ATOM 0 HA ASP A 135 4.637 -3.345 -0.363 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.960 -3.898 -0.385 1.00 0.00 H new ATOM 0 HB3 ASP A 135 1.978 -2.449 -1.370 1.00 0.00 H new ATOM 134 N GLN A 136 4.450 -1.137 -1.885 1.00 0.00 N ATOM 135 CA GLN A 136 4.785 0.179 -2.419 1.00 0.00 C ATOM 136 C GLN A 136 3.872 0.548 -3.584 1.00 0.00 C ATOM 137 O GLN A 136 3.908 -0.083 -4.641 1.00 0.00 O ATOM 138 CB GLN A 136 6.246 0.211 -2.871 1.00 0.00 C ATOM 139 CG GLN A 136 7.210 -0.368 -1.850 1.00 0.00 C ATOM 140 CD GLN A 136 8.653 0.001 -2.132 1.00 0.00 C ATOM 141 OE1 GLN A 136 8.971 1.164 -2.380 1.00 0.00 O ATOM 142 NE2 GLN A 136 9.534 -0.991 -2.099 1.00 0.00 N ATOM 0 H GLN A 136 4.530 -1.899 -2.559 1.00 0.00 H new ATOM 0 HA GLN A 136 4.639 0.911 -1.625 1.00 0.00 H new ATOM 0 HB2 GLN A 136 6.341 -0.344 -3.804 1.00 0.00 H new ATOM 0 HB3 GLN A 136 6.530 1.242 -3.083 1.00 0.00 H new ATOM 0 HG2 GLN A 136 6.936 -0.013 -0.856 1.00 0.00 H new ATOM 0 HG3 GLN A 136 7.112 -1.454 -1.839 1.00 0.00 H new ATOM 0 HE21 GLN A 136 9.226 -1.940 -1.889 1.00 0.00 H new ATOM 0 HE22 GLN A 136 10.520 -0.804 -2.284 1.00 0.00 H new ATOM 151 N VAL A 137 3.057 1.579 -3.384 1.00 0.00 N ATOM 152 CA VAL A 137 2.137 2.041 -4.417 1.00 0.00 C ATOM 153 C VAL A 137 2.354 3.521 -4.713 1.00 0.00 C ATOM 154 O VAL A 137 2.638 4.306 -3.809 1.00 0.00 O ATOM 155 CB VAL A 137 0.669 1.821 -4.002 1.00 0.00 C ATOM 156 CG1 VAL A 137 0.345 0.335 -3.949 1.00 0.00 C ATOM 157 CG2 VAL A 137 0.388 2.483 -2.662 1.00 0.00 C ATOM 0 H VAL A 137 3.015 2.111 -2.515 1.00 0.00 H new ATOM 0 HA VAL A 137 2.342 1.456 -5.314 1.00 0.00 H new ATOM 0 HB VAL A 137 0.026 2.283 -4.751 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.696 0.200 -3.654 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.504 -0.107 -4.932 1.00 0.00 H new ATOM 0 HG13 VAL A 137 0.994 -0.153 -3.222 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.653 2.317 -2.385 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.039 2.053 -1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.577 3.554 -2.738 1.00 0.00 H new ATOM 167 N ARG A 138 2.222 3.899 -5.982 1.00 0.00 N ATOM 168 CA ARG A 138 2.412 5.288 -6.386 1.00 0.00 C ATOM 169 C ARG A 138 1.171 6.121 -6.084 1.00 0.00 C ATOM 170 O ARG A 138 0.084 5.587 -5.869 1.00 0.00 O ATOM 171 CB ARG A 138 2.753 5.376 -7.876 1.00 0.00 C ATOM 172 CG ARG A 138 4.078 6.074 -8.157 1.00 0.00 C ATOM 173 CD ARG A 138 5.035 5.172 -8.920 1.00 0.00 C ATOM 174 NE ARG A 138 5.838 5.918 -9.885 1.00 0.00 N ATOM 175 CZ ARG A 138 6.930 5.432 -10.471 1.00 0.00 C ATOM 176 NH1 ARG A 138 7.354 4.206 -10.192 1.00 0.00 N ATOM 177 NH2 ARG A 138 7.602 6.177 -11.339 1.00 0.00 N ATOM 0 H ARG A 138 1.985 3.265 -6.745 1.00 0.00 H new ATOM 0 HA ARG A 138 3.246 5.690 -5.810 1.00 0.00 H new ATOM 0 HB2 ARG A 138 2.786 4.369 -8.293 1.00 0.00 H new ATOM 0 HB3 ARG A 138 1.954 5.909 -8.392 1.00 0.00 H new ATOM 0 HG2 ARG A 138 3.897 6.982 -8.732 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.536 6.378 -7.216 1.00 0.00 H new ATOM 0 HD2 ARG A 138 5.694 4.664 -8.216 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.468 4.400 -9.440 1.00 0.00 H new ATOM 0 HE ARG A 138 5.545 6.866 -10.124 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.842 3.629 -9.524 1.00 0.00 H new ATOM 0 HH12 ARG A 138 8.192 3.841 -10.645 1.00 0.00 H new ATOM 0 HH21 ARG A 138 7.282 7.121 -11.556 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.439 5.806 -11.789 1.00 0.00 H new ATOM 191 N VAL A 139 1.350 7.436 -6.061 1.00 0.00 N ATOM 192 CA VAL A 139 0.260 8.362 -5.774 1.00 0.00 C ATOM 193 C VAL A 139 -0.552 8.682 -7.033 1.00 0.00 C ATOM 194 O VAL A 139 -0.052 8.563 -8.153 1.00 0.00 O ATOM 195 CB VAL A 139 0.803 9.668 -5.170 1.00 0.00 C ATOM 196 CG1 VAL A 139 -0.334 10.605 -4.794 1.00 0.00 C ATOM 197 CG2 VAL A 139 1.681 9.372 -3.962 1.00 0.00 C ATOM 0 H VAL A 139 2.247 7.888 -6.239 1.00 0.00 H new ATOM 0 HA VAL A 139 -0.397 7.875 -5.053 1.00 0.00 H new ATOM 0 HB VAL A 139 1.413 10.165 -5.924 1.00 0.00 H new ATOM 0 HG11 VAL A 139 0.075 11.522 -4.369 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -0.916 10.846 -5.683 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -0.977 10.120 -4.060 1.00 0.00 H new ATOM 0 HG21 VAL A 139 2.057 10.307 -3.547 1.00 0.00 H new ATOM 0 HG22 VAL A 139 1.095 8.849 -3.206 1.00 0.00 H new ATOM 0 HG23 VAL A 139 2.521 8.747 -4.267 1.00 0.00 H new ATOM 207 N VAL A 140 -1.812 9.069 -6.839 1.00 0.00 N ATOM 208 CA VAL A 140 -2.708 9.389 -7.951 1.00 0.00 C ATOM 209 C VAL A 140 -2.775 10.888 -8.241 1.00 0.00 C ATOM 210 O VAL A 140 -3.113 11.294 -9.354 1.00 0.00 O ATOM 211 CB VAL A 140 -4.134 8.896 -7.660 1.00 0.00 C ATOM 212 CG1 VAL A 140 -4.157 7.383 -7.508 1.00 0.00 C ATOM 213 CG2 VAL A 140 -4.683 9.582 -6.412 1.00 0.00 C ATOM 0 H VAL A 140 -2.238 9.169 -5.917 1.00 0.00 H new ATOM 0 HA VAL A 140 -2.295 8.882 -8.823 1.00 0.00 H new ATOM 0 HB VAL A 140 -4.774 9.156 -8.503 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.175 7.053 -7.302 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -3.805 6.919 -8.429 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -3.507 7.090 -6.683 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.694 9.225 -6.215 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -4.044 9.351 -5.559 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -4.703 10.660 -6.569 1.00 0.00 H new ATOM 223 N SER A 141 -2.484 11.707 -7.239 1.00 0.00 N ATOM 224 CA SER A 141 -2.546 13.158 -7.401 1.00 0.00 C ATOM 225 C SER A 141 -1.310 13.689 -8.119 1.00 0.00 C ATOM 226 O SER A 141 -0.183 13.358 -7.761 1.00 0.00 O ATOM 227 CB SER