USER MOD reduce.3.24.130724 H: found=0, std=0, add=574, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 575 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 172 THR OG1 : rot 180:sc= -0.0886 USER MOD Set 1.2: A 176 HIS : no HD1:sc= -9.29! C(o=-9.4!,f=-9!) USER MOD Single : A 133 ASN : amide:sc= -0.815 K(o=-0.82,f=-0.21) USER MOD Single : A 140 GLN : amide:sc= -2.86! C(o=-2.9!,f=-11!) USER MOD Single : A 141 THR OG1 : rot -13:sc= -0.182 USER MOD Single : A 143 SER OG : rot 61:sc= 1.05 USER MOD Single : A 148 GLN : amide:sc= -4.32! C(o=-4.3!,f=-11!) USER MOD Single : A 151 SER OG : rot -53:sc= 0.773 USER MOD Single : A 159 ASN : amide:sc=-0.00881 X(o=-0.0088,f=-0.48) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot 180:sc= 0.115 USER MOD Single : A 179 ASN : amide:sc=-0.00382 X(o=-0.0038,f=-0.016) USER MOD Single : A 181 MET CE :methyl 157:sc= -5.59! (180deg=-8.49!) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 MET CE :methyl -112:sc= -6.54! (180deg=-8.84!) USER MOD Single : A 185 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.0334) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 SER OG : rot 180:sc= 0 USER MOD Single : A 191 HIS : no HD1:sc= -1.17 K(o=-1.2,f=-2.3) USER MOD Single : A 195 MET CE :methyl -172:sc= -8.51! (180deg=-8.81!) USER MOD ----------------------------------------------------------------- ATOM 68 N ASP A 131 14.875 -6.685 1.497 1.00 0.00 N ATOM 69 CA ASP A 131 14.510 -7.924 0.819 1.00 0.00 C ATOM 70 C ASP A 131 13.079 -7.862 0.297 1.00 0.00 C ATOM 71 O ASP A 131 12.173 -7.422 1.001 1.00 0.00 O ATOM 72 CB ASP A 131 14.665 -9.112 1.770 1.00 0.00 C ATOM 73 CG ASP A 131 15.712 -10.100 1.295 1.00 0.00 C ATOM 74 OD1 ASP A 131 16.915 -9.832 1.492 1.00 0.00 O ATOM 75 OD2 ASP A 131 15.327 -11.143 0.725 1.00 0.00 O ATOM 0 HA ASP A 131 15.180 -8.053 -0.031 1.00 0.00 H new ATOM 0 HB2 ASP A 131 14.936 -8.748 2.761 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.707 -9.622 1.869 1.00 0.00 H new ATOM 80 N ALA A 132 12.890 -8.307 -0.941 1.00 0.00 N ATOM 81 CA ALA A 132 11.573 -8.302 -1.569 1.00 0.00 C ATOM 82 C ALA A 132 10.542 -9.031 -0.712 1.00 0.00 C ATOM 83 O ALA A 132 9.499 -8.471 -0.366 1.00 0.00 O ATOM 84 CB ALA A 132 11.647 -8.931 -2.952 1.00 0.00 C ATOM 0 H ALA A 132 13.635 -8.677 -1.531 1.00 0.00 H new ATOM 0 HA ALA A 132 11.253 -7.264 -1.665 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.658 -8.921 -3.410 1.00 0.00 H new ATOM 0 HB2 ALA A 132 12.340 -8.364 -3.573 1.00 0.00 H new ATOM 0 HB3 ALA A 132 11.996 -9.960 -2.866 1.00 0.00 H new ATOM 90 N ASN A 133 10.831 -10.282 -0.369 1.00 0.00 N ATOM 91 CA ASN A 133 9.924 -11.060 0.440 1.00 0.00 C ATOM 92 C ASN A 133 9.788 -10.436 1.806 1.00 0.00 C ATOM 93 O ASN A 133 8.727 -10.494 2.428 1.00 0.00 O ATOM 94 CB ASN A 133 10.395 -12.505 0.542 1.00 0.00 C ATOM 95 CG ASN A 133 9.491 -13.413 -0.251 1.00 0.00 C ATOM 96 OD1 ASN A 133 9.947 -14.291 -0.985 1.00 0.00 O ATOM 97 ND2 ASN A 133 8.194 -13.198 -0.101 1.00 0.00 N ATOM 0 H ASN A 133 11.684 -10.770 -0.641 1.00 0.00 H new ATOM 0 HA ASN A 133 8.944 -11.065 -0.037 1.00 0.00 H new ATOM 0 HB2 ASN A 133 11.417 -12.587 0.173 1.00 0.00 H new ATOM 0 HB3 ASN A 133 10.407 -12.817 1.586 1.00 0.00 H new ATOM 0 HD21 ASN A 133 7.520 -13.773 -0.606 1.00 0.00 H new ATOM 0 HD22 ASN A 133 7.868 -12.457 0.520 1.00 0.00 H new ATOM 104 N ASP A 134 10.855 -9.798 2.252 1.00 0.00 N ATOM 105 CA ASP A 134 10.826 -9.121 3.527 1.00 0.00 C ATOM 106 C ASP A 134 9.759 -8.042 3.469 1.00 0.00 C ATOM 107 O ASP A 134 9.123 -7.720 4.471 1.00 0.00 O ATOM 108 CB ASP A 134 12.192 -8.519 3.864 1.00 0.00 C ATOM 109 CG ASP A 134 12.247 -7.965 5.274 1.00 0.00 C ATOM 110 OD1 ASP A 134 11.440 -8.406 6.118 1.00 0.00 O ATOM 111 OD2 ASP A 134 13.101 -7.091 5.535 1.00 0.00 O ATOM 0 H ASP A 134 11.742 -9.737 1.753 1.00 0.00 H new ATOM 0 HA ASP A 134 10.590 -9.835 4.316 1.00 0.00 H new ATOM 0 HB2 ASP A 134 12.961 -9.282 3.746 1.00 0.00 H new ATOM 0 HB3 ASP A 134 12.420 -7.723 3.155 1.00 0.00 H new ATOM 116 N ILE A 135 9.537 -7.518 2.260 1.00 0.00 N ATOM 117 CA ILE A 135 8.510 -6.515 2.051 1.00 0.00 C ATOM 118 C ILE A 135 7.179 -7.092 2.487 1.00 0.00 C ATOM 119 O ILE A 135 6.484 -6.522 3.321 1.00 0.00 O ATOM 120 CB ILE A 135 8.386 -6.099 0.574 1.00 0.00 C ATOM 121 CG1 ILE A 135 9.747 -5.729 -0.019 1.00 0.00 C ATOM 122 CG2 ILE A 135 7.417 -4.939 0.445 1.00 0.00 C ATOM 123 CD1 ILE A 135 10.381 -4.514 0.616 1.00 0.00 C ATOM 0 H ILE A 135 10.056 -7.775 1.420 1.00 0.00 H new ATOM 0 HA ILE A 135 8.786 -5.634 2.630 1.00 0.00 H new ATOM 0 HB ILE A 135 8.003 -6.950 0.011 1.00 0.00 H new ATOM 0 HG12 ILE A 135 10.422 -6.578 0.089 1.00 0.00 H new ATOM 0 HG13 ILE A 135 9.630 -5.549 -1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 135 7.334 -4.649 -0.602 1.00 0.00 H new ATOM 0 HG22 ILE A 135 6.438 -5.240 0.817 1.00 0.00 H new ATOM 0 HG23 ILE A 135 7.782 -4.093 1.027 1.00 0.00 H new ATOM 0 HD11 ILE A 135 11.342 -4.316 0.142 1.00 0.00 H new ATOM 0 HD12 ILE A 135 9.727 -3.652 0.485 1.00 0.00 H new ATOM 0 HD13 ILE A 135 10.532 -4.696 1.680 1.00 0.00 H new ATOM 135 N ARG A 136 6.850 -8.256 1.926 1.00 0.00 N ATOM 136 CA ARG A 136 5.613 -8.955 2.263 1.00 0.00 C ATOM 137 C ARG A 136 5.448 -9.019 3.768 1.00 0.00 C ATOM 138 O ARG A 136 4.385 -8.719 4.312 1.00 0.00 O ATOM 139 CB ARG A 136 5.638 -10.374 1.703 1.00 0.00 C ATOM 140 CG ARG A 136 5.040 -10.484 0.318 1.00 0.00 C ATOM 141 CD ARG A 136 4.954 -11.931 -0.138 1.00 0.00 C ATOM 142 NE ARG A 136 3.758 -12.184 -0.935 1.00 0.00 N ATOM 143 CZ ARG A 136 3.347 -13.400 -1.281 1.00 0.00 C ATOM 144 NH1 ARG A 136 4.035 -14.467 -0.901 1.00 0.00 N ATOM 145 NH2 ARG A 136 2.246 -13.549 -2.005 1.00 0.00 N ATOM 0 H ARG A 136 7.426 -8.735 1.234 1.00 0.00 H new ATOM 0 HA ARG A 136 4.778 -8.409 1.825 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.669 -10.727 1.675 1.00 0.00 H new ATOM 0 HB3 ARG A 136 5.094 -11.033 2.379 1.00 0.00 H new ATOM 0 HG2 ARG A 136 4.044 -10.040 0.314 1.00 0.00 H new ATOM 0 HG3 ARG A 136 5.645 -9.915 -0.387 1.00 0.00 H new ATOM 0 HD2 ARG A 136 5.839 -12.179 -0.724 1.00 0.00 H new ATOM 0 HD3 ARG A 136 4.954 -12.586 0.733 1.00 0.00 H new ATOM 0 HE ARG A 136 3.207 -11.383 -1.244 1.00 0.00 H new ATOM 0 HH11 ARG A 136 4.881 -14.356 -0.342 1.00 0.00 H new ATOM 0 HH12 ARG A 136 3.718 -15.399 -1.167 1.00 0.00 H new ATOM 0 HH21 ARG A 136 1.713 -12.730 -2.297 1.00 0.00 H new ATOM 0 HH22 ARG A 136 1.932 -14.483 -2.270 1.00 0.00 H new ATOM 159 N ALA A 137 6.526 -9.407 4.428 1.00 0.00 N ATOM 160 CA ALA A 137 6.542 -9.514 5.870 1.00 0.00 C ATOM 161 C ALA A 137 6.150 -8.189 6.507 1.00 0.00 C ATOM 162 O ALA A 137 5.524 -8.158 7.565 1.00 0.00 O ATOM 163 CB ALA A 137 7.921 -9.946 6.334 1.00 0.00 C ATOM 0 H ALA A 137 7.408 -9.655 3.979 1.00 0.00 H new ATOM 0 HA ALA A 137 5.815 -10.264 6.180 1.00 0.00 H new ATOM 0 HB1 ALA A 137 7.931 -10.026 7.421 1.00 0.00 H new ATOM 0 HB2 ALA A 137 8.165 -10.914 5.897 1.00 0.00 H new ATOM 0 HB3 ALA A 137 8.659 -9.209 6.018 1.00 0.00 H new ATOM 169 N ARG A 138 6.519 -7.093 5.849 1.00 0.00 N ATOM 170 CA ARG A 138 6.201 -5.760 6.345 1.00 0.00 C ATOM 171 C ARG A 138 4.816 -5.330 5.873 1.00 0.00 C ATOM 172 O ARG A 138 4.036 -4.765 6.637 1.00 0.00 O ATOM 173 CB ARG A 138 7.250 -4.751 5.875 1.00 0.00 C ATOM 174 CG ARG A 138 8.553 -4.824 6.654 1.00 0.00 C ATOM 175 CD ARG A 138 9.530 -3.747 6.208 1.00 0.00 C ATOM 176 NE ARG A 138 10.829 -3.884 6.861 1.00 0.00 N ATOM 177 CZ ARG A 138 11.953 -3.360 6.383 1.00 0.00 C ATOM 178 NH1 ARG A 138 11.935 -2.664 5.254 1.00 0.00 N ATOM 179 NH2 ARG A 138 13.095 -3.529 7.033 1.00 0.00 N ATOM 0 H ARG A 138 7.038 -7.103 4.971 1.00 0.00 H new ATOM 0 HA ARG A 138 6.206 -5.791 7.435 1.00 0.00 H new ATOM 0 HB2 ARG A 138 7.458 -4.920 4.818 1.00 0.00 H new ATOM 0 HB3 ARG A 138 6.840 -3.745 5.962 1.00 0.00 H new ATOM 0 HG2 ARG A 138 8.348 -4.713 7.719 1.00 0.00 H new ATOM 0 HG3 ARG A 138 9.005 -5.806 6.517 1.00 0.00 H new ATOM 0 HD2 ARG A 138 9.660 -3.800 5.127 1.00 0.00 H new ATOM 0 HD3 ARG A 138 9.114 -2.765 6.431 1.00 0.00 H new ATOM 0 HE ARG A 138 10.876 -4.411 7.733 1.00 0.00 H new ATOM 0 HH11 ARG A 138 11.058 -2.530 4.751 1.00 0.00 H new ATOM 0 HH12 ARG A 138 12.799 -2.263 4.889 1.00 0.00 H new ATOM 0 HH21 ARG A 138 13.113 -4.062 7.902 1.00 0.00 H new ATOM 0 HH22 ARG A 138 13.956 -3.126 6.664 1.00 0.00 H new ATOM 193 N LEU A 139 4.519 -5.618 4.608 1.00 0.00 N ATOM 194 CA LEU A 139 3.230 -5.276 4.015 1.00 0.00 C ATOM 195 C LEU A 139 2.080 -5.693 4.924 1.00 0.00 C ATOM 196 O LEU A 139 0.992 -5.120 4.872 1.00 0.00 O ATOM 197 CB LEU A 139 3.080 -5.951 2.649 1.00 0.00 C ATOM 198 CG LEU A 139 4.222 -5.712 1.647 1.00 0.00 C ATOM 199 CD1 LEU A 139 3.674 -5.731 0.234 1.00 0.00 C ATOM 200 CD2 LEU A 139 4.951 -4.399 1.907 1.00 0.00 C ATOM 0 H LEU A 139 5.159 -6.091 3.970 1.00 0.00 H new ATOM 0 HA LEU A 139 3.195 -4.194 3.889 1.00 0.00 H new ATOM 0 HB2 LEU A 139 2.981 -7.025 2.806 1.00 0.00 H new ATOM 0 HB3 LEU A 139 2.149 -5.608 2.197 1.00 0.00 H new ATOM 0 HG LEU A 139 4.947 -6.516 1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 139 4.486 -5.561 -0.473 1.00 0.00 H new ATOM 0 HD12 LEU A 139 3.215 -6.700 0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 139 2.926 -4.946 0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 139 5.749 -4.274 1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 139 4.248 -3.570 1.823 1.00 0.00 H new ATOM 0 HD23 LEU A 139 5.378 -4.412 2.910 1.00 0.00 H new ATOM 212 N GLN A 140 2.330 -6.699 5.750 1.00 0.00 N ATOM 213 CA GLN A 140 1.322 -7.207 6.668 1.00 0.00 C ATOM 214 C GLN A 140 1.489 -6.601 8.054 1.00 0.00 C ATOM 215 O GLN A 140 0.507 -6.249 8.708 1.00 0.00 O ATOM 216 CB GLN A 140 1.410 -8.728 6.729 1.00 0.00 C ATOM 217 CG GLN A 140 1.466 -9.357 5.350 1.00 0.00 C ATOM 218 CD GLN A 140 0.306 -10.296 5.087 1.00 0.00 C ATOM 219 OE1 GLN A 140 -0.773 -9.869 4.676 1.00 0.00 O ATOM 220 NE2 GLN A 140 0.523 -11.585 5.324 1.00 0.00 N ATOM 0 H GLN A 140 3.227 -7.181 5.803 1.00 0.00 H new ATOM 0 HA GLN A 140 0.336 -6.920 6.302 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.297 -9.016 7.294 1.00 0.00 H new ATOM 0 HB3 GLN A 140 0.547 -9.118 7.269 1.00 0.00 H new ATOM 0 HG2 GLN A 140 1.469 -8.570 4.596 1.00 0.00 H new ATOM 0 HG3 GLN A 140 2.402 -9.904 5.243 1.00 0.00 H new ATOM 0 HE21 GLN A 140 1.433 -11.895 5.664 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -0.221 -12.265 5.166 1.00 0.00 H new ATOM 229 N THR A 141 2.735 -6.461 8.494 1.00 0.00 N ATOM 230 CA THR A 141 3.013 -5.872 9.798 1.00 0.00 C ATOM 231 C THR A 141 2.304 -4.526 9.925 1.00 0.00 C ATOM 232 O THR A 141 1.993 -4.074 11.027 1.00 0.00 O ATOM 233 CB THR A 141 4.521 -5.693 9.998 1.00 0.00 C ATOM 234 OG1 THR A 141 5.060 -4.836 9.008 1.00 0.00 O ATOM 235 CG2 THR A 141 5.289 -6.995 9.951 1.00 0.00 C ATOM 0 H THR A 141 3.563 -6.745 7.971 1.00 0.00 H new ATOM 0 HA THR A 141 2.640 -6.546 10.569 1.00 0.00 H new ATOM 0 HB THR A 141 4.632 -5.262 10.993 1.00 0.00 H new ATOM 0 HG1 THR A 141 4.400 -4.704 8.295 1.00 0.00 H new ATOM 0 HG21 THR A 141 6.351 -6.797 10.099 1.00 0.00 H new ATOM 0 HG22 THR A 141 4.930 -7.658 10.738 1.00 0.00 H new ATOM 0 HG23 THR A 141 5.141 -7.470 8.981 1.00 0.00 H new ATOM 243 N LEU A 142 2.042 -3.898 8.779 1.00 0.00 N ATOM 244 CA LEU A 142 1.360 -2.614 8.745 1.00 0.00 C ATOM 245 C LEU A 142 -0.050 -2.739 9.310 1.00 0.00 C ATOM 246 O LEU A 142 -0.274 -2.509 10.498 1.00 0.00 O ATOM 247 CB LEU A 142 1.337 -2.073 7.313 1.00 0.00 C ATOM 248 CG LEU A 142 2.720 -1.732 6.745 1.00 0.00 C ATOM 249 CD1 LEU A 142 2.919 -2.380 5.387 1.00 0.00 C ATOM 250 CD2 LEU A 142 2.906 -0.228 6.650 1.00 0.00 C ATOM 0 H LEU A 142 2.295 -4.263 7.861 1.00 