USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=10 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= -0.23 X(o=-0.23,f=-0.0092) USER MOD Single : A 136 GLN : amide:sc= 0 X(o=0,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 150 THR OG1 : rot 171:sc= -0.207 USER MOD Single : A 152 THR OG1 : rot -130:sc= -0.0492 USER MOD Single : A 155 ASN : amide:sc= -0.59 K(o=-0.59,f=-1.6!) USER MOD Single : A 160 LYS NZ :NH3+ 162:sc= 1.11 (180deg=0.83) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl 143:sc= -0.879 (180deg=-3.32!) USER MOD Single : A 166 THR OG1 : rot 180:sc= 0 USER MOD Single : A 172 THR OG1 : rot -18:sc= 0.573 USER MOD Single : A 179 SER OG : rot 70:sc= 1.01 USER MOD Single : A 180 GLN :FLIP amide:sc= -0.35 F(o=-1.1,f=-0.35) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 127 -2.336 -15.021 -10.567 1.00 0.00 N ATOM 2 CA ALA A 127 -3.206 -15.827 -9.674 1.00 0.00 C ATOM 3 C ALA A 127 -3.091 -15.356 -8.229 1.00 0.00 C ATOM 4 O ALA A 127 -3.198 -16.152 -7.296 1.00 0.00 O ATOM 5 CB ALA A 127 -2.848 -17.302 -9.780 1.00 0.00 C ATOM 0 HA ALA A 127 -4.239 -15.692 -9.993 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.494 -17.881 -9.120 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -2.986 -17.637 -10.808 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -1.808 -17.446 -9.488 1.00 0.00 H new ATOM 13 N GLN A 128 -2.870 -14.059 -8.050 1.00 0.00 N ATOM 14 CA GLN A 128 -2.738 -13.481 -6.718 1.00 0.00 C ATOM 15 C GLN A 128 -2.748 -11.957 -6.782 1.00 0.00 C ATOM 16 O GLN A 128 -1.714 -11.328 -7.007 1.00 0.00 O ATOM 17 CB GLN A 128 -1.450 -13.971 -6.053 1.00 0.00 C ATOM 18 CG GLN A 128 -1.688 -14.944 -4.909 1.00 0.00 C ATOM 19 CD GLN A 128 -0.446 -15.175 -4.072 1.00 0.00 C ATOM 20 OE1 GLN A 128 -0.023 -16.313 -3.869 1.00 0.00 O ATOM 21 NE2 GLN A 128 0.145 -14.093 -3.579 1.00 0.00 N ATOM 0 H GLN A 128 -2.778 -13.387 -8.812 1.00 0.00 H new ATOM 0 HA GLN A 128 -3.591 -13.804 -6.121 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -0.824 -14.452 -6.804 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -0.895 -13.111 -5.678 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -2.485 -14.561 -4.272 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -2.032 -15.896 -5.313 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -0.240 -13.169 -3.773 1.00 0.00 H new ATOM 0 HE22 GLN A 128 0.984 -14.186 -3.007 1.00 0.00 H new ATOM 30 N VAL A 129 -3.924 -11.369 -6.581 1.00 0.00 N ATOM 31 CA VAL A 129 -4.067 -9.918 -6.614 1.00 0.00 C ATOM 32 C VAL A 129 -4.440 -9.372 -5.239 1.00 0.00 C ATOM 33 O VAL A 129 -5.135 -8.363 -5.129 1.00 0.00 O ATOM 34 CB VAL A 129 -5.137 -9.482 -7.633 1.00 0.00 C ATOM 35 CG1 VAL A 129 -4.700 -9.829 -9.049 1.00 0.00 C ATOM 36 CG2 VAL A 129 -6.477 -10.127 -7.310 1.00 0.00 C ATOM 0 H VAL A 129 -4.790 -11.875 -6.394 1.00 0.00 H new ATOM 0 HA VAL A 129 -3.102 -9.512 -6.915 1.00 0.00 H new ATOM 0 HB VAL A 129 -5.254 -8.400 -7.567 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -5.469 -9.513 -9.755 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -3.765 -9.317 -9.277 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.553 -10.906 -9.131 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -7.220 -9.807 -8.040 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -6.377 -11.212 -7.345 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -6.795 -9.825 -6.312 1.00 0.00 H new ATOM 46 N ALA A 130 -3.974 -10.049 -4.195 1.00 0.00 N ATOM 47 CA ALA A 130 -4.257 -9.633 -2.828 1.00 0.00 C ATOM 48 C ALA A 130 -3.301 -8.533 -2.379 1.00 0.00 C ATOM 49 O ALA A 130 -2.264 -8.307 -3.002 1.00 0.00 O ATOM 50 CB ALA A 130 -4.171 -10.825 -1.887 1.00 0.00 C ATOM 0 H ALA A 130 -3.399 -10.888 -4.270 1.00 0.00 H new ATOM 0 HA ALA A 130 -5.270 -9.231 -2.799 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -4.385 -10.501 -0.869 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.898 -11.579 -2.188 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -3.168 -11.251 -1.930 1.00 0.00 H new ATOM 56 N PHE A 131 -3.656 -7.851 -1.295 1.00 0.00 N ATOM 57 CA PHE A 131 -2.828 -6.774 -0.763 1.00 0.00 C ATOM 58 C PHE A 131 -2.183 -7.184 0.557 1.00 0.00 C ATOM 59 O PHE A 131 -2.619 -8.139 1.200 1.00 0.00 O ATOM 60 CB PHE A 131 -3.666 -5.510 -0.564 1.00 0.00 C ATOM 61 CG PHE A 131 -2.857 -4.244 -0.583 1.00 0.00 C ATOM 62 CD1 PHE A 131 -2.618 -3.579 -1.776 1.00 0.00 C ATOM 63 CD2 PHE A 131 -2.338 -3.719 0.589 1.00 0.00 C ATOM 64 CE1 PHE A 131 -1.875 -2.414 -1.798 1.00 0.00 C ATOM 65 CE2 PHE A 131 -1.595 -2.553 0.572 1.00 0.00 C ATOM 66 CZ PHE A 131 -1.363 -1.900 -0.623 1.00 0.00 C ATOM 0 H PHE A 131 -4.512 -8.025 -0.768 1.00 0.00 H new ATOM 0 HA PHE A 131 -2.037 -6.568 -1.484 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -4.423 -5.459 -1.346 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -4.194 -5.580 0.387 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -3.017 -3.976 -2.698 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -2.516 -4.226 1.526 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -1.695 -1.906 -2.734 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -1.196 -2.153 1.493 1.00 0.00 H new ATOM 0 HZ PHE A 131 -0.782 -0.989 -0.638 1.00 0.00 H new ATOM 76 N ARG A 132 -1.144 -6.457 0.952 1.00 0.00 N ATOM 77 CA ARG A 132 -0.440 -6.746 2.197 1.00 0.00 C ATOM 78 C ARG A 132 0.341 -5.526 2.674 1.00 0.00 C ATOM 79 O ARG A 132 0.860 -4.754 1.869 1.00 0.00 O ATOM 80 CB ARG A 132 0.510 -7.931 2.006 1.00 0.00 C ATOM 81 CG ARG A 132 0.989 -8.543 3.312 1.00 0.00 C ATOM 82 CD ARG A 132 2.438 -8.181 3.604 1.00 0.00 C ATOM 83 NE ARG A 132 3.235 -9.355 3.951 1.00 0.00 N ATOM 84 CZ ARG A 132 4.565 -9.387 3.904 1.00 0.00 C ATOM 85 NH1 ARG A 132 5.250 -8.314 3.528 1.00 0.00 N ATOM 86 NH2 ARG A 132 5.214 -10.496 4.235 1.00 0.00 N ATOM 0 H ARG A 132 -0.771 -5.664 0.430 1.00 0.00 H new ATOM 0 HA ARG A 132 -1.181 -7.001 2.955 1.00 0.00 H new ATOM 0 HB2 ARG A 132 0.007 -8.698 1.418 1.00 0.00 H new ATOM 0 HB3 ARG A 132 1.375 -7.603 1.429 1.00 0.00 H new ATOM 0 HG2 ARG A 132 0.356 -8.198 4.129 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.887 -9.627 3.265 1.00 0.00 H new ATOM 0 HD2 ARG A 132 2.873 -7.692 2.732 1.00 0.00 H new ATOM 0 HD3 ARG A 132 2.474 -7.463 4.423 1.00 0.00 H new ATOM 0 HE ARG A 132 2.744 -10.199 4.246 1.00 0.00 H new ATOM 0 HH11 ARG A 132 4.757 -7.458 3.273 1.00 0.00 H new ATOM 0 HH12 ARG A 132 6.269 -8.345 3.494 1.00 0.00 H new ATOM 0 HH21 ARG A 132 4.694 -11.324 4.525 1.00 0.00 H new ATOM 0 HH22 ARG A 132 6.233 -10.521 4.199 1.00 0.00 H new ATOM 100 N GLU A 133 0.418 -5.357 3.990 1.00 0.00 N ATOM 101 CA GLU A 133 