A 141 -2.687 13.836 -6.036 1.00 0.00 C ATOM 228 OG SER A 141 -3.636 14.888 -6.085 1.00 0.00 O ATOM 0 H SER A 141 -2.204 11.396 -6.309 1.00 0.00 H new ATOM 0 HA SER A 141 -3.419 13.389 -8.011 1.00 0.00 H new ATOM 0 HB2 SER A 141 -2.992 13.101 -5.291 1.00 0.00 H new ATOM 0 HB3 SER A 141 -1.720 14.228 -5.720 1.00 0.00 H new ATOM 0 HG SER A 141 -3.709 15.304 -5.201 1.00 0.00 H new ATOM 234 N GLY A 142 -1.541 14.518 -9.136 1.00 0.00 N ATOM 235 CA GLY A 142 -0.449 15.094 -9.907 1.00 0.00 C ATOM 236 C GLY A 142 0.697 15.603 -9.051 1.00 0.00 C ATOM 237 O GLY A 142 1.831 15.148 -9.201 1.00 0.00 O ATOM 0 H GLY A 142 -2.472 14.803 -9.442 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -0.069 14.343 -10.599 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -0.835 15.917 -10.509 1.00 0.00 H new ATOM 241 N PRO A 143 0.439 16.556 -8.136 1.00 0.00 N ATOM 242 CA PRO A 143 1.475 17.116 -7.263 1.00 0.00 C ATOM 243 C PRO A 143 2.280 16.035 -6.544 1.00 0.00 C ATOM 244 O PRO A 143 3.410 16.274 -6.117 1.00 0.00 O ATOM 245 CB PRO A 143 0.690 17.968 -6.253 1.00 0.00 C ATOM 246 CG PRO A 143 -0.747 17.613 -6.452 1.00 0.00 C ATOM 247 CD PRO A 143 -0.872 17.165 -7.879 1.00 0.00 C ATOM 0 HA PRO A 143 2.211 17.686 -7.830 1.00 0.00 H new ATOM 0 HB2 PRO A 143 1.008 17.756 -5.232 1.00 0.00 H new ATOM 0 HB3 PRO A 143 0.858 19.031 -6.424 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.051 16.821 -5.767 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -1.391 18.470 -6.255 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -1.684 16.450 -8.010 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -1.070 18.000 -8.551 1.00 0.00 H new ATOM 255 N PHE A 144 1.692 14.850 -6.410 1.00 0.00 N ATOM 256 CA PHE A 144 2.357 13.738 -5.739 1.00 0.00 C ATOM 257 C PHE A 144 2.522 12.539 -6.673 1.00 0.00 C ATOM 258 O PHE A 144 2.967 11.474 -6.246 1.00 0.00 O ATOM 259 CB PHE A 144 1.551 13.306 -4.515 1.00 0.00 C ATOM 260 CG PHE A 144 1.084 14.444 -3.657 1.00 0.00 C ATOM 261 CD1 PHE A 144 1.991 15.301 -3.059 1.00 0.00 C ATOM 262 CD2 PHE A 144 -0.269 14.648 -3.443 1.00 0.00 C ATOM 263 CE1 PHE A 144 1.557 16.346 -2.264 1.00 0.00 C ATOM 264 CE2 PHE A 144 -0.712 15.687 -2.651 1.00 0.00 C ATOM 265 CZ PHE A 144 0.203 16.539 -2.060 1.00 0.00 C ATOM 0 H PHE A 144 0.757 14.635 -6.757 1.00 0.00 H new ATOM 0 HA PHE A 144 3.345 14.082 -5.434 1.00 0.00 H new ATOM 0 HB2 PHE A 144 0.684 12.736 -4.847 1.00 0.00 H new ATOM 0 HB3 PHE A 144 2.161 12.635 -3.910 1.00 0.00 H new ATOM 0 HD1 PHE A 144 3.049 15.152 -3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -0.987 13.985 -3.902 1.00 0.00 H new ATOM 0 HE1 PHE A 144 2.274 17.010 -1.804 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -1.770 15.835 -2.493 1.00 0.00 H new ATOM 0 HZ PHE A 144 -0.140 17.354 -1.440 1.00 0.00 H new ATOM 275 N ALA A 145 2.147 12.705 -7.939 1.00 0.00 N ATOM 276 CA ALA A 145 2.231 11.622 -8.915 1.00 0.00 C ATOM 277 C ALA A 145 3.674 11.274 -9.282 1.00 0.00 C ATOM 278 O ALA A 145 3.995 11.089 -10.456 1.00 0.00 O ATOM 279 CB ALA A 145 1.445 11.988 -10.166 1.00 0.00 C ATOM 0 H ALA A 145 1.781 13.581 -8.313 1.00 0.00 H new ATOM 0 HA ALA A 145 1.797 10.736 -8.453 1.00 0.00 H new ATOM 0 HB1 ALA A 145 1.513 11.175 -10.889 1.00 0.00 H new ATOM 0 HB2 ALA A 145 0.400 12.154 -9.904 1.00 0.00 H new ATOM 0 HB3 ALA A 145 1.859 12.897 -10.603 1.00 0.00 H new ATOM 285 N ASP A 146 4.536 11.168 -8.277 1.00 0.00 N ATOM 286 CA ASP A 146 5.931 10.822 -8.504 1.00 0.00 C ATOM 287 C ASP A 146 6.566 10.309 -7.221 1.00 0.00 C ATOM 288 O ASP A 146 7.760 10.493 -6.984 1.00 0.00 O ATOM 289 CB ASP A 146 6.710 12.024 -9.042 1.00 0.00 C ATOM 290 CG ASP A 146 6.555 13.253 -8.168 1.00 0.00 C ATOM 291 OD1 ASP A 146 5.415 13.543 -7.747 1.00 0.00 O ATOM 292 OD2 ASP A 146 7.574 13.924 -7.901 1.00 0.00 O ATOM 0 H ASP A 146 4.292 11.317 -7.298 1.00 0.00 H new ATOM 0 HA ASP A 146 5.968 10.030 -9.252 1.00 0.00 H new ATOM 0 HB2 ASP A 146 7.766 11.765 -9.116 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.367 12.254 -10.051 1.00 0.00 H new ATOM 297 N PHE A 147 5.752 9.660 -6.401 1.00 0.00 N ATOM 298 CA PHE A 147 6.216 9.110 -5.135 1.00 0.00 C ATOM 299 C PHE A 147 5.322 7.959 -4.696 1.00 0.00 C ATOM 300 O PHE A 147 4.117 7.969 -4.941 1.00 0.00 O ATOM 301 CB PHE A 147 6.240 10.194 -4.055 1.00 0.00 C ATOM 302 CG PHE A 147 6.953 11.448 -4.475 1.00 0.00 C ATOM 303 CD1 PHE A 147 8.337 11.498 -4.501 1.00 0.00 C ATOM 304 CD2 PHE A 147 6.239 12.577 -4.842 1.00 0.00 C ATOM 305 CE1 PHE A 147 8.996 12.650 -4.887 1.00 0.00 C ATOM 306 CE2 PHE A 147 6.891 13.732 -5.228 1.00 0.00 C ATOM 307 CZ PHE A 147 8.272 13.769 -5.250 1.00 0.00 C ATOM 0 H PHE A 147 4.763 9.501 -6.591 1.00 0.00 H new ATOM 0 HA PHE A 147 7.229 8.735 -5.277 1.00 0.00 H new ATOM 0 HB2 PHE A 147 5.215 10.444 -3.780 1.00 0.00 H new ATOM 0 HB3 PHE A 147 6.721 9.795 -3.162 1.00 0.00 H new ATOM 0 HD1 PHE A 147 8.908 10.627 -4.216 1.00 0.00 H new ATOM 0 HD2 PHE A 147 5.159 12.554 -4.826 1.00 0.00 H new ATOM 0 HE1 PHE A 147 10.076 12.675 -4.905 1.00 0.00 H new ATOM 0 HE2 PHE A 147 6.322 14.605 -5.512 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.784 14.671 -5.550 1.00 0.00 H new ATOM 317 N THR A 148 5.917 6.966 -4.046 1.00 0.00 N ATOM 318 CA THR A 148 5.164 5.810 -3.579 1.00 0.00 C ATOM 319 C THR A 148 4.885 5.914 -2.084 1.00 0.00 C ATOM 320 O THR A 148 5.442 6.767 -1.395 1.00 0.00 O ATOM 321 CB THR A 148 5.928 4.520 -3.881 1.00 0.00 C ATOM 322 OG1 THR A 148 7.324 4.714 -3.721 1.00 0.00 O ATOM 323 CG2 THR A 148 5.695 4.000 -5.283 1.00 0.00 C ATOM 0 H THR A 148 6.914 6.938 -3.831 1.00 0.00 H new ATOM 0 HA THR A 148 4.211 