0.00 H new ATOM 0 HA LEU A 142 1.905 -1.907 9.371 1.00 0.00 H new ATOM 0 HB2 LEU A 142 0.863 -2.811 6.666 1.00 0.00 H new ATOM 0 HB3 LEU A 142 0.715 -1.178 7.285 1.00 0.00 H new ATOM 0 HG LEU A 142 3.473 -2.128 7.427 1.00 0.00 H new ATOM 0 HD11 LEU A 142 3.907 -2.125 5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 142 2.837 -3.462 5.485 1.00 0.00 H new ATOM 0 HD13 LEU A 142 2.157 -2.019 4.696 1.00 0.00 H new ATOM 0 HD21 LEU A 142 3.894 -0.008 6.245 1.00 0.00 H new ATOM 0 HD22 LEU A 142 2.143 0.192 5.995 1.00 0.00 H new ATOM 0 HD23 LEU A 142 2.815 0.213 7.642 1.00 0.00 H new ATOM 262 N SER A 143 -0.991 -3.116 8.459 1.00 0.00 N ATOM 263 CA SER A 143 -2.383 -3.289 8.872 1.00 0.00 C ATOM 264 C SER A 143 -3.293 -3.443 7.659 1.00 0.00 C ATOM 265 O SER A 143 -2.876 -3.202 6.526 1.00 0.00 O ATOM 266 CB SER A 143 -2.850 -2.098 9.715 1.00 0.00 C ATOM 267 OG SER A 143 -2.617 -2.326 11.094 1.00 0.00 O ATOM 0 H SER A 143 -0.819 -3.310 7.472 1.00 0.00 H new ATOM 0 HA SER A 143 -2.440 -4.196 9.474 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.325 -1.197 9.399 1.00 0.00 H new ATOM 0 HB3 SER A 143 -3.913 -1.924 9.547 1.00 0.00 H new ATOM 0 HG SER A 143 -1.657 -2.445 11.248 1.00 0.00 H new ATOM 273 N GLU A 144 -4.543 -3.834 7.902 1.00 0.00 N ATOM 274 CA GLU A 144 -5.514 -4.004 6.825 1.00 0.00 C ATOM 275 C GLU A 144 -5.479 -2.807 5.887 1.00 0.00 C ATOM 276 O GLU A 144 -5.761 -2.926 4.698 1.00 0.00 O ATOM 277 CB GLU A 144 -6.923 -4.178 7.398 1.00 0.00 C ATOM 278 CG GLU A 144 -7.608 -5.462 6.953 1.00 0.00 C ATOM 279 CD GLU A 144 -7.698 -5.585 5.445 1.00 0.00 C ATOM 280 OE1 GLU A 144 -6.639 -5.706 4.795 1.00 0.00 O ATOM 281 OE2 GLU A 144 -8.828 -5.564 4.915 1.00 0.00 O ATOM 0 H GLU A 144 -4.906 -4.038 8.833 1.00 0.00 H new ATOM 0 HA GLU A 144 -5.250 -4.900 6.263 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -6.868 -4.164 8.487 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -7.535 -3.327 7.099 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -7.062 -6.317 7.351 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -8.611 -5.499 7.377 1.00 0.00 H new ATOM 288 N ARG A 145 -5.116 -1.655 6.439 1.00 0.00 N ATOM 289 CA ARG A 145 -5.025 -0.429 5.672 1.00 0.00 C ATOM 290 C ARG A 145 -4.046 -0.586 4.516 1.00 0.00 C ATOM 291 O ARG A 145 -4.394 -0.335 3.363 1.00 0.00 O ATOM 292 CB ARG A 145 -4.587 0.717 6.581 1.00 0.00 C ATOM 293 CG ARG A 145 -5.272 0.716 7.937 1.00 0.00 C ATOM 294 CD ARG A 145 -6.778 0.553 7.801 1.00 0.00 C ATOM 295 NE ARG A 145 -7.255 -0.671 8.438 1.00 0.00 N ATOM 296 CZ ARG A 145 -8.516 -0.863 8.812 1.00 0.00 C ATOM 297 NH1 ARG A 145 -9.421 0.084 8.612 1.00 0.00 N ATOM 298 NH2 ARG A 145 -8.872 -2.004 9.386 1.00 0.00 N ATOM 0 H ARG A 145 -4.879 -1.550 7.425 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.008 -0.204 5.258 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -3.509 0.660 6.728 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -4.791 1.664 6.081 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.871 -0.093 8.548 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -5.051 1.648 8.458 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -7.278 1.413 8.248 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -7.048 0.541 6.745 1.00 0.00 H new ATOM 0 HE ARG A 145 -6.583 -1.420 8.605 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -9.151 0.963 8.170 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -10.388 -0.066 8.900 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -8.178 -2.735 9.541 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -9.840 -2.150 9.673 1.00 0.00 H new ATOM 312 N GLU A 146 -2.823 -1.010 4.826 1.00 0.00 N ATOM 313 CA GLU A 146 -1.809 -1.202 3.796 1.00 0.00 C ATOM 314 C GLU A 146 -2.227 -2.289 2.829 1.00 0.00 C ATOM 315 O GLU A 146 -2.326 -2.064 1.624 1.00 0.00 O ATOM 316 CB GLU A 146 -0.453 -1.558 4.408 1.00 0.00 C ATOM 317 CG GLU A 146 0.682 -1.419 3.410 1.00 0.00 C ATOM 318 CD GLU A 146 1.180 -2.755 2.900 1.00 0.00 C ATOM 319 OE1 GLU A 146 0.413 -3.739 2.961 1.00 0.00 O ATOM 320 OE2 GLU A 146 2.336 -2.816 2.439 1.00 0.00 O ATOM 0 H GLU A 146 -2.513 -1.225 5.774 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.711 -0.259 3.258 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -0.262 -0.912 5.265 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -0.483 -2.582 4.781 1.00 0.00 H new ATOM 0 HG2 GLU A 146 0.347 -0.815 2.567 1.00 0.00 H new ATOM 0 HG3 GLU A 146 1.508 -0.883 3.878 1.00 0.00 H new ATOM 327 N ARG A 147 -2.489 -3.469 3.369 1.00 0.00 N ATOM 328 CA ARG A 147 -2.912 -4.600 2.563 1.00 0.00 C ATOM 329 C ARG A 147 -4.091 -4.195 1.696 1.00 0.00 C ATOM 330 O ARG A 147 -4.284 -4.718 0.598 1.00 0.00 O ATOM 331 CB ARG A 147 -3.293 -5.785 3.453 1.00 0.00 C ATOM 332 CG ARG A 147 -2.360 -5.983 4.637 1.00 0.00 C ATOM 333 CD ARG A 147 -1.820 -7.402 4.691 1.00 0.00 C ATOM 334 NE ARG A 147 -2.013 -8.012 6.004 1.00 0.00 N ATOM 335 CZ ARG A 147 -3.199 -8.383 6.477 1.00 0.00 C ATOM 336 NH1 ARG A 147 -4.291 -8.208 5.746 1.00 0.00 N ATOM 337 NH2 ARG A 147 -3.293 -8.930 7.681 1.00 0.00 N ATOM 0 H ARG A 147 -2.415 -3.667 4.367 1.00 0.00 H new ATOM 0 HA ARG A 147 -2.083 -4.906 1.924 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -4.308 -5.640 3.822 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -3.300 -6.693 2.851 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -1.530 -5.279 4.569 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -2.892 -5.760 5.562 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -2.317 -8.008 3.933 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -0.758 -7.395 4.447 1.00 0.00 H new ATOM 0 HE ARG A 147 -1.192 -8.162 6.591 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -4.222 -7.788 4.819 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -5.200 -8.493 