1.134 -4.230 4.576 1.00 0.00 C ATOM 102 C GLU A 133 2.626 -4.317 4.271 1.00 0.00 C ATOM 103 O GLU A 133 3.233 -5.381 4.385 1.00 0.00 O ATOM 104 CB GLU A 133 0.912 -4.189 6.089 1.00 0.00 C ATOM 105 CG GLU A 133 1.092 -5.537 6.767 1.00 0.00 C ATOM 106 CD GLU A 133 -0.198 -6.066 7.365 1.00 0.00 C ATOM 107 OE1 GLU A 133 -1.056 -5.244 7.747 1.00 0.00 O ATOM 108 OE2 GLU A 133 -0.349 -7.303 7.450 1.00 0.00 O ATOM 0 H GLU A 133 -0.007 -5.986 4.671 1.00 0.00 H new ATOM 0 HA GLU A 133 0.744 -3.313 4.134 1.00 0.00 H new ATOM 0 HB2 GLU A 133 1.606 -3.474 6.530 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -0.094 -3.822 6.290 1.00 0.00 H new ATOM 0 HG2 GLU A 133 1.474 -6.256 6.042 1.00 0.00 H new ATOM 0 HG3 GLU A 133 1.842 -5.447 7.553 1.00 0.00 H new ATOM 115 N GLY A 134 3.212 -3.188 3.881 1.00 0.00 N ATOM 116 CA GLY A 134 4.627 -3.158 3.565 1.00 0.00 C ATOM 117 C GLY A 134 4.889 -2.950 2.086 1.00 0.00 C ATOM 118 O GLY A 134 5.941 -2.438 1.702 1.00 0.00 O ATOM 0 H GLY A 134 2.731 -2.294 3.779 1.00 0.00 H new ATOM 0 HA2 GLY A 134 5.105 -2.359 4.131 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.087 -4.093 3.884 1.00 0.00 H new ATOM 122 N ASP A 135 3.932 -3.349 1.255 1.00 0.00 N ATOM 123 CA ASP A 135 4.065 -3.203 -0.190 1.00 0.00 C ATOM 124 C ASP A 135 4.231 -1.737 -0.576 1.00 0.00 C ATOM 125 O ASP A 135 4.000 -0.842 0.237 1.00 0.00 O ATOM 126 CB ASP A 135 2.842 -3.796 -0.895 1.00 0.00 C ATOM 127 CG ASP A 135 3.058 -5.236 -1.314 1.00 0.00 C ATOM 128 OD1 ASP A 135 4.126 -5.534 -1.889 1.00 0.00 O ATOM 129 OD2 ASP A 135 2.159 -6.068 -1.066 1.00 0.00 O ATOM 0 H ASP A 135 3.056 -3.776 1.557 1.00 0.00 H new ATOM 0 HA ASP A 135 4.957 -3.744 -0.507 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.980 -3.739 -0.230 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.607 -3.196 -1.774 1.00 0.00 H new ATOM 134 N GLN A 136 4.636 -1.500 -1.818 1.00 0.00 N ATOM 135 CA GLN A 136 4.835 -0.140 -2.311 1.00 0.00 C ATOM 136 C GLN A 136 3.810 0.207 -3.385 1.00 0.00 C ATOM 137 O GLN A 136 3.608 -0.551 -4.333 1.00 0.00 O ATOM 138 CB GLN A 136 6.251 0.019 -2.868 1.00 0.00 C ATOM 139 CG GLN A 136 7.338 -0.125 -1.816 1.00 0.00 C ATOM 140 CD GLN A 136 8.283 1.061 -1.784 1.00 0.00 C ATOM 141 OE1 GLN A 136 9.116 1.229 -2.675 1.00 0.00 O ATOM 142 NE2 GLN A 136 8.159 1.891 -0.754 1.00 0.00 N ATOM 0 H GLN A 136 4.833 -2.230 -2.502 1.00 0.00 H new ATOM 0 HA GLN A 136 4.701 0.546 -1.475 1.00 0.00 H new ATOM 0 HB2 GLN A 136 6.411 -0.725 -3.648 1.00 0.00 H new ATOM 0 HB3 GLN A 136 6.340 0.998 -3.338 1.00 0.00 H new ATOM 0 HG2 GLN A 136 6.876 -0.243 -0.836 1.00 0.00 H new ATOM 0 HG3 GLN A 136 7.908 -1.033 -2.011 1.00 0.00 H new ATOM 0 HE21 GLN A 136 7.455 1.713 -0.038 1.00 0.00 H new ATOM 0 HE22 GLN A 136 8.768 2.706 -0.679 1.00 0.00 H new ATOM 151 N VAL A 137 3.165 1.358 -3.228 1.00 0.00 N ATOM 152 CA VAL A 137 2.160 1.809 -4.183 1.00 0.00 C ATOM 153 C VAL A 137 2.364 3.279 -4.536 1.00 0.00 C ATOM 154 O VAL A 137 2.717 4.090 -3.680 1.00 0.00 O ATOM 155 CB VAL A 137 0.737 1.622 -3.628 1.00 0.00 C ATOM 156 CG1 VAL A 137 0.403 0.143 -3.500 1.00 0.00 C ATOM 157 CG2 VAL A 137 0.589 2.328 -2.288 1.00 0.00 C ATOM 0 H VAL A 137 3.321 1.996 -2.448 1.00 0.00 H new ATOM 0 HA VAL A 137 2.276 1.200 -5.080 1.00 0.00 H new ATOM 0 HB VAL A 137 0.032 2.070 -4.328 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.607 0.031 -3.106 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.465 -0.330 -4.480 1.00 0.00 H new ATOM 0 HG13 VAL A 137 1.112 -0.333 -2.822 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.424 2.185 -1.911 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.303 1.912 -1.577 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.782 3.393 -2.415 1.00 0.00 H new ATOM 167 N ARG A 138 2.142 3.617 -5.804 1.00 0.00 N ATOM 168 CA ARG A 138 2.304 4.991 -6.264 1.00 0.00 C ATOM 169 C ARG A 138 1.087 5.835 -5.901 1.00 0.00 C ATOM 170 O ARG A 138 0.041 5.308 -5.525 1.00 0.00 O ATOM 171 CB ARG A 138 2.534 5.025 -7.778 1.00 0.00 C ATOM 172 CG ARG A 138 3.744 5.851 -8.193 1.00 0.00 C ATOM 173 CD ARG A 138 4.519 5.180 -9.317 1.00 0.00 C ATOM 174 NE ARG A 138 3.999 5.539 -10.633 1.00 0.00 N ATOM 175 CZ ARG A 138 4.285 6.679 -11.259 1.00 0.00 C ATOM 176 NH1 ARG A 138 5.083 7.575 -10.689 1.00 0.00 N ATOM 177 NH2 ARG A 138 3.771 6.923 -12.456 1.00 0.00 N ATOM 0 H ARG A 138 1.851 2.960 -6.528 1.00 0.00 H new ATOM 0 HA ARG A 138 3.176 5.412 -5.764 1.00 0.00 H new ATOM 0 HB2 ARG A 138 2.659 4.005 -8.141 1.00 0.00 H new ATOM 0 HB3 ARG A 138 1.645 5.429 -8.263 1.00 0.00 H new ATOM 0 HG2 ARG A 138 3.418 6.840 -8.515 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.399 5.995 -7.334 1.00 0.00 H new ATOM 0 HD2 ARG A 138 5.569 5.464 -9.253 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.474 4.098 -9.193 1.00 0.00 H new ATOM 0 HE ARG A 138 3.380 4.877 -11.101 1.00 0.00 H new ATOM 0 HH11 ARG A 138 5.480 7.391 -9.768 1.00 0.00 H new ATOM 0 HH12 ARG A 138 5.299 8.447 -11.173 1.00 0.00 H new ATOM 0 HH21 ARG A 138 3.157 6.238 -12.897 1.00 0.00 H new ATOM 0 HH22 ARG A 138 3.989 7.796 -12.936 1.00 0.00 H new ATOM 191 N VAL A 139 1.238 7.150 -6.012 1.00 0.00 N ATOM 192 CA VAL A 139 0.158 8.078 -5.695 1.00 0.00 C ATOM 193 C VAL A 139 -0.841 8.170 -6.847 1.00 0.00 C ATOM 194 O VAL A 139 -0.587 7.664 -7.940 1.00 0.00 O ATOM 195 CB VAL A 139 0.709 9.485 -5.384 1.00 0.00 C ATOM 196 CG1 VAL A 139 -0.344 10.339 -4.693 1.00 0.00 C ATOM 197 CG2 VAL A 139 1.967 9.390 -4.531 1.00 0.00 C ATOM 0 H VAL A 139 2.101 7.599 -6.320 1.00 0.00 H new ATOM 0 HA VAL A 139 -0.351 7.692 -4.812 1.00 0.00 H new ATOM 0 HB VAL A 139 0.968 9.965 -6.328 1.00 0.00 H new ATOM 0 HG11 VAL A 139 0.068 11.326 -4.484 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -1.214 10.439 -5.342 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -0.641 9.864 -3.758 1.00 0.00 H new ATOM 0 HG21 VAL A 139 2.341 10.392 -4.322 1.00 0.00 H new ATOM 0 HG22 VAL A 139 1.733 8.887 -3.593 1.00 0.00 H new ATOM 0 HG23 VAL A 139 2.728 8.823 -5.067 1.00 0.00 H new ATOM 207 N VAL A 140 -1.982 8.808 -6.596 1.00 0.00 N ATOM 208 CA VAL A 140 -3.018 8.950 -7.613 1.00 0.00 C ATOM 209 C VAL A 140 -2.691 10.072 -8.605 1.00 0.00 C ATOM 210 O VAL A 140 -2.489 9.813 -9.791 1.00 0.00 O ATOM 211 CB VAL A 140 -4.411 9.199 -6.981 1.00 0.00 C ATOM 212 CG1 VAL A 140 -4.351 10.258 -5.885 1.00 0.00 C ATOM 213 CG2 VAL A 140 -5.432 9.582 -8.046 1.00 0.00 C ATOM 0 H VAL A 140 -2.211 9.234 -5.698 1.00 0.00 H new ATOM 0 HA VAL A 140 -3.047 8.006 -8.157 1.00 0.00 H new ATOM 0 HB VAL A 140 -4.730 8.265 -6.519 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.346 10.405 -5.466 