5.789 -4.108 1.00 0.00 H new ATOM 0 HB THR A 148 5.547 3.786 -3.171 1.00 0.00 H new ATOM 0 HG1 THR A 148 7.795 3.877 -3.917 1.00 0.00 H new ATOM 0 HG21 THR A 148 6.266 3.083 -5.431 1.00 0.00 H new ATOM 0 HG22 THR A 148 4.634 3.793 -5.423 1.00 0.00 H new ATOM 0 HG23 THR A 148 6.017 4.749 -6.007 1.00 0.00 H new ATOM 331 N GLY A 149 4.015 5.040 -1.588 1.00 0.00 N ATOM 332 CA GLY A 149 3.675 5.052 -0.177 1.00 0.00 C ATOM 333 C GLY A 149 3.722 3.670 0.443 1.00 0.00 C ATOM 334 O GLY A 149 3.179 2.713 -0.111 1.00 0.00 O ATOM 0 H GLY A 149 3.540 4.324 -2.138 1.00 0.00 H new ATOM 0 HA2 GLY A 149 4.364 5.709 0.354 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.676 5.470 -0.051 1.00 0.00 H new ATOM 338 N THR A 150 4.373 3.567 1.596 1.00 0.00 N ATOM 339 CA THR A 150 4.491 2.294 2.298 1.00 0.00 C ATOM 340 C THR A 150 3.294 2.069 3.217 1.00 0.00 C ATOM 341 O THR A 150 3.154 2.736 4.242 1.00 0.00 O ATOM 342 CB THR A 150 5.786 2.253 3.110 1.00 0.00 C ATOM 343 OG1 THR A 150 6.858 2.814 2.374 1.00 0.00 O ATOM 344 CG2 THR A 150 6.192 0.853 3.518 1.00 0.00 C ATOM 0 H THR A 150 4.828 4.350 2.065 1.00 0.00 H new ATOM 0 HA THR A 150 4.512 1.497 1.554 1.00 0.00 H new ATOM 0 HB THR A 150 5.581 2.832 4.011 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.677 2.780 2.911 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.118 0.895 4.091 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.406 0.410 4.130 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.344 0.244 2.627 1.00 0.00 H new ATOM 352 N VAL A 151 2.434 1.127 2.843 1.00 0.00 N ATOM 353 CA VAL A 151 1.249 0.816 3.635 1.00 0.00 C ATOM 354 C VAL A 151 1.633 0.257 5.001 1.00 0.00 C ATOM 355 O VAL A 151 2.350 -0.737 5.098 1.00 0.00 O ATOM 356 CB VAL A 151 0.341 -0.200 2.918 1.00 0.00 C ATOM 357 CG1 VAL A 151 -0.984 -0.341 3.648 1.00 0.00 C ATOM 358 CG2 VAL A 151 0.120 0.207 1.469 1.00 0.00 C ATOM 0 H VAL A 151 2.535 0.566 1.997 1.00 0.00 H new ATOM 0 HA VAL A 151 0.704 1.751 3.765 1.00 0.00 H new ATOM 0 HB VAL A 151 0.838 -1.170 2.925 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -1.612 -1.063 3.126 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -0.804 -0.686 4.666 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -1.488 0.625 3.676 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.524 -0.524 0.980 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -0.353 1.188 1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 151 1.079 0.249 0.952 1.00 0.00 H new ATOM 368 N THR A 152 1.146 0.904 6.055 1.00 0.00 N ATOM 369 CA THR A 152 1.434 0.472 7.417 1.00 0.00 C ATOM 370 C THR A 152 0.259 -0.305 8.003 1.00 0.00 C ATOM 371 O THR A 152 0.445 -1.342 8.640 1.00 0.00 O ATOM 372 CB THR A 152 1.753 1.679 8.302 1.00 0.00 C ATOM 373 OG1 THR A 152 0.978 2.801 7.918 1.00 0.00 O ATOM 374 CG2 THR A 152 3.210 2.087 8.257 1.00 0.00 C ATOM 0 H THR A 152 0.550 1.729 5.992 1.00 0.00 H new ATOM 0 HA THR A 152 2.302 -0.186 7.385 1.00 0.00 H new ATOM 0 HB THR A 152 1.514 1.364 9.318 1.00 0.00 H new ATOM 0 HG1 THR A 152 1.529 3.610 7.962 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.367 2.948 8.906 1.00 0.00 H new ATOM 0 HG22 THR A 152 3.831 1.258 8.597 1.00 0.00 H new ATOM 0 HG23 THR A 152 3.483 2.349 7.235 1.00 0.00 H new ATOM 382 N GLU A 153 -0.948 0.203 7.782 1.00 0.00 N ATOM 383 CA GLU A 153 -2.153 -0.445 8.288 1.00 0.00 C ATOM 384 C GLU A 153 -3.251 -0.456 7.228 1.00 0.00 C ATOM 385 O GLU A 153 -3.309 0.425 6.370 1.00 0.00 O ATOM 386 CB GLU A 153 -2.651 0.269 9.546 1.00 0.00 C ATOM 387 CG GLU A 153 -2.052 -0.279 10.833 1.00 0.00 C ATOM 388 CD GLU A 153 -2.073 0.732 11.962 1.00 0.00 C ATOM 389 OE1 GLU A 153 -1.186 1.611 11.990 1.00 0.00 O ATOM 390 OE2 GLU A 153 -2.978 0.646 12.819 1.00 0.00 O ATOM 0 H GLU A 153 -1.119 1.060 7.257 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.903 -1.476 8.538 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -2.416 1.331 9.469 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -3.737 0.186 9.596 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -2.604 -1.169 11.136 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -1.024 -0.590 10.647 1.00 0.00 H new ATOM 397 N ILE A 154 -4.119 -1.460 7.294 1.00 0.00 N ATOM 398 CA ILE A 154 -5.216 -1.585 6.341 1.00 0.00 C ATOM 399 C ILE A 154 -6.549 -1.766 7.059 1.00 0.00 C ATOM 400 O ILE A 154 -6.669 -2.586 7.970 1.00 0.00 O ATOM 401 CB ILE A 154 -4.994 -2.771 5.382 1.00 0.00 C ATOM 402 CG1 ILE A 154 -3.604 -2.691 4.749 1.00 0.00 C ATOM 403 CG2 ILE A 154 -6.069 -2.794 4.307 1.00 0.00 C ATOM 404 CD1 ILE A 154 -2.988 -4.044 4.471 1.00 0.00 C ATOM 0 H ILE A 154 -4.084 -2.198 7.997 1.00 0.00 H new ATOM 0 HA ILE A 154 -5.241 -0.661 5.763 1.00 0.00 H new ATOM 0 HB ILE A 154 -5.060 -3.696 5.954 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -3.670 -2.132 3.815 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -2.944 -2.129 5.410 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -5.897 -3.638 3.639 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -7.049 -2.895 4.774 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -6.033 -1.866 3.737 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -2.004 -3.910 4.023 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -2.889 -4.598 5.405 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -3.627 -4.601 3.785 1.00 0.00 H new ATOM 416 N ASN A 155 -7.549 -0.997 6.642 1.00 0.00 N ATOM 417 CA ASN A 155 -8.875 -1.072 7.246 1.00 0.00 C ATOM 418 C ASN A 155 -9.913 -1.531 6.223 1.00 0.00 C ATOM 419 O ASN A 155 -10.578 -0.710 5.592 1.00 0.00 O ATOM 420 CB ASN A 155 -9.272 0.290 7.823 1.00 