6.111 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -2.455 -9.067 8.246 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -4.204 -9.214 8.042 1.00 0.00 H new ATOM 351 N GLN A 148 -4.873 -3.243 2.198 1.00 0.00 N ATOM 352 CA GLN A 148 -6.024 -2.754 1.474 1.00 0.00 C ATOM 353 C GLN A 148 -5.604 -1.731 0.426 1.00 0.00 C ATOM 354 O GLN A 148 -5.633 -2.006 -0.772 1.00 0.00 O ATOM 355 CB GLN A 148 -7.031 -2.132 2.438 1.00 0.00 C ATOM 356 CG GLN A 148 -7.917 -3.151 3.139 1.00 0.00 C ATOM 357 CD GLN A 148 -8.694 -2.550 4.293 1.00 0.00 C ATOM 358 OE1 GLN A 148 -8.858 -3.174 5.341 1.00 0.00 O ATOM 359 NE2 GLN A 148 -9.177 -1.327 4.106 1.00 0.00 N ATOM 0 H GLN A 148 -4.724 -2.800 3.104 1.00 0.00 H new ATOM 0 HA GLN A 148 -6.494 -3.597 0.968 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -6.492 -1.554 3.189 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -7.661 -1.432 1.889 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -8.615 -3.577 2.418 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -7.300 -3.970 3.508 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -9.018 -0.846 3.221 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -9.707 -0.869 4.847 1.00 0.00 H new ATOM 368 N VAL A 149 -5.210 -0.547 0.881 1.00 0.00 N ATOM 369 CA VAL A 149 -4.788 0.507 -0.027 1.00 0.00 C ATOM 370 C VAL A 149 -3.722 0.011 -0.996 1.00 0.00 C ATOM 371 O VAL A 149 -3.824 0.234 -2.199 1.00 0.00 O ATOM 372 CB VAL A 149 -4.265 1.741 0.732 1.00 0.00 C ATOM 373 CG1 VAL A 149 -2.940 1.433 1.396 1.00 0.00 C ATOM 374 CG2 VAL A 149 -4.137 2.931 -0.207 1.00 0.00 C ATOM 0 H VAL A 149 -5.175 -0.296 1.869 1.00 0.00 H new ATOM 0 HA VAL A 149 -5.671 0.801 -0.594 1.00 0.00 H new ATOM 0 HB VAL A 149 -4.983 1.999 1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -2.585 2.316 1.928 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -3.069 0.612 2.101 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -2.210 1.149 0.638 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -3.766 3.793 0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -3.440 2.688 -1.009 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -5.113 3.165 -0.633 1.00 0.00 H new ATOM 384 N LEU A 150 -2.705 -0.663 -0.467 1.00 0.00 N ATOM 385 CA LEU A 150 -1.618 -1.187 -1.290 1.00 0.00 C ATOM 386 C LEU A 150 -2.150 -2.068 -2.416 1.00 0.00 C ATOM 387 O LEU A 150 -1.935 -1.779 -3.593 1.00 0.00 O ATOM 388 CB LEU A 150 -0.629 -1.979 -0.430 1.00 0.00 C ATOM 389 CG LEU A 150 0.632 -2.463 -1.154 1.00 0.00 C ATOM 390 CD1 LEU A 150 1.152 -1.398 -2.109 1.00 0.00 C ATOM 391 CD2 LEU A 150 1.708 -2.847 -0.152 1.00 0.00 C ATOM 0 H LEU A 150 -2.610 -0.860 0.529 1.00 0.00 H new ATOM 0 HA LEU A 150 -1.102 -0.337 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -0.327 -1.357 0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -1.146 -2.846 -0.017 1.00 0.00 H new ATOM 0 HG LEU A 150 0.370 -3.345 -1.737 1.00 0.00 H new ATOM 0 HD11 LEU A 150 2.047 -1.765 -2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 150 0.387 -1.171 -2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 150 1.394 -0.495 -1.549 1.00 0.00 H new ATOM 0 HD21 LEU A 150 2.596 -3.188 -0.684 1.00 0.00 H new ATOM 0 HD22 LEU A 150 1.962 -1.981 0.459 1.00 0.00 H new ATOM 0 HD23 LEU A 150 1.339 -3.648 0.489 1.00 0.00 H new ATOM 403 N SER A 151 -2.841 -3.146 -2.046 1.00 0.00 N ATOM 404 CA SER A 151 -3.406 -4.087 -3.020 1.00 0.00 C ATOM 405 C SER A 151 -3.971 -3.363 -4.237 1.00 0.00 C ATOM 406 O SER A 151 -3.759 -3.786 -5.373 1.00 0.00 O ATOM 407 CB SER A 151 -4.497 -4.939 -2.366 1.00 0.00 C ATOM 408 OG SER A 151 -5.618 -4.148 -2.011 1.00 0.00 O ATOM 0 H SER A 151 -3.025 -3.392 -1.073 1.00 0.00 H new ATOM 0 HA SER A 151 -2.598 -4.735 -3.359 1.00 0.00 H new ATOM 0 HB2 SER A 151 -4.807 -5.727 -3.052 1.00 0.00 H new ATOM 0 HB3 SER A 151 -4.097 -5.428 -1.478 1.00 0.00 H new ATOM 0 HG SER A 151 -5.323 -3.387 -1.468 1.00 0.00 H new ATOM 414 N ALA A 152 -4.673 -2.263 -3.997 1.00 0.00 N ATOM 415 CA ALA A 152 -5.240 -1.484 -5.086 1.00 0.00 C ATOM 416 C ALA A 152 -4.204 -0.510 -5.618 1.00 0.00 C ATOM 417 O ALA A 152 -4.022 -0.381 -6.829 1.00 0.00 O ATOM 418 CB ALA A 152 -6.488 -0.751 -4.634 1.00 0.00 C ATOM 0 H ALA A 152 -4.862 -1.894 -3.065 1.00 0.00 H new ATOM 0 HA ALA A 152 -5.527 -2.163 -5.889 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -6.893 -0.176 -5.466 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -7.231 -1.473 -4.296 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -6.238 -0.077 -3.815 1.00 0.00 H new ATOM 424 N VAL A 153 -3.486 0.141 -4.702 1.00 0.00 N ATOM 425 CA VAL A 153 -2.427 1.060 -5.071 1.00 0.00 C ATOM 426 C VAL A 153 -1.514 0.362 -6.085 1.00 0.00 C ATOM 427 O VAL A 153 -0.912 0.993 -6.955 1.00 0.00 O ATOM 428 CB VAL A 153 -1.656 1.504 -3.792 1.00 0.00 C ATOM 429 CG1 VAL A 153 -0.147 1.415 -3.941 1.00 0.00 C ATOM 430 CG2 VAL A 153 -2.078 2.903 -3.381 1.00 0.00 C ATOM 0 H VAL A 153 -3.625 0.043 -3.696 1.00 0.00 H new ATOM 0 HA VAL A 153 -2.830 1.960 -5.534 1.00 0.00 H new ATOM 0 HB VAL A 153 -1.924 0.801 -3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 153 0.330 1.738 -3.016 1.00 0.00 H new ATOM 0 HG12 VAL A 153 0.137 0.385 -4.155 1.00 0.00 H new ATOM 0 HG13 VAL A 153 0.176 2.058 -4.759 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -1.531 3.200 -2.486 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.858 3.601 -4.189 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -3.148 2.914 -3.173 1.00 0.00 H new ATOM 440 N VAL A 154 -1.454 -0.962 -5.957 1.00 0.00 N ATOM 441 CA VAL A 154 -0.669 -1.804 -6.838 1.00 0.00 C ATOM 442 C VAL A 154 -1.090 -1.604 -8.289 1.00 0.00 C ATOM 443 O VAL A 154 -0.315 -1.123 -9.116 1.00 0.00 O ATOM 444 CB VAL A 154 -0.865 -3.285 -6.462 1.00 0.00 C ATOM 445 CG1 VAL A 154 -0.078 -4.190 -7.390 1.00 0.00 C