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -3.671 9.930 -5.099 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -3.992 11.197 -6.306 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -6.401 9.751 -7.577 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -5.108 10.493 -8.549 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.518 8.776 -8.775 1.00 0.00 H new ATOM 223 N SER A 141 -2.648 11.312 -8.127 1.00 0.00 N ATOM 224 CA SER A 141 -2.353 12.447 -8.993 1.00 0.00 C ATOM 225 C SER A 141 -1.890 13.654 -8.179 1.00 0.00 C ATOM 226 O SER A 141 -1.518 13.523 -7.014 1.00 0.00 O ATOM 227 CB SER A 141 -3.587 12.810 -9.821 1.00 0.00 C ATOM 228 OG SER A 141 -3.244 13.033 -11.178 1.00 0.00 O ATOM 0 H SER A 141 -2.813 11.555 -7.150 1.00 0.00 H new ATOM 0 HA SER A 141 -1.543 12.162 -9.665 1.00 0.00 H new ATOM 0 HB2 SER A 141 -4.321 12.007 -9.756 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.055 13.704 -9.409 1.00 0.00 H new ATOM 0 HG SER A 141 -4.050 13.262 -11.686 1.00 0.00 H new ATOM 234 N GLY A 142 -1.918 14.829 -8.803 1.00 0.00 N ATOM 235 CA GLY A 142 -1.501 16.041 -8.124 1.00 0.00 C ATOM 236 C GLY A 142 0.007 16.189 -8.074 1.00 0.00 C ATOM 237 O GLY A 142 0.722 15.497 -8.799 1.00 0.00 O ATOM 0 H GLY A 142 -2.222 14.962 -9.767 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.931 16.904 -8.632 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -1.897 16.039 -7.108 1.00 0.00 H new ATOM 241 N PRO A 143 0.525 17.084 -7.218 1.00 0.00 N ATOM 242 CA PRO A 143 1.970 17.303 -7.085 1.00 0.00 C ATOM 243 C PRO A 143 2.698 16.057 -6.591 1.00 0.00 C ATOM 244 O PRO A 143 3.919 15.955 -6.703 1.00 0.00 O ATOM 245 CB PRO A 143 2.073 18.430 -6.051 1.00 0.00 C ATOM 246 CG PRO A 143 0.778 18.399 -5.314 1.00 0.00 C ATOM 247 CD PRO A 143 -0.250 17.945 -6.310 1.00 0.00 C ATOM 0 HA PRO A 143 2.434 17.546 -8.041 1.00 0.00 H new ATOM 0 HB2 PRO A 143 2.914 18.271 -5.377 1.00 0.00 H new ATOM 0 HB3 PRO A 143 2.229 19.395 -6.533 1.00 0.00 H new ATOM 0 HG2 PRO A 143 0.828 17.717 -4.465 1.00 0.00 H new ATOM 0 HG3 PRO A 143 0.530 19.384 -4.918 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -1.062 17.398 -5.831 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -0.700 18.786 -6.838 1.00 0.00 H new ATOM 255 N PHE A 144 1.940 15.111 -6.043 1.00 0.00 N ATOM 256 CA PHE A 144 2.513 13.870 -5.531 1.00 0.00 C ATOM 257 C PHE A 144 2.281 12.717 -6.502 1.00 0.00 C ATOM 258 O PHE A 144 2.342 11.554 -6.110 1.00 0.00 O ATOM 259 CB PHE A 144 1.903 13.517 -4.172 1.00 0.00 C ATOM 260 CG PHE A 144 1.565 14.712 -3.325 1.00 0.00 C ATOM 261 CD1 PHE A 144 2.566 15.503 -2.784 1.00 0.00 C ATOM 262 CD2 PHE A 144 0.244 15.041 -3.069 1.00 0.00 C ATOM 263 CE1 PHE A 144 2.256 16.600 -2.005 1.00 0.00 C ATOM 264 CE2 PHE A 144 -0.073 16.137 -2.291 1.00 0.00 C ATOM 265 CZ PHE A 144 0.934 16.917 -1.758 1.00 0.00 C ATOM 0 H PHE A 144 0.927 15.180 -5.942 1.00 0.00 H new ATOM 0 HA PHE A 144 3.586 14.025 -5.418 1.00 0.00 H new ATOM 0 HB2 PHE A 144 0.998 12.931 -4.333 1.00 0.00 H new ATOM 0 HB3 PHE A 144 2.601 12.883 -3.626 1.00 0.00 H new ATOM 0 HD1 PHE A 144 3.601 15.259 -2.974 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -0.547 14.433 -3.483 1.00 0.00 H new ATOM 0 HE1 PHE A 144 3.045 17.209 -1.590 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -1.107 16.384 -2.100 1.00 0.00 H new ATOM 0 HZ PHE A 144 0.689 17.774 -1.149 1.00 0.00 H new ATOM 275 N ALA A 145 2.009 13.036 -7.765 1.00 0.00 N ATOM 276 CA ALA A 145 1.760 12.009 -8.773 1.00 0.00 C ATOM 277 C ALA A 145 3.059 11.441 -9.344 1.00 0.00 C ATOM 278 O ALA A 145 3.156 11.180 -10.544 1.00 0.00 O ATOM 279 CB ALA A 145 0.895 12.572 -9.891 1.00 0.00 C ATOM 0 H ALA A 145 1.956 13.993 -8.114 1.00 0.00 H new ATOM 0 HA ALA A 145 1.232 11.190 -8.285 1.00 0.00 H new ATOM 0 HB1 ALA A 145 0.716 11.798 -10.637 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -0.057 12.908 -9.480 1.00 0.00 H new ATOM 0 HB3 ALA A 145 1.406 13.414 -10.358 1.00 0.00 H new ATOM 285 N ASP A 146 4.048 11.242 -8.481 1.00 0.00 N ATOM 286 CA ASP A 146 5.330 10.694 -8.903 1.00 0.00 C ATOM 287 C ASP A 146 6.096 10.132 -7.712 1.00 0.00 C ATOM 288 O ASP A 146 7.322 10.229 -7.645 1.00 0.00 O ATOM 289 CB ASP A 146 6.166 11.764 -9.609 1.00 0.00 C ATOM 290 CG ASP A 146 6.982 11.198 -10.754 1.00 0.00 C ATOM 291 OD1 ASP A 146 6.458 11.145 -11.887 1.00 0.00 O ATOM 292 OD2 ASP A 146 8.145 10.809 -10.519 1.00 0.00 O ATOM 0 H ASP A 146 3.986 11.452 -7.485 1.00 0.00 H new ATOM 0 HA ASP A 146 5.136 9.882 -9.604 1.00 0.00 H new ATOM 0 HB2 ASP A 146 5.507 12.545 -9.988 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.835 12.234 -8.887 1.00 0.00 H new ATOM 297 N PHE A 147 5.364 9.546 -6.773 1.00 0.00 N ATOM 298 CA PHE A 147 5.971 8.968 -5.582 1.00 0.00 C ATOM 299 C PHE A 147 5.201 7.733 -5.127 1.00 0.00 C ATOM 300 O PHE A 147 4.132 7.426 -5.656 1.00 0.00 O ATOM 301 CB PHE A 147 6.009 9.998 -4.451 1.00 0.00 C ATOM 302 CG PHE A 147 6.582 11.325 -4.863 1.00 0.00 C ATOM 303 CD1 PHE A 147 5.819 12.231 -5.581 1.00 0.00 C ATOM 304 CD2 PHE A 147 7.883 11.666 -4.530 1.00 0.00 C ATOM 305 CE1 PHE A 147 6.343 13.452 -5.962 1.00 0.00 C ATOM 306 CE2 PHE A 147 8.413 12.886 -4.907 1.00 0.00 C ATOM 307 CZ PHE A 147 7.641 13.781 -5.624 1.00 0.00 C ATOM 0 H PHE A 147 4.349 9.459 -6.814 1.00 0.00 H new ATOM 0 HA PHE A 147 6.990 8.673 -5.832 1.00 0.00 H new ATOM 0 HB2 PHE A 147 4.997 10.150 -4.075 1.00 0.00 H new ATOM 0 HB3 PHE A 147 6.599 9.598 -3.626 1.00 0.00 H new ATOM 0 HD1 PHE A 147 4.803 11.980 -5.846 1.00 0.00 H new ATOM 0 HD2 PHE A 147 8.490 10.971 -3.969 1.00 0.00 H new ATOM 0 HE1 PHE A 147 5.738 14.148 -6.524 1.00 0.00 H new ATOM 0 HE2 PHE A 147 9.429 13.139 -4.642 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.052 14.735 -5.919 1.00 0.00 H new ATOM 317 N THR A 148 5.750 7.028 -4.145 1.00 0.00 N ATOM 318 CA THR A 148 5.113 5.828 -3.619 1.00 0.00 C ATOM 319 C THR A 148 4.865 5.957 -2.120 1.00 0.00 C ATOM 320 O THR A 148 5.061 7.025 -1.538 1.00 0.00 O ATOM 321 CB THR A 148 5.976 4.597 -3.901 1.00 0.00 C ATOM 322 OG1 THR A 148 7.167 4.632 -3.134 1.00 0.00 O ATOM 323 CG2 THR A 148 6.372 4.464 -5.355 1.00 0.00 C ATOM 0 H THR A 148 6.635 7.267 -3.697 1.00 0.00 H new ATOM 0 HA THR A 148 4.152 5.709 -4.120 1.00 0.00 H new ATOM 0 HB THR A 148 5.356 3.743 -3.630 1.00 0.00 H new ATOM 0 HG1 THR A 148 7.704 3.835 -3.327 1.00 0.00 H new ATOM 0 HG21 THR A 148 6.983 3.571 -5.486 1.00 0.00 H new ATOM 0 HG22 THR A 148 5.476 4.384 -5.970 1.00 0.00 H new ATOM 0 HG23 THR A 148 6.943 5.341 -5.658 1.00 0.00 H new ATOM 331 N GLY A 149 4.437 4.864 -1.497 1.00 0.00 N ATOM 332 CA GLY A 149 4.170 4.880 -0.072 1.00 0.00 C ATOM 333 C GLY A 