0.00 C ATOM 421 CG ASN A 155 -9.451 0.251 9.328 1.00 0.00 C ATOM 422 OD1 ASN A 155 -8.882 -0.601 10.010 1.00 0.00 O ATOM 423 ND2 ASN A 155 -10.245 1.176 9.854 1.00 0.00 N ATOM 0 H ASN A 155 -7.467 -0.315 5.888 1.00 0.00 H new ATOM 0 HA ASN A 155 -8.841 -1.803 8.053 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -8.508 1.025 7.570 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -10.200 0.622 7.358 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -10.403 1.199 10.861 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -10.697 1.863 9.251 1.00 0.00 H new ATOM 430 N PRO A 156 -10.065 -2.854 6.047 1.00 0.00 N ATOM 431 CA PRO A 156 -11.027 -3.419 5.095 1.00 0.00 C ATOM 432 C PRO A 156 -12.458 -2.977 5.386 1.00 0.00 C ATOM 433 O PRO A 156 -13.281 -2.866 4.478 1.00 0.00 O ATOM 434 CB PRO A 156 -10.891 -4.934 5.292 1.00 0.00 C ATOM 435 CG PRO A 156 -9.550 -5.123 5.916 1.00 0.00 C ATOM 436 CD PRO A 156 -9.311 -3.903 6.757 1.00 0.00 C ATOM 0 HA PRO A 156 -10.824 -3.090 4.076 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -11.683 -5.321 5.933 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -10.962 -5.464 4.342 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -9.526 -6.027 6.524 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -8.777 -5.230 5.155 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -9.672 -4.039 7.776 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -8.250 -3.661 6.824 1.00 0.00 H new ATOM 444 N GLU A 157 -12.745 -2.729 6.659 1.00 0.00 N ATOM 445 CA GLU A 157 -14.077 -2.301 7.074 1.00 0.00 C ATOM 446 C GLU A 157 -14.464 -0.985 6.406 1.00 0.00 C ATOM 447 O GLU A 157 -15.428 -0.926 5.644 1.00 0.00 O ATOM 448 CB GLU A 157 -14.134 -2.147 8.595 1.00 0.00 C ATOM 449 CG GLU A 157 -15.536 -1.899 9.128 1.00 0.00 C ATOM 450 CD GLU A 157 -15.648 -2.165 10.616 1.00 0.00 C ATOM 451 OE1 GLU A 157 -15.106 -1.363 11.406 1.00 0.00 O ATOM 452 OE2 GLU A 157 -16.278 -3.177 10.993 1.00 0.00 O ATOM 0 H GLU A 157 -12.074 -2.817 7.422 1.00 0.00 H new ATOM 0 HA GLU A 157 -14.788 -3.067 6.763 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -13.732 -3.048 9.059 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -13.489 -1.320 8.893 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -15.821 -0.867 8.924 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -16.242 -2.536 8.594 1.00 0.00 H new ATOM 459 N ARG A 158 -13.707 0.067 6.699 1.00 0.00 N ATOM 460 CA ARG A 158 -13.976 1.382 6.126 1.00 0.00 C ATOM 461 C ARG A 158 -13.433 1.481 4.705 1.00 0.00 C ATOM 462 O ARG A 158 -13.987 2.193 3.868 1.00 0.00 O ATOM 463 CB ARG A 158 -13.355 2.475 6.999 1.00 0.00 C ATOM 464 CG ARG A 158 -14.142 3.776 6.994 1.00 0.00 C ATOM 465 CD ARG A 158 -13.429 4.862 7.783 1.00 0.00 C ATOM 466 NE ARG A 158 -13.801 4.846 9.195 1.00 0.00 N ATOM 467 CZ ARG A 158 -13.582 5.861 10.029 1.00 0.00 C ATOM 468 NH1 ARG A 158 -12.995 6.969 9.598 1.00 0.00 N ATOM 469 NH2 ARG A 158 -13.952 5.764 11.299 1.00 0.00 N ATOM 0 H ARG A 158 -12.905 0.036 7.328 1.00 0.00 H new ATOM 0 HA ARG A 158 -15.056 1.521 6.091 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -13.278 2.110 8.023 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -12.340 2.672 6.653 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -14.290 4.109 5.967 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -15.131 3.606 7.419 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -12.351 4.729 7.691 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -13.668 5.836 7.356 1.00 0.00 H new ATOM 0 HE ARG A 158 -14.254 4.010 9.564 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -12.708 7.048 8.622 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -12.830 7.743 10.242 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -14.403 4.913 11.635 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -13.785 6.540 11.939 1.00 0.00 H new ATOM 483 N GLY A 159 -12.348 0.762 4.439 1.00 0.00 N ATOM 484 CA GLY A 159 -11.750 0.783 3.117 1.00 0.00 C ATOM 485 C GLY A 159 -10.643 1.812 2.995 1.00 0.00 C ATOM 486 O GLY A 159 -10.374 2.317 1.906 1.00 0.00 O ATOM 0 H GLY A 159 -11.872 0.165 5.115 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -11.350 -0.205 2.887 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -12.521 0.995 2.376 1.00 0.00 H new ATOM 490 N LYS A 160 -10.000 2.123 4.117 1.00 0.00 N ATOM 491 CA LYS A 160 -8.915 3.098 4.130 1.00 0.00 C ATOM 492 C LYS A 160 -7.568 2.406 4.326 1.00 0.00 C ATOM 493 O LYS A 160 -7.509 1.256 4.761 1.00 0.00 O ATOM 494 CB LYS A 160 -9.142 4.131 5.235 1.00 0.00 C ATOM 495 CG LYS A 160 -9.587 5.489 4.716 1.00 0.00 C ATOM 496 CD LYS A 160 -9.461 6.565 5.784 1.00 0.00 C ATOM 497 CE LYS A 160 -10.821 6.981 6.322 1.00 0.00 C ATOM 498 NZ LYS A 160 -11.535 7.891 5.383 1.00 0.00 N ATOM 0 H LYS A 160 -10.211 1.714 5.027 1.00 0.00 H new ATOM 0 HA LYS A 160 -8.904 3.608 3.167 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -9.894 3.751 5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -8.219 4.253 5.802 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -8.985 5.763 3.850 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -10.622 5.429 4.379 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -8.843 6.196 6.602 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -8.952 7.434 5.367 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -11.428 6.093 6.500 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -10.694 7.478 7.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -12.458 8.152 5.