ATOM 446 CG2 VAL A 154 -0.485 -3.525 -5.009 1.00 0.00 C ATOM 0 H VAL A 154 -1.954 -1.478 -5.233 1.00 0.00 H new ATOM 0 HA VAL A 154 0.379 -1.527 -6.727 1.00 0.00 H new ATOM 0 HB VAL A 154 -1.921 -3.529 -6.579 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -0.234 -5.230 -7.103 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -0.416 -4.042 -8.416 1.00 0.00 H new ATOM 0 HG13 VAL A 154 0.983 -3.949 -7.320 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -0.631 -4.577 -4.764 1.00 0.00 H new ATOM 0 HG22 VAL A 154 0.561 -3.259 -4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -1.113 -2.912 -4.363 1.00 0.00 H new ATOM 456 N ALA A 155 -2.330 -1.982 -8.585 1.00 0.00 N ATOM 457 CA ALA A 155 -2.873 -1.852 -9.932 1.00 0.00 C ATOM 458 C ALA A 155 -2.682 -0.440 -10.477 1.00 0.00 C ATOM 459 O ALA A 155 -2.057 -0.247 -11.520 1.00 0.00 O ATOM 460 CB ALA A 155 -4.348 -2.226 -9.943 1.00 0.00 C ATOM 0 H ALA A 155 -2.979 -2.382 -7.907 1.00 0.00 H new ATOM 0 HA ALA A 155 -2.326 -2.537 -10.580 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -4.742 -2.125 -10.954 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -4.464 -3.257 -9.610 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -4.896 -1.564 -9.272 1.00 0.00 H new ATOM 466 N GLY A 156 -3.225 0.543 -9.768 1.00 0.00 N ATOM 467 CA GLY A 156 -3.104 1.923 -10.200 1.00 0.00 C ATOM 468 C GLY A 156 -4.445 2.543 -10.544 1.00 0.00 C ATOM 469 O GLY A 156 -4.523 3.465 -11.355 1.00 0.00 O ATOM 0 H GLY A 156 -3.747 0.409 -8.902 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -2.629 2.507 -9.412 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -2.450 1.972 -11.071 1.00 0.00 H new ATOM 473 N LEU A 157 -5.505 2.033 -9.923 1.00 0.00 N ATOM 474 CA LEU A 157 -6.853 2.539 -10.161 1.00 0.00 C ATOM 475 C LEU A 157 -7.048 3.901 -9.495 1.00 0.00 C ATOM 476 O LEU A 157 -6.177 4.369 -8.763 1.00 0.00 O ATOM 477 CB LEU A 157 -7.886 1.538 -9.635 1.00 0.00 C ATOM 478 CG LEU A 157 -7.593 0.073 -9.967 1.00 0.00 C ATOM 479 CD1 LEU A 157 -8.069 -0.834 -8.844 1.00 0.00 C ATOM 480 CD2 LEU A 157 -8.248 -0.313 -11.284 1.00 0.00 C ATOM 0 H LEU A 157 -5.456 1.268 -9.250 1.00 0.00 H new ATOM 0 HA LEU A 157 -6.992 2.664 -11.235 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -7.953 1.643 -8.552 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -8.863 1.799 -10.042 1.00 0.00 H new ATOM 0 HG LEU A 157 -6.515 -0.050 -10.070 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -7.852 -1.872 -9.098 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -7.553 -0.571 -7.920 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -9.143 -0.711 -8.707 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -8.030 -1.358 -11.506 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -9.327 -0.175 -11.208 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -7.857 0.317 -12.083 1.00 0.00 H new ATOM 492 N PRO A 158 -8.191 4.564 -9.745 1.00 0.00 N ATOM 493 CA PRO A 158 -8.482 5.880 -9.164 1.00 0.00 C ATOM 494 C PRO A 158 -8.570 5.831 -7.642 1.00 0.00 C ATOM 495 O PRO A 158 -8.908 4.799 -7.063 1.00 0.00 O ATOM 496 CB PRO A 158 -9.843 6.258 -9.762 1.00 0.00 C ATOM 497 CG PRO A 158 -10.025 5.356 -10.935 1.00 0.00 C ATOM 498 CD PRO A 158 -9.282 4.093 -10.611 1.00 0.00 C ATOM 0 HA PRO A 158 -7.694 6.600 -9.388 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -10.643 6.122 -9.034 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -9.862 7.305 -10.065 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -11.082 5.152 -11.109 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -9.635 5.815 -11.843 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -9.918 3.370 -10.101 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -8.903 3.606 -11.509 1.00 0.00 H new ATOM 506 N ASN A 159 -8.267 6.954 -7.000 1.00 0.00 N ATOM 507 CA ASN A 159 -8.314 7.039 -5.546 1.00 0.00 C ATOM 508 C ASN A 159 -9.660 6.553 -5.016 1.00 0.00 C ATOM 509 O ASN A 159 -9.763 6.104 -3.874 1.00 0.00 O ATOM 510 CB ASN A 159 -8.063 8.477 -5.090 1.00 0.00 C ATOM 511 CG ASN A 159 -6.605 8.733 -4.761 1.00 0.00 C ATOM 512 OD1 ASN A 159 -5.711 8.086 -5.308 1.00 0.00 O ATOM 513 ND2 ASN A 159 -6.357 9.681 -3.865 1.00 0.00 N ATOM 0 H ASN A 159 -7.986 7.818 -7.464 1.00 0.00 H new ATOM 0 HA ASN A 159 -7.531 6.396 -5.144 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -8.382 9.165 -5.873 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -8.673 8.689 -4.212 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -5.395 9.898 -3.605 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -7.129 10.192 -3.437 1.00 0.00 H new ATOM 520 N LYS A 160 -10.688 6.643 -5.853 1.00 0.00 N ATOM 521 CA LYS A 160 -12.028 6.212 -5.469 1.00 0.00 C ATOM 522 C LYS A 160 -12.183 4.707 -5.645 1.00 0.00 C ATOM 523 O LYS A 160 -12.423 3.984 -4.679 1.00 0.00 O ATOM 524 CB LYS A 160 -13.082 6.948 -6.299 1.00 0.00 C ATOM 525 CG LYS A 160 -14.075 7.736 -5.462 1.00 0.00 C ATOM 526 CD LYS A 160 -14.682 8.885 -6.250 1.00 0.00 C ATOM 527 CE LYS A 160 -16.118 9.152 -5.832 1.00 0.00 C ATOM 528 NZ LYS A 160 -16.203 9.699 -4.450 1.00 0.00 N ATOM 0 H LYS A 160 -10.619 7.011 -6.802 1.00 0.00 H new ATOM 0 HA LYS A 160 -12.174 6.454 -4.416 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -12.580 7.628 -6.988 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -13.625 6.224 -6.906 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -14.868 7.072 -5.116 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -13.576 8.126 -4.575 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -14.085 9.785 -6.100 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -14.649 8.654 -7.315 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -16.574 9.855 -6.529 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -16.691 8.227 -5.