149 4.247 3.501 0.551 1.00 0.00 C ATOM 334 O GLY A 149 3.863 2.510 -0.069 1.00 0.00 O ATOM 0 H GLY A 149 4.270 3.968 -1.954 1.00 0.00 H new ATOM 0 HA2 GLY A 149 4.886 5.538 0.421 1.00 0.00 H new ATOM 0 HA3 GLY A 149 3.179 5.299 0.104 1.00 0.00 H new ATOM 338 N THR A 150 4.746 3.439 1.781 1.00 0.00 N ATOM 339 CA THR A 150 4.871 2.173 2.493 1.00 0.00 C ATOM 340 C THR A 150 3.641 1.912 3.356 1.00 0.00 C ATOM 341 O THR A 150 3.459 2.537 4.401 1.00 0.00 O ATOM 342 CB THR A 150 6.128 2.176 3.363 1.00 0.00 C ATOM 343 OG1 THR A 150 7.177 2.880 2.724 1.00 0.00 O ATOM 344 CG2 THR A 150 6.637 0.787 3.687 1.00 0.00 C ATOM 0 H THR A 150 5.071 4.251 2.306 1.00 0.00 H new ATOM 0 HA THR A 150 4.951 1.375 1.755 1.00 0.00 H new ATOM 0 HB THR A 150 5.834 2.663 4.293 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.921 2.997 3.350 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.530 0.862 4.307 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.867 0.234 4.225 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.880 0.264 2.762 1.00 0.00 H new ATOM 352 N VAL A 151 2.796 0.987 2.910 1.00 0.00 N ATOM 353 CA VAL A 151 1.581 0.644 3.640 1.00 0.00 C ATOM 354 C VAL A 151 1.901 0.084 5.020 1.00 0.00 C ATOM 355 O VAL A 151 2.819 -0.722 5.178 1.00 0.00 O ATOM 356 CB VAL A 151 0.729 -0.382 2.866 1.00 0.00 C ATOM 357 CG1 VAL A 151 -0.607 -0.598 3.562 1.00 0.00 C ATOM 358 CG2 VAL A 151 0.523 0.068 1.426 1.00 0.00 C ATOM 0 H VAL A 151 2.931 0.462 2.046 1.00 0.00 H new ATOM 0 HA VAL A 151 1.013 1.568 3.752 1.00 0.00 H new ATOM 0 HB VAL A 151 1.263 -1.332 2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -1.196 -1.325 3.002 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -0.435 -0.971 4.572 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -1.149 0.347 3.611 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.081 -0.670 0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 151 0.011 1.030 1.415 1.00 0.00 H new ATOM 0 HG23 VAL A 151 1.490 0.166 0.933 1.00 0.00 H new ATOM 368 N THR A 152 1.136 0.514 6.019 1.00 0.00 N ATOM 369 CA THR A 152 1.332 0.056 7.389 1.00 0.00 C ATOM 370 C THR A 152 0.077 -0.639 7.910 1.00 0.00 C ATOM 371 O THR A 152 0.148 -1.740 8.458 1.00 0.00 O ATOM 372 CB THR A 152 1.692 1.232 8.298 1.00 0.00 C ATOM 373 OG1 THR A 152 0.690 2.232 8.244 1.00 0.00 O ATOM 374 CG2 THR A 152 3.009 1.884 7.941 1.00 0.00 C ATOM 0 H THR A 152 0.373 1.181 5.904 1.00 0.00 H new ATOM 0 HA THR A 152 2.154 -0.660 7.394 1.00 0.00 H new ATOM 0 HB THR A 152 1.775 0.808 9.299 1.00 0.00 H new ATOM 0 HG1 THR A 152 1.107 3.104 8.082 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.203 2.710 8.625 1.00 0.00 H new ATOM 0 HG22 THR A 152 3.811 1.151 8.021 1.00 0.00 H new ATOM 0 HG23 THR A 152 2.963 2.262 6.920 1.00 0.00 H new ATOM 382 N GLU A 153 -1.070 0.010 7.734 1.00 0.00 N ATOM 383 CA GLU A 153 -2.341 -0.547 8.184 1.00 0.00 C ATOM 384 C GLU A 153 -3.370 -0.532 7.058 1.00 0.00 C ATOM 385 O GLU A 153 -3.234 0.216 6.089 1.00 0.00 O ATOM 386 CB GLU A 153 -2.870 0.240 9.386 1.00 0.00 C ATOM 387 CG GLU A 153 -3.258 1.672 9.056 1.00 0.00 C ATOM 388 CD GLU A 153 -3.294 2.564 10.282 1.00 0.00 C ATOM 389 OE1 GLU A 153 -2.474 2.348 11.197 1.00 0.00 O ATOM 390 OE2 GLU A 153 -4.143 3.480 10.325 1.00 0.00 O ATOM 0 H GLU A 153 -1.145 0.922 7.283 1.00 0.00 H new ATOM 0 HA GLU A 153 -2.171 -1.581 8.483 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -3.738 -0.277 9.794 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -2.109 0.250 10.166 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -2.549 2.080 8.335 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -4.238 1.678 8.578 1.00 0.00 H new ATOM 397 N ILE A 154 -4.397 -1.365 7.190 1.00 0.00 N ATOM 398 CA ILE A 154 -5.447 -1.446 6.183 1.00 0.00 C ATOM 399 C ILE A 154 -6.814 -1.651 6.829 1.00 0.00 C ATOM 400 O ILE A 154 -6.981 -2.509 7.696 1.00 0.00 O ATOM 401 CB ILE A 154 -5.186 -2.594 5.187 1.00 0.00 C ATOM 402 CG1 ILE A 154 -3.751 -2.525 4.661 1.00 0.00 C ATOM 403 CG2 ILE A 154 -6.181 -2.537 4.038 1.00 0.00 C ATOM 404 CD1 ILE A 154 -2.766 -3.324 5.485 1.00 0.00 C ATOM 0 H ILE A 154 -4.524 -1.993 7.984 1.00 0.00 H new ATOM 0 HA ILE A 154 -5.440 -0.499 5.644 1.00 0.00 H new ATOM 0 HB ILE A 154 -5.317 -3.543 5.707 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -3.731 -2.888 3.633 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -3.431 -1.483 4.637 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -5.983 -3.354 3.344 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -7.194 -2.631 4.429 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -6.080 -1.585 3.516 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -1.769 -3.229 5.054 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -2.756 -2.946 6.507 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -3.061 -4.373 5.488 1.00 0.00 H new ATOM 416 N ASN A 155 -7.790 -0.860 6.397 1.00 0.00 N ATOM 417 CA ASN A 155 -9.144 -0.954 6.931 1.00 0.00 C ATOM 418 C ASN A 155 -10.072 -1.650 5.935 1.00 0.00 C ATOM 419 O ASN A 155 -10.412 -1.084 4.896 1.00 0.00 O ATOM 420 CB ASN A 155 -9.681 0.441 7.260 1.00 0.00 C ATOM 421 CG ASN A 155 -9.701 0.717 8.751 1.00 0.00 C ATOM 422 OD1 ASN A 155 -9.033 0.036 9.529 1.00 0.00 O ATOM 423 ND2 ASN A 155 -10.470 1.721 9.156 1.00 0.00 N ATOM 0 H ASN A 155 -7.669 -0.146 5.678 1.00 0.00 H new ATOM 0 HA ASN A 155 -9.110 -1.547 7.845 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -9.065 1.191 6.763 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -10.690 0.542 6.861 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -10.524 1.954 10.147 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -11.007 2.259 8.476 1.00 0.00 H new ATOM 430 N PRO A 156 -10.496 -2.891 6.236 1.00 0.00 N ATOM 431 CA PRO A 156 -11.386 -3.653 5.355 1.00 0.00 C ATOM 432 C PRO A 156 -12.821 -3.140 5.394 1.00 0.00 C ATOM 433 O PRO A 156 -13.470 -3.002 4.356 1.00 0.00 O ATOM 434 CB PRO A 156 -11.309 -5.070 5.921 1.00 0.00 C ATOM 435 CG PRO A 156 -11.005 -4.880 7.366 1.00 0.00 C ATOM 436 CD PRO A 156 -10.142 -3.650 7.451 1.00 0.00 C ATOM 0 HA PRO A 156 -11.088 -3.578 4.309 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -12.248 -5.605 5.780 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -10.533 -5.653 5.426 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -11.921 -4.755 7.944 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -10.487 -5.749 7.773 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -10.348 -3.078 8.355 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -9.082 -3.905 7.470 1.00 0.00 H new ATOM 444 N GLU A 157 -13.313 -2.863 6.597 1.00 0.00 N