USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 761 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 162 TYR OH : rot 180:sc= -0.955 USER MOD Single : A 93 GLN : amide:sc= -0.207 K(o=-0.21,f=-1.2) USER MOD Single : A 96 LYS NZ :NH3+ -123:sc= 0.279 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -0.386 K(o=-0.39,f=-0.9) USER MOD Single : A 103 SER OG : rot 158:sc= 1.59 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot -96:sc= 0.3 USER MOD Single : A 127 LYS NZ :NH3+ 137:sc= -0.0741 (180deg=-0.41) USER MOD Single : A 132 MET CE :methyl 145:sc= -0.279 (180deg=-2.42!) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.839 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 70:sc= -0.774 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0.00641 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 SER OG : rot 76:sc= 0.47 USER MOD Single : A 161 HIS : no HD1:sc= -1.85 K(o=-1.8,f=-2.7!) USER MOD Single : A 167 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 169 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 GLN : amide:sc= 0.103 X(o=0.1,f=-0.027) USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -9.313 10.154 2.566 1.00 0.00 N ATOM 86 CA VAL A 86 -7.858 10.106 2.618 1.00 0.00 C ATOM 87 C VAL A 86 -7.279 9.544 1.323 1.00 0.00 C ATOM 88 O VAL A 86 -6.248 10.012 0.839 1.00 0.00 O ATOM 89 CB VAL A 86 -7.365 9.248 3.798 1.00 0.00 C ATOM 90 CG1 VAL A 86 -7.746 9.890 5.123 1.00 0.00 C ATOM 91 CG2 VAL A 86 -7.921 7.835 3.703 1.00 0.00 C ATOM 0 HA VAL A 86 -7.514 11.131 2.754 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.278 9.189 3.749 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -7.389 9.269 5.944 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.292 10.879 5.192 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -8.830 9.983 5.184 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -7.561 7.245 4.546 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -9.010 7.870 3.724 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.591 7.376 2.771 1.00 0.00 H new ATOM 101 N ARG A 87 -7.950 8.541 0.766 1.00 0.00 N ATOM 102 CA ARG A 87 -7.502 7.918 -0.472 1.00 0.00 C ATOM 103 C ARG A 87 -7.585 8.902 -1.638 1.00 0.00 C ATOM 104 O ARG A 87 -6.675 8.979 -2.462 1.00 0.00 O ATOM 105 CB ARG A 87 -8.341 6.674 -0.775 1.00 0.00 C ATOM 106 CG ARG A 87 -7.513 5.469 -1.192 1.00 0.00 C ATOM 107 CD ARG A 87 -6.908 4.766 0.012 1.00 0.00 C ATOM 108 NE ARG A 87 -7.932 4.267 0.927 1.00 0.00 N ATOM 109 CZ ARG A 87 -8.658 3.175 0.703 1.00 0.00 C ATOM 110 NH1 ARG A 87 -8.478 2.465 -0.404 1.00 0.00 N ATOM 111 NH2 ARG A 87 -9.567 2.790 1.589 1.00 0.00 N ATOM 0 H ARG A 87 -8.806 8.143 1.153 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.461 7.622 -0.345 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.925 6.415 0.109 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -9.051 6.909 -1.568 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -8.139 4.770 -1.746 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -6.718 5.788 -1.866 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -6.289 3.935 -0.327 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -6.253 5.456 0.543 1.00 0.00 H new ATOM 0 HE ARG A 87 -8.100 4.787 1.788 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -7.780 2.756 -1.089 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -9.038 1.629 -0.570 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -9.709 3.331 2.442 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -10.124 1.953 1.417 1.00 0.00 H new ATOM 125 N LEU A 88 -8.681 9.649 -1.696 1.00 0.00 N ATOM 126 CA LEU A 88 -8.883 10.627 -2.759 1.00 0.00 C ATOM 127 C LEU A 88 -7.800 11.700 -2.723 1.00 0.00 C ATOM 128 O LEU A 88 -7.247 12.073 -3.758 1.00 0.00 O ATOM 129 CB LEU A 88 -10.263 11.274 -2.629 1.00 0.00 C ATOM 130 CG LEU A 88 -11.402 10.510 -3.307 1.00 0.00 C ATOM 131 CD1 LEU A 88 -12.739 11.174 -3.013 1.00 0.00 C ATOM 132 CD2 LEU A 88 -11.166 10.422 -4.807 1.00 0.00 C ATOM 0 H LEU A 88 -9.443 9.597 -1.020 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.822 10.107 -3.715 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -10.498 11.383 -1.570 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -10.218 12.278 -3.050 1.00 0.00 H new ATOM 0 HG LEU A 88 -11.426 9.498 -2.904 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -13.537 10.617 -3.503 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -12.911 11.184 -1.937 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -12.727 12.197 -3.388 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -11.986 9.875 -5.273 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -11.115 11.427 -5.227 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -10.228 9.901 -4.998 1.00 0.00 H new ATOM 144 N ASP A 89 -7.504 12.196 -1.525 1.00 0.00 N ATOM 145 CA ASP A 89 -6.492 13.228 -1.352 1.00 0.00 C ATOM 146 C ASP A 89 -5.141 12.765 -1.890 1.00 0.00 C ATOM 147 O ASP A 89 -4.427 13.530 -2.539 1.00 0.00 O ATOM 148 CB ASP A 89 -6.366 13.603 0.126 1.00 0.00 C ATOM 149 CG ASP A 89 -7.379 14.650 0.544 1.00 0.00 C ATOM 150 OD1 ASP A 89 -8.557 14.527 0.151 1.00 0.00 O ATOM 151 OD2 ASP A 89 -6.992 15.594 1.265 1.00 0.00 O ATOM 0 H ASP A 89 -7.953 11.898 -0.659 1.00 0.00 H new ATOM 0 HA ASP A 89 -6.804 14.106 -1.918 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -6.497 12.710 0.737 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -5.360 13.977 0.319 1.00 0.00 H new ATOM 156 N PHE A 90 -4.796 11.512 -1.612 1.00 0.00 N ATOM 157 CA PHE A 90 -3.529 10.949 -2.068 1.00 0.00 C ATOM 158 C PHE A 90 -3.426 11.001 -3.589 1.00 0.00 C ATOM 159 O PHE A 90 -2.378 11.337 -4.139 1.00 0.00 O ATOM 160 CB PHE A 90 -3.384 9.506 -1.584 1.00 0.00 C ATOM 161 CG PHE A 90 -2.043 8.903 -1.886 1.00 0.00 C ATOM 162 CD1 PHE A 90 -1.728 8.490 -3.171 1.00 0.00 C ATOM 163 CD2 PHE A 90 -1.096 8.747 -0.886 1.00 0.00 C ATOM 164 CE1 PHE A 90 -0.495 7.934 -3.452 1.00 0.00 C ATOM 165 CE2 PHE A 90 0.138 8.192 -1.162 1.00 0.00 C ATOM 166 CZ PHE A 90 0.439 7.784 -2.446 1.00 0.00 C ATOM 0 H PHE A 90 -5.375 10.867 -1.074 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.722 11.548 -1.647 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.554 9.474 -0.508 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.160 8.896 -2.047 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.455 8.604 -3.962 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.326 9.063 0.121 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.262 7.617 -4.458 1.00 0.00 H new ATOM 0 HE2 PHE A 90 0.867 8.077 -0.374 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.403 7.348 -2.663 1.00 0.00 H new ATOM 176 N LEU A 91 -4.521 10.664 -4.262 1.00 0.00 N ATOM 177 CA LEU A 91 -4.553 10.672 -5.721 1.00 0.00 C ATOM 178 C LEU A 91 -4.378 12.088 -6.261 1.00 0.00 C ATOM 179 O LEU A 91 -3.795 12.287 -7.327 1.00 0.00 O ATOM 180 CB LEU A 91 -5.872 10.080 -6.225 1.00 0.00 C ATOM 181 CG LEU A 91 -5.847 8.573 -6.486 1.00 0.00 C ATOM 182 CD1 LEU A 91 -4.967 8.254 -7.685 1.00 0.00 C ATOM 183 CD2 LEU A 91 -5.363 7.826 -5.253 1.00 0.00 C ATOM 0 H LEU A 91 -5.397 10.382 -3.822 1.00 0.00 H new ATOM 0 HA LEU A 91 -3.726 10.060 -6.082 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.652 10.294 -5.494 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.152 10.589 -7.148 1.00 0.00 H new ATOM 0 HG LEU A 91 -6.862 8.245 -6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -4.961 7.177 -7.856 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -5.358 8.759 -8.568 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.950 8.596 -7.491 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.352 6.755 -5.457 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -4.356 8.157 -4.999 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.034 8.029 -4.418 1.00 0.00 H new ATOM 195 N ASP A 92 -4.885 13.066 -5.518 1.00 0.00 N ATOM 196 CA ASP A 92 -4.784 14.463 -5.923 1.00 0.00 C ATOM 197 C ASP A 92 -3.328 14.921 -5.949 1.00 0.00 C ATOM 198 O ASP A 92 -2.910 15.641 -6.854 1.00 0.00 O ATOM 199 CB ASP A 92 -5.595 15.350 -4.974 1.00 0.00 C ATOM 200 CG ASP A 92 -6.505 16.309 -5.716 1.00 0.00 C ATOM 201 OD1 ASP A 92 -5.995 17.085 -6.550 1.00 0.00 O ATOM 202 OD2 ASP A 92 -7.729 16.282 -5.462 1.00 0.00 O ATOM 0 H ASP A 92 -5.370 12.917 -4.633 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.190 14.553 -6.930 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -6.194 14.721 -4.316 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.914 15.917 -4.340 1.00 0.00 H new ATOM 207 N GLN A 93 -2.562 14.496 -4.949 1.00 0.00 N ATOM 208 CA GLN A 93 -1.153 14.862 -4.859 1.00 0.00 C ATOM 209 C GLN A 93 -0.380 14.353 -6.071 1.00 0.00 C ATOM 210 O GLN A 93 0.444 15.070 -6.642 1.00 0.00 O ATOM 211 CB GLN A 93 -0.539 14.297 -3.576 1.00 0.00 C ATOM 212 CG GLN A 93 -1.322 14.645 -2.321 1.00 0.00 C ATOM 213 CD GLN A 93 -1.534 16.138 -2.160 1.00 0.00 C ATOM 214 OE1 GLN A 93 -0.739 16.945 -2.643 1.00 0.00 O ATOM 215 NE2 GLN A 93 -2.612 16.513 -1.481 1.00 0.00 N ATOM 0 H GLN A 93 -2.893 13.899 -4.191 1.00 0.00 H new ATOM 0 HA GLN A 93 -1.087 15.950 -4.838 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -0.471 13.213 -3.663 1.00 0.00 H new ATOM 0 HB3 GLN A 93 0.479 14.673 -3.475 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -2.290 14.146 -2.351 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -0.793 14.261 -1.449 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -3.244 15.810 -1.098 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -2.808 17.504 -1.342 1.00 0.00 H new ATOM 224 N LEU A 94 -0.651 13.111 -6.461 1.00 0.00 N ATOM 225 CA LEU A 94 0.020 12.505 -7.605 1.00 0.00 C ATOM 226 C LEU A 94 -0.400 13.184 -8.904 1.00 0.00 C ATOM 227 O LEU A 94 0.425 13.428 -9.785 1.00 0.00 O ATOM 228 CB LEU A 94 -0.297 11.010 -7.672 1.00 0.00 C ATOM 229 CG LEU A 94 0.803 10.141 -8.291 1.00 0.00 C ATOM 230 CD1 LEU A 94 1.395 9.204 -7.248 1.00 0.00 C ATOM 231 CD2 LEU A 94 0.261 9.350 -9.473 1.00 0.00 C ATOM 0 H LEU A 94 -1.331 12.505 -6.001 1.00 0.00 H new ATOM 0 HA LEU A 94 1.094 12.638 -7.478 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.498 10.651 -6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.213 10.874 -8.247 1.00 0.00 H new ATOM 0 HG LEU A 94 1.594 10.798 -8.652 1.00 0.00 H new ATOM 0 HD11 LEU A 94 2.174 8.595 -7.706 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.823 9.789 -6.434 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.612 8.556 -6.855 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.058 8.740 -9.898 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.551 8.705 -9.137 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.112 10.039 -10.231 1.00 0.00 H new ATOM 243 N ALA A 95 -1.691 13.484 -9.018 1.00 0.00 N ATOM 244 CA ALA A 95 -2.223 14.132 -10.210 1.00 0.00 C ATOM 245 C ALA A 95 -1.713 15.563 -10.335 1.00 0.00 C ATOM 246 O ALA A 95 -1.463 16.050 -11.438 1.00 0.00 O ATOM 247 CB ALA A 95 -3.743 14.111 -10.186 1.00 0.00 C ATOM 0 H ALA A 95 -2.387 13.288 -8.299 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.875 13.576 -11.081 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.128 14.598 -11.082 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.092 13.079 -10.156 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.100 14.641 -9.303 1.00 0.00 H new ATOM 253 N LYS A 96 -1.565 16.235 -9.197 1.00 0.00 N ATOM 254 CA LYS A 96 -1.087 17.613 -9.181 1.00 0.00 C ATOM 255 C LYS A 96 0.414 17.675 -9.444 1.00 0.00 C ATOM 256 O LYS A 96 0.898 18.583 -10.119 1.00 0.00 O ATOM 257 CB LYS A 96 -1.406 18.267 -7.835 1.00 0.00 C ATOM 258 CG LYS A 96 -2.890 18.500 -7.609 1.00 0.00 C ATOM 259 CD LYS A 96 -3.396 19.688 -8.412 1.00 0.00 C ATOM 260 CE LYS A 96 -4.889 19.585 -8.679 1.00 0.00 C ATOM 261 NZ LYS A 96 -5.174 19.065 -10.046 1.00 0.00 N ATOM 0 H LYS A 96 -1.769 15.848 -8.276 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.598 18.157 -9.975 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -1.019 17.637 -7.034 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -0.883 19.221 -7.771 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.447 17.606 -7.890 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.075 18.671 -6.549 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -3.185 20.610 -7.871 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -2.859 19.744 -9.359 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -5.346 18.929 -7.938 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -5.348 20.567 -8.