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -17.199 9.867 -4.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -15.791 9.017 -3.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -15.678 10.595 -4.398 1.00 0.00 H new ATOM 542 N SER A 161 -12.039 4.235 -6.882 1.00 0.00 N ATOM 543 CA SER A 161 -12.157 2.807 -7.172 1.00 0.00 C ATOM 544 C SER A 161 -11.339 1.996 -6.174 1.00 0.00 C ATOM 545 O SER A 161 -11.825 1.025 -5.595 1.00 0.00 O ATOM 546 CB SER A 161 -11.689 2.511 -8.598 1.00 0.00 C ATOM 547 OG SER A 161 -12.483 1.503 -9.198 1.00 0.00 O ATOM 0 H SER A 161 -11.841 4.817 -7.696 1.00 0.00 H new ATOM 0 HA SER A 161 -13.205 2.522 -7.082 1.00 0.00 H new ATOM 0 HB2 SER A 161 -11.738 3.421 -9.196 1.00 0.00 H new ATOM 0 HB3 SER A 161 -10.646 2.195 -8.583 1.00 0.00 H new ATOM 0 HG SER A 161 -12.164 1.334 -10.109 1.00 0.00 H new ATOM 553 N ILE A 162 -10.097 2.418 -5.970 1.00 0.00 N ATOM 554 CA ILE A 162 -9.200 1.762 -5.036 1.00 0.00 C ATOM 555 C ILE A 162 -9.803 1.709 -3.642 1.00 0.00 C ATOM 556 O ILE A 162 -10.085 0.637 -3.108 1.00 0.00 O ATOM 557 CB ILE A 162 -7.872 2.530 -4.973 1.00 0.00 C ATOM 558 CG1 ILE A 162 -7.186 2.474 -6.330 1.00 0.00 C ATOM 559 CG2 ILE A 162 -6.958 1.998 -3.874 1.00 0.00 C ATOM 560 CD1 ILE A 162 -5.901 3.245 -6.359 1.00 0.00 C ATOM 0 H ILE A 162 -9.688 3.221 -6.447 1.00 0.00 H new ATOM 0 HA ILE A 162 -9.034 0.743 -5.386 1.00 0.00 H new ATOM 0 HB ILE A 162 -8.089 3.569 -4.724 1.00 0.00 H new ATOM 0 HG12 ILE A 162 -6.987 1.434 -6.590 1.00 0.00 H new ATOM 0 HG13 ILE A 162 -7.860 2.869 -7.090 1.00 0.00 H new ATOM 0 HG21 ILE A 162 -6.030 2.569 -3.864 1.00 0.00 H new ATOM 0 HG22 ILE A 162 -7.455 2.096 -2.909 1.00 0.00 H new ATOM 0 HG23 ILE A 162 -6.736 0.948 -4.062 1.00 0.00 H new ATOM 0 HD11 ILE A 162 -5.454 3.171 -7.351 1.00 0.00 H new ATOM 0 HD12 ILE A 162 -6.099 4.292 -6.128 1.00 0.00 H new ATOM 0 HD13 ILE A 162 -5.213 2.834 -5.620 1.00 0.00 H new ATOM 572 N ALA A 163 -9.984 2.883 -3.059 1.00 0.00 N ATOM 573 CA ALA A 163 -10.536 2.997 -1.728 1.00 0.00 C ATOM 574 C ALA A 163 -11.844 2.257 -1.625 1.00 0.00 C ATOM 575 O ALA A 163 -12.088 1.539 -0.659 1.00 0.00 O ATOM 576 CB ALA A 163 -10.733 4.456 -1.371 1.00 0.00 C ATOM 0 H ALA A 163 -9.753 3.775 -3.495 1.00 0.00 H new ATOM 0 HA ALA A 163 -9.833 2.549 -1.025 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -11.149 4.532 -0.366 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -9.773 4.972 -1.406 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -11.418 4.916 -2.083 1.00 0.00 H new ATOM 582 N TYR A 164 -12.693 2.432 -2.622 1.00 0.00 N ATOM 583 CA TYR A 164 -13.972 1.766 -2.600 1.00 0.00 C ATOM 584 C TYR A 164 -13.829 0.285 -2.923 1.00 0.00 C ATOM 585 O TYR A 164 -14.724 -0.512 -2.637 1.00 0.00 O ATOM 586 CB TYR A 164 -14.976 2.435 -3.541 1.00 0.00 C ATOM 587 CG TYR A 164 -16.215 2.924 -2.822 1.00 0.00 C ATOM 588 CD1 TYR A 164 -16.697 2.249 -1.686 1.00 0.00 C ATOM 589 CD2 TYR A 164 -16.904 4.068 -3.256 1.00 0.00 C ATOM 590 CE1 TYR A 164 -17.828 2.697 -1.003 1.00 0.00 C ATOM 591 CE2 TYR A 164 -18.041 4.524 -2.581 1.00 0.00 C ATOM 592 CZ TYR A 164 -18.498 3.836 -1.455 1.00 0.00 C ATOM 593 OH TYR A 164 -19.613 4.283 -0.786 1.00 0.00 O ATOM 0 H TYR A 164 -12.521 3.018 -3.439 1.00 0.00 H new ATOM 0 HA TYR A 164 -14.363 1.855 -1.586 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -14.495 3.276 -4.040 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -15.267 1.728 -4.317 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -16.182 1.367 -1.336 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -16.551 4.604 -4.124 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -18.183 2.167 -0.131 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -18.563 5.403 -2.929 1.00 0.00 H new ATOM 0 HH TYR A 164 -19.959 5.086 -1.228 1.00 0.00 H new ATOM 603 N ASP A 165 -12.691 -0.088 -3.499 1.00 0.00 N ATOM 604 CA ASP A 165 -12.432 -1.479 -3.830 1.00 0.00 C ATOM 605 C ASP A 165 -11.994 -2.250 -2.585 1.00 0.00 C ATOM 606 O ASP A 165 -11.998 -3.481 -2.573 1.00 0.00 O ATOM 607 CB ASP A 165 -11.360 -1.582 -4.917 1.00 0.00 C ATOM 608 CG ASP A 165 -10.961 -3.017 -5.205 1.00 0.00 C ATOM 609 OD1 ASP A 165 -11.838 -3.903 -5.128 1.00 0.00 O ATOM 610 OD2 ASP A 165 -9.773 -3.253 -5.509 1.00 0.00 O ATOM 0 H ASP A 165 -11.937 0.554 -3.745 1.00 0.00 H new ATOM 0 HA ASP A 165 -13.355 -1.919 -4.209 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -11.730 -1.120 -5.833 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -10.479 -1.018 -4.609 1.00 0.00 H new ATOM 615 N LEU A 166 -11.624 -1.519 -1.530 1.00 0.00 N ATOM 616 CA LEU A 166 -11.197 -2.140 -0.284 1.00 0.00 C ATOM 617 C LEU A 166 -12.178 -1.809 0.837 1.00 0.00 C ATOM 618 O LEU A 166 -11.785 -1.562 1.977 1.00 0.00 O ATOM 619 CB LEU A 166 -9.789 -1.672 0.094 1.00 0.00 C ATOM 620 CG LEU A 166 -8.851 -1.401 -1.086 1.00 0.00 C ATOM 621 CD1 LEU A 166 -7.877 -0.283 -0.744 1.00 0.00 C ATOM 622 CD2 LEU A 166 -8.099 -2.666 -1.476 1.00 0.00 C ATOM 0 H LEU A 166 -11.613 -0.499 -1.519 1.00 0.00 H new ATOM 0 HA LEU A 166 -11.178 -3.220 -0.427 1.00 0.00 H new ATOM 0 HB2 LEU A 166 -9.874 -0.761 0.686 1.00 0.00 H new ATOM 0 HB3 LEU A 166 -9.332 -2.427 0.734 1.00 0.00 H new ATOM 0 HG LEU A 166 -9.453 -1.086 -1.939 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -7.217 -0.103 -1.593 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -8.433 0.627 -0.517 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -7.282 -0.571 0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -7.438 -2.452 -2.316 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -7.508 -3.014 -0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -8.812 -3.439 -1.763 1.00 0.00 H new ATOM 634 N ASP A 167 -13.461 -1.829 0.496 1.00 0.00 N ATOM 635 CA ASP A 167 -14.531 -1.555 1.453 1.00 0.00 C ATOM 636 C ASP A 167 -14.237 -0.331 