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -10.968 8.750 5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -11.679 7.408 4.473 1.00 0.00 H new ATOM 512 N VAL A 161 -6.490 3.114 4.005 1.00 0.00 N ATOM 513 CA VAL A 161 -5.147 2.566 4.148 1.00 0.00 C ATOM 514 C VAL A 161 -4.120 3.673 4.352 1.00 0.00 C ATOM 515 O VAL A 161 -3.997 4.580 3.530 1.00 0.00 O ATOM 516 CB VAL A 161 -4.745 1.735 2.914 1.00 0.00 C ATOM 517 CG1 VAL A 161 -5.547 0.444 2.857 1.00 0.00 C ATOM 518 CG2 VAL A 161 -4.931 2.547 1.640 1.00 0.00 C ATOM 0 H VAL A 161 -6.521 4.068 3.644 1.00 0.00 H new ATOM 0 HA VAL A 161 -5.162 1.920 5.026 1.00 0.00 H new ATOM 0 HB VAL A 161 -3.690 1.476 2.999 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -5.250 -0.130 1.979 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -5.357 -0.143 3.756 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -6.610 0.678 2.795 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -4.642 1.944 0.779 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -5.977 2.839 1.544 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.307 3.440 1.683 1.00 0.00 H new ATOM 528 N LYS A 162 -3.381 3.589 5.454 1.00 0.00 N ATOM 529 CA LYS A 162 -2.360 4.582 5.765 1.00 0.00 C ATOM 530 C LYS A 162 -1.041 4.234 5.085 1.00 0.00 C ATOM 531 O LYS A 162 -0.713 3.060 4.912 1.00 0.00 O ATOM 532 CB LYS A 162 -2.159 4.680 7.279 1.00 0.00 C ATOM 533 CG LYS A 162 -1.133 5.724 7.688 1.00 0.00 C ATOM 534 CD LYS A 162 -0.721 5.558 9.142 1.00 0.00 C ATOM 535 CE LYS A 162 -0.165 6.853 9.715 1.00 0.00 C ATOM 536 NZ LYS A 162 -0.418 6.966 11.178 1.00 0.00 N ATOM 0 H LYS A 162 -3.470 2.844 6.145 1.00 0.00 H new ATOM 0 HA LYS A 162 -2.698 5.547 5.388 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -3.113 4.916 7.750 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -1.848 3.707 7.660 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -0.254 5.643 7.048 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -1.546 6.721 7.537 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -1.581 5.238 9.731 1.00 0.00 H new ATOM 0 HD3 LYS A 162 0.030 4.772 9.221 1.00 0.00 H new ATOM 0 HE2 LYS A 162 0.908 6.902 9.527 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -0.618 7.701 9.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -0.024 7.862 11.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -1.442 6.945 11.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 0.036 6.171 11.671 1.00 0.00 H new ATOM 550 N VAL A 163 -0.289 5.259 4.699 1.00 0.00 N ATOM 551 CA VAL A 163 0.993 5.056 4.035 1.00 0.00 C ATOM 552 C VAL A 163 2.000 6.129 4.436 1.00 0.00 C ATOM 553 O VAL A 163 1.645 7.122 5.072 1.00 0.00 O ATOM 554 CB VAL A 163 0.837 5.058 2.501 1.00 0.00 C ATOM 555 CG1 VAL A 163 -0.142 3.980 2.063 1.00 0.00 C ATOM 556 CG2 VAL A 163 0.386 6.425 2.007 1.00 0.00 C ATOM 0 H VAL A 163 -0.545 6.237 4.834 1.00 0.00 H new ATOM 0 HA VAL A 163 1.363 4.082 4.354 1.00 0.00 H new ATOM 0 HB VAL A 163 1.809 4.840 2.058 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -0.239 3.996 0.977 1.00 0.00 H new ATOM 0 HG12 VAL A 163 0.226 3.004 2.380 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -1.115 4.166 2.517 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.282 6.404 0.922 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -0.574 6.677 2.458 1.00 0.00 H new ATOM 0 HG23 VAL A 163 1.126 7.175 2.286 1.00 0.00 H new ATOM 566 N MET A 164 3.256 5.927 4.052 1.00 0.00 N ATOM 567 CA MET A 164 4.314 6.882 4.365 1.00 0.00 C ATOM 568 C MET A 164 4.951 7.418 3.086 1.00 0.00 C ATOM 569 O MET A 164 5.640 6.690 2.370 1.00 0.00 O ATOM 570 CB MET A 164 5.376 6.229 5.256 1.00 0.00 C ATOM 571 CG MET A 164 6.212 5.176 4.548 1.00 0.00 C ATOM 572 SD MET A 164 7.848 5.780 4.085 1.00 0.00 S ATOM 573 CE MET A 164 8.890 4.794 5.158 1.00 0.00 C ATOM 0 H MET A 164 3.566 5.111 3.524 1.00 0.00 H new ATOM 0 HA MET A 164 3.872 7.719 4.906 1.00 0.00 H new ATOM 0 HB2 MET A 164 6.038 7.004 5.643 1.00 0.00 H new ATOM 0 HB3 MET A 164 4.884 5.771 6.115 1.00 0.00 H new ATOM 0 HG2 MET A 164 6.320 4.307 5.197 1.00 0.00 H new ATOM 0 HG3 MET A 164 5.686 4.842 3.654 1.00 0.00 H new ATOM 0 HE1 MET A 164 9.935 5.053 4.989 1.00 0.00 H new ATOM 0 HE2 MET A 164 8.631 4.991 6.198 1.00 0.00 H new ATOM 0 HE3 MET A 164 8.739 3.737 4.941 1.00 0.00 H new ATOM 583 N VAL A 165 4.716 8.695 2.803 1.00 0.00 N ATOM 584 CA VAL A 165 5.265 9.326 1.609 1.00 0.00 C ATOM 585 C VAL A 165 6.512 10.137 1.940 1.00 0.00 C ATOM 586 O VAL A 165 6.719 10.539 3.085 1.00 0.00 O ATOM 587 CB VAL A 165 4.232 10.249 0.935 1.00 0.00 C ATOM 588 CG1 VAL A 165 3.140 9.429 0.266 1.00 0.00 C ATOM 589 CG2 VAL A 165 3.640 11.217 1.945 1.00 0.00 C ATOM 0 H VAL A 165 4.149 9.313 3.384 1.00 0.00 H new ATOM 0 HA VAL A 165 5.528 8.523 0.921 1.00 0.00 H new ATOM 0 HB VAL A 165 4.740 10.831 0.166 1.00 0.00 H new ATOM 0 HG11 VAL A 165 2.419 10.098 -0.205 1.00 0.00 H new ATOM 0 HG12 VAL A 165 3.583 8.782 -0.491 1.00 0.00 H new ATOM 0 HG13 VAL A 165 2.634 8.819 1.014 1.00 0.00 H new ATOM 0 HG21 VAL A 165 2.913 11.860 1.450 1.00 0.00 H new ATOM 0 HG22 VAL A 165 3.147 10.657 2.740 1.00 0.00 H new ATOM 0 HG23 VAL A 165 4.435 11.829 2.371 1.00 0.00 H new ATOM 599 N THR A 166 7.342 10.374 0.930 1.00 0.00 N ATOM 600 CA THR A 166 8.569 11.137 1.112 1.00 0.00 C ATOM 601 C THR A 166 8.830 12.045 -0.085 1.00 0.00 C ATOM 602 O THR A 166 9.369 11.606 -1.102 1.00 0.00 O ATOM 603 CB THR A 166 9.754 10.196 1.321 1.00 0.00 C ATOM 604 OG1 THR A 166 9.794 9.207 0.307 1.00 0.00 O ATOM 605 CG2 THR A 166 9.726 9.483 2.655 1.00 0.00 C ATOM 0 H THR A 166 7.186 10.048 -0.024 1.00 0.00 H new ATOM 0 HA THR A 166 8.449 11.761 1.998 1.00 0.00 H new ATOM 0 HB THR A 166 10.637 