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -5.765 19.748 -10.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -4.280 18.926 -10.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.677 18.157 -9.974 1.00 0.00 H new ATOM 275 N PHE A 97 1.147 16.704 -8.907 1.00 0.00 N ATOM 276 CA PHE A 97 2.593 16.652 -9.083 1.00 0.00 C ATOM 277 C PHE A 97 2.960 16.399 -10.542 1.00 0.00 C ATOM 278 O PHE A 97 3.798 17.098 -11.112 1.00 0.00 O ATOM 279 CB PHE A 97 3.196 15.560 -8.198 1.00 0.00 C ATOM 280 CG PHE A 97 4.690 15.652 -8.066 1.00 0.00 C ATOM 281 CD1 PHE A 97 5.264 16.409 -7.057 1.00 0.00 C ATOM 282 CD2 PHE A 97 5.519 14.981 -8.951 1.00 0.00 C ATOM 283 CE1 PHE A 97 6.638 16.496 -6.933 1.00 0.00 C ATOM 284 CE2 PHE A 97 6.894 15.063 -8.831 1.00 0.00 C ATOM 285 CZ PHE A 97 7.453 15.822 -7.822 1.00 0.00 C ATOM 0 H PHE A 97 0.763 15.943 -8.347 1.00 0.00 H new ATOM 0 HA PHE A 97 3.002 17.619 -8.789 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.747 15.618 -7.206 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.935 14.585 -8.609 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.631 16.937 -6.360 1.00 0.00 H new ATOM 0 HD2 PHE A 97 5.086 14.388 -9.743 1.00 0.00 H new ATOM 0 HE1 PHE A 97 7.074 17.090 -6.143 1.00 0.00 H new ATOM 0 HE2 PHE A 97 7.530 14.534 -9.525 1.00 0.00 H new ATOM 0 HZ PHE A 97 8.527 15.889 -7.728 1.00 0.00 H new ATOM 295 N TRP A 98 2.329 15.395 -11.142 1.00 0.00 N ATOM 296 CA TRP A 98 2.592 15.051 -12.535 1.00 0.00 C ATOM 297 C TRP A 98 2.163 16.180 -13.467 1.00 0.00 C ATOM 298 O TRP A 98 2.790 16.417 -14.499 1.00 0.00 O ATOM 299 CB TRP A 98 1.864 13.760 -12.911 1.00 0.00 C ATOM 300 CG TRP A 98 2.665 12.524 -12.639 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.466 11.624 -11.631 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.794 12.051 -13.384 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.401 10.620 -11.705 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.225 10.859 -12.772 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.480 12.517 -14.510 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.311 10.128 -13.247 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.559 11.789 -14.981 1.00 0.00 C ATOM 308 CH2 TRP A 98 5.964 10.606 -14.351 1.00 0.00 C ATOM 0 H TRP A 98 1.632 14.806 -10.686 1.00 0.00 H new ATOM 0 HA TRP A 98 3.666 14.900 -12.647 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.927 13.706 -12.357 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.607 13.792 -13.970 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.688 11.692 -10.885 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.470 9.826 -11.069 1.00 0.00 H new ATOM 0 HE3 TRP A 98 4.174 13.428 -15.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.627 9.216 -12.762 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 6.098 12.139 -15.849 1.00 0.00 H new ATOM 0 HH2 TRP A 98 6.809 10.060 -14.744 1.00 0.00 H new ATOM 319 N GLU A 99 1.087 16.871 -13.101 1.00 0.00 N ATOM 320 CA GLU A 99 0.573 17.969 -13.905 1.00 0.00 C ATOM 321 C GLU A 99 1.655 19.019 -14.148 1.00 0.00 C ATOM 322 O GLU A 99 1.830 19.496 -15.269 1.00 0.00 O ATOM 323 CB GLU A 99 -0.635 18.611 -13.221 1.00 0.00 C ATOM 324 CG GLU A 99 -1.842 18.759 -14.134 1.00 0.00 C ATOM 325 CD GLU A 99 -3.092 18.120 -13.561 1.00 0.00 C ATOM 326 OE1 GLU A 99 -3.417 18.400 -12.388 1.00 0.00 O ATOM 327 OE2 GLU A 99 -3.744 17.338 -14.285 1.00 0.00 O ATOM 0 H GLU A 99 0.555 16.687 -12.250 1.00 0.00 H new ATOM 0 HA GLU A 99 0.261 17.565 -14.868 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.915 18.009 -12.356 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.350 19.594 -12.846 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.030 19.818 -14.313 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -1.619 18.307 -15.101 1.00 0.00 H new ATOM 334 N LEU A 100 2.381 19.367 -13.092 1.00 0.00 N ATOM 335 CA LEU A 100 3.449 20.354 -13.193 1.00 0.00 C ATOM 336 C LEU A 100 4.529 19.881 -14.162 1.00 0.00 C ATOM 337 O LEU A 100 5.216 20.690 -14.787 1.00 0.00 O ATOM 338 CB LEU A 100 4.062 20.619 -11.817 1.00 0.00 C ATOM 339 CG LEU A 100 3.055 20.962 -10.715 1.00 0.00 C ATOM 340 CD1 LEU A 100 3.565 20.493 -9.362 1.00 0.00 C ATOM 341 CD2 LEU A 100 2.778 22.457 -10.693 1.00 0.00 C ATOM 0 H LEU A 100 2.250 18.981 -12.157 1.00 0.00 H new ATOM 0 HA LEU A 100 3.021 21.281 -13.574 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.626 19.738 -11.511 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.775 21.439 -11.905 1.00 0.00 H new ATOM 0 HG LEU A 100 2.121 20.443 -10.928 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.837 20.745 -8.591 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.712 19.413 -9.383 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.513 20.984 -9.140 1.00 0.00 H new ATOM 0 HD21 LEU A 100 2.060 22.683 -9.904 1.00 0.00 H new ATOM 0 HD22 LEU A 100 3.706 22.996 -10.504 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.368 22.765 -11.655 1.00 0.00 H new ATOM 353 N GLN A 101 4.667 18.564 -14.284 1.00 0.00 N ATOM 354 CA GLN A 101 5.659 17.977 -15.178 1.00 0.00 C ATOM 355 C GLN A 101 5.161 17.994 -16.621 1.00 0.00 C ATOM 356 O GLN A 101 5.928 18.251 -17.550 1.00 0.00 O ATOM 357 CB GLN A 101 5.972 16.542 -14.752 1.00 0.00 C ATOM 358 CG GLN A 101 6.538 16.434 -13.344 1.00 0.00 C ATOM 359 CD GLN A 101 7.718 17.356 -13.115 1.00 0.00 C ATOM 360 OE1 GLN A 101 8.864 16.997 -13.390 1.00 0.00 O ATOM 361 NE2 GLN A 101 7.446 18.554 -12.611 1.00 0.00 N ATOM 0 H GLN A 101 4.104 17.883 -13.775 1.00 0.00 H new ATOM 0 HA GLN A 101 6.569 18.573 -15.117 1.00 0.00 H new ATOM 0 HB2 GLN A 101 5.061 15.946 -14.815 1.00 0.00 H new ATOM 0 HB3 GLN A 101 6.684 16.110 -15.455 1.00 0.00 H new ATOM 0 HG2 GLN A 101 5.755 16.668 -12.623 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.845 15.405 -13.158 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.482 18.811 -12.398 1.00 0.00 H new ATOM 0 HE22 GLN A 101 8.201 19.218 -12.437 1.00 0.00 H new ATOM 370 N GLY A 102 3.874 17.715 -16.799 1.00 0.00 N ATOM 371 CA GLY A 102 3.295 17.703 -18.127 1.00 0.00 C ATOM 372 C GLY A 102 2.407 16.496 -18.372 1.00 0.00 C ATOM 373 O GLY A 102 1.747 16.405 -19.409 1.00 0.00 O ATOM 0 H GLY A 102 3.222 17.497 -16.046 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.712 18.612 -18.272 1.00 0.00 H new ATOM 0 HA3 GLY A 102 4.095 17.716 -18.867 1.00 0.00 H new ATOM 377 N SER A 103 2.386 15.564 -17.421 1.00 0.00 N ATOM 378 CA SER A 103 1.572 14.361 -17.551 1.00 0.00 C ATOM 379 C SER A 103 0.199 14.561 -16.917 1.00 0.00 C ATOM 380 O SER A 103 -0.174 15.676 -16.555 1.00 0.00 O ATOM 381 CB SER A 103 2.278 13.170 -16.901 1.00 0.00 C ATOM 382 OG SER A 103 3.667 13.183 -17.187 1.00 0.00 O ATOM 0 H SER A 103 2.922 15.620 -16.555 1.00 0.00 H new ATOM 0 HA SER A 103 1.435 14.158 -18.613 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.125 13.197 -15.822 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.838 12.241 -17.262 1.00 0.00 H new ATOM 0 HG SER A 103 4.145 12.658 -16.511 1.00 0.00 H new ATOM 388 N THR A 104 -0.550 13.470 -16.785 1.00 0.00 N ATOM 389 CA THR A 104 -1.883 13.523 -16.196 1.00 0.00 C ATOM 390 C THR A 104 -2.231 12.205 -15.513 1.00 0.00 C ATOM 391 O THR A 104 -2.315 11.162 -16.162 1.00 0.00 O ATOM 392 CB THR A 104 -2.925 13.845 -17.269 1.00 0.00 C ATOM 393 OG1 THR A 104 -4.231 13.826 -16.723 1.00 0.00 O ATOM 394 CG2 THR A 104 -2.900 12.878 -18.435 1.00 0.00 C ATOM 0 H THR A 104 -0.256 12.538 -17.078 1.00 0.00 H new ATOM 0 HA THR A 104 -1.888 14.312 -15.444 1.00 0.00 H new ATOM 0 HB THR A 104 -2.666 14.839 -17.635 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.882 14.036 -17.425 1.00 0.00 H new ATOM 0 HG21 THR A 104 -3.663 13.162 -19.160 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.919 12.906 -18.910 1.00 0.00 H new ATOM 0 HG23 THR A 104 -3.100 11.869 -18.075 1.00 0.00 H new ATOM 402 N LEU A 105 -2.432 12.259 -14.201 1.00 0.00 N ATOM 403 CA LEU A 105 -2.771 11.070 -13.429 1.00 0.00 C ATOM 404 C LEU A 105 -4.141 10.532 -13.831 1.00 0.00 C ATOM 405 O LEU A 105 -5.162 11.189 -13.627 1.00 0.00 O ATOM 406 CB LEU A 105 -2.751 11.387 -11.929 1.00 0.00 C ATOM 407 CG LEU A 105 -3.175 10.243 -11.003 1.00 0.00 C ATOM 408 CD1 LEU A 105 -4.692 10.129 -10.950 1.00 0.00 C ATOM 409 CD2 LEU A 105 -2.555 8.927 -11.452 1.00 0.00 C ATOM 0 H LEU A 105 -2.366 13.115 -13.650 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.025 10.304 -13.641 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.742 11.697 -11.655 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.406 12.239 -11.748 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.812 10.466 -10.000 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -4.972 9.311 -10.287 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -5.114 11.061 -10.574 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -5.077 9.934 -11.951 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -2.870 8.129 -10.780 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.882 8.698 -12.466 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -1.468 9.011 -11.432 1.00 0.00 H new ATOM 421 N LYS A 106 -4.154 9.331 -14.403 1.00 0.00 N ATOM 422 CA LYS A 106 -5.399 8.703 -14.830 1.00 0.00 C ATOM 423 C LYS A 106 -5.518 7.292 -14.265 1.00 0.00 C ATOM 424 O LYS A 106 -4.788 6.387 -14.668 1.00 0.00 O ATOM 425 CB LYS A 106 -5.473 8.660 -16.358 1.00 0.00 C ATOM 426 CG LYS A 106 -6.893 8.716 -16.899 1.00 0.00 C ATOM 427 CD LYS A 106 -7.067 9.845 -17.903 1.00 0.00 C ATOM 428 CE LYS A 106 -7.091 11.200 -17.219 1.00 0.00 C ATOM 429 NZ LYS A 106 -8.417 11.491 -16.608 1.00 0.00 N ATOM 0 H LYS A 106 -3.318 8.775 -14.581 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.228 9.299 -14.448 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.905 9.496 -16.765 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -4.994 7.747 -16.711 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.140 7.766 -17.373 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.592 8.852 -16.074 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.254 9.817 -18.628 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -7.994 9.700 -18.458 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.321 11.231 -16.448 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.847 11.977 -17.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -8.391 12.425 -16.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -9.148 11.487 -17.