ATOM 445 CA GLU A 157 -14.673 -2.367 6.772 1.00 0.00 C ATOM 446 C GLU A 157 -14.836 -0.985 6.147 1.00 0.00 C ATOM 447 O GLU A 157 -15.823 -0.716 5.461 1.00 0.00 O ATOM 448 CB GLU A 157 -15.031 -2.313 8.258 1.00 0.00 C ATOM 449 CG GLU A 157 -15.259 -3.680 8.879 1.00 0.00 C ATOM 450 CD GLU A 157 -16.213 -3.635 10.057 1.00 0.00 C ATOM 451 OE1 GLU A 157 -17.226 -2.907 9.972 1.00 0.00 O ATOM 452 OE2 GLU A 157 -15.949 -4.326 11.061 1.00 0.00 O ATOM 0 H GLU A 157 -12.790 -2.974 7.466 1.00 0.00 H new ATOM 0 HA GLU A 157 -15.350 -3.055 6.266 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -14.231 -1.807 8.798 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -15.931 -1.711 8.385 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -15.654 -4.357 8.122 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -14.303 -4.090 9.206 1.00 0.00 H new ATOM 459 N ARG A 158 -13.864 -0.112 6.389 1.00 0.00 N ATOM 460 CA ARG A 158 -13.903 1.243 5.849 1.00 0.00 C ATOM 461 C ARG A 158 -13.363 1.276 4.423 1.00 0.00 C ATOM 462 O ARG A 158 -13.909 1.960 3.558 1.00 0.00 O ATOM 463 CB ARG A 158 -13.095 2.191 6.739 1.00 0.00 C ATOM 464 CG ARG A 158 -13.939 3.266 7.404 1.00 0.00 C ATOM 465 CD ARG A 158 -13.349 3.694 8.736 1.00 0.00 C ATOM 466 NE ARG A 158 -14.338 4.354 9.585 1.00 0.00 N ATOM 467 CZ ARG A 158 -14.203 4.511 10.900 1.00 0.00 C ATOM 468 NH1 ARG A 158 -13.120 4.058 11.521 1.00 0.00 N ATOM 469 NH2 ARG A 158 -15.152 5.121 11.597 1.00 0.00 N ATOM 0 H ARG A 158 -13.040 -0.318 6.955 1.00 0.00 H new ATOM 0 HA ARG A 158 -14.942 1.572 5.830 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -12.588 1.610 7.509 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -12.320 2.668 6.139 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -14.015 4.130 6.744 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -14.951 2.892 7.557 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -12.951 2.821 9.254 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -12.512 4.370 8.561 1.00 0.00 H new ATOM 0 HE ARG A 158 -15.183 4.716 9.143 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -12.387 3.587 10.990 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -13.021 4.181 12.529 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -15.986 5.470 11.126 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -15.048 5.241 12.605 1.00 0.00 H new ATOM 483 N GLY A 159 -12.286 0.533 4.186 1.00 0.00 N ATOM 484 CA GLY A 159 -11.692 0.492 2.863 1.00 0.00 C ATOM 485 C GLY A 159 -10.642 1.569 2.669 1.00 0.00 C ATOM 486 O GLY A 159 -10.519 2.138 1.585 1.00 0.00 O ATOM 0 H GLY A 159 -11.815 -0.040 4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -11.240 -0.486 2.701 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -12.474 0.611 2.113 1.00 0.00 H new ATOM 490 N LYS A 160 -9.884 1.849 3.724 1.00 0.00 N ATOM 491 CA LYS A 160 -8.840 2.865 3.668 1.00 0.00 C ATOM 492 C LYS A 160 -7.466 2.249 3.913 1.00 0.00 C ATOM 493 O LYS A 160 -7.350 1.051 4.169 1.00 0.00 O ATOM 494 CB LYS A 160 -9.110 3.962 4.699 1.00 0.00 C ATOM 495 CG LYS A 160 -10.059 5.041 4.203 1.00 0.00 C ATOM 496 CD LYS A 160 -10.505 5.951 5.337 1.00 0.00 C ATOM 497 CE LYS A 160 -9.659 7.212 5.405 1.00 0.00 C ATOM 498 NZ LYS A 160 -10.336 8.295 6.170 1.00 0.00 N ATOM 0 H LYS A 160 -9.973 1.386 4.629 1.00 0.00 H new ATOM 0 HA LYS A 160 -8.849 3.303 2.670 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -9.526 3.509 5.599 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -8.164 4.424 4.983 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -9.568 5.633 3.431 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -10.931 4.577 3.742 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -11.552 6.221 5.198 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -10.437 5.415 6.283 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -8.701 6.982 5.872 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -9.445 7.560 4.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -9.635 9.008 6.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -11.061 8.742 5.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -10.786 7.893 7.017 1.00 0.00 H new ATOM 512 N VAL A 161 -6.431 3.077 3.836 1.00 0.00 N ATOM 513 CA VAL A 161 -5.064 2.616 4.051 1.00 0.00 C ATOM 514 C VAL A 161 -4.142 3.779 4.396 1.00 0.00 C ATOM 515 O VAL A 161 -4.448 4.939 4.114 1.00 0.00 O ATOM 516 CB VAL A 161 -4.520 1.863 2.813 1.00 0.00 C ATOM 517 CG1 VAL A 161 -4.926 2.571 1.530 1.00 0.00 C ATOM 518 CG2 VAL A 161 -3.006 1.692 2.875 1.00 0.00 C ATOM 0 H VAL A 161 -6.512 4.072 3.626 1.00 0.00 H new ATOM 0 HA VAL A 161 -5.087 1.924 4.893 1.00 0.00 H new ATOM 0 HB VAL A 161 -4.964 0.867 2.817 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -4.533 2.024 0.673 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -6.013 2.613 1.466 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -4.523 3.584 1.530 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -2.663 1.159 1.988 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -2.531 2.672 2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -2.740 1.123 3.766 1.00 0.00 H new ATOM 528 N LYS A 162 -3.014 3.454 5.010 1.00 0.00 N ATOM 529 CA LYS A 162 -2.033 4.460 5.402 1.00 0.00 C ATOM 530 C LYS A 162 -0.648 4.100 4.875 1.00 0.00 C ATOM 531 O LYS A 162 -0.201 2.960 5.003 1.00 0.00 O ATOM 532 CB LYS A 162 -1.994 4.595 6.925 1.00 0.00 C ATOM 533 CG LYS A 162 -1.013 5.647 7.417 1.00 0.00 C ATOM 534 CD LYS A 162 -0.740 5.501 8.905 1.00 0.00 C ATOM 535 CE LYS A 162 -0.122 6.764 9.484 1.00 0.00 C ATOM 536 NZ LYS A 162 1.352 6.637 9.647 1.00 0.00 N ATOM 0 H LYS A 162 -2.753 2.497 5.249 1.00 0.00 H new ATOM 0 HA LYS A 162 -2.331 5.414 4.967 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -2.992 4.844 7.285 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -1.729 3.631 7.360 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -0.078 5.561 6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -1.412 6.641 7.215 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -1.671 5.278 9.427 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -0.071 4.657 9.072 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -0.344 7.608 8.831 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -0.577 6.980 10.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 1.735 7.519 10.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 1.563 5.847 10.