10.834 1.287 1.00 0.00 H new ATOM 0 HG1 THR A 166 9.680 9.632 -0.569 1.00 0.00 H new ATOM 0 HG21 THR A 166 10.596 8.831 2.738 1.00 0.00 H new ATOM 0 HG22 THR A 166 9.745 10.217 3.460 1.00 0.00 H new ATOM 0 HG23 THR A 166 8.817 8.886 2.730 1.00 0.00 H new ATOM 613 N ILE A 167 8.445 13.310 0.041 1.00 0.00 N ATOM 614 CA ILE A 167 8.640 14.278 -1.033 1.00 0.00 C ATOM 615 C ILE A 167 10.075 14.792 -1.050 1.00 0.00 C ATOM 616 O ILE A 167 10.373 15.849 -0.494 1.00 0.00 O ATOM 617 CB ILE A 167 7.678 15.475 -0.896 1.00 0.00 C ATOM 618 CG1 ILE A 167 6.242 14.986 -0.697 1.00 0.00 C ATOM 619 CG2 ILE A 167 7.775 16.373 -2.119 1.00 0.00 C ATOM 620 CD1 ILE A 167 5.822 14.915 0.755 1.00 0.00 C ATOM 0 H ILE A 167 7.997 13.689 0.875 1.00 0.00 H new ATOM 0 HA ILE A 167 8.429 13.760 -1.969 1.00 0.00 H new ATOM 0 HB ILE A 167 7.966 16.055 -0.019 1.00 0.00 H new ATOM 0 HG12 ILE A 167 5.563 15.651 -1.231 1.00 0.00 H new ATOM 0 HG13 ILE A 167 6.138 13.998 -1.145 1.00 0.00 H new ATOM 0 HG21 ILE A 167 7.090 17.214 -2.008 1.00 0.00 H new ATOM 0 HG22 ILE A 167 8.795 16.746 -2.217 1.00 0.00 H new ATOM 0 HG23 ILE A 167 7.510 15.804 -3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 167 4.793 14.561 0.819 1.00 0.00 H new ATOM 0 HD12 ILE A 167 6.477 14.227 1.290 1.00 0.00 H new ATOM 0 HD13 ILE A 167 5.893 15.906 1.203 1.00 0.00 H new ATOM 632 N PHE A 168 10.961 14.033 -1.687 1.00 0.00 N ATOM 633 CA PHE A 168 12.368 14.407 -1.776 1.00 0.00 C ATOM 634 C PHE A 168 13.003 14.471 -0.390 1.00 0.00 C ATOM 635 O PHE A 168 13.322 15.549 0.111 1.00 0.00 O ATOM 636 CB PHE A 168 12.517 15.756 -2.484 1.00 0.00 C ATOM 637 CG PHE A 168 12.551 15.646 -3.982 1.00 0.00 C ATOM 638 CD1 PHE A 168 11.375 15.539 -4.708 1.00 0.00 C ATOM 639 CD2 PHE A 168 13.757 15.650 -4.663 1.00 0.00 C ATOM 640 CE1 PHE A 168 11.403 15.438 -6.087 1.00 0.00 C ATOM 641 CE2 PHE A 168 13.792 15.549 -6.041 1.00 0.00 C ATOM 642 CZ PHE A 168 12.613 15.443 -6.754 1.00 0.00 C ATOM 0 H PHE A 168 10.729 13.154 -2.150 1.00 0.00 H new ATOM 0 HA PHE A 168 12.885 13.643 -2.357 1.00 0.00 H new ATOM 0 HB2 PHE A 168 11.689 16.403 -2.194 1.00 0.00 H new ATOM 0 HB3 PHE A 168 13.433 16.238 -2.142 1.00 0.00 H new ATOM 0 HD1 PHE A 168 10.427 15.534 -4.191 1.00 0.00 H new ATOM 0 HD2 PHE A 168 14.681 15.733 -4.111 1.00 0.00 H new ATOM 0 HE1 PHE A 168 10.480 15.355 -6.642 1.00 0.00 H new ATOM 0 HE2 PHE A 168 14.739 15.553 -6.560 1.00 0.00 H new ATOM 0 HZ PHE A 168 12.637 15.364 -7.831 1.00 0.00 H new ATOM 652 N GLY A 169 13.180 13.307 0.227 1.00 0.00 N ATOM 653 CA GLY A 169 13.775 13.250 1.549 1.00 0.00 C ATOM 654 C GLY A 169 12.973 14.016 2.581 1.00 0.00 C ATOM 655 O GLY A 169 13.529 14.791 3.359 1.00 0.00 O ATOM 0 H GLY A 169 12.922 12.402 -0.166 1.00 0.00 H new ATOM 0 HA2 GLY A 169 13.861 12.209 1.860 1.00 0.00 H new ATOM 0 HA3 GLY A 169 14.786 13.655 1.506 1.00 0.00 H new ATOM 659 N ARG A 170 11.662 13.801 2.589 1.00 0.00 N ATOM 660 CA ARG A 170 10.781 14.478 3.535 1.00 0.00 C ATOM 661 C ARG A 170 9.618 13.578 3.938 1.00 0.00 C ATOM 662 O ARG A 170 8.574 13.564 3.286 1.00 0.00 O ATOM 663 CB ARG A 170 10.246 15.776 2.925 1.00 0.00 C ATOM 664 CG ARG A 170 11.270 16.900 2.893 1.00 0.00 C ATOM 665 CD ARG A 170 10.761 18.142 3.606 1.00 0.00 C ATOM 666 NE ARG A 170 9.521 18.642 3.021 1.00 0.00 N ATOM 667 CZ ARG A 170 9.051 19.872 3.216 1.00 0.00 C ATOM 668 NH1 ARG A 170 9.714 20.730 3.979 1.00 0.00 N ATOM 669 NH2 ARG A 170 7.913 20.246 2.645 1.00 0.00 N ATOM 0 H ARG A 170 11.185 13.163 1.951 1.00 0.00 H new ATOM 0 HA ARG A 170 11.361 14.713 4.427 1.00 0.00 H new ATOM 0 HB2 ARG A 170 9.905 15.577 1.909 1.00 0.00 H new ATOM 0 HB3 ARG A 170 9.376 16.104 3.494 1.00 0.00 H new ATOM 0 HG2 ARG A 170 12.195 16.564 3.362 1.00 0.00 H new ATOM 0 HG3 ARG A 170 11.509 17.146 1.858 1.00 0.00 H new ATOM 0 HD2 ARG A 170 10.598 17.914 4.659 1.00 0.00 H new ATOM 0 HD3 ARG A 170 11.522 18.921 3.563 1.00 0.00 H new ATOM 0 HE ARG A 170 8.982 18.011 2.427 1.00 0.00 H new ATOM 0 HH11 ARG A 170 10.590 20.449 4.420 1.00 0.00 H new ATOM 0 HH12 ARG A 170 9.349 21.671 4.124 1.00 0.00 H new ATOM 0 HH21 ARG A 170 7.398 19.591 2.057 1.00 0.00 H new ATOM 0 HH22 ARG A 170 7.553 21.189 2.795 1.00 0.00 H new ATOM 683 N GLU A 171 9.807 12.826 5.020 1.00 0.00 N ATOM 684 CA GLU A 171 8.774 11.921 5.512 1.00 0.00 C ATOM 685 C GLU A 171 7.488 12.680 5.829 1.00 0.00 C ATOM 686 O GLU A 171 7.525 13.788 6.361 1.00 0.00 O ATOM 687 CB GLU A 171 9.265 11.187 6.761 1.00 0.00 C ATOM 688 CG GLU A 171 9.708 12.117 7.878 1.00 0.00 C ATOM 689 CD GLU A 171 11.212 12.307 7.916 1.00 0.00 C ATOM 690 OE1 GLU A 171 11.930 11.311 8.146 1.00 0.00 O ATOM 691 OE2 GLU A 171 11.671 13.451 7.716 1.00 0.00 O ATOM 0 H GLU A 171 10.665 12.826 5.571 1.00 0.00 H new ATOM 0 HA GLU A 171 8.561 11.194 4.729 1.00 0.00 H new ATOM 0 HB2 GLU A 171 8.467 10.543 7.131 1.00 0.00 H new ATOM 0 HB3 GLU A 171 10.097 10.539 6.488 1.00 0.00 H new ATOM 0 HG2 GLU A 171 9.226 13.086 7.751 1.00 0.00 H new ATOM 0 HG3 GLU A 171 9.372 11.716 8.834 1.00 0.00 H new ATOM 698 N THR A 172 6.353 12.074 5.497 1.00 0.00 N ATOM 699 CA THR A 172 5.055 12.693 5.746 1.00 0.00 C ATOM 700 C THR A 172 3.941 11.646 5.743 1.00 0.00 C ATOM 701 O THR A 172 3.449 11.258 4.683 1.00 0.00 O ATOM 702 CB THR A 172 4.768 13.760 4.689 1.00 0.00 C ATOM 703 OG1 THR A 172 5.941 14.491 4.381 1.00 0.00 O ATOM 704 CG2 THR A 172 3.706 14.751 5.114 1.00 0.00 C ATOM 0 H THR A 172 6.305 11.156 5.055 1.00 0.00 H new ATOM 0 HA THR A 172 5.086 13.161 6.730 1.00 0.00 H new ATOM 0 HB THR A 172 4.405 13.214 3.818 1.00 0.00 H new ATOM 0 HG1 THR A 172 6.462 14.633 5.199 1.00 0.00 H new ATOM 