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -8.639 10.764 -15.898 1.00 0.00 H new ATOM 443 N ILE A 107 -6.442 7.113 -13.327 1.00 0.00 N ATOM 444 CA ILE A 107 -6.655 5.813 -12.701 1.00 0.00 C ATOM 445 C ILE A 107 -7.369 4.853 -13.655 1.00 0.00 C ATOM 446 O ILE A 107 -8.545 5.037 -13.965 1.00 0.00 O ATOM 447 CB ILE A 107 -7.480 5.936 -11.404 1.00 0.00 C ATOM 448 CG1 ILE A 107 -8.688 6.852 -11.617 1.00 0.00 C ATOM 449 CG2 ILE A 107 -6.607 6.458 -10.271 1.00 0.00 C ATOM 450 CD1 ILE A 107 -9.794 6.637 -10.607 1.00 0.00 C ATOM 0 H ILE A 107 -7.056 7.852 -12.983 1.00 0.00 H new ATOM 0 HA ILE A 107 -5.669 5.417 -12.457 1.00 0.00 H new ATOM 0 HB ILE A 107 -7.847 4.946 -11.133 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -8.360 7.890 -11.569 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.085 6.689 -12.619 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -7.202 6.540 -9.361 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -5.779 5.769 -10.102 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.214 7.439 -10.537 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -10.617 7.319 -10.818 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -10.150 5.609 -10.670 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -9.413 6.828 -9.604 1.00 0.00 H new ATOM 462 N PRO A 108 -6.666 3.810 -14.135 1.00 0.00 N ATOM 463 CA PRO A 108 -7.247 2.825 -15.055 1.00 0.00 C ATOM 464 C PRO A 108 -8.293 1.948 -14.377 1.00 0.00 C ATOM 465 O PRO A 108 -8.208 1.674 -13.180 1.00 0.00 O ATOM 466 CB PRO A 108 -6.043 1.986 -15.485 1.00 0.00 C ATOM 467 CG PRO A 108 -5.070 2.117 -14.368 1.00 0.00 C ATOM 468 CD PRO A 108 -5.256 3.506 -13.823 1.00 0.00 C ATOM 0 HA PRO A 108 -7.769 3.301 -15.885 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -6.323 0.945 -15.645 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.621 2.350 -16.422 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.255 1.367 -13.599 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.049 1.968 -14.719 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.064 3.546 -12.751 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.578 4.217 -14.295 1.00 0.00 H new ATOM 476 N VAL A 109 -9.280 1.508 -15.152 1.00 0.00 N ATOM 477 CA VAL A 109 -10.342 0.658 -14.627 1.00 0.00 C ATOM 478 C VAL A 109 -10.060 -0.813 -14.914 1.00 0.00 C ATOM 479 O VAL A 109 -10.005 -1.230 -16.071 1.00 0.00 O ATOM 480 CB VAL A 109 -11.711 1.033 -15.227 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.826 0.268 -14.533 1.00 0.00 C ATOM 482 CG2 VAL A 109 -11.942 2.533 -15.130 1.00 0.00 C ATOM 0 H VAL A 109 -9.366 1.726 -16.145 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.371 0.817 -13.549 1.00 0.00 H new ATOM 0 HB VAL A 109 -11.714 0.755 -16.281 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.785 0.546 -14.970 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -12.666 -0.803 -14.660 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.828 0.511 -13.470 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.913 2.780 -15.558 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -11.919 2.838 -14.084 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.160 3.058 -15.678 1.00 0.00 H new ATOM 492 N VAL A 110 -9.880 -1.594 -13.853 1.00 0.00 N ATOM 493 CA VAL A 110 -9.603 -3.018 -13.990 1.00 0.00 C ATOM 494 C VAL A 110 -10.706 -3.858 -13.354 1.00 0.00 C ATOM 495 O VAL A 110 -11.171 -3.560 -12.255 1.00 0.00 O ATOM 496 CB VAL A 110 -8.254 -3.392 -13.347 1.00 0.00 C ATOM 497 CG1 VAL A 110 -7.881 -4.827 -13.685 1.00 0.00 C ATOM 498 CG2 VAL A 110 -7.164 -2.431 -13.796 1.00 0.00 C ATOM 0 H VAL A 110 -9.921 -1.263 -12.889 1.00 0.00 H new ATOM 0 HA VAL A 110 -9.560 -3.230 -15.058 1.00 0.00 H new ATOM 0 HB VAL A 110 -8.354 -3.312 -12.265 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.925 -5.073 -13.222 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.651 -5.501 -13.309 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -7.799 -4.937 -14.766 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -6.218 -2.711 -13.332 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -7.063 -2.476 -14.880 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -7.428 -1.416 -13.498 1.00 0.00 H new ATOM 508 N GLU A 111 -11.117 -4.910 -14.053 1.00 0.00 N ATOM 509 CA GLU A 111 -12.165 -5.795 -13.558 1.00 0.00 C ATOM 510 C GLU A 111 -13.466 -5.029 -13.333 1.00 0.00 C ATOM 511 O GLU A 111 -14.215 -5.319 -12.401 1.00 0.00 O ATOM 512 CB GLU A 111 -11.723 -6.464 -12.255 1.00 0.00 C ATOM 513 CG GLU A 111 -10.881 -7.712 -12.465 1.00 0.00 C ATOM 514 CD GLU A 111 -11.723 -8.960 -12.642 1.00 0.00 C ATOM 515 OE1 GLU A 111 -12.920 -8.827 -12.977 1.00 0.00 O ATOM 516 OE2 GLU A 111 -11.188 -10.071 -12.443 1.00 0.00 O ATOM 0 H GLU A 111 -10.740 -5.171 -14.964 1.00 0.00 H new ATOM 0 HA GLU A 111 -12.342 -6.562 -14.312 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.153 -5.747 -11.664 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -12.607 -6.726 -11.673 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.250 -7.576 -13.343 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -10.216 -7.845 -11.612 1.00 0.00 H new ATOM 523 N ARG A 112 -13.725 -4.049 -14.192 1.00 0.00 N ATOM 524 CA ARG A 112 -14.934 -3.241 -14.087 1.00 0.00 C ATOM 525 C ARG A 112 -14.990 -2.520 -12.742 1.00 0.00 C ATOM 526 O ARG A 112 -16.070 -2.250 -12.215 1.00 0.00 O ATOM 527 CB ARG A 112 -16.175 -4.120 -14.264 1.00 0.00 C ATOM 528 CG ARG A 112 -16.888 -3.903 -15.589 1.00 0.00 C ATOM 529 CD ARG A 112 -17.508 -2.517 -15.668 1.00 0.00 C ATOM 530 NE ARG A 112 -18.572 -2.448 -16.667 1.00 0.00 N ATOM 531 CZ ARG A 112 -18.355 -2.452 -17.980 1.00 0.00 C ATOM 532 NH1 ARG A 112 -17.118 -2.521 -18.456 1.00 0.00 N ATOM 533 NH2 ARG A 112 -19.378 -2.388 -18.821 1.00 0.00 N ATOM 0 H ARG A 112 -13.114 -3.795 -14.968 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.913 -2.492 -14.878 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.883 -5.167 -14.185 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -16.871 -3.921 -13.449 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -16.182 -4.034 -16.409 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -17.665 -4.658 -15.713 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -17.909 -2.243 -14.692 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -16.735 -1.788 -15.911 1.00 0.00 H new ATOM 0 HE ARG A 112 -19.536 -2.394 -16.339 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -16.327 -2.571 -17.814 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -16.959 -2.524 -19.463 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -20.331 -2.336 -18.462 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -19.212 -2.391 -19.827 1.00 0.00 H new ATOM 547 N LYS A 113 -13.820 -2.209 -12.193 1.00 0.00 N ATOM 548 CA LYS A 113 -13.737 -1.519 -10.911 1.00 0.00 C ATOM 549 C LYS A 113 -12.475 -0.665 -10.834 1.00 0.00 C ATOM 550 O LYS A 113 -11.560 -0.818 -11.642 1.00 0.00 O ATOM 551 CB LYS A 113 -13.758 -2.531 -9.763 1.00 0.00 C ATOM 552 CG LYS A 113 -15.047 -2.509 -8.956 1.00 0.00 C ATOM 553 CD LYS A 113 -14.772 -2.461 -7.462 1.00 0.00 C ATOM 554 CE LYS A 113 -14.908 -1.049 -6.911 1.00 0.00 C ATOM 555 NZ LYS A 113 -13.647 -0.576 -6.274 1.00 0.00 N ATOM 0 H LYS A 113 -12.917 -2.424 -12.616 1.00 0.00 H new ATOM 0 HA LYS A 113 -14.602 -0.862 -10.821 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -13.610 -3.532 -10.169 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -12.919 -2.330 -9.097 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -15.643 -1.643 -9.245 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -15.638 -3.395 -9.189 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -15.465 -3.123 -6.943 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -13.767 -2.834 -7.265 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -15.184 -0.370 -7.718 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -15.716 -1.021 -6.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -13.782 0.389 -5.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -13.397 -1.209 -5.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -12.881 -0.578 -6.977 1.00 0.00 H new ATOM 569 N ILE A 114 -12.434 0.235 -9.856 1.00 0.00 N ATOM 570 CA ILE A 114 -11.284 1.112 -9.673 1.00 0.00 C ATOM 571 C ILE A 114 -10.108 0.359 -9.064 1.00 0.00 C ATOM 572 O ILE A 114 -10.283 -0.454 -8.154 1.00 0.00 O ATOM 573 CB ILE A 114 -11.630 2.314 -8.773 1.00 0.00 C ATOM 574 CG1 ILE A 114 -12.929 2.974 -9.241 1.00 0.00 C ATOM 575 CG2 ILE A 114 -10.490 3.320 -8.769 1.00 0.00 C ATOM 576 CD1 ILE A 114 -13.353 4.147 -8.384 1.00 0.00 C ATOM 0 H ILE A 114 -13.184 0.375 -9.179 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.006 1.476 -10.662 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.774 1.955 -7.754 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -12.805 3.312 -10.270 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -13.725 2.229 -9.243 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.751 4.163 -8.129 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.585 2.843 -8.391 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.316 3.676 -9.784 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -14.281 4.566 -8.774 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -13.509 3.811 -7.359 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -12.575 4.910 -8.401 1.00 0.00 H new ATOM 588 N LEU A 115 -8.912 0.630 -9.571 1.00 0.00 N ATOM 589 CA LEU A 115 -7.704 -0.024 -9.075 1.00 0.00 C ATOM 590 C LEU A 115 -7.061 0.792 -7.960 1.00 0.00 C ATOM 591 O LEU A 115 -6.637 1.929 -8.172 1.00 0.00 O ATOM 592 CB LEU A 115 -6.706 -0.225 -10.218 1.00 0.00 C ATOM 593 CG LEU A 115 -5.365 -0.837 -9.807 1.00 0.00 C ATOM 594 CD1 LEU A 115 -4.813 -1.713 -10.922 1.00 0.00 C ATOM 595 CD2 LEU A 115 -4.370 0.255 -9.443 1.00 0.00 C ATOM 0 H LEU A 115 -8.751 1.298 -10.325 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.986 -0.996 -8.670 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.164 -0.865 -10.972 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.518 0.739 -10.690 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.527 -1.462 -8.929 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.859 -2.139 -10.611 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.517 -2.517 -11.136 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -4.666 -1.111 -11.819 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.422 -0.198 -9.153 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.213 0.906 -10.303 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.761 0.841 -8.611 1.00 0.00 H new ATOM 607 N ASP A 116 -6.991 0.206 -6.770 1.00 0.00 N ATOM 608 CA ASP A 116 -6.398 0.878 -5.619 1.00 0.00 C ATOM 609 C ASP A 116 -4.907 1.111 -5.836 1.00 0.00 C ATOM 610 O ASP A 116 -4.195 0.230 -6.320 1.00 0.00 O ATOM 611 CB ASP A 116 -6.618 0.050 -4.350 1.00 0.00 C ATOM 612 CG ASP A 116 -6.714 0.914 -3.107 1.00 0.00 C ATOM 613 OD1 ASP A 116 -6.065 1.979 -3.072 1.00 0.00 O ATOM 614 OD2 ASP A 116 -7.440 0.522 -2.168 1.00 0.00 O ATOM 0 H ASP A 116 -7.338 -0.734 -6.577 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.886 1.846 -5.502 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.532 -0.535 -4.455 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.798 -0.658 -4.235 1.00 0.00 H new ATOM 619 N LEU A 117 -4.440 2.303 -5.479 1.00 0.00 N ATOM 620 CA LEU A 117 -3.033 2.651 -5.638 1.00 0.00 C ATOM 621 C LEU A 117 -2.335 2.737 -4.283 1.00 0.00 C ATOM 622 O LEU A 117 -1.242 2.199 -4.103 1.00 0.00 O ATOM 