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 1.789 6.456 8.721 1.00 0.00 H new ATOM 550 N VAL A 163 0.030 5.081 4.285 1.00 0.00 N ATOM 551 CA VAL A 163 1.366 4.863 3.740 1.00 0.00 C ATOM 552 C VAL A 163 2.284 6.046 4.040 1.00 0.00 C ATOM 553 O VAL A 163 1.820 7.150 4.325 1.00 0.00 O ATOM 554 CB VAL A 163 1.321 4.631 2.215 1.00 0.00 C ATOM 555 CG1 VAL A 163 0.390 3.479 1.874 1.00 0.00 C ATOM 556 CG2 VAL A 163 0.898 5.901 1.488 1.00 0.00 C ATOM 0 H VAL A 163 -0.323 6.031 4.173 1.00 0.00 H new ATOM 0 HA VAL A 163 1.763 3.970 4.223 1.00 0.00 H new ATOM 0 HB VAL A 163 2.325 4.367 1.881 1.00 0.00 H new ATOM 0 HG11 VAL A 163 0.373 3.332 0.794 1.00 0.00 H new ATOM 0 HG12 VAL A 163 0.745 2.569 2.358 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -0.616 3.708 2.225 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.873 5.715 0.414 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -0.093 6.201 1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 163 1.611 6.697 1.701 1.00 0.00 H new ATOM 566 N MET A 164 3.589 5.807 3.967 1.00 0.00 N ATOM 567 CA MET A 164 4.572 6.852 4.224 1.00 0.00 C ATOM 568 C MET A 164 5.146 7.383 2.914 1.00 0.00 C ATOM 569 O MET A 164 5.793 6.650 2.167 1.00 0.00 O ATOM 570 CB MET A 164 5.696 6.323 5.120 1.00 0.00 C ATOM 571 CG MET A 164 6.634 5.350 4.423 1.00 0.00 C ATOM 572 SD MET A 164 7.691 4.455 5.578 1.00 0.00 S ATOM 573 CE MET A 164 6.469 3.762 6.689 1.00 0.00 C ATOM 0 H MET A 164 3.990 4.899 3.732 1.00 0.00 H new ATOM 0 HA MET A 164 4.072 7.672 4.740 1.00 0.00 H new ATOM 0 HB2 MET A 164 6.276 7.166 5.494 1.00 0.00 H new ATOM 0 HB3 MET A 164 5.255 5.830 5.986 1.00 0.00 H new ATOM 0 HG2 MET A 164 6.047 4.636 3.846 1.00 0.00 H new ATOM 0 HG3 MET A 164 7.257 5.896 3.715 1.00 0.00 H new ATOM 0 HE1 MET A 164 6.781 2.764 6.996 1.00 0.00 H new ATOM 0 HE2 MET A 164 6.374 4.399 7.569 1.00 0.00 H new ATOM 0 HE3 MET A 164 5.507 3.701 6.180 1.00 0.00 H new ATOM 583 N VAL A 165 4.899 8.659 2.638 1.00 0.00 N ATOM 584 CA VAL A 165 5.386 9.284 1.414 1.00 0.00 C ATOM 585 C VAL A 165 6.528 10.251 1.701 1.00 0.00 C ATOM 586 O VAL A 165 6.701 10.708 2.832 1.00 0.00 O ATOM 587 CB VAL A 165 4.259 10.041 0.685 1.00 0.00 C ATOM 588 CG1 VAL A 165 3.259 9.064 0.090 1.00 0.00 C ATOM 589 CG2 VAL A 165 3.571 11.010 1.634 1.00 0.00 C ATOM 0 H VAL A 165 4.365 9.280 3.245 1.00 0.00 H new ATOM 0 HA VAL A 165 5.750 8.480 0.774 1.00 0.00 H new ATOM 0 HB VAL A 165 4.697 10.616 -0.131 1.00 0.00 H new ATOM 0 HG11 VAL A 165 2.470 9.616 -0.421 1.00 0.00 H new ATOM 0 HG12 VAL A 165 3.766 8.413 -0.622 1.00 0.00 H new ATOM 0 HG13 VAL A 165 2.822 8.461 0.886 1.00 0.00 H new ATOM 0 HG21 VAL A 165 2.778 11.537 1.104 1.00 0.00 H new ATOM 0 HG22 VAL A 165 3.144 10.458 2.471 1.00 0.00 H new ATOM 0 HG23 VAL A 165 4.298 11.731 2.008 1.00 0.00 H new ATOM 599 N THR A 166 7.306 10.561 0.668 1.00 0.00 N ATOM 600 CA THR A 166 8.432 11.476 0.804 1.00 0.00 C ATOM 601 C THR A 166 8.714 12.185 -0.517 1.00 0.00 C ATOM 602 O THR A 166 8.729 11.559 -1.577 1.00 0.00 O ATOM 603 CB THR A 166 9.678 10.720 1.269 1.00 0.00 C ATOM 604 OG1 THR A 166 10.787 11.595 1.368 1.00 0.00 O ATOM 605 CG2 THR A 166 10.070 9.586 0.346 1.00 0.00 C ATOM 0 H THR A 166 7.176 10.191 -0.273 1.00 0.00 H new ATOM 0 HA THR A 166 8.173 12.226 1.552 1.00 0.00 H new ATOM 0 HB THR A 166 9.416 10.302 2.241 1.00 0.00 H new ATOM 0 HG1 THR A 166 11.574 11.094 1.668 1.00 0.00 H new ATOM 0 HG21 THR A 166 10.961 9.092 0.734 1.00 0.00 H new ATOM 0 HG22 THR A 166 9.253 8.867 0.286 1.00 0.00 H new ATOM 0 HG23 THR A 166 10.279 9.981 -0.648 1.00 0.00 H new ATOM 613 N ILE A 167 8.936 13.493 -0.445 1.00 0.00 N ATOM 614 CA ILE A 167 9.217 14.285 -1.637 1.00 0.00 C ATOM 615 C ILE A 167 10.716 14.375 -1.896 1.00 0.00 C ATOM 616 O ILE A 167 11.218 13.840 -2.884 1.00 0.00 O ATOM 617 CB ILE A 167 8.641 15.709 -1.515 1.00 0.00 C ATOM 618 CG1 ILE A 167 7.179 15.656 -1.062 1.00 0.00 C ATOM 619 CG2 ILE A 167 8.766 16.446 -2.841 1.00 0.00 C ATOM 620 CD1 ILE A 167 6.989 15.989 0.401 1.00 0.00 C ATOM 0 H ILE A 167 8.927 14.026 0.424 1.00 0.00 H new ATOM 0 HA ILE A 167 8.736 13.778 -2.474 1.00 0.00 H new ATOM 0 HB ILE A 167 9.213 16.254 -0.764 1.00 0.00 H new ATOM 0 HG12 ILE A 167 6.595 16.352 -1.664 1.00 0.00 H new ATOM 0 HG13 ILE A 167 6.783 14.659 -1.254 1.00 0.00 H new ATOM 0 HG21 ILE A 167 8.355 17.450 -2.739 1.00 0.00 H new ATOM 0 HG22 ILE A 167 9.817 16.511 -3.124 1.00 0.00 H new ATOM 0 HG23 ILE A 167 8.216 15.905 -3.611 1.00 0.00 H new ATOM 0 HD11 ILE A 167 5.930 15.932 0.653 1.00 0.00 H new ATOM 0 HD12 ILE A 167 7.546 15.278 1.011 1.00 0.00 H new ATOM 0 HD13 ILE A 167 7.354 16.997 0.595 1.00 0.00 H new ATOM 632 N PHE A 168 11.426 15.056 -1.004 1.00 0.00 N ATOM 633 CA PHE A 168 12.868 15.216 -1.135 1.00 0.00 C ATOM 634 C PHE A 168 13.531 15.302 0.236 1.00 0.00 C ATOM 635 O PHE A 168 13.735 16.392 0.772 1.00 0.00 O ATOM 636 CB PHE A 168 13.192 16.468 -1.955 1.00 0.00 C ATOM 637 CG PHE A 168 14.025 16.187 -3.174 1.00 0.00 C ATOM 638 CD1 PHE A 168 15.408 16.156 -3.090 1.00 0.00 C ATOM 639 CD2 PHE A 168 13.425 15.954 -4.401 1.00 0.00 C ATOM 640 CE1 PHE A 168 16.177 15.898 -4.209 1.00 0.00 C ATOM 641 CE2 PHE A 168 14.188 15.695 -5.522 1.00 0.00 C ATOM 642 CZ PHE A 168 15.566 15.667 -5.426 1.00 0.00 C ATOM 0 H PHE A 168 11.025 15.507 -0.181 1.00 0.00 H new ATOM 0 HA PHE A 168 13.261 14.342 -1.654 1.00 0.00 H new ATOM 0 HB2 PHE A 168 12.260 16.942 -2.263 1.00 0.00 H new ATOM 0 HB3 PHE A 168 13.719 17.182 -1.321 1.00 0.00 H new ATOM 0 HD1 PHE A 168 15.890 16.335 -2.140 1.00 0.00 H new ATOM 0 HD2 PHE A 168 12.348 15.975 -4.481 1.00 0.00 H new ATOM 0 HE1 PHE A 168 17.254 15.877 -4.132 1.00 0.00 H new ATOM 0 HE2 PHE A 168 13.708 15.515 -6.473 1.00 0.00 H new ATOM 0 HZ PHE A 168 16.165 15.465 -6.302 1.00 0.00 H new ATOM 652 N GLY A 169 13.865 14.145 0.800 1.00 0.00 N ATOM 653 CA GLY A 169 14.499 14.112 2.103 1.00 0.00 C ATOM 654 C GLY A 169 13.552 14.510 3.218 1.00 0.00 C ATOM 655 O GLY A 169 13.983 14.987 4.267 1.00 0.00 O ATOM 0 H GLY A 169 13.707 13.230 0.377 1.00 0.00 H new ATOM 0 HA2 GLY A 169 14.879 13.108 2.294 1.00 0.00 H new ATOM 0 HA3 GLY A 169 15.358 14.783 2.103 1.00 0.00 H new ATOM 659 N ARG A 170 12.256 14.314 2.990 1.00 0.00 N ATOM 660 CA ARG A 170 11.245 14.656 3.982 1.00 0.00 C ATOM 661 C ARG A 170 10.047 13.718 3.883 1.00 0.00 C ATOM 662 O ARG A 170 9.308 13.738 2.897 1.00 0.00 O ATOM 663 CB ARG A 170 10.788 16.104 3.798 1.00 0.00 C ATOM 664 CG ARG A 170 10.310 16.760 5.083 1.00 0.00 C ATOM 665 CD ARG A 170 9.227 17.793 4.812 1.00 0.00 C ATOM 666 NE ARG A 170 9.718 18.896 3.988 1.00 0.00 N ATOM 667 CZ ARG A 170 9.084 20.060 3.856 1.00 0.00 C ATOM 668 NH1 ARG A 170 7.940 20.276 4.491 1.00 0.00 N ATOM 669 NH2 ARG A 170 9.599 21.010 3.088 1.00 0.00 N ATOM 0 H ARG A 170 11.883 13.920 2.126 1.00 0.00 H new ATOM 0 HA ARG A 170 11.691 14.546 4.970 1.00 0.00 H new ATOM 0 