2.318 1.00 0.00 C ATOM 637 O ASP A 167 -14.384 -0.383 3.540 1.00 0.00 O ATOM 638 CB ASP A 167 -14.751 -2.774 2.350 1.00 0.00 C ATOM 639 CG ASP A 167 -16.216 -3.138 2.484 1.00 0.00 C ATOM 640 OD1 ASP A 167 -17.064 -2.222 2.428 1.00 0.00 O ATOM 641 OD2 ASP A 167 -16.517 -4.339 2.648 1.00 0.00 O ATOM 0 H ASP A 167 -13.790 -2.035 -0.447 1.00 0.00 H new ATOM 0 HA ASP A 167 -15.433 -1.344 0.878 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -14.204 -3.624 1.943 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -14.338 -2.573 3.338 1.00 0.00 H new ATOM 646 N ILE A 168 -13.833 0.770 1.692 1.00 0.00 N ATOM 647 CA ILE A 168 -13.536 1.991 2.434 1.00 0.00 C ATOM 648 C ILE A 168 -13.602 3.237 1.552 1.00 0.00 C ATOM 649 O ILE A 168 -13.589 3.149 0.325 1.00 0.00 O ATOM 650 CB ILE A 168 -12.167 1.910 3.120 1.00 0.00 C ATOM 651 CG1 ILE A 168 -11.124 1.309 2.193 1.00 0.00 C ATOM 652 CG2 ILE A 168 -12.267 1.093 4.384 1.00 0.00 C ATOM 653 CD1 ILE A 168 -10.139 2.332 1.724 1.00 0.00 C ATOM 0 H ILE A 168 -13.705 0.843 0.683 1.00 0.00 H new ATOM 0 HA ILE A 168 -14.309 2.080 3.198 1.00 0.00 H new ATOM 0 HB ILE A 168 -11.855 2.924 3.372 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -10.597 0.508 2.711 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -11.619 0.860 1.332 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -11.289 1.042 4.863 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -12.980 1.560 5.064 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -12.604 0.086 4.140 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -9.411 1.860 1.064 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -10.663 3.120 1.183 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -9.624 2.762 2.583 1.00 0.00 H new ATOM 665 N SER A 169 -13.695 4.399 2.198 1.00 0.00 N ATOM 666 CA SER A 169 -13.787 5.672 1.492 1.00 0.00 C ATOM 667 C SER A 169 -12.426 6.136 0.978 1.00 0.00 C ATOM 668 O SER A 169 -11.385 5.700 1.467 1.00 0.00 O ATOM 669 CB SER A 169 -14.387 6.740 2.408 1.00 0.00 C ATOM 670 OG SER A 169 -14.525 6.258 3.733 1.00 0.00 O ATOM 0 H SER A 169 -13.708 4.482 3.214 1.00 0.00 H new ATOM 0 HA SER A 169 -14.437 5.523 0.630 1.00 0.00 H new ATOM 0 HB2 SER A 169 -13.751 7.625 2.404 1.00 0.00 H new ATOM 0 HB3 SER A 169 -15.361 7.046 2.026 1.00 0.00 H new ATOM 0 HG SER A 169 -14.909 6.960 4.298 1.00 0.00 H new ATOM 676 N PRO A 170 -12.424 7.036 -0.025 1.00 0.00 N ATOM 677 CA PRO A 170 -11.191 7.566 -0.617 1.00 0.00 C ATOM 678 C PRO A 170 -10.476 8.562 0.285 1.00 0.00 C ATOM 679 O PRO A 170 -9.336 8.942 0.018 1.00 0.00 O ATOM 680 CB PRO A 170 -11.680 8.236 -1.899 1.00 0.00 C ATOM 681 CG PRO A 170 -13.077 8.653 -1.590 1.00 0.00 C ATOM 682 CD PRO A 170 -13.628 7.604 -0.662 1.00 0.00 C ATOM 0 HA PRO A 170 -10.452 6.783 -0.785 1.00 0.00 H new ATOM 0 HB2 PRO A 170 -11.059 9.092 -2.162 1.00 0.00 H new ATOM 0 HB3 PRO A 170 -11.648 7.548 -2.744 1.00 0.00 H new ATOM 0 HG2 PRO A 170 -13.096 9.637 -1.121 1.00 0.00 H new ATOM 0 HG3 PRO A 170 -13.674 8.722 -2.499 1.00 0.00 H new ATOM 0 HD2 PRO A 170 -14.305 8.036 0.075 1.00 0.00 H new ATOM 0 HD3 PRO A 170 -14.191 6.844 -1.205 1.00 0.00 H new ATOM 690 N ARG A 171 -11.125 8.954 1.370 1.00 0.00 N ATOM 691 CA ARG A 171 -10.518 9.865 2.321 1.00 0.00 C ATOM 692 C ARG A 171 -9.597 9.069 3.231 1.00 0.00 C ATOM 693 O ARG A 171 -8.594 9.578 3.734 1.00 0.00 O ATOM 694 CB ARG A 171 -11.590 10.584 3.143 1.00 0.00 C ATOM 695 CG ARG A 171 -11.077 11.822 3.860 1.00 0.00 C ATOM 696 CD ARG A 171 -10.777 11.535 5.323 1.00 0.00 C ATOM 697 NE ARG A 171 -11.965 11.662 6.162 1.00 0.00 N ATOM 698 CZ ARG A 171 -12.451 12.828 6.578 1.00 0.00 C ATOM 699 NH1 ARG A 171 -11.851 13.959 6.233 1.00 0.00 N ATOM 700 NH2 ARG A 171 -13.536 12.863 7.339 1.00 0.00 N ATOM 0 H ARG A 171 -12.070 8.655 1.612 1.00 0.00 H new ATOM 0 HA ARG A 171 -9.947 10.624 1.787 1.00 0.00 H new ATOM 0 HB2 ARG A 171 -12.411 10.869 2.485 1.00 0.00 H new ATOM 0 HB3 ARG A 171 -11.998 9.891 3.879 1.00 0.00 H new ATOM 0 HG2 ARG A 171 -10.174 12.182 3.366 1.00 0.00 H new ATOM 0 HG3 ARG A 171 -11.818 12.618 3.789 1.00 0.00 H new ATOM 0 HD2 ARG A 171 -10.372 10.528 5.419 1.00 0.00 H new ATOM 0 HD3 ARG A 171 -10.009 12.222 5.677 1.00 0.00 H new ATOM 0 HE ARG A 171 -12.449 10.810 6.445 1.00 0.00 H new ATOM 0 HH11 ARG A 171 -11.016 13.935 5.648 1.00 0.00 H new ATOM 0 HH12 ARG A 171 -12.225 14.853 6.553 1.00 0.00 H new ATOM 0 HH21 ARG A 171 -14.000 11.995 7.606 1.00 0.00 H new ATOM 0 HH22 ARG A 171 -13.907 13.758 7.657 1.00 0.00 H new ATOM 714 N THR A 172 -9.945 7.798 3.421 1.00 0.00 N ATOM 715 CA THR A 172 -9.160 6.909 4.250 1.00 0.00 C ATOM 716 C THR A 172 -7.886 6.491 3.518 1.00 0.00 C ATOM 717 O THR A 172 -6.792 6.627 4.050 1.00 0.00 O ATOM 718 CB THR A 172 -10.011 5.694 4.679 1.00 0.00 C ATOM 719 OG1 THR A 172 -10.072 5.608 6.092 1.00 0.00 O ATOM 720 CG2 THR A 172 -9.518 4.350 4.170 1.00 0.00 C ATOM 0 H THR A 172 -10.771 7.367 3.006 1.00 0.00 H new ATOM 0 HA THR A 172 -8.856 7.432 5.157 1.00 0.00 H new ATOM 0 HB THR A 172 -10.986 5.880 4.229 1.00 0.00 H new ATOM 0 HG1 THR A 172 -10.616 4.834 6.349 1.00 0.00 H new ATOM 0 HG21 THR A 172 -10.181 3.561 4.525 1.00 0.00 H new ATOM 0 HG22 THR A 172 -9.510 4.355 3.080 1.00 0.00 H new ATOM 0 HG23 THR A 172 -8.509 4.169 4.540 1.00 0.00 H new ATOM 728 N VAL A 173 -8.034 5.985 2.293 1.00 0.00 N ATOM 729 CA VAL A 173 -6.891 5.558 1.500 1.00 0.00 C ATOM 730 C VAL A 173 -5.774 6.589 1.563 1.00 0.00 C ATOM 731 O VAL A 173 -4.613 6.249 1.788 1.00 0.00 O ATOM 732 CB VAL A 173 -7.289 5.328 0.037 1.00 0.00 C ATOM 733 CG1 VAL A 173 -8.132 4.070 -0.092 1.00 0.00 C ATOM 734 CG2 VAL A 173 -8.025 6.538 -0.510 1.00 0.00 C ATOM 0 H VAL A 173 -8.936 5.863 1.832 1.00 0.00 H new ATOM 0 HA VAL A 173 -6.535 4.618 1.921 1.00 0.00 H new ATOM 0 HB VAL A 173 -6.384 5.190 -0.554 