623 CB LEU A 117 -2.895 3.981 -6.379 1.00 0.00 C ATOM 624 CG LEU A 117 -3.189 3.919 -7.880 1.00 0.00 C ATOM 625 CD1 LEU A 117 -2.960 5.278 -8.524 1.00 0.00 C ATOM 626 CD2 LEU A 117 -2.326 2.859 -8.547 1.00 0.00 C ATOM 0 H LEU A 117 -5.015 3.044 -5.078 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.556 1.865 -6.223 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.568 4.706 -5.922 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.881 4.355 -6.238 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.236 3.647 -8.016 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.174 5.216 -9.591 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.619 6.014 -8.064 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.923 5.579 -8.379 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -2.547 2.828 -9.614 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.274 3.102 -8.402 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.538 1.886 -8.104 1.00 0.00 H new ATOM 638 N TYR A 118 -2.970 3.418 -3.337 1.00 0.00 N ATOM 639 CA TYR A 118 -2.407 3.574 -2.001 1.00 0.00 C ATOM 640 C TYR A 118 -2.191 2.219 -1.335 1.00 0.00 C ATOM 641 O TYR A 118 -1.105 1.928 -0.836 1.00 0.00 O ATOM 642 CB TYR A 118 -3.328 4.439 -1.136 1.00 0.00 C ATOM 643 CG TYR A 118 -2.656 4.987 0.103 1.00 0.00 C ATOM 644 CD1 TYR A 118 -1.452 5.676 0.019 1.00 0.00 C ATOM 645 CD2 TYR A 118 -3.229 4.819 1.358 1.00 0.00 C ATOM 646 CE1 TYR A 118 -0.836 6.179 1.149 1.00 0.00 C ATOM 647 CE2 TYR A 118 -2.620 5.319 2.493 1.00 0.00 C ATOM 648 CZ TYR A 118 -1.424 5.998 2.383 1.00 0.00 C ATOM 649 OH TYR A 118 -0.814 6.497 3.511 1.00 0.00 O ATOM 0 H TYR A 118 -3.874 3.871 -3.470 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.439 4.066 -2.099 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.700 5.270 -1.735 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -4.194 3.848 -0.838 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -0.990 5.821 -0.946 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.166 4.289 1.448 1.00 0.00 H new ATOM 0 HE1 TYR A 118 0.100 6.711 1.066 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -3.078 5.179 3.461 1.00 0.00 H new ATOM 0 HH TYR A 118 -1.358 6.285 4.298 1.00 0.00 H new ATOM 659 N ALA A 119 -3.234 1.396 -1.331 1.00 0.00 N ATOM 660 CA ALA A 119 -3.162 0.075 -0.728 1.00 0.00 C ATOM 661 C ALA A 119 -2.089 -0.780 -1.392 1.00 0.00 C ATOM 662 O ALA A 119 -1.284 -1.421 -0.715 1.00 0.00 O ATOM 663 CB ALA A 119 -4.516 -0.614 -0.809 1.00 0.00 C ATOM 0 H ALA A 119 -4.140 1.623 -1.740 1.00 0.00 H new ATOM 0 HA ALA A 119 -2.889 0.197 0.320 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.449 -1.602 -0.354 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.259 -0.020 -0.278 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -4.811 -0.714 -1.853 1.00 0.00 H new ATOM 669 N LEU A 120 -2.086 -0.789 -2.721 1.00 0.00 N ATOM 670 CA LEU A 120 -1.115 -1.570 -3.480 1.00 0.00 C ATOM 671 C LEU A 120 0.314 -1.156 -3.135 1.00 0.00 C ATOM 672 O LEU A 120 1.222 -1.986 -3.116 1.00 0.00 O ATOM 673 CB LEU A 120 -1.355 -1.400 -4.980 1.00 0.00 C ATOM 674 CG LEU A 120 -0.458 -2.250 -5.881 1.00 0.00 C ATOM 675 CD1 LEU A 120 -0.597 -3.723 -5.533 1.00 0.00 C ATOM 676 CD2 LEU A 120 -0.795 -2.012 -7.345 1.00 0.00 C ATOM 0 H LEU A 120 -2.745 -0.264 -3.295 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.244 -2.618 -3.211 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.395 -1.643 -5.196 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.213 -0.351 -5.238 1.00 0.00 H new ATOM 0 HG LEU A 120 0.578 -1.954 -5.715 1.00 0.00 H new ATOM 0 HD11 LEU A 120 0.048 -4.313 -6.184 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.306 -3.880 -4.494 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -1.633 -4.033 -5.671 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -0.147 -2.625 -7.972 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -1.836 -2.280 -7.527 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -0.644 -0.960 -7.587 1.00 0.00 H new ATOM 688 N SER A 121 0.504 0.131 -2.864 1.00 0.00 N ATOM 689 CA SER A 121 1.822 0.652 -2.522 1.00 0.00 C ATOM 690 C SER A 121 2.332 0.044 -1.220 1.00 0.00 C ATOM 691 O SER A 121 3.492 -0.354 -1.121 1.00 0.00 O ATOM 692 CB SER A 121 1.776 2.176 -2.403 1.00 0.00 C ATOM 693 OG SER A 121 3.027 2.694 -1.984 1.00 0.00 O ATOM 0 H SER A 121 -0.237 0.832 -2.875 1.00 0.00 H new ATOM 0 HA SER A 121 2.510 0.376 -3.321 1.00 0.00 H new ATOM 0 HB2 SER A 121 1.503 2.611 -3.365 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.003 2.465 -1.691 1.00 0.00 H new ATOM 0 HG SER A 121 2.971 3.670 -1.917 1.00 0.00 H new ATOM 699 N LYS A 122 1.458 -0.023 -0.221 1.00 0.00 N ATOM 700 CA LYS A 122 1.821 -0.580 1.077 1.00 0.00 C ATOM 701 C LYS A 122 2.075 -2.082 0.980 1.00 0.00 C ATOM 702 O LYS A 122 3.005 -2.605 1.593 1.00 0.00 O ATOM 703 CB LYS A 122 0.717 -0.305 2.099 1.00 0.00 C ATOM 704 CG LYS A 122 0.379 1.171 2.247 1.00 0.00 C ATOM 705 CD LYS A 122 0.711 1.685 3.639 1.00 0.00 C ATOM 706 CE LYS A 122 2.213 1.763 3.860 1.00 0.00 C ATOM 707 NZ LYS A 122 2.566 1.680 5.305 1.00 0.00 N ATOM 0 H LYS A 122 0.493 0.302 -0.286 1.00 0.00 H new ATOM 0 HA LYS A 122 2.742 -0.097 1.404 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.182 -0.847 1.806 1.00 0.00 H new ATOM 0 HB3 LYS A 122 1.024 -0.698 3.068 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.931 1.747 1.505 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.681 1.324 2.045 1.00 0.00 H new ATOM 0 HD2 LYS A 122 0.270 2.672 3.778 1.00 0.00 H new ATOM 0 HD3 LYS A 122 0.266 1.028 4.386 1.00 0.00 H new ATOM 0 HE2 LYS A 122 2.702 0.953 3.319 1.00 0.00 H new ATOM 0 HE3 LYS A 122 2.593 2.697 3.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 3.599 1.737 5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 2.120 2.468 5.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 2.226 0.777 5.694 1.00 0.00 H new ATOM 721 N ILE A 123 1.238 -2.772 0.212 1.00 0.00 N ATOM 722 CA ILE A 123 1.367 -4.210 0.042 1.00 0.00 C ATOM 723 C ILE A 123 2.731 -4.584 -0.532 1.00 0.00 C ATOM 724 O ILE A 123 3.375 -5.521 -0.061 1.00 0.00 O ATOM 725 CB ILE A 123 0.260 -4.770 -0.877 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.120 -4.383 -0.343 1.00 0.00 C ATOM 727 CG2 ILE A 123 0.380 -6.284 -0.997 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.163 -4.219 -1.427 1.00 0.00 C ATOM 0 H ILE A 123 0.462 -2.355 -0.302 1.00 0.00 H new ATOM 0 HA ILE A 123 1.265 -4.652 1.033 1.00 0.00 H new ATOM 0 HB ILE A 123 0.382 -4.337 -1.870 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.455 -5.145 0.360 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.037 -3.450 0.214 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.408 -6.661 -1.648 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.352 -6.540 -1.418 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.282 -6.736 -0.010 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.117 -3.945 -0.976 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.850 -3.436 -2.118 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.275 -5.158 -1.969 1.00 0.00 H new ATOM 740 N VAL A 124 3.163 -3.850 -1.552 1.00 0.00 N ATOM 741 CA VAL A 124 4.449 -4.112 -2.188 1.00 0.00 C ATOM 742 C VAL A 124 5.598 -3.969 -1.195 1.00 0.00 C ATOM 743 O VAL A 124 6.449 -4.849 -1.086 1.00 0.00 O ATOM 744 CB VAL A 124 4.694 -3.162 -3.375 1.00 0.00 C ATOM 745 CG1 VAL A 124 5.941 -3.574 -4.143 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.480 -3.124 -4.293 1.00 0.00 C ATOM 0 H VAL A 124 2.643 -3.071 -1.955 1.00 0.00 H new ATOM 0 HA VAL A 124 4.414 -5.139 -2.553 1.00 0.00 H new ATOM 0 HB VAL A 124 4.853 -2.158 -2.983 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.097 -2.890 -4.978 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.805 -3.539 -3.479 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.816 -4.588 -4.523 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.674 -2.447 -5.125 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.283 -4.125 -4.678 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.612 -2.773 -3.734 1.00 0.00 H new ATOM 756 N ALA A 125 5.618 -2.850 -0.479 1.00 0.00 N ATOM 757 CA ALA A 125 6.661 -2.588 0.497 1.00 0.00 C ATOM 758 C ALA A 125 6.659 -3.632 1.609 1.00 0.00 C ATOM 759 O ALA A 125 7.707 -4.164 1.978 1.00 0.00 O ATOM 760 CB ALA A 125 6.497 -1.194 1.081 1.00 0.00 C ATOM 0 H ALA A 125 4.920 -2.110 -0.559 1.00 0.00 H new ATOM 0 HA ALA A 125 7.621 -2.648 -0.015 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.285 -1.010 1.811 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.563 -0.455 0.283 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.525 -1.116 1.569 1.00 0.00 H new ATOM 766 N SER A 126 5.476 -3.918 2.144 1.00 0.00 N ATOM 767 CA SER A 126 5.335 -4.891 3.217 1.00 0.00 C ATOM 768 C SER A 126 5.893 -6.252 2.809 1.00 0.00 C ATOM 769 O SER A 126 6.293 -7.049 3.657 1.00 0.00 O ATOM 770 CB SER A 126 3.867 -5.030 3.620 1.00 0.00 C ATOM 771 OG SER A 126 3.016 -4.927 2.493 1.00 0.00 O ATOM 0 H SER A 126 4.600 -3.487 1.849 1.00 0.00 H new ATOM 0 HA SER A 126 5.909 -4.529 4.070 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.711 -5.991 4.111 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.611 -4.257 4.345 1.00 0.00 H new ATOM 0 HG SER A 126 2.683 -4.008 2.417 1.00 0.00 H new ATOM 777 N LYS A 127 5.917 -6.513 1.504 1.00 0.00 N ATOM 778 CA LYS A 127 6.426 -7.779 0.990 1.00 0.00 C ATOM 779 C LYS A 127 7.947 -7.749 0.879 1.00 0.00 C ATOM 780 O LYS A 127 8.603 -8.788 0.934 1.00 0.00 O ATOM 781 CB LYS A 127 5.809 -8.084 -0.377 1.00 0.00 C ATOM 782 CG LYS A 127 4.316 -8.358 -0.323 1.00 0.00 C ATOM 783 CD LYS A 127 4.028 -9.780 0.133 1.00 0.00 C ATOM 784 CE LYS A 127 2.846 -10.376 -0.615 1.00 0.00 C ATOM 785 NZ LYS A 127 2.478 -11.720 -0.089 1.00 0.00 N ATOM 0 H LYS A 127 5.591 -5.866 0.786 1.00 0.00 H new ATOM 0 HA LYS A 127 6.146 -8.566 1.691 1.00 0.00 H new ATOM 0 HB2 LYS A 127 5.991 -7.242 -1.045 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.313 -8.948 -0.809 1.00 0.00 H new ATOM 0 HG2 LYS A 127 3.840 -7.653 0.358 1.00 0.00 H new ATOM 0 HG3 LYS A 127 3.879 -8.195 -1.308 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.910 -10.400 -0.026 1.00 0.00 H new ATOM 0 HD3 LYS A 127 3.823 -9.786 1.204 1.00 0.00 H new ATOM 0 HE2 LYS A 127 1.989 -9.707 -0.533 1.00 0.00 H new ATOM 0 HE3 LYS A 127 3.089 -10.455 -1.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.443 -11.791 -0.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.829 -12.454 -0.