HB2 ARG A 170 11.613 16.687 3.387 1.00 0.00 H new ATOM 0 HB3 ARG A 170 9.982 16.131 3.065 1.00 0.00 H new ATOM 0 HG2 ARG A 170 9.926 15.998 5.761 1.00 0.00 H new ATOM 0 HG3 ARG A 170 11.152 17.237 5.584 1.00 0.00 H new ATOM 0 HD2 ARG A 170 8.385 17.314 4.312 1.00 0.00 H new ATOM 0 HD3 ARG A 170 8.855 18.185 5.758 1.00 0.00 H new ATOM 0 HE ARG A 170 10.596 18.767 3.485 1.00 0.00 H new ATOM 0 HH11 ARG A 170 7.541 19.549 5.084 1.00 0.00 H new ATOM 0 HH12 ARG A 170 7.459 21.169 4.386 1.00 0.00 H new ATOM 0 HH21 ARG A 170 10.480 20.849 2.599 1.00 0.00 H new ATOM 0 HH22 ARG A 170 9.115 21.902 2.986 1.00 0.00 H new ATOM 683 N GLU A 171 9.860 12.895 4.910 1.00 0.00 N ATOM 684 CA GLU A 171 8.751 11.948 4.939 1.00 0.00 C ATOM 685 C GLU A 171 7.515 12.579 5.573 1.00 0.00 C ATOM 686 O GLU A 171 7.618 13.539 6.335 1.00 0.00 O ATOM 687 CB GLU A 171 9.148 10.689 5.710 1.00 0.00 C ATOM 688 CG GLU A 171 8.439 9.432 5.230 1.00 0.00 C ATOM 689 CD GLU A 171 9.159 8.164 5.641 1.00 0.00 C ATOM 690 OE1 GLU A 171 10.048 7.716 4.887 1.00 0.00 O ATOM 691 OE2 GLU A 171 8.836 7.620 6.718 1.00 0.00 O ATOM 0 H GLU A 171 10.462 12.865 5.733 1.00 0.00 H new ATOM 0 HA GLU A 171 8.511 11.675 3.911 1.00 0.00 H new ATOM 0 HB2 GLU A 171 10.225 10.544 5.623 1.00 0.00 H new ATOM 0 HB3 GLU A 171 8.931 10.837 6.768 1.00 0.00 H new ATOM 0 HG2 GLU A 171 7.425 9.416 5.630 1.00 0.00 H new ATOM 0 HG3 GLU A 171 8.352 9.460 4.144 1.00 0.00 H new ATOM 698 N THR A 172 6.347 12.031 5.254 1.00 0.00 N ATOM 699 CA THR A 172 5.093 12.541 5.795 1.00 0.00 C ATOM 700 C THR A 172 3.986 11.492 5.692 1.00 0.00 C ATOM 701 O THR A 172 3.548 11.150 4.593 1.00 0.00 O ATOM 702 CB THR A 172 4.675 13.810 5.049 1.00 0.00 C ATOM 703 OG1 THR A 172 5.698 14.789 5.113 1.00 0.00 O ATOM 704 CG2 THR A 172 3.409 14.435 5.593 1.00 0.00 C ATOM 0 H THR A 172 6.243 11.235 4.625 1.00 0.00 H new ATOM 0 HA THR A 172 5.249 12.776 6.848 1.00 0.00 H new ATOM 0 HB THR A 172 4.493 13.494 4.022 1.00 0.00 H new ATOM 0 HG1 THR A 172 6.319 14.567 5.838 1.00 0.00 H new ATOM 0 HG21 THR A 172 3.170 15.330 5.019 1.00 0.00 H new ATOM 0 HG22 THR A 172 2.588 13.722 5.513 1.00 0.00 H new ATOM 0 HG23 THR A 172 3.556 14.703 6.639 1.00 0.00 H new ATOM 712 N PRO A 173 3.513 10.966 6.838 1.00 0.00 N ATOM 713 CA PRO A 173 2.451 9.955 6.860 1.00 0.00 C ATOM 714 C PRO A 173 1.093 10.541 6.491 1.00 0.00 C ATOM 715 O PRO A 173 0.606 11.463 7.147 1.00 0.00 O ATOM 716 CB PRO A 173 2.450 9.473 8.311 1.00 0.00 C ATOM 717 CG PRO A 173 2.975 10.628 9.091 1.00 0.00 C ATOM 718 CD PRO A 173 3.972 11.313 8.198 1.00 0.00 C ATOM 0 HA PRO A 173 2.626 9.160 6.135 1.00 0.00 H new ATOM 0 HB2 PRO A 173 1.447 9.198 8.637 1.00 0.00 H new ATOM 0 HB3 PRO A 173 3.079 8.591 8.436 1.00 0.00 H new ATOM 0 HG2 PRO A 173 2.170 11.308 9.371 1.00 0.00 H new ATOM 0 HG3 PRO A 173 3.445 10.293 10.016 1.00 0.00 H new ATOM 0 HD2 PRO A 173 3.978 12.391 8.356 1.00 0.00 H new ATOM 0 HD3 PRO A 173 4.986 10.958 8.382 1.00 0.00 H new ATOM 726 N VAL A 174 0.487 10.005 5.438 1.00 0.00 N ATOM 727 CA VAL A 174 -0.814 10.479 4.983 1.00 0.00 C ATOM 728 C VAL A 174 -1.802 9.328 4.830 1.00 0.00 C ATOM 729 O VAL A 174 -1.432 8.232 4.403 1.00 0.00 O ATOM 730 CB VAL A 174 -0.702 11.227 3.642 1.00 0.00 C ATOM 731 CG1 VAL A 174 0.131 12.490 3.801 1.00 0.00 C ATOM 732 CG2 VAL A 174 -0.112 10.322 2.570 1.00 0.00 C ATOM 0 H VAL A 174 0.876 9.242 4.884 1.00 0.00 H new ATOM 0 HA VAL A 174 -1.181 11.166 5.745 1.00 0.00 H new ATOM 0 HB VAL A 174 -1.704 11.518 3.327 1.00 0.00 H new ATOM 0 HG11 VAL A 174 0.198 13.004 2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -0.340 13.147 4.533 1.00 0.00 H new ATOM 0 HG13 VAL A 174 1.132 12.225 4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 174 -0.041 10.870 1.630 1.00 0.00 H new ATOM 0 HG22 VAL A 174 0.882 9.996 2.876 1.00 0.00 H new ATOM 0 HG23 VAL A 174 -0.754 9.451 2.435 1.00 0.00 H new ATOM 742 N GLU A 175 -3.060 9.584 5.175 1.00 0.00 N ATOM 743 CA GLU A 175 -4.103 8.571 5.072 1.00 0.00 C ATOM 744 C GLU A 175 -4.822 8.673 3.731 1.00 0.00 C ATOM 745 O GLU A 175 -5.283 9.748 3.344 1.00 0.00 O ATOM 746 CB GLU A 175 -5.105 8.719 6.218 1.00 0.00 C ATOM 747 CG GLU A 175 -5.593 10.143 6.422 1.00 0.00 C ATOM 748 CD GLU A 175 -6.988 10.201 7.013 1.00 0.00 C ATOM 749 OE1 GLU A 175 -7.900 9.559 6.449 1.00 0.00 O ATOM 750 OE2 GLU A 175 -7.169 10.889 8.039 1.00 0.00 O ATOM 0 H GLU A 175 -3.381 10.485 5.529 1.00 0.00 H new ATOM 0 HA GLU A 175 -3.633 7.590 5.140 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -5.963 8.075 6.025 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -4.643 8.367 7.140 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -4.901 10.670 7.080 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -5.585 10.667 5.466 1.00 0.00 H new ATOM 757 N LEU A 176 -4.909 7.552 3.024 1.00 0.00 N ATOM 758 CA LEU A 176 -5.568 7.517 1.722 1.00 0.00 C ATOM 759 C LEU A 176 -6.438 6.281 1.580 1.00 0.00 C ATOM 760 O LEU A 176 -6.805 5.640 2.565 1.00 0.00 O ATOM 761 CB LEU A 176 -4.538 7.503 0.591 1.00 0.00 C ATOM 762 CG LEU A 176 -3.131 7.976 0.967 1.00 0.00 C ATOM 763 CD1 LEU A 176 -2.242 6.790 1.303 1.00 0.00 C ATOM 764 CD2 LEU A 176 -2.525 8.796 -0.164 1.00 0.00 C ATOM 0 H LEU A 176 -4.532 6.655 3.330 1.00 0.00 H new ATOM 0 HA LEU A 176 -6.186 8.412 1.656 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -4.468 6.488 0.201 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -4.908 8.131 -0.220 1.00 0.00 H new ATOM 0 HG LEU A 176 -3.205 8.610 1.850 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -1.246 7.145 1.568 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -2.668 6.243 2.144 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -2.174 6.130 0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -1.525 9.124 0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -2.464 8.185 -1.064 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -3.151 9.667 -0.358 1.00 0.00 H new ATOM 776 N ASP A 177 -6.735 5.942 0.332 1.00 0.00 N ATOM 777 CA ASP A 177 -7.526 4.772 0.030 1.00 0.00 C ATOM 778 C ASP A 177 -7.117 4.192 -1.318 1.00 0.00 C ATOM 779 O ASP A 177 -6.601 4.901 -2.179 1.00 0.00 O ATOM 780 CB ASP A 177 -9.024 5.099 0.038 1.00 0.00 C ATOM 781 CG ASP A 177 -9.315 6.547 -0.310 1.00 0.00 C ATOM 782 OD1 ASP A 177 -8.897 7.438 0.459 1.00 0.00 O ATOM 783 OD2 ASP A 177 -9.962 6.789 -1.351 1.00 0.00 O ATOM 0 H ASP A 177 -6.434 6.469 -0.488 1.00 0.00 H new ATOM 0 HA ASP A 177 -7.340 4.029 0.805 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -9.536 4.450 -0.672 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -9.434 4.878 1.024 1.00 0.00 H new ATOM 788 N PHE A 178 -7.340 