0 HG21 THR A 172 3.550 15.481 4.319 1.00 0.00 H new ATOM 0 HG22 THR A 172 2.773 14.223 5.309 1.00 0.00 H new ATOM 0 HG23 THR A 172 4.029 15.264 6.020 1.00 0.00 H new ATOM 712 N PRO A 173 3.524 11.175 6.932 1.00 0.00 N ATOM 713 CA PRO A 173 2.460 10.171 7.051 1.00 0.00 C ATOM 714 C PRO A 173 1.093 10.736 6.679 1.00 0.00 C ATOM 715 O PRO A 173 0.644 11.730 7.252 1.00 0.00 O ATOM 716 CB PRO A 173 2.496 9.786 8.531 1.00 0.00 C ATOM 717 CG PRO A 173 3.071 10.977 9.216 1.00 0.00 C ATOM 718 CD PRO A 173 4.050 11.580 8.249 1.00 0.00 C ATOM 0 HA PRO A 173 2.615 9.329 6.377 1.00 0.00 H new ATOM 0 HB2 PRO A 173 1.498 9.557 8.905 1.00 0.00 H new ATOM 0 HB3 PRO A 173 3.109 8.900 8.695 1.00 0.00 H new ATOM 0 HG2 PRO A 173 2.290 11.691 9.477 1.00 0.00 H new ATOM 0 HG3 PRO A 173 3.565 10.692 10.145 1.00 0.00 H new ATOM 0 HD2 PRO A 173 4.095 12.665 8.347 1.00 0.00 H new ATOM 0 HD3 PRO A 173 5.060 11.203 8.412 1.00 0.00 H new ATOM 726 N VAL A 174 0.435 10.098 5.716 1.00 0.00 N ATOM 727 CA VAL A 174 -0.880 10.542 5.269 1.00 0.00 C ATOM 728 C VAL A 174 -1.803 9.355 5.011 1.00 0.00 C ATOM 729 O VAL A 174 -1.361 8.299 4.560 1.00 0.00 O ATOM 730 CB VAL A 174 -0.779 11.386 3.985 1.00 0.00 C ATOM 731 CG1 VAL A 174 -2.127 11.997 3.636 1.00 0.00 C ATOM 732 CG2 VAL A 174 0.282 12.466 4.139 1.00 0.00 C ATOM 0 H VAL A 174 0.790 9.274 5.231 1.00 0.00 H new ATOM 0 HA VAL A 174 -1.296 11.155 6.068 1.00 0.00 H new ATOM 0 HB VAL A 174 -0.483 10.731 3.165 1.00 0.00 H new ATOM 0 HG11 VAL A 174 -2.033 12.589 2.726 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -2.857 11.203 3.479 1.00 0.00 H new ATOM 0 HG13 VAL A 174 -2.459 12.638 4.453 1.00 0.00 H new ATOM 0 HG21 VAL A 174 0.340 13.053 3.222 1.00 0.00 H new ATOM 0 HG22 VAL A 174 0.019 13.119 4.971 1.00 0.00 H new ATOM 0 HG23 VAL A 174 1.249 12.001 4.334 1.00 0.00 H new ATOM 742 N GLU A 175 -3.087 9.540 5.300 1.00 0.00 N ATOM 743 CA GLU A 175 -4.074 8.486 5.100 1.00 0.00 C ATOM 744 C GLU A 175 -4.654 8.545 3.689 1.00 0.00 C ATOM 745 O GLU A 175 -4.868 9.627 3.141 1.00 0.00 O ATOM 746 CB GLU A 175 -5.197 8.610 6.132 1.00 0.00 C ATOM 747 CG GLU A 175 -5.892 9.962 6.114 1.00 0.00 C ATOM 748 CD GLU A 175 -5.944 10.610 7.484 1.00 0.00 C ATOM 749 OE1 GLU A 175 -4.987 11.331 7.837 1.00 0.00 O ATOM 750 OE2 GLU A 175 -6.943 10.397 8.203 1.00 0.00 O ATOM 0 H GLU A 175 -3.468 10.410 5.673 1.00 0.00 H new ATOM 0 HA GLU A 175 -3.576 7.525 5.228 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -5.935 7.829 5.950 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -4.787 8.435 7.126 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -5.372 10.625 5.422 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -6.907 9.840 5.735 1.00 0.00 H new ATOM 757 N LEU A 176 -4.902 7.377 3.106 1.00 0.00 N ATOM 758 CA LEU A 176 -5.453 7.296 1.756 1.00 0.00 C ATOM 759 C LEU A 176 -6.345 6.076 1.602 1.00 0.00 C ATOM 760 O LEU A 176 -6.784 5.477 2.582 1.00 0.00 O ATOM 761 CB LEU A 176 -4.339 7.202 0.711 1.00 0.00 C ATOM 762 CG LEU A 176 -2.935 7.578 1.193 1.00 0.00 C ATOM 763 CD1 LEU A 176 -1.888 7.083 0.207 1.00 0.00 C ATOM 764 CD2 LEU A 176 -2.821 9.085 1.385 1.00 0.00 C ATOM 0 H LEU A 176 -4.731 6.473 3.546 1.00 0.00 H new ATOM 0 HA LEU A 176 -6.035 8.204 1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -4.310 6.181 0.330 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -4.599 7.848 -0.128 1.00 0.00 H new ATOM 0 HG LEU A 176 -2.758 7.097 2.155 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -0.895 7.357 0.563 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -1.955 5.999 0.119 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -2.063 7.538 -0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -1.816 9.333 1.728 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -3.016 9.588 0.438 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -3.549 9.413 2.127 1.00 0.00 H new ATOM 776 N ASP A 177 -6.573 5.701 0.349 1.00 0.00 N ATOM 777 CA ASP A 177 -7.370 4.540 0.032 1.00 0.00 C ATOM 778 C ASP A 177 -6.902 3.930 -1.281 1.00 0.00 C ATOM 779 O ASP A 177 -6.313 4.612 -2.119 1.00 0.00 O ATOM 780 CB ASP A 177 -8.856 4.896 -0.046 1.00 0.00 C ATOM 781 CG ASP A 177 -9.284 5.858 1.046 1.00 0.00 C ATOM 782 OD1 ASP A 177 -8.849 7.028 1.011 1.00 0.00 O ATOM 783 OD2 ASP A 177 -10.054 5.442 1.938 1.00 0.00 O ATOM 0 H ASP A 177 -6.210 6.195 -0.466 1.00 0.00 H new ATOM 0 HA ASP A 177 -7.242 3.809 0.830 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -9.069 5.339 -1.019 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -9.448 3.984 0.026 1.00 0.00 H new ATOM 788 N PHE A 178 -7.156 2.641 -1.448 1.00 0.00 N ATOM 789 CA PHE A 178 -6.755 1.924 -2.657 1.00 0.00 C ATOM 790 C PHE A 178 -7.115 2.707 -3.919 1.00 0.00 C ATOM 791 O PHE A 178 -6.433 2.608 -4.939 1.00 0.00 O ATOM 792 CB PHE A 178 -7.418 0.546 -2.699 1.00 0.00 C ATOM 793 CG PHE A 178 -7.325 -0.208 -1.402 1.00 0.00 C ATOM 794 CD1 PHE A 178 -6.093 -0.574 -0.884 1.00 0.00 C ATOM 795 CD2 PHE A 178 -8.470 -0.550 -0.702 1.00 0.00 C ATOM 796 CE1 PHE A 178 -6.005 -1.266 0.308 1.00 0.00 C ATOM 797 CE2 PHE A 178 -8.389 -1.244 0.491 1.00 0.00 C ATOM 798 CZ PHE A 178 -7.155 -1.603 0.997 1.00 0.00 C ATOM 0 H PHE A 178 -7.640 2.064 -0.760 1.00 0.00 H new ATOM 0 HA PHE A 178 -5.672 1.807 -2.627 1.00 0.00 H new ATOM 0 HB2 PHE A 178 -8.468 0.666 -2.965 1.00 0.00 H new ATOM 0 HB3 PHE A 178 -6.955 -0.047 -3.488 1.00 0.00 H new ATOM 0 HD1 PHE A 178 -5.191 -0.315 -1.419 1.00 0.00 H new ATOM 0 HD2 PHE A 178 -9.438 -0.271 -1.093 1.00 0.00 H new ATOM 0 HE1 PHE A 178 -5.038 -1.544 0.702 1.00 0.00 H new ATOM 0 HE2 PHE A 178 -9.290 -1.505 