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 2.905 -11.854 0.850 1.00 0.00 H new ATOM 799 N GLY A 128 8.503 -6.551 0.724 1.00 0.00 N ATOM 800 CA GLY A 128 9.942 -6.412 0.609 1.00 0.00 C ATOM 801 C GLY A 128 10.348 -5.121 -0.075 1.00 0.00 C ATOM 802 O GLY A 128 11.450 -4.616 0.145 1.00 0.00 O ATOM 0 H GLY A 128 7.982 -5.675 0.676 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.388 -6.449 1.603 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.342 -7.257 0.049 1.00 0.00 H new ATOM 806 N GLY A 129 9.461 -4.586 -0.905 1.00 0.00 N ATOM 807 CA GLY A 129 9.753 -3.351 -1.609 1.00 0.00 C ATOM 808 C GLY A 129 9.244 -3.363 -3.037 1.00 0.00 C ATOM 809 O GLY A 129 8.422 -2.529 -3.415 1.00 0.00 O ATOM 0 H GLY A 129 8.544 -4.985 -1.104 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.302 -2.516 -1.073 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.830 -3.184 -1.612 1.00 0.00 H new ATOM 813 N PHE A 130 9.735 -4.308 -3.832 1.00 0.00 N ATOM 814 CA PHE A 130 9.325 -4.423 -5.226 1.00 0.00 C ATOM 815 C PHE A 130 9.975 -5.633 -5.890 1.00 0.00 C ATOM 816 O PHE A 130 9.289 -6.523 -6.391 1.00 0.00 O ATOM 817 CB PHE A 130 9.689 -3.151 -5.993 1.00 0.00 C ATOM 818 CG PHE A 130 8.980 -3.019 -7.311 1.00 0.00 C ATOM 819 CD1 PHE A 130 9.394 -3.751 -8.412 1.00 0.00 C ATOM 820 CD2 PHE A 130 7.898 -2.163 -7.448 1.00 0.00 C ATOM 821 CE1 PHE A 130 8.742 -3.631 -9.625 1.00 0.00 C ATOM 822 CE2 PHE A 130 7.244 -2.038 -8.657 1.00 0.00 C ATOM 823 CZ PHE A 130 7.666 -2.774 -9.749 1.00 0.00 C ATOM 0 H PHE A 130 10.417 -5.005 -3.534 1.00 0.00 H new ATOM 0 HA PHE A 130 8.244 -4.557 -5.248 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.454 -2.284 -5.375 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.765 -3.136 -6.166 1.00 0.00 H new ATOM 0 HD1 PHE A 130 10.235 -4.422 -8.322 1.00 0.00 H new ATOM 0 HD2 PHE A 130 7.563 -1.587 -6.598 1.00 0.00 H new ATOM 0 HE1 PHE A 130 9.074 -4.207 -10.476 1.00 0.00 H new ATOM 0 HE2 PHE A 130 6.404 -1.366 -8.750 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.156 -2.679 -10.696 1.00 0.00 H new ATOM 833 N GLU A 131 11.304 -5.656 -5.892 1.00 0.00 N ATOM 834 CA GLU A 131 12.051 -6.754 -6.495 1.00 0.00 C ATOM 835 C GLU A 131 11.703 -8.083 -5.832 1.00 0.00 C ATOM 836 O GLU A 131 11.547 -9.101 -6.505 1.00 0.00 O ATOM 837 CB GLU A 131 13.554 -6.495 -6.386 1.00 0.00 C ATOM 838 CG GLU A 131 14.072 -5.482 -7.394 1.00 0.00 C ATOM 839 CD GLU A 131 14.889 -6.122 -8.500 1.00 0.00 C ATOM 840 OE1 GLU A 131 14.475 -7.187 -9.004 1.00 0.00 O ATOM 841 OE2 GLU A 131 15.944 -5.559 -8.861 1.00 0.00 O ATOM 0 H GLU A 131 11.886 -4.926 -5.482 1.00 0.00 H new ATOM 0 HA GLU A 131 11.773 -6.812 -7.547 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.781 -6.143 -5.380 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.087 -7.436 -6.522 1.00 0.00 H new ATOM 0 HG2 GLU A 131 13.229 -4.949 -7.833 1.00 0.00 H new ATOM 0 HG3 GLU A 131 14.684 -4.742 -6.878 1.00 0.00 H new ATOM 848 N MET A 132 11.585 -8.066 -4.509 1.00 0.00 N ATOM 849 CA MET A 132 11.258 -9.271 -3.756 1.00 0.00 C ATOM 850 C MET A 132 9.899 -9.826 -4.175 1.00 0.00 C ATOM 851 O MET A 132 9.702 -11.039 -4.225 1.00 0.00 O ATOM 852 CB MET A 132 11.261 -8.978 -2.254 1.00 0.00 C ATOM 853 CG MET A 132 11.842 -10.106 -1.416 1.00 0.00 C ATOM 854 SD MET A 132 10.951 -10.350 0.133 1.00 0.00 S ATOM 855 CE MET A 132 11.815 -9.205 1.204 1.00 0.00 C ATOM 0 H MET A 132 11.711 -7.232 -3.936 1.00 0.00 H new ATOM 0 HA MET A 132 12.019 -10.021 -3.974 1.00 0.00 H new ATOM 0 HB2 MET A 132 11.833 -8.068 -2.071 1.00 0.00 H new ATOM 0 HB3 MET A 132 10.239 -8.783 -1.928 1.00 0.00 H new ATOM 0 HG2 MET A 132 11.820 -11.031 -1.993 1.00 0.00 H new ATOM 0 HG3 MET A 132 12.888 -9.891 -1.199 1.00 0.00 H new ATOM 0 HE1 MET A 132 11.111 -8.766 1.911 1.00 0.00 H new ATOM 0 HE2 MET A 132 12.594 -9.736 1.751 1.00 0.00 H new ATOM 0 HE3 MET A 132 12.267 -8.415 0.604 1.00 0.00 H new ATOM 865 N VAL A 133 8.966 -8.928 -4.473 1.00 0.00 N ATOM 866 CA VAL A 133 7.627 -9.328 -4.886 1.00 0.00 C ATOM 867 C VAL A 133 7.653 -10.023 -6.243 1.00 0.00 C ATOM 868 O VAL A 133 7.011 -11.057 -6.434 1.00 0.00 O ATOM 869 CB VAL A 133 6.678 -8.118 -4.962 1.00 0.00 C ATOM 870 CG1 VAL A 133 5.245 -8.575 -5.198 1.00 0.00 C ATOM 871 CG2 VAL A 133 6.776 -7.281 -3.695 1.00 0.00 C ATOM 0 H VAL A 133 9.113 -7.919 -4.436 1.00 0.00 H new ATOM 0 HA VAL A 133 7.259 -10.024 -4.132 1.00 0.00 H new ATOM 0 HB VAL A 133 6.980 -7.496 -5.805 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.590 -7.706 -5.249 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.189 -9.127 -6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 133 4.929 -9.220 -4.378 1.00 0.00 H new ATOM 0 HG21 VAL A 133 6.098 -6.431 -3.767 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.502 -7.891 -2.834 1.00 0.00 H new ATOM 0 HG23 VAL A 133 7.798 -6.921 -3.575 1.00 0.00 H new ATOM 881 N THR A 134 8.399 -9.451 -7.182 1.00 0.00 N ATOM 882 CA THR A 134 8.508 -10.016 -8.521 1.00 0.00 C ATOM 883 C THR A 134 9.304 -11.319 -8.502 1.00 0.00 C ATOM 884 O THR A 134 9.030 -12.236 -9.275 1.00 0.00 O ATOM 885 CB THR A 134 9.174 -9.016 -9.468 1.00 0.00 C ATOM 886 OG1 THR A 134 8.777 -7.692 -9.156 1.00 0.00 O ATOM 887 CG2 THR A 134 8.846 -9.260 -10.925 1.00 0.00 C ATOM 0 H THR A 134 8.937 -8.596 -7.040 1.00 0.00 H new ATOM 0 HA THR A 134 7.501 -10.231 -8.878 1.00 0.00 H new ATOM 0 HB THR A 134 10.246 -9.153 -9.326 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.214 -7.066 -9.771 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.350 -8.516 -11.541 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.182 -10.256 -11.212 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.769 -9.184 -11.073 1.00 0.00 H new ATOM 895 N LYS A 135 10.292 -11.389 -7.616 1.00 0.00 N ATOM 896 CA LYS A 135 11.129 -12.571 -7.498 1.00 0.00 C ATOM 897 C LYS A 135 10.303 -13.791 -7.101 1.00 0.00 C ATOM 898 O LYS A 135 10.562 -14.904 -7.560 1.00 0.00 O ATOM 899 CB LYS A 135 12.237 -12.334 -6.471 1.00 0.00 C ATOM 900 CG LYS A 135 13.379 -11.477 -6.995 1.00 0.00 C ATOM 901 CD LYS A 135 14.677 -12.265 -7.085 1.00 0.00 C ATOM 902 CE LYS A 135 15.444 -12.224 -5.772 1.00 0.00 C ATOM 903 NZ LYS A 135 16.790 -12.850 -5.893 1.00 0.00 N ATOM 0 H LYS A 135 10.531 -10.638 -6.969 1.00 0.00 H new ATOM 0 HA LYS A 135 11.579 -12.764 -8.472 1.00 0.00 H new ATOM 0 HB2 LYS A 135 11.809 -11.855 -5.591 1.00 0.00 H new ATOM 0 HB3 LYS A 135 12.634 -13.296 -6.149 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.120 -11.088 -7.980 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.520 -10.617 -6.340 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.458 -13.300 -7.348 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.297 -11.857 -7.883 1.00 0.00 H new ATOM 0 HE2 LYS A 135 15.553 -11.189 -5.448 1.00 0.00 H new ATOM 0 HE3 LYS A 135 14.872 -12.741 -5.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 17.279 -12.801 -4.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 16.686 -13.845 -6.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 17.346 -12.342 -6.610 1.00 0.00 H new ATOM 917 N GLU A 136 9.312 -13.576 -6.243 1.00 0.00 N ATOM 918 CA GLU A 136 8.450 -14.660 -5.783 1.00 0.00 C ATOM 919 C GLU A 136 7.079 -14.611 -6.460 1.00 0.00 C ATOM 920 O GLU A 136 6.194 -15.403 -6.136 1.00 0.00 O ATOM 921 CB GLU A 136 8.280 -14.592 -4.264 1.00 0.00 C ATOM 922 CG GLU A 136 9.559 -14.884 -3.496 1.00 0.00 C ATOM 923 CD GLU A 136 9.339 -15.835 -2.335 1.00 0.00 C ATOM 924 OE1 GLU A 136 8.473 -16.727 -2.455 1.00 0.00 O ATOM 925 OE2 GLU A 136 10.032 -15.688 -1.307 1.00 0.00 O ATOM 0 H GLU A 136 9.085 -12.662 -5.852 1.00 0.00 H new ATOM 0 HA GLU A 136 8.929 -15.601 -6.053 1.00 0.00 H new ATOM 0 HB2 GLU A 136 7.920 -13.600 -3.991 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.513 -15.304 -3.960 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.297 -15.311 -4.175 1.00 0.00 H new ATOM 0 HG3 GLU A 136 9.975 -13.949 -3.121 1.00 0.00 H new ATOM 932 N LYS A 137 6.907 -13.683 -7.398 1.00 0.00 N ATOM 933 CA LYS A 137 5.641 -13.544 -8.111 1.00 0.00 C ATOM 934 C LYS A 137 4.490 -13.313 -7.136 1.00 0.00 C ATOM 935 O LYS A 137 3.358 -13.729 -7.387 1.00 0.00 O ATOM 936 CB LYS A 137 5.368 -14.791 -8.954 1.00 0.00 C ATOM 937 CG LYS A 137 4.548 -14.513 -10.204 1.00 0.00 C ATOM 938 CD LYS A 137 5.425 -14.040 -11.352 1.00 0.00 C ATOM 939 CE LYS A 137 4.609 -13.784 -12.608 1.00 0.00 C ATOM 940 NZ LYS A 137 4.521 -14.994 -13.471 1.00 0.00 N ATOM 0 H LYS A 137 7.627 -13.018 -7.681 1.00 0.00 H new ATOM 0 HA LYS A 137 5.716 -12.678 -8.769 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.319 -15.238 -9.245 1.00 0.00 H new ATOM 0 HB3 LYS A 137 4.845 -15.526 -8.342 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.016 -15.417 -10.500 1.00 0.00 H new ATOM 0 HG3 LYS A 137 3.794 -13.757 -9.985 1.00 0.00 H new ATOM 0 HD2 LYS A 137 5.944 -13.127 -11.062 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.189 -14.789 -11.560 1.00 0.00 H new ATOM 0 HE2 LYS A 137 3.605 -13.463 -12.329 1.00 0.00 H new ATOM 0 HE3 LYS A 137 5.059 -12.968 -13.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 3.956 -14.777 -14.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 5.477 -15.286 -13.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 4.068 -15.766 -12.941 1.00 0.00 H new ATOM 954 N LYS A 138 4.788 -12.649 -6.025 1.00 0.00 N ATOM 955 CA LYS A 138 3.778 -12.362 -5.010 1.00 0.00 C ATOM 956 C LYS A 138 2.759 -11.339 -5.511 1.00 0.00 C ATOM 957 O LYS A 138 1.714 -11.141 -4.892 1.00 0.00 O ATOM 958 CB LYS A 138 4.444 -11.849 -3.733 1.00 0.00 C ATOM 959 CG LYS A 138 5.659 -12.663 -3.312 1.00 0.00 C ATOM 960 CD LYS A 138 5.763 -12.772 -1.798 1.00 0.00 C ATOM 961 CE LYS A 138 6.950 -11.988 -1.261 1.00 0.00 C ATOM 962 NZ LYS A 138 7.643 -12.714 -0.160 1.00 0.00 N ATOM 0 H LYS A 138 5.720 -12.299 -5.803 1.00 0.00 H new ATOM 0 HA LYS A 138 3.249 -13.290 -4.795 1.00 0.00 H new ATOM 0 HB2 LYS A 138 4.745 -10.812 -3.881 1.00 0.00 H new ATOM 0 HB3 LYS A 138 3.714 -11.856 -2.924 1.00 0.00 H new ATOM 0 HG2 LYS A 138 5.597 -13.661 -3.746 1.00 0.00 H new ATOM 0 HG3 LYS A 138 6.563 -12.199 -3.707 1.00 0.00 H new ATOM 0 HD2 LYS A 138 4.845 -12.401 -1.342 1.00 0.00 H new ATOM 0 HD3 LYS A 138 5.860 -13.820 -1.514 1.00 0.00 H new ATOM 0 HE2 LYS A 138 7.655 -11.797 -2.070 1.00 0.00 H new ATOM 0 HE3 LYS A 138 6.610 -11.018 -0.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 8.446 -12.146 0.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 6.978 -12.874 0.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 7.990 -13.629 -0.512 1.00 0.00 H new ATOM 976 N TRP A 139 3.067 -10.691 -6.633 1.00 0.00 N ATOM 977 CA TRP A 139 2.172 -9.689 -7.208 1.00 0.00 C ATOM 978 C TRP A 139 0.766 -10.252 -7.397 1.00 0.00 C ATOM 979 O TRP A 139 -0.224 -9.535 -7.250 1.00 0.00 O ATOM 980 CB TRP A 139 2.720 -9.197 -8.549 1.00 0.00 C ATOM 981 CG TRP A 139 3.924 -8.315 -8.412 1.00 0.00 C ATOM 982 CD1 TRP A 139 5.230 -8.680 -8.571 1.00 0.00 C ATOM 983 CD2 TRP A 139 3.932 -6.922 -8.084 1.00 0.00 C ATOM 984 NE1 TRP A 139 6.050 -7.597 -8.365 1.00 0.00 N ATOM 985 CE2 TRP A 139 5.278 -6.506 -8.064 1.00 0.00 C ATOM 986 CE3 TRP A 139 2.933 -5.984 -7.808 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.647 -5.194 -7.777 1.00 0.00 C ATOM 988 CZ3 TRP A 139 3.301 -4.682 -7.523 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.648 -4.298 -7.511 1.00 0.00 C ATOM 0 H TRP A 139 3.927 -10.841 -7.161 1.00 0.00 H new ATOM 0 HA TRP A 139 2.115 -8.851 -6.514 1.00 0.00 H new ATOM 0 HB2 TRP A 139 2.978 -10.058 -9.166 1.00 0.00 H new ATOM 0 HB3 TRP A 139 1.937 -8.651 -9.075 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.569 -9.674 -8.822 1.00 0.00 H new ATOM 0 HE1 TRP A 139 7.068 -7.604 -8.426 1.00 0.00 H new ATOM 0 HE3 TRP A 139 1.892 -6.271 -7.817 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.685 -4.895 -7.