2.896 -1.484 1.00 0.00 N ATOM 789 CA PHE A 178 -6.993 2.194 -2.720 1.00 0.00 C ATOM 790 C PHE A 178 -7.395 2.993 -3.961 1.00 0.00 C ATOM 791 O PHE A 178 -6.771 2.870 -5.015 1.00 0.00 O ATOM 792 CB PHE A 178 -7.664 0.820 -2.753 1.00 0.00 C ATOM 793 CG PHE A 178 -7.234 -0.087 -1.635 1.00 0.00 C ATOM 794 CD1 PHE A 178 -5.890 -0.312 -1.387 1.00 0.00 C ATOM 795 CD2 PHE A 178 -8.174 -0.713 -0.833 1.00 0.00 C ATOM 796 CE1 PHE A 178 -5.491 -1.145 -0.360 1.00 0.00 C ATOM 797 CE2 PHE A 178 -7.781 -1.547 0.196 1.00 0.00 C ATOM 798 CZ PHE A 178 -6.438 -1.765 0.433 1.00 0.00 C ATOM 0 H PHE A 178 -7.764 2.301 -0.772 1.00 0.00 H new ATOM 0 HA PHE A 178 -5.910 2.074 -2.734 1.00 0.00 H new ATOM 0 HB2 PHE A 178 -8.745 0.952 -2.707 1.00 0.00 H new ATOM 0 HB3 PHE A 178 -7.442 0.339 -3.706 1.00 0.00 H new ATOM 0 HD1 PHE A 178 -5.145 0.169 -2.004 1.00 0.00 H new ATOM 0 HD2 PHE A 178 -9.226 -0.547 -1.014 1.00 0.00 H new ATOM 0 HE1 PHE A 178 -4.440 -1.312 -0.177 1.00 0.00 H new ATOM 0 HE2 PHE A 178 -8.524 -2.028 0.815 1.00 0.00 H new ATOM 0 HZ PHE A 178 -6.129 -2.418 1.236 1.00 0.00 H new ATOM 808 N SER A 179 -8.438 3.809 -3.831 1.00 0.00 N ATOM 809 CA SER A 179 -8.918 4.620 -4.948 1.00 0.00 C ATOM 810 C SER A 179 -8.071 5.880 -5.143 1.00 0.00 C ATOM 811 O SER A 179 -8.420 6.751 -5.940 1.00 0.00 O ATOM 812 CB SER A 179 -10.381 5.011 -4.722 1.00 0.00 C ATOM 813 OG SER A 179 -10.684 5.081 -3.340 1.00 0.00 O ATOM 0 H SER A 179 -8.966 3.926 -2.966 1.00 0.00 H new ATOM 0 HA SER A 179 -8.833 4.017 -5.852 1.00 0.00 H new ATOM 0 HB2 SER A 179 -10.579 5.975 -5.190 1.00 0.00 H new ATOM 0 HB3 SER A 179 -11.034 4.283 -5.204 1.00 0.00 H new ATOM 0 HG SER A 179 -10.227 5.852 -2.944 1.00 0.00 H new ATOM 819 N GLN A 180 -6.960 5.977 -4.416 1.00 0.00 N ATOM 820 CA GLN A 180 -6.076 7.133 -4.521 1.00 0.00 C ATOM 821 C GLN A 180 -4.619 6.703 -4.698 1.00 0.00 C ATOM 822 O GLN A 180 -3.709 7.531 -4.637 1.00 0.00 O ATOM 823 CB GLN A 180 -6.209 8.018 -3.281 1.00 0.00 C ATOM 824 CG GLN A 180 -7.641 8.167 -2.787 1.00 0.00 C ATOM 825 CD GLN A 180 -7.836 9.402 -1.931 1.00 0.00 C ATOM 826 OE1 GLN A 180 -7.459 9.307 -0.661 1.00 0.00 O flip ATOM 827 NE2 GLN A 180 -8.322 10.429 -2.404 1.00 0.00 N flip ATOM 0 H GLN A 180 -6.652 5.269 -3.749 1.00 0.00 H new ATOM 0 HA GLN A 180 -6.374 7.701 -5.402 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -5.599 7.600 -2.480 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -5.807 9.006 -3.506 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -8.314 8.213 -3.643 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -7.917 7.283 -2.212 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -8.598 10.458 -3.386 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -8.449 11.252 -1.814 1.00 0.00 H new ATOM 836 N VAL A 181 -4.402 5.409 -4.919 1.00 0.00 N ATOM 837 CA VAL A 181 -3.055 4.883 -5.105 1.00 0.00 C ATOM 838 C VAL A 181 -3.034 3.793 -6.171 1.00 0.00 C ATOM 839 O VAL A 181 -4.080 3.391 -6.681 1.00 0.00 O ATOM 840 CB VAL A 181 -2.488 4.313 -3.793 1.00 0.00 C ATOM 841 CG1 VAL A 181 -2.087 5.437 -2.849 1.00 0.00 C ATOM 842 CG2 VAL A 181 -3.499 3.388 -3.131 1.00 0.00 C ATOM 0 H VAL A 181 -5.141 4.708 -4.973 1.00 0.00 H new ATOM 0 HA VAL A 181 -2.432 5.717 -5.428 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.596 3.732 -4.028 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -1.689 5.013 -1.927 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -1.325 6.056 -3.323 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -2.960 6.048 -2.620 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -3.080 2.995 -2.205 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -4.410 3.944 -2.910 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -3.732 2.562 -3.803 1.00 0.00 H new ATOM 852 N VAL A 182 -1.839 3.318 -6.501 1.00 0.00 N ATOM 853 CA VAL A 182 -1.683 2.274 -7.507 1.00 0.00 C ATOM 854 C VAL A 182 -0.496 1.372 -7.184 1.00 0.00 C ATOM 855 O VAL A 182 0.444 1.785 -6.506 1.00 0.00 O ATOM 856 CB VAL A 182 -1.488 2.871 -8.913 1.00 0.00 C ATOM 857 CG1 VAL A 182 -2.767 3.542 -9.390 1.00 0.00 C ATOM 858 CG2 VAL A 182 -0.327 3.855 -8.919 1.00 0.00 C ATOM 0 H VAL A 182 -0.964 3.639 -6.087 1.00 0.00 H new ATOM 0 HA VAL A 182 -2.600 1.685 -7.494 1.00 0.00 H new ATOM 0 HB VAL A 182 -1.251 2.061 -9.602 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.610 3.958 -10.385 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -3.572 2.807 -9.426 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -3.037 4.342 -8.701 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.204 4.267 -9.921 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -0.532 4.663 -8.217 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.587 3.341 -8.624 1.00 0.00 H new ATOM 868 N LYS A 183 -0.548 0.137 -7.672 1.00 0.00 N ATOM 869 CA LYS A 183 0.524 -0.824 -7.434 1.00 0.00 C ATOM 870 C LYS A 183 1.757 -0.479 -8.261 1.00 0.00 C ATOM 871 O LYS A 183 1.657 -0.185 -9.452 1.00 0.00 O ATOM 872 CB LYS A 183 0.048 -2.241 -7.766 1.00 0.00 C ATOM 873 CG LYS A 183 0.283 -3.239 -6.643 1.00 0.00 C ATOM 874 CD LYS A 183 -1.001 -3.540 -5.886 1.00 0.00 C ATOM 875 CE LYS A 183 -0.863 -4.789 -5.031 1.00 0.00 C ATOM 876 NZ LYS A 183 -1.270 -6.016 -5.769 1.00 0.00 N ATOM 0 H LYS A 183 -1.320 -0.222 -8.234 1.00 0.00 H new ATOM 0 HA LYS A 183 0.795 -0.778 -6.379 1.00 0.00 H new ATOM 0 HB2 LYS A 183 -1.016 -2.213 -7.999 1.00 0.00 H new ATOM 0 HB3 LYS A 183 0.562 -2.588 -8.663 1.00 0.00 H new ATOM 0 HG2 LYS A 183 0.689 -4.163 -7.055 1.00 0.00 H new ATOM 0 HG3 LYS A 183 1.029 -2.843 -5.953 1.00 0.00 H new ATOM 0 HD2 LYS A 183 -1.259 -2.691 -5.253 1.00 0.00 H new ATOM 0 HD3 LYS A 183 -1.820 -3.671 -6.594 1.00 0.00 H new ATOM 0 HE2 LYS A 183 0.171 -4.890 -4.701 1.00 0.00 H new ATOM 0 HE3 LYS A 183 -1.475 -4.685 -4.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -1.161 -6.845 -5.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -2.264 -5.931 -6.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -0.670 -6.130 -6.610 1.00 0.00 H new ATOM 890 N ALA A 184 2.922 -0.515 -7.621 1.00 0.00 N ATOM 891 CA ALA A 184 4.176 -0.205 -8.296 1.00 0.00 C ATOM 892 C ALA A 184 5.146 -1.377 -8.216 1.00 0.00 C ATOM 893 O ALA A 184 4.695 -2.498 -7.895 1.00 0.00 O ATOM 894 CB ALA A 184 4.804 1.044 -7.695 1.00 0.00 C ATOM 895 OXT ALA A 184 6.350 -1.169 -8.477 1.00 0.00 O ATOM 0 H ALA A 184 3.023 -0.756 -6.635 1.00 0.00 H new ATOM 0 HA ALA A 184 3.958 -0.019 -9.348 1.00 0.00 H new ATOM 0 HB1 ALA A 184 5.740 1.264 -8.209 1.00 0.00 H new ATOM 0 HB2 ALA A 184 4.121 1.886 -7.809 1.00 0.00 H new ATOM 0 HB3 ALA A 184 5.002 0.878 -6.636 1.00 0.00 H new TER 901 ALA A 184