1.027 1.00 0.00 H new ATOM 0 HZ PHE A 178 -7.089 -2.146 1.928 1.00 0.00 H new ATOM 808 N SER A 179 -8.191 3.486 -3.842 1.00 0.00 N ATOM 809 CA SER A 179 -8.644 4.283 -4.980 1.00 0.00 C ATOM 810 C SER A 179 -7.852 5.585 -5.115 1.00 0.00 C ATOM 811 O SER A 179 -8.197 6.445 -5.926 1.00 0.00 O ATOM 812 CB SER A 179 -10.135 4.595 -4.844 1.00 0.00 C ATOM 813 OG SER A 179 -10.365 5.553 -3.825 1.00 0.00 O ATOM 0 H SER A 179 -8.765 3.583 -3.005 1.00 0.00 H new ATOM 0 HA SER A 179 -8.474 3.694 -5.881 1.00 0.00 H new ATOM 0 HB2 SER A 179 -10.519 4.969 -5.793 1.00 0.00 H new ATOM 0 HB3 SER A 179 -10.682 3.680 -4.617 1.00 0.00 H new ATOM 0 HG SER A 179 -11.325 5.736 -3.759 1.00 0.00 H new ATOM 819 N GLN A 180 -6.793 5.730 -4.322 1.00 0.00 N ATOM 820 CA GLN A 180 -5.964 6.931 -4.365 1.00 0.00 C ATOM 821 C GLN A 180 -4.505 6.588 -4.671 1.00 0.00 C ATOM 822 O GLN A 180 -3.647 7.473 -4.712 1.00 0.00 O ATOM 823 CB GLN A 180 -6.054 7.683 -3.036 1.00 0.00 C ATOM 824 CG GLN A 180 -7.296 8.550 -2.910 1.00 0.00 C ATOM 825 CD GLN A 180 -7.026 9.851 -2.176 1.00 0.00 C ATOM 826 OE1 GLN A 180 -6.976 10.920 -2.783 1.00 0.00 O ATOM 827 NE2 GLN A 180 -6.851 9.763 -0.863 1.00 0.00 N ATOM 0 H GLN A 180 -6.489 5.032 -3.643 1.00 0.00 H new ATOM 0 HA GLN A 180 -6.339 7.568 -5.166 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -6.040 6.962 -2.219 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -5.170 8.311 -2.923 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -7.683 8.772 -3.905 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -8.071 7.994 -2.383 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -6.901 8.855 -0.402 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -6.666 10.604 -0.316 1.00 0.00 H new ATOM 836 N VAL A 181 -4.225 5.304 -4.889 1.00 0.00 N ATOM 837 CA VAL A 181 -2.869 4.861 -5.190 1.00 0.00 C ATOM 838 C VAL A 181 -2.876 3.727 -6.209 1.00 0.00 C ATOM 839 O VAL A 181 -3.932 3.203 -6.564 1.00 0.00 O ATOM 840 CB VAL A 181 -2.138 4.391 -3.920 1.00 0.00 C ATOM 841 CG1 VAL A 181 -1.713 5.581 -3.075 1.00 0.00 C ATOM 842 CG2 VAL A 181 -3.015 3.443 -3.116 1.00 0.00 C ATOM 0 H VAL A 181 -4.918 4.556 -4.862 1.00 0.00 H new ATOM 0 HA VAL A 181 -2.341 5.718 -5.608 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.241 3.850 -4.221 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -1.198 5.228 -2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -1.042 6.217 -3.653 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -2.594 6.153 -2.783 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -2.480 3.122 -2.222 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -3.933 3.954 -2.826 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -3.262 2.572 -3.723 1.00 0.00 H new ATOM 852 N VAL A 182 -1.690 3.352 -6.676 1.00 0.00 N ATOM 853 CA VAL A 182 -1.558 2.280 -7.654 1.00 0.00 C ATOM 854 C VAL A 182 -0.322 1.430 -7.376 1.00 0.00 C ATOM 855 O VAL A 182 0.680 1.926 -6.863 1.00 0.00 O ATOM 856 CB VAL A 182 -1.470 2.834 -9.089 1.00 0.00 C ATOM 857 CG1 VAL A 182 -2.796 3.452 -9.505 1.00 0.00 C ATOM 858 CG2 VAL A 182 -0.342 3.846 -9.203 1.00 0.00 C ATOM 0 H VAL A 182 -0.806 3.775 -6.392 1.00 0.00 H new ATOM 0 HA VAL A 182 -2.451 1.661 -7.564 1.00 0.00 H new ATOM 0 HB VAL A 182 -1.253 2.007 -9.765 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.715 3.838 -10.521 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -3.579 2.694 -9.466 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -3.046 4.267 -8.826 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.296 4.226 -10.224 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -0.524 4.673 -8.516 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.604 3.366 -8.951 1.00 0.00 H new ATOM 868 N LYS A 183 -0.403 0.148 -7.716 1.00 0.00 N ATOM 869 CA LYS A 183 0.709 -0.770 -7.502 1.00 0.00 C ATOM 870 C LYS A 183 1.885 -0.420 -8.406 1.00 0.00 C ATOM 871 O LYS A 183 1.741 -0.331 -9.626 1.00 0.00 O ATOM 872 CB LYS A 183 0.265 -2.211 -7.758 1.00 0.00 C ATOM 873 CG LYS A 183 1.071 -3.242 -6.987 1.00 0.00 C ATOM 874 CD LYS A 183 0.484 -3.491 -5.606 1.00 0.00 C ATOM 875 CE LYS A 183 -0.171 -4.861 -5.515 1.00 0.00 C ATOM 876 NZ LYS A 183 -1.639 -4.793 -5.751 1.00 0.00 N ATOM 0 H LYS A 183 -1.227 -0.278 -8.141 1.00 0.00 H new ATOM 0 HA LYS A 183 1.031 -0.675 -6.465 1.00 0.00 H new ATOM 0 HB2 LYS A 183 -0.787 -2.311 -7.491 1.00 0.00 H new ATOM 0 HB3 LYS A 183 0.345 -2.423 -8.824 1.00 0.00 H new ATOM 0 HG2 LYS A 183 1.097 -4.177 -7.546 1.00 0.00 H new ATOM 0 HG3 LYS A 183 2.101 -2.900 -6.889 1.00 0.00 H new ATOM 0 HD2 LYS A 183 1.271 -3.413 -4.856 1.00 0.00 H new ATOM 0 HD3 LYS A 183 -0.251 -2.719 -5.378 1.00 0.00 H new ATOM 0 HE2 LYS A 183 0.283 -5.530 -6.246 1.00 0.00 H new ATOM 0 HE3 LYS A 183 0.019 -5.289 -4.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -2.110 -5.560 -5.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -2.002 -3.876 -5.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -1.832 -4.895 -6.768 1.00 0.00 H new ATOM 890 N ALA A 184 3.052 -0.222 -7.799 1.00 0.00 N ATOM 891 CA ALA A 184 4.255 0.117 -8.550 1.00 0.00 C ATOM 892 C ALA A 184 4.975 -1.139 -9.030 1.00 0.00 C ATOM 893 O ALA A 184 5.478 -1.130 -10.174 1.00 0.00 O ATOM 894 CB ALA A 184 5.185 0.968 -7.696 1.00 0.00 C ATOM 895 OXT ALA A 184 5.031 -2.119 -8.259 1.00 0.00 O ATOM 0 H ALA A 184 3.189 -0.291 -6.791 1.00 0.00 H new ATOM 0 HA ALA A 184 3.958 0.690 -9.428 1.00 0.00 H new ATOM 0 HB1 ALA A 184 6.080 1.215 -8.268 1.00 0.00 H new ATOM 0 HB2 ALA A 184 4.674 1.887 -7.407 1.00 0.00 H new ATOM 0 HB3 ALA A 184 5.468 0.413 -6.802 1.00 0.00 H new TER 901 ALA A 184