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.538 -3.949 -7.306 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.903 -3.273 -7.287 1.00 0.00 H new ATOM 1000 N SER A 140 0.687 -11.537 -7.721 1.00 0.00 N ATOM 1001 CA SER A 140 -0.599 -12.195 -7.928 1.00 0.00 C ATOM 1002 C SER A 140 -1.402 -12.241 -6.632 1.00 0.00 C ATOM 1003 O SER A 140 -2.623 -12.088 -6.640 1.00 0.00 O ATOM 1004 CB SER A 140 -0.390 -13.613 -8.463 1.00 0.00 C ATOM 1005 OG SER A 140 0.127 -13.590 -9.783 1.00 0.00 O ATOM 0 H SER A 140 1.497 -12.144 -7.846 1.00 0.00 H new ATOM 0 HA SER A 140 -1.161 -11.617 -8.662 1.00 0.00 H new ATOM 0 HB2 SER A 140 0.295 -14.154 -7.810 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.337 -14.153 -8.449 1.00 0.00 H new ATOM 0 HG SER A 140 0.253 -14.508 -10.101 1.00 0.00 H new ATOM 1011 N LYS A 141 -0.707 -12.453 -5.520 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.355 -12.521 -4.215 1.00 0.00 C ATOM 1013 C LYS A 141 -1.862 -11.146 -3.789 1.00 0.00 C ATOM 1014 O LYS A 141 -2.879 -11.033 -3.107 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.383 -13.066 -3.168 1.00 0.00 C ATOM 1016 CG LYS A 141 -0.031 -14.531 -3.368 1.00 0.00 C ATOM 1017 CD LYS A 141 0.173 -15.241 -2.040 1.00 0.00 C ATOM 1018 CE LYS A 141 1.548 -14.953 -1.461 1.00 0.00 C ATOM 1019 NZ LYS A 141 2.540 -15.998 -1.841 1.00 0.00 N ATOM 0 H LYS A 141 0.305 -12.581 -5.496 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.208 -13.195 -4.294 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.532 -12.475 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -0.820 -12.938 -2.178 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.826 -15.024 -3.927 1.00 0.00 H new ATOM 0 HG3 LYS A 141 0.876 -14.610 -3.967 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.594 -14.923 -1.334 1.00 0.00 H new ATOM 0 HD3 LYS A 141 0.053 -16.315 -2.178 1.00 0.00 H new ATOM 0 HE2 LYS A 141 1.893 -13.980 -1.811 1.00 0.00 H new ATOM 0 HE3 LYS A 141 1.480 -14.895 -0.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 3.465 -15.765 -1.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 2.224 -16.923 -1.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 2.624 -16.036 -2.877 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.143 -10.105 -4.197 1.00 0.00 N ATOM 1034 CA VAL A 142 -1.521 -8.738 -3.857 1.00 0.00 C ATOM 1035 C VAL A 142 -2.911 -8.405 -4.385 1.00 0.00 C ATOM 1036 O VAL A 142 -3.743 -7.849 -3.668 1.00 0.00 O ATOM 1037 CB VAL A 142 -0.512 -7.720 -4.424 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -0.810 -6.323 -3.901 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.911 -8.133 -4.081 1.00 0.00 C ATOM 0 H VAL A 142 -0.297 -10.182 -4.762 1.00 0.00 H new ATOM 0 HA VAL A 142 -1.523 -8.671 -2.769 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.611 -7.704 -5.509 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.087 -5.619 -4.312 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.815 -6.029 -4.202 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.741 -6.319 -2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.610 -7.403 -4.489 1.00 0.00 H new ATOM 0 HG22 VAL A 142 1.025 -8.179 -2.998 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.119 -9.113 -4.510 1.00 0.00 H new ATOM 1049 N GLY A 143 -3.157 -8.748 -5.646 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.449 -8.478 -6.250 1.00 0.00 C ATOM 1051 C GLY A 143 -5.576 -9.234 -5.572 1.00 0.00 C ATOM 1052 O GLY A 143 -6.661 -8.691 -5.364 1.00 0.00 O ATOM 0 H GLY A 143 -2.485 -9.208 -6.260 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.653 -7.408 -6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.417 -8.749 -7.305 1.00 0.00 H new ATOM 1056 N SER A 144 -5.318 -10.492 -5.228 1.00 0.00 N ATOM 1057 CA SER A 144 -6.320 -11.324 -4.570 1.00 0.00 C ATOM 1058 C SER A 144 -6.754 -10.708 -3.243 1.00 0.00 C ATOM 1059 O SER A 144 -7.919 -10.797 -2.859 1.00 0.00 O ATOM 1060 CB SER A 144 -5.768 -12.732 -4.336 1.00 0.00 C ATOM 1061 OG SER A 144 -5.867 -13.521 -5.509 1.00 0.00 O ATOM 0 H SER A 144 -4.425 -10.957 -5.393 1.00 0.00 H new ATOM 0 HA SER A 144 -7.191 -11.385 -5.222 1.00 0.00 H new ATOM 0 HB2 SER A 144 -4.726 -12.670 -4.023 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.317 -13.211 -3.525 1.00 0.00 H new ATOM 0 HG SER A 144 -5.506 -14.415 -5.333 1.00 0.00 H new ATOM 1067 N ARG A 145 -5.807 -10.084 -2.551 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.092 -9.453 -1.267 1.00 0.00 C ATOM 1069 C ARG A 145 -6.933 -8.194 -1.455 1.00 0.00 C ATOM 1070 O ARG A 145 -7.773 -7.866 -0.617 1.00 0.00 O ATOM 1071 CB ARG A 145 -4.787 -9.109 -0.544 1.00 0.00 C ATOM 1072 CG ARG A 145 -4.443 -10.071 0.580 1.00 0.00 C ATOM 1073 CD ARG A 145 -3.285 -9.556 1.420 1.00 0.00 C ATOM 1074 NE ARG A 145 -3.263 -10.160 2.750 1.00 0.00 N ATOM 1075 CZ ARG A 145 -2.454 -9.766 3.731 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -1.599 -8.769 3.534 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -2.498 -10.369 4.911 1.00 0.00 N ATOM 0 H ARG A 145 -4.837 -10.002 -2.857 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.659 -10.158 -0.660 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -3.972 -9.102 -1.267 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -4.861 -8.100 -0.138 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -5.317 -10.218 1.215 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -4.186 -11.044 0.161 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -2.345 -9.767 0.910 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -3.360 -8.473 1.515 1.00 0.00 H new ATOM 0 HE ARG A 145 -3.906 -10.929 2.938 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -1.560 -8.302 2.628 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -0.981 -8.470 4.289 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -3.152 -11.136 5.068 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.878 -10.066 5.662 1.00 0.00 H new ATOM 1091 N LEU A 146 -6.701 -7.493 -2.561 1.00 0.00 N ATOM 1092 CA LEU A 146 -7.439 -6.270 -2.858 1.00 0.00 C ATOM 1093 C LEU A 146 -8.858 -6.590 -3.318 1.00 0.00 C ATOM 1094 O LEU A 146 -9.829 -6.287 -2.625 1.00 0.00 O ATOM 1095 CB LEU A 146 -6.711 -5.461 -3.934 1.00 0.00 C ATOM 1096 CG LEU A 146 -6.769 -3.941 -3.751 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -5.401 -3.395 -3.370 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -7.279 -3.269 -5.017 1.00 0.00 C ATOM 0 H LEU A 146 -6.009 -7.750 -3.265 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.498 -5.678 -1.945 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -5.666 -5.770 -3.955 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.137 -5.711 -4.906 1.00 0.00 H new ATOM 0 HG LEU A 146 -7.464 -3.720 -2.941 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -5.463 -2.314 -3.245 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -5.075 -3.851 -2.435 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -4.684 -3.629 -4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -7.313 -2.190 -4.868 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -6.610 -3.500 -5.846 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -8.280 -3.636 -5.246 1.00 0.00 H new ATOM 1110 N GLY A 147 -8.970 -7.203 -4.492 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.275 -7.552 -5.023 1.00 0.00 C ATOM 1112 C GLY A 147 -10.204 -8.042 -6.457 1.00 0.00 C ATOM 1113 O GLY A 147 -11.059 -7.705 -7.278 1.00 0.00 O ATOM 0 H GLY A 147 -8.182 -7.464 -5.084 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -10.723 -8.326 -4.399 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -10.930 -6.682 -4.971 1.00 0.00 H new ATOM 1117 N TYR A 148 -9.183 -8.836 -6.760 1.00 0.00 N ATOM 1118 CA TYR A 148 -9.005 -9.372 -8.105 1.00 0.00 C ATOM 1119 C TYR A 148 -9.198 -10.885 -8.118 1.00 0.00 C ATOM 1120 O TYR A 148 -9.099 -11.542 -7.081 1.00 0.00 O ATOM 1121 CB TYR A 148 -7.614 -9.021 -8.636 1.00 0.00 C ATOM 1122 CG TYR A 148 -7.415 -7.542 -8.882 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -7.847 -6.951 -10.062 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -6.796 -6.738 -7.934 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -7.668 -5.600 -10.290 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -6.612 -5.385 -8.156 1.00 0.00 C ATOM 1127 CZ TYR A 148 -7.050 -4.822 -9.335 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.871 -3.477 -9.560 1.00 0.00 O ATOM 0 H TYR A 148 -8.466 -9.123 -6.093 1.00 0.00 H new ATOM 0 HA TYR A 148 -9.759 -8.921 -8.751 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -6.865 -9.366 -7.924 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -7.442 -9.562 -9.567 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -8.331 -7.557 -10.814 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -6.453 -7.176 -7.008 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -8.011 -5.156 -11.213 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -6.128 -4.773 -7.409 1.00 0.00 H new ATOM 0 HH TYR A 148 -7.739 -3.022 -9.531 1.00 0.00 H new ATOM 1138 N LEU A 149 -9.475 -11.433 -9.296 1.00 0.00 N ATOM 1139 CA LEU A 149 -9.682 -12.868 -9.444 1.00 0.00 C ATOM 1140 C LEU A 149 -8.551 -13.502 -10.250 1.00 0.00 C ATOM 1141 O LEU A 149 -7.938 -12.849 -11.095 1.00 0.00 O ATOM 1142 CB LEU A 149 -11.024 -13.144 -10.124 1.00 0.00 C ATOM 1143 CG LEU A 149 -12.198 -12.314 -9.599 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -13.448 -12.580 -10.424 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -12.450 -12.619 -8.131 1.00 0.00 C ATOM 0 H LEU A 149 -9.561 -10.904 -10.164 1.00 0.00 H new ATOM 0 HA LEU A 149 -9.688 -13.312 -8.449 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -10.917 -12.959 -11.193 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -11.264 -14.201 -10.005 1.00 0.00 H new ATOM 0 HG LEU A 149 -11.944 -11.258 -9.691 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -14.273 -11.982 -10.037 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -13.262 -12.312 -11.464 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -13.706 -13.637 -10.363 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -13.288 -12.020 -7.774 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -12.684 -13.677 -8.014 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -11.559 -12.378 -7.551 1.00 0.00 H new ATOM 1157 N PRO A 150 -8.260 -14.790 -10.000 1.00 0.00 N ATOM 1158 CA PRO A 150 -7.196 -15.510 -10.708 1.00 0.00 C ATOM 1159 C PRO A 150 -7.553 -15.780 -12.166 1.00 0.00 C ATOM 1160 O PRO A 150 -8.137 -16.814 -12.492 1.00 0.00 O ATOM 1161 CB PRO A 150 -7.081 -16.826 -9.935 1.00 0.00 C ATOM 1162 CG PRO A 150 -8.423 -17.021 -9.319 1.00 0.00 C ATOM 1163 CD PRO A 150 -8.943 -15.644 -9.010 1.00 0.00 C ATOM 0 HA PRO A 150 -6.269 -14.938 -10.741 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -6.825 -17.653 -10.597 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -6.301 -16.772 -9.176 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -9.092 -17.547 -10.000 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -8.353 -17.623 -8.413 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -10.027 -15.591 -9.114 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -8.705 -15.345 -7.989 1.00 0.00 H new ATOM 1171 N GLY A 151 -7.198 -14.843 -13.039 1.00 0.00 N ATOM 1172 CA GLY A 151 -7.490 -14.999 -14.452 1.00 0.00 C ATOM 1173 C GLY A 151 -6.268 -15.399 -15.255 1.00 0.00 C ATOM 1174 O GLY A 151 -5.382 -16.087 -14.749 1.00 0.00 O ATOM 0 H GLY A 151 -6.714 -13.979 -12.794 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -8.267 -15.753 -14.578 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -7.888 -14.063 -14.843 1.00 0.00 H new ATOM 1178 N LYS A 152 -6.221 -14.969 -16.511 1.00 0.00 N ATOM 1179 CA LYS A 152 -5.099 -15.286 -17.388 1.00 0.00 C ATOM 1180 C LYS A 152 -4.015 -14.216 -17.292 1.00 0.00 C ATOM 1181 O LYS A 152 -2.828 -14.528 -17.197 1.00 0.00 O ATOM 1182 CB LYS A 152 -5.577 -15.420 -18.834 1.00 0.00 C ATOM 1183 CG LYS A 152 -6.491 -16.611 -19.064 1.00 0.00 C ATOM 1184 CD LYS A 152 -5.750 -17.926 -18.883 1.00 0.00 C ATOM 1185 CE LYS A 152 -6.680 -19.117 -19.048 1.00 0.00 C ATOM 1186 NZ LYS A 152 -5.957 -20.322 -19.537 1.00 0.00 N ATOM 0 H LYS A 152 -6.947 -14.400 -16.945 1.00 0.00 H new ATOM 0 HA LYS A 152 -4.674 -16.237 -17.066 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -6.102 -14.509 -19.120 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -4.709 -15.507 -19.488 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -7.330 -16.566 -18.369 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -6.907 -16.562 -20.070 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -4.941 -17.992 -19.610 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -5.293 -17.954 -17.894 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -7.155 -19.341 -18.093 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -7.476 -18.862 -19.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -6.626 -21.112 -19.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -5.524 -20.117 -20.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -5.214 -20.581 -18.857 1.00 0.00 H new ATOM 1200 N GLY A 153 -4.433 -12.955 -17.320 1.00 0.00 N ATOM 1201 CA GLY A 153 -3.485 -11.859 -17.235 1.00 0.00 C ATOM 1202 C GLY A 153 -4.002 -10.707 -16.396 1.00 0.00 C ATOM 1203 O GLY A 153 -4.798 -9.895 -16.868 1.00 0.00 O ATOM 0 H GLY A 153 -5.410 -12.672 -17.400 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.550 -12.224 -16.809 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.259 -11.500 -18.239 1.00 0.00 H new ATOM 1207 N THR A 154 -3.551 -10.639 -15.148 1.00 0.00 N ATOM 1208 CA THR A 154 -3.975 -9.579 -14.240 1.00 0.00 C ATOM 1209 C THR A 154 -2.794 -9.048 -13.433 1.00 0.00 C ATOM 1210 O THR A 154 -2.579 -7.840 -13.350 1.00 0.00 O ATOM 1211 CB THR A 154 -5.063 -10.091 -13.297 1.00 0.00 C ATOM 1212 OG1 THR A 154 -5.999 -10.891 -13.999 1.00 0.00 O ATOM 1213 CG2 THR A 154 -5.833 -8.984 -12.610 1.00 0.00 C ATOM 0 H THR A 154 -2.893 -11.304 -14.742 1.00 0.00 H new ATOM 0 HA THR A 154 -4.378 -8.763 -14.839 1.00 0.00 H new ATOM 0 HB THR A 154 -4.536 -10.670 -12.538 1.00 0.00 H new ATOM 0 HG1 THR A 154 -6.687 -11.211 -13.378 1.00 0.00 H new ATOM 0 HG21 THR A 154 -6.589 -9.418 -11.956 1.00 0.00 H new ATOM 0 HG22 THR A 154 -5.148 -8.377 -12.019 1.00 0.00 H new ATOM 0 HG23 THR A 154 -6.318 -8.359 -13.360 1.00 0.00 H new ATOM 1221 N GLY A 155 -2.032 -9.961 -12.839 1.00 0.00 N ATOM 1222 CA GLY A 155 -0.883 -9.564 -12.046 1.00 0.00 C ATOM 1223 C GLY A 155 0.131 -8.775 -12.849 1.00 0.00 C ATOM 1224 O GLY A 155 0.784 -7.874 -12.322 1.00 0.00 O ATOM 0 H GLY A 155 -2.189 -10.967 -12.893 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -1.219 -8.964 -11.201 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -0.404 -10.453 -11.635 1.00 0.00 H new ATOM 1228 N SER A 156 0.262 -9.112 -14.127 1.00 0.00 N ATOM 1229 CA SER A 156 1.205 -8.426 -15.005 1.00 0.00 C ATOM 1230 C SER A 156 0.801 -6.969 -15.206 1.00 0.00 C ATOM 1231 O SER A 156 1.648 -6.078 -15.229 1.00 0.00 O ATOM 1232 CB SER A 156 1.284 -9.137 -16.358 1.00 0.00 C ATOM 1233 OG SER A 156 1.230 -10.544 -16.198 1.00 0.00 O ATOM 0 H SER A 156 -0.272 -9.855 -14.579 1.00 0.00 H new ATOM 0 HA SER A 156 2.187 -8.450 -14.532 1.00 0.00 H new ATOM 0 HB2 SER A 156 0.462 -8.808 -16.994 1.00 0.00 H new ATOM 0 HB3 SER A 156 2.209 -8.861 -16.864 1.00 0.00 H new ATOM 0 HG SER A 156 1.280 -10.975 -17.077 1.00 0.00 H new ATOM 1239 N LEU A 157 -0.500 -6.737 -15.354 1.00 0.00 N ATOM 1240 CA LEU A 157 -1.017 -5.388 -15.552 1.00 0.00 C ATOM 1241 C LEU A 157 -0.847 -4.548 -14.289 1.00 0.00 C ATOM 1242 O LEU A 157 -0.518 -3.364 -14.359 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.492 -5.437 -15.952 1.00 0.00 C ATOM 1244 CG LEU A 157 -2.754 -5.566 -17.454 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -2.900 -7.028 -17.847 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -3.994 -4.779 -17.849 1.00 0.00 C ATOM 0 H LEU A 157 -1.214 -7.465 -15.341 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.446 -4.922 -16.355 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.962 -6.279 -15.443 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.981 -4.532 -15.590 1.00 0.00 H new ATOM 0 HG LEU A 157 -1.900 -5.151 -17.989 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -3.086 -7.100 -18.919 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -1.983 -7.564 -17.601 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -3.735 -7.469 -17.303 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -4.165 -4.882 -18.921 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -4.857 -5.163 -17.305 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -3.850 -3.727 -17.604 1.00 0.00 H new ATOM 1258 N LEU A 158 -1.072 -5.172 -13.138 1.00 0.00 N ATOM 1259 CA LEU A 158 -0.943 -4.482 -11.859 1.00 0.00 C ATOM 1260 C LEU A 158 0.474 -3.951 -11.667 1.00 0.00 C ATOM 1261 O LEU A 158 0.670 -2.849 -11.155 1.00 0.00 O ATOM 1262 CB LEU A 158 -1.307 -5.425 -10.709 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.726 -5.992 -10.761 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -2.840 -7.228 -9.882 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -3.737 -4.938 -10.335 1.00 0.00 C ATOM 0 H LEU A 158 -1.344 -6.152 -13.064 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.631 -3.637 -11.859 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.601 -6.255 -10.703 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.180 -4.891 -9.767 1.00 0.00 H new ATOM 0 HG LEU A 158 -2.943 -6.281 -11.789 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -3.857 -7.617 -9.932 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -2.142 -7.989 -10.232 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -2.602 -6.965 -8.851 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -4.742 -5.359 -10.378 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -3.521 -4.618 -9.316 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.674 -4.081 -11.006 1.00 0.00 H new ATOM 1277 N LYS A 159 1.457 -4.743 -12.081 1.00 0.00 N ATOM 1278 CA LYS A 159 2.856 -4.353 -11.956 1.00 0.00 C ATOM 1279 C LYS A 159 3.192 -3.218 -12.920 1.00 0.00 C ATOM 1280 O LYS A 159 3.914 -2.285 -12.568 1.00 0.00 O ATOM 1281 CB LYS A 159 3.768 -5.554 -12.220 1.00 0.00 C ATOM 1282 CG LYS A 159 4.806 -5.780 -11.134 1.00 0.00 C ATOM 1283 CD LYS A 159 6.144 -5.159 -11.505 1.00 0.00 C ATOM 1284 CE LYS A 159 6.989 -6.113 -12.334 1.00 0.00 C ATOM 1285 NZ LYS A 159 7.999 -5.392 -13.155 1.00 0.00 N ATOM 0 H LYS A 159 1.311 -5.659 -12.506 1.00 0.00 H new ATOM 0 HA LYS A 159 3.021 -4.000 -10.938 1.00 0.00 H new ATOM 0 HB2 LYS A 159 3.155 -6.450 -12.317 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.277 -5.411 -13.173 1.00 0.00 H new ATOM 0 HG2 LYS A 159 4.452 -5.352 -10.196 1.00 0.00 H new ATOM 0 HG3 LYS A 159 4.934 -6.850 -10.968 1.00 0.00 H new ATOM 0 HD2 LYS A 159 5.977 -4.239 -12.065 1.00 0.00 H new ATOM 0 HD3 LYS A 159 6.684 -4.887 -10.598 1.00 0.00 H new ATOM 0 HE2 LYS A 159 7.495 -6.817 -11.673 1.00 0.00 H new ATOM 0 HE3 LYS A 159 6.341 -6.697 -12.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 8.554 -6.079 -13.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 7.516 -4.738 -13.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 8.634 -4.854 -12.531 1.00 0.00 H new ATOM 1299 N SER A 160 2.664 -3.307 -14.137 1.00 0.00 N ATOM 1300 CA SER A 160 2.908 -2.287 -15.151 1.00 0.00 C ATOM 1301 C SER A 160 2.260 -0.963 -14.757 1.00 0.00 C ATOM 1302 O SER A 160 2.880 0.096 -14.853 1.00 0.00 O ATOM 1303 CB SER A 160 2.372 -2.748 -16.507 1.00 0.00 C ATOM 1304 OG SER A 160 2.969 -3.971 -16.903 1.00 0.00 O ATOM 0 H SER A 160 2.065 -4.074 -14.444 1.00 0.00 H new ATOM 0 HA SER A 160 3.985 -2.135 -15.227 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.290 -2.869 -16.452 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.569 -1.983 -17.258 1.00 0.00 H new ATOM 0 HG SER A 160 2.579 -4.707 -16.387 1.00 0.00 H new ATOM 1310 N HIS A 161 1.008 -1.032 -14.314 1.00 0.00 N ATOM 1311 CA HIS A 161 0.277 0.161 -13.905 1.00 0.00 C ATOM 1312 C HIS A 161 0.878 0.759 -12.637 1.00 0.00 C ATOM 1313 O HIS A 161 1.062 1.972 -12.537 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.199 -0.174 -13.675 1.00 0.00 C ATOM 1315 CG HIS A 161 -2.033 -0.084 -14.916 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.128 1.060 -15.678 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -2.815 -1.006 -15.526 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -2.932 0.841 -16.703 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.360 -0.406 -16.634 1.00 0.00 N ATOM 0 H HIS A 161 0.480 -1.901 -14.229 1.00 0.00 H new ATOM 0 HA HIS A 161 0.355 0.897 -14.705 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.275 -1.182 -13.268 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.605 0.504 -12.924 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -2.979 -2.023 -15.202 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.194 1.559 -17.466 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -3.994 -0.852 -17.297 1.00 0.00 H new ATOM 1328 N TYR A 162 1.180 -0.101 -11.671 1.00 0.00 N ATOM 1329 CA TYR A 162 1.763 0.341 -10.408 1.00 0.00 C ATOM 1330 C TYR A 162 3.094 1.047 -10.642 1.00 0.00 C ATOM 1331 O TYR A 162 3.369 2.091 -10.048 1.00 0.00 O ATOM 1332 CB TYR A 162 1.959 -0.851 -9.468 1.00 0.00 C ATOM 1333 CG TYR A 162 2.607 -0.489 -8.150 1.00 0.00 C ATOM 1334 CD1 TYR A 162 1.935 0.291 -7.217 1.00 0.00 C ATOM 1335 CD2 TYR A 162 3.887 -0.928 -7.839 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.523 0.624 -6.011 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.482 -0.599 -6.637 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.796 0.177 -5.726 1.00 0.00 C ATOM 1339 OH TYR A 162 4.385 0.507 -4.526 1.00 0.00 O ATOM 0 H TYR A 162 1.031 -1.108 -11.737 1.00 0.00 H new ATOM 0 HA TYR A 162 1.075 1.048 -9.945 1.00 0.00 H new ATOM 0 HB2 TYR A 162 0.990 -1.310 -9.272 1.00 0.00 H new ATOM 0 HB3 TYR A 162 2.571 -1.600 -9.970 1.00 0.00 H new ATOM 0 HD1 TYR A 162 0.938 0.643 -7.437 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.426 -1.537 -8.549 1.00 0.00 H new ATOM 0 HE1 TYR A 162 1.988 1.231 -5.296 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.479 -0.947 -6.411 1.00 0.00 H new ATOM 0 HH TYR A 162 5.281 0.112 -4.482 1.00 0.00 H new ATOM 1349 N GLU A 163 3.918 0.472 -11.512 1.00 0.00 N ATOM 1350 CA GLU A 163 5.221 1.045 -11.826 1.00 0.00 C ATOM 1351 C GLU A 163 5.171 1.822 -13.137 1.00 0.00 C ATOM 1352 O GLU A 163 5.682 1.368 -14.161 1.00 0.00 O ATOM 1353 CB GLU A 163 6.278 -0.058 -11.913 1.00 0.00 C ATOM 1354 CG GLU A 163 7.705 0.466 -11.934 1.00 0.00 C ATOM 1355 CD GLU A 163 8.474 0.018 -13.162 1.00 0.00 C ATOM 1356 OE1 GLU A 163 8.628 -1.208 -13.352 1.00 0.00 O ATOM 1357 OE2 GLU A 163 8.922 0.891 -13.934 1.00 0.00 O ATOM 0 H GLU A 163 3.706 -0.391 -12.012 1.00 0.00 H new ATOM 0 HA GLU A 163 5.490 1.735 -11.026 1.00 0.00 H new ATOM 0 HB2 GLU A 163 6.159 -0.731 -11.064 1.00 0.00 H new ATOM 0 HB3 GLU A 163 6.103 -0.647 -12.813 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.688 1.555 -11.898 1.00 0.00 H new ATOM 0 HG3 GLU A 163 8.226 0.125 -11.039 1.00 0.00 H new ATOM 1364 N ARG A 164 4.550 2.996 -13.098 1.00 0.00 N ATOM 1365 CA ARG A 164 4.433 3.835 -14.284 1.00 0.00 C ATOM 1366 C ARG A 164 3.950 5.239 -13.926 1.00 0.00 C ATOM 1367 O ARG A 164 4.422 6.227 -14.486 1.00 0.00 O ATOM 1368 CB ARG A 164 3.477 3.194 -15.293 1.00 0.00 C ATOM 1369 CG ARG A 164 4.163 2.729 -16.569 1.00 0.00 C ATOM 1370 CD ARG A 164 3.299 2.986 -17.793 1.00 0.00 C ATOM 1371 NE ARG A 164 3.921 2.485 -19.017 1.00 0.00 N ATOM 1372 CZ ARG A 164 4.028 1.193 -19.319 1.00 0.00 C ATOM 1373 NH1 ARG A 164 3.557 0.270 -18.490 1.00 0.00 N ATOM 1374 NH2 ARG A 164 4.608 0.824 -20.452 1.00 0.00 N ATOM 0 H ARG A 164 4.121 3.387 -12.259 1.00 0.00 H new ATOM 0 HA ARG A 164 5.423 3.921 -14.732 1.00 0.00 H new ATOM 0 HB2 ARG A 164 2.984 2.342 -14.824 1.00 0.00 H new ATOM 0 HB3 ARG A 164 2.698 3.912 -15.550 1.00 0.00 H new ATOM 0 HG2 ARG A 164 5.116 3.247 -16.680 1.00 0.00 H new ATOM 0 HG3 ARG A 164 4.385 1.664 -16.496 1.00 0.00 H new ATOM 0 HD2 ARG A 164 2.328 2.509 -17.658 1.00 0.00 H new ATOM 0 HD3 ARG A 164 3.117 4.056 -17.890 1.00 0.00 H new ATOM 0 HE ARG A 164 4.295 3.165 -19.679 1.00 0.00 H new ATOM 0 HH11 ARG A 164 3.110 0.549 -17.617 1.00 0.00 H new ATOM 0 HH12 ARG A 164 3.642 -0.719 -18.726 1.00 0.00 H new ATOM 0 HH21 ARG A 164 4.972 1.530 -21.092 1.00 0.00 H new ATOM 0 HH22 ARG A 164 4.690 -0.166 -20.684 1.00 0.00 H new ATOM 1388 N ILE A 165 3.005 5.322 -12.994 1.00 0.00 N ATOM 1389 CA ILE A 165 2.460 6.609 -12.575 1.00 0.00 C ATOM 1390 C ILE A 165 2.551 6.795 -11.062 1.00 0.00 C ATOM 1391 O ILE A 165 2.816 7.896 -10.579 1.00 0.00 O ATOM 1392 CB ILE A 165 0.988 6.765 -13.005 1.00 0.00 C ATOM 1393 CG1 ILE A 165 0.797 6.305 -14.455 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.539 8.209 -12.839 1.00 0.00 C ATOM 1395 CD1 ILE A 165 -0.198 5.175 -14.602 1.00 0.00 C ATOM 0 H ILE A 165 2.602 4.516 -12.516 1.00 0.00 H new ATOM 0 HA ILE A 165 3.064 7.372 -13.066 1.00 0.00 H new ATOM 0 HB ILE A 165 0.372 6.135 -12.363 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.465 7.152 -15.056 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.759 5.987 -14.857 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.502 8.304 -13.147 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.637 8.503 -11.794 1.00 0.00 H new ATOM 0 HG23 ILE A 165 1.160 8.857 -13.458 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -0.284 4.900 -15.653 1.00 0.00 H new ATOM 0 HD12 ILE A 165 0.143 4.313 -14.028 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -1.171 5.496 -14.231 1.00 0.00 H new ATOM 1407 N LEU A 166 2.323 5.718 -10.317 1.00 0.00 N ATOM 1408 CA LEU A 166 2.370 5.772 -8.859 1.00 0.00 C ATOM 1409 C LEU A 166 3.792 5.576 -8.337 1.00 0.00 C ATOM 1410 O LEU A 166 4.339 6.443 -7.656 1.00 0.00 O ATOM 1411 CB LEU A 166 1.447 4.711 -8.261 1.00 0.00 C ATOM 1412 CG LEU A 166 1.275 4.784 -6.742 1.00 0.00 C ATOM 1413 CD1 LEU A 166 0.221 5.817 -6.374 1.00 0.00 C ATOM 1414 CD2 LEU A 166 0.908 3.418 -6.181 1.00 0.00 C ATOM 0 H LEU A 166 2.104 4.798 -10.698 1.00 0.00 H new ATOM 0 HA LEU A 166 2.031 6.762 -8.553 1.00 0.00 H new ATOM 0 HB2 LEU A 166 0.466 4.800 -8.727 1.00 0.00 H new ATOM 0 HB3 LEU A 166 1.835 3.726 -8.521 1.00 0.00 H new ATOM 0 HG LEU A 166 2.223 5.091 -6.301 1.00 0.00 H new ATOM 0 HD11 LEU A 166 0.112 5.855 -5.290 1.00 0.00 H new ATOM 0 HD12 LEU A 166 0.527 6.796 -6.743 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -0.732 5.541 -6.825 1.00 0.00 H new ATOM 0 HD21 LEU A 166 0.790 3.489 -5.100 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -0.028 3.081 -6.627 1.00 0.00 H new ATOM 0 HD23 LEU A 166 1.699 2.705 -6.414 1.00 0.00 H new ATOM 1426 N TYR A 167 4.382 4.427 -8.654 1.00 0.00 N ATOM 1427 CA TYR A 167 5.738 4.107 -8.211 1.00 0.00 C ATOM 1428 C TYR A 167 6.707 5.266 -8.458 1.00 0.00 C ATOM 1429 O TYR A 167 7.485 5.627 -7.574 1.00 0.00 O ATOM 1430 CB TYR A 167 6.243 2.846 -8.912 1.00 0.00 C ATOM 1431 CG TYR A 167 7.223 2.047 -8.084 1.00 0.00 C ATOM 1432 CD1 TYR A 167 6.951 1.737 -6.757 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.423 1.604 -8.628 1.00 0.00 C ATOM 1434 CE1 TYR A 167 7.845 1.007 -5.997 1.00 0.00 C ATOM 1435 CE2 TYR A 167 9.322 0.875 -7.874 1.00 0.00 C ATOM 1436 CZ TYR A 167 9.028 0.578 -6.560 1.00 0.00 C ATOM 1437 OH TYR A 167 9.922 -0.148 -5.806 1.00 0.00 O ATOM 0 H TYR A 167 3.942 3.699 -9.217 1.00 0.00 H new ATOM 0 HA TYR A 167 5.696 3.931 -7.136 1.00 0.00 H new ATOM 0 HB2 TYR A 167 5.391 2.214 -9.163 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.718 3.128 -9.851 1.00 0.00 H new ATOM 0 HD1 TYR A 167 6.026 2.072 -6.312 1.00 0.00 H new ATOM 0 HD2 TYR A 167 8.656 1.834 -9.657 1.00 0.00 H new ATOM 0 HE1 TYR A 167 7.618 0.774 -4.967 1.00 0.00 H new ATOM 0 HE2 TYR A 167 10.251 0.539 -8.312 1.00 0.00 H new ATOM 0 HH TYR A 167 10.704 -0.373 -6.353 1.00 0.00 H new ATOM 1447 N PRO A 168 6.683 5.863 -9.664 1.00 0.00 N ATOM 1448 CA PRO A 168 7.574 6.976 -10.003 1.00 0.00 C ATOM 1449 C PRO A 168 7.474 8.128 -9.007 1.00 0.00 C ATOM 1450 O PRO A 168 8.451 8.836 -8.764 1.00 0.00 O ATOM 1451 CB PRO A 168 7.082 7.428 -11.380 1.00 0.00 C ATOM 1452 CG PRO A 168 6.390 6.242 -11.952 1.00 0.00 C ATOM 1453 CD PRO A 168 5.798 5.500 -10.785 1.00 0.00 C ATOM 0 HA PRO A 168 8.620 6.670 -9.986 1.00 0.00 H new ATOM 0 HB2 PRO A 168 6.405 8.278 -11.297 1.00 0.00 H new ATOM 0 HB3 PRO A 168 7.913 7.743 -12.012 1.00 0.00 H new ATOM 0 HG2 PRO A 168 5.614 6.545 -12.655 1.00 0.00 H new ATOM 0 HG3 PRO A 168 7.089 5.611 -12.501 1.00 0.00 H new ATOM 0 HD2 PRO A 168 4.768 5.802 -10.598 1.00 0.00 H new ATOM 0 HD3 PRO A 168 5.788 4.424 -10.957 1.00 0.00 H new ATOM 1461 N TYR A 169 6.288 8.313 -8.436 1.00 0.00 N ATOM 1462 CA TYR A 169 6.064 9.382 -7.470 1.00 0.00 C ATOM 1463 C TYR A 169 7.031 9.271 -6.294 1.00 0.00 C ATOM 1464 O TYR A 169 7.726 10.231 -5.960 1.00 0.00 O ATOM 1465 CB TYR A 169 4.621 9.346 -6.961 1.00 0.00 C ATOM 1466 CG TYR A 169 4.238 10.557 -6.141 1.00 0.00 C ATOM 1467 CD1 TYR A 169 4.427 11.843 -6.636 1.00 0.00 C ATOM 1468 CD2 TYR A 169 3.689 10.416 -4.873 1.00 0.00 C ATOM 1469 CE1 TYR A 169 4.078 12.952 -5.890 1.00 0.00 C ATOM 1470 CE2 TYR A 169 3.337 11.521 -4.120 1.00 0.00 C ATOM 1471 CZ TYR A 169 3.534 12.787 -4.634 1.00 0.00 C ATOM 1472 OH TYR A 169 3.186 13.890 -3.887 1.00 0.00 O ATOM 0 H TYR A 169 5.468 7.737 -8.626 1.00 0.00 H new ATOM 0 HA TYR A 169 6.242 10.332 -7.974 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.946 9.266 -7.813 1.00 0.00 H new ATOM 0 HB3 TYR A 169 4.480 8.449 -6.357 1.00 0.00 H new ATOM 0 HD1 TYR A 169 4.853 11.977 -7.619 1.00 0.00 H new ATOM 0 HD2 TYR A 169 3.534 9.427 -4.468 1.00 0.00 H new ATOM 0 HE1 TYR A 169 4.231 13.944 -6.289 1.00 0.00 H new ATOM 0 HE2 TYR A 169 2.911 11.394 -3.136 1.00 0.00 H new ATOM 0 HH TYR A 169 2.816 13.599 -3.027 1.00 0.00 H new ATOM 1482 N GLU A 170 7.070 8.098 -5.672 1.00 0.00 N ATOM 1483 CA GLU A 170 7.951 7.866 -4.536 1.00 0.00 C ATOM 1484 C GLU A 170 9.406 8.143 -4.909 1.00 0.00 C ATOM 1485 O GLU A 170 10.109 8.870 -4.209 1.00 0.00 O ATOM 1486 CB GLU A 170 7.802 6.429 -4.033 1.00 0.00 C ATOM 1487 CG GLU A 170 7.054 6.321 -2.713 1.00 0.00 C ATOM 1488 CD GLU A 170 5.885 5.360 -2.781 1.00 0.00 C ATOM 1489 OE1 GLU A 170 4.791 5.782 -3.212 1.00 0.00 O ATOM 1490 OE2 GLU A 170 6.061 4.183 -2.400 1.00 0.00 O ATOM 0 H GLU A 170 6.501 7.294 -5.936 1.00 0.00 H new ATOM 0 HA GLU A 170 7.664 8.552 -3.739 1.00 0.00 H new ATOM 0 HB2 GLU A 170 7.278 5.841 -4.787 1.00 0.00 H new ATOM 0 HB3 GLU A 170 8.792 5.989 -3.917 1.00 0.00 H new ATOM 0 HG2 GLU A 170 7.744 5.994 -1.935 1.00 0.00 H new ATOM 0 HG3 GLU A 170 6.692 7.307 -2.423 1.00 0.00 H new ATOM 1497 N LEU A 171 9.848 7.556 -6.016 1.00 0.00 N ATOM 1498 CA LEU A 171 11.211 7.737 -6.484 1.00 0.00 C ATOM 1499 C LEU A 171 11.490 9.202 -6.804 1.00 0.00 C ATOM 1500 O LEU A 171 12.606 9.688 -6.615 1.00 0.00 O ATOM 1501 CB LEU A 171 11.468 6.874 -7.721 1.00 0.00 C ATOM 1502 CG LEU A 171 11.725 5.392 -7.435 1.00 0.00 C ATOM 1503 CD1 LEU A 171 12.862 5.232 -6.440 1.00 0.00 C ATOM 1504 CD2 LEU A 171 10.460 4.725 -6.915 1.00 0.00 C ATOM 0 H LEU A 171 9.278 6.950 -6.605 1.00 0.00 H new ATOM 0 HA LEU A 171 11.885 7.425 -5.686 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.609 6.956 -8.387 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.327 7.279 -8.256 1.00 0.00 H new ATOM 0 HG LEU A 171 12.013 4.904 -8.366 1.00 0.00 H new ATOM 0 HD11 LEU A 171 13.031 4.172 -6.248 1.00 0.00 H new ATOM 0 HD12 LEU A 171 13.769 5.676 -6.850 1.00 0.00 H new ATOM 0 HD13 LEU A 171 12.602 5.733 -5.507 1.00 0.00 H new ATOM 0 HD21 LEU A 171 10.659 3.672 -6.716 1.00 0.00 H new ATOM 0 HD22 LEU A 171 10.143 5.214 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 171 9.670 4.810 -7.662 1.00 0.00 H new ATOM 1516 N PHE A 172 10.469 9.897 -7.292 1.00 0.00 N ATOM 1517 CA PHE A 172 10.600 11.308 -7.641 1.00 0.00 C ATOM 1518 C PHE A 172 11.045 12.132 -6.437 1.00 0.00 C ATOM 1519 O PHE A 172 11.812 13.085 -6.573 1.00 0.00 O ATOM 1520 CB PHE A 172 9.270 11.841 -8.178 1.00 0.00 C ATOM 1521 CG PHE A 172 9.426 12.950 -9.178 1.00 0.00 C ATOM 1522 CD1 PHE A 172 9.978 14.165 -8.807 1.00 0.00 C ATOM 1523 CD2 PHE A 172 9.017 12.776 -10.490 1.00 0.00 C ATOM 1524 CE1 PHE A 172 10.122 15.186 -9.727 1.00 0.00 C ATOM 1525 CE2 PHE A 172 9.157 13.793 -11.415 1.00 0.00 C ATOM 1526 CZ PHE A 172 9.710 15.000 -11.033 1.00 0.00 C ATOM 0 H PHE A 172 9.541 9.507 -7.455 1.00 0.00 H new ATOM 0 HA PHE A 172 11.362 11.397 -8.415 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.720 11.021 -8.640 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.668 12.198 -7.343 1.00 0.00 H new ATOM 0 HD1 PHE A 172 10.300 14.316 -7.787 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.584 11.834 -10.794 1.00 0.00 H new ATOM 0 HE1 PHE A 172 10.556 16.128 -9.426 1.00 0.00 H new ATOM 0 HE2 PHE A 172 8.835 13.645 -12.435 1.00 0.00 H new ATOM 0 HZ PHE A 172 9.820 15.797 -11.754 1.00 0.00 H new ATOM 1536 N GLN A 173 10.556 11.758 -5.258 1.00 0.00 N ATOM 1537 CA GLN A 173 10.903 12.464 -4.030 1.00 0.00 C ATOM 1538 C GLN A 173 12.211 11.939 -3.448 1.00 0.00 C ATOM 1539 O GLN A 173 13.066 12.714 -3.023 1.00 0.00 O ATOM 1540 CB GLN A 173 9.780 12.318 -3.002 1.00 0.00 C ATOM 1541 CG GLN A 173 8.428 12.784 -3.514 1.00 0.00 C ATOM 1542 CD GLN A 173 7.275 12.007 -2.910 1.00 0.00 C ATOM 1543 OE1 GLN A 173 7.157 11.898 -1.690 1.00 0.00 O ATOM 1544 NE2 GLN A 173 6.418 11.461 -3.765 1.00 0.00 N ATOM 0 H GLN A 173 9.920 10.972 -5.128 1.00 0.00 H new ATOM 0 HA GLN A 173 11.034 13.519 -4.272 1.00 0.00 H new ATOM 0 HB2 GLN A 173 9.706 11.273 -2.702 1.00 0.00 H new ATOM 0 HB3 GLN A 173 10.038 12.888 -2.110 1.00 0.00 H new ATOM 0 HG2 GLN A 173 8.304 13.843 -3.289 1.00 0.00 H new ATOM 0 HG3 GLN A 173 8.400 12.683 -4.599 1.00 0.00 H new ATOM 0 HE21 GLN A 173 6.555 11.577 -4.769 1.00 0.00 H new ATOM 0 HE22 GLN A 173 5.622 10.925 -3.418 1.00 0.00 H new ATOM 1553 N SER A 174 12.361 10.618 -3.435 1.00 0.00 N ATOM 1554 CA SER A 174 13.565 9.993 -2.906 1.00 0.00 C ATOM 1555 C SER A 174 14.541 9.655 -4.029 1.00 0.00 C ATOM 1556 O SER A 174 15.298 8.689 -3.938 1.00 0.00 O ATOM 1557 CB SER A 174 13.208 8.725 -2.126 1.00 0.00 C ATOM 1558 OG SER A 174 12.125 8.958 -1.243 1.00 0.00 O ATOM 0 H SER A 174 11.663 9.961 -3.785 1.00 0.00 H new ATOM 0 HA SER A 174 14.045 10.702 -2.232 1.00 0.00 H new ATOM 0 HB2 SER A 174 12.949 7.927 -2.822 1.00 0.00 H new ATOM 0 HB3 SER A 174 14.076 8.386 -1.561 1.00 0.00 H new ATOM 0 HG SER A 174 11.915 8.133 -0.758 1.00 0.00 H new ATOM 1564 N GLY A 175 14.518 10.460 -5.085 1.00 0.00 N ATOM 1565 CA GLY A 175 15.404 10.231 -6.210 1.00 0.00 C ATOM 1566 C GLY A 175 15.613 11.479 -7.046 1.00 0.00 C ATOM 1567 O GLY A 175 15.387 11.418 -8.273 1.00 0.00 O ATOM 1568 OXT GLY A 175 16.004 12.519 -6.474 1.00 0.00 O ATOM 0 H GLY A 175 13.902 11.267 -5.182 1.00 0.00 H new ATOM 0 HA2 GLY A 175 16.368 9.877 -5.844 1.00 0.00 H new ATOM 0 HA3 GLY A 175 14.992 9.441 -6.838 1.00 0.00 H new