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -8.406 3.921 -1.136 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -7.560 3.211 0.259 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -9.035 4.174 0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -8.300 6.358 -1.549 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -8.926 6.713 0.079 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -7.379 7.414 -0.453 1.00 0.00 H new ATOM 744 N GLU A 174 -6.139 7.856 1.393 1.00 0.00 N ATOM 745 CA GLU A 174 -5.165 8.933 1.465 1.00 0.00 C ATOM 746 C GLU A 174 -4.465 8.872 2.813 1.00 0.00 C ATOM 747 O GLU A 174 -3.249 9.037 2.907 1.00 0.00 O ATOM 748 CB GLU A 174 -5.847 10.290 1.280 1.00 0.00 C ATOM 749 CG GLU A 174 -5.420 11.018 0.015 1.00 0.00 C ATOM 750 CD GLU A 174 -3.933 11.311 -0.016 1.00 0.00 C ATOM 751 OE1 GLU A 174 -3.236 10.952 0.957 1.00 0.00 O ATOM 752 OE2 GLU A 174 -3.466 11.901 -1.012 1.00 0.00 O ATOM 0 H GLU A 174 -7.095 8.158 1.206 1.00 0.00 H new ATOM 0 HA GLU A 174 -4.434 8.815 0.665 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -6.927 10.145 1.259 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -5.627 10.919 2.143 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -5.686 10.416 -0.854 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -5.973 11.954 -0.065 1.00 0.00 H new ATOM 759 N VAL A 175 -5.249 8.601 3.854 1.00 0.00 N ATOM 760 CA VAL A 175 -4.712 8.481 5.202 1.00 0.00 C ATOM 761 C VAL A 175 -3.905 7.197 5.337 1.00 0.00 C ATOM 762 O VAL A 175 -2.732 7.217 5.709 1.00 0.00 O ATOM 763 CB VAL A 175 -5.829 8.475 6.263 1.00 0.00 C ATOM 764 CG1 VAL A 175 -5.241 8.628 7.658 1.00 0.00 C ATOM 765 CG2 VAL A 175 -6.843 9.574 5.981 1.00 0.00 C ATOM 0 H VAL A 175 -6.257 8.461 3.787 1.00 0.00 H new ATOM 0 HA VAL A 175 -4.073 9.348 5.370 1.00 0.00 H new ATOM 0 HB VAL A 175 -6.345 7.516 6.213 1.00 0.00 H new ATOM 0 HG11 VAL A 175 -6.045 8.622 8.394 1.00 0.00 H new ATOM 0 HG12 VAL A 175 -4.559 7.802 7.858 1.00 0.00 H new ATOM 0 HG13 VAL A 175 -4.697 9.571 7.722 1.00 0.00 H new ATOM 0 HG21 VAL A 175 -7.624 9.553 6.742 1.00 0.00 H new ATOM 0 HG22 VAL A 175 -6.344 10.543 6.000 1.00 0.00 H new ATOM 0 HG23 VAL A 175 -7.289 9.415 4.999 1.00 0.00 H new ATOM 775 N HIS A 176 -4.551 6.080 5.023 1.00 0.00 N ATOM 776 CA HIS A 176 -3.926 4.770 5.091 1.00 0.00 C ATOM 777 C HIS A 176 -2.647 4.728 4.267 1.00 0.00 C ATOM 778 O HIS A 176 -1.555 4.595 4.812 1.00 0.00 O ATOM 779 CB HIS A 176 -4.899 3.702 4.589 1.00 0.00 C ATOM 780 CG HIS A 176 -6.129 3.565 5.433 1.00 0.00 C ATOM 781 ND1 HIS A 176 -6.493 4.489 6.390 1.00 0.00 N ATOM 782 CD2 HIS A 176 -7.081 2.603 5.459 1.00 0.00 C ATOM 783 CE1 HIS A 176 -7.615 4.101 6.969 1.00 0.00 C ATOM 784 NE2 HIS A 176 -7.993 2.961 6.423 1.00 0.00 N ATOM 0 H HIS A 176 -5.523 6.060 4.714 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.669 4.571 6.131 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.195 3.943 3.568 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.384 2.742 4.554 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -7.117 1.720 4.839 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -8.135 4.628 7.756 1.00 0.00 H new ATOM 0 HE2 HIS A 176 -8.827 2.431 6.675 1.00 0.00 H new ATOM 793 N ARG A 177 -2.789 4.833 2.947 1.00 0.00 N ATOM 794 CA ARG A 177 -1.642 4.797 2.039 1.00 0.00 C ATOM 795 C ARG A 177 -0.466 5.610 2.590 1.00 0.00 C ATOM 796 O ARG A 177 0.647 5.103 2.722 1.00 0.00 O ATOM 797 CB ARG A 177 -2.059 5.296 0.639 1.00 0.00 C ATOM 798 CG ARG A 177 -1.802 6.776 0.377 1.00 0.00 C ATOM 799 CD ARG A 177 -2.043 7.137 -1.079 1.00 0.00 C ATOM 800 NE ARG A 177 -2.056 8.582 -1.289 1.00 0.00 N ATOM 801 CZ ARG A 177 -1.858 9.157 -2.472 1.00 0.00 C ATOM 802 NH1 ARG A 177 -1.634 8.411 -3.544 1.00 0.00 N ATOM 803 NH2 ARG A 177 -1.886 10.478 -2.582 1.00 0.00 N ATOM 0 H ARG A 177 -3.689 4.944 2.481 1.00 0.00 H new ATOM 0 HA ARG A 177 -1.305 3.764 1.953 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -1.526 4.712 -0.111 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -3.122 5.098 0.501 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -2.452 7.377 1.014 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -0.775 7.021 0.648 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -1.266 6.688 -1.697 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -2.994 6.715 -1.405 1.00 0.00 H new ATOM 0 HE ARG A 177 -2.226 9.184 -0.483 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -1.613 7.394 -3.463 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -1.482 8.853 -4.451 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -2.060 11.055 -1.759 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -1.734 10.917 -3.490 1.00 0.00 H new ATOM 817 N ALA A 178 -0.727 6.875 2.906 1.00 0.00 N ATOM 818 CA ALA A 178 0.298 7.762 3.438 1.00 0.00 C ATOM 819 C ALA A 178 0.855 7.228 4.747 1.00 0.00 C ATOM 820 O ALA A 178 2.001 7.503 5.109 1.00 0.00 O ATOM 821 CB ALA A 178 -0.275 9.153 3.644 1.00 0.00 C ATOM 0 H ALA A 178 -1.644 7.309 2.802 1.00 0.00 H new ATOM 0 HA ALA A 178 1.114 7.813 2.717 1.00 0.00 H new ATOM 0 HB1 ALA A 178 0.498 9.810 4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 178 -0.629 9.546 2.691 1.00 0.00 H new ATOM 0 HB3 ALA A 178 -1.106 9.104 4.347 1.00 0.00 H new ATOM 827 N ASN A 179 0.043 6.451 5.450 1.00 0.00 N ATOM 828 CA ASN A 179 0.454 5.874 6.714 1.00 0.00 C ATOM 829 C ASN A 179 1.231 4.605 6.456 1.00 0.00 C ATOM 830 O ASN A 179 2.253 4.346 7.079 1.00 0.00 O ATOM 831 CB ASN A 179 -0.768 5.570 7.582 1.00 0.00 C ATOM 832 CG ASN A 179 -0.721 6.279 8.920 1.00 0.00 C ATOM 833 OD1 ASN A 179 0.223 6.113 9.692 1.00 0.00 O ATOM 834 ND2 ASN A 179 -1.746 7.077 9.200 1.00 0.00 N ATOM 0 H ASN A 179 -0.905 6.208 5.163 1.00 0.00 H new ATOM 0 HA ASN A 179 1.086 6.587 7.243 1.00 0.00 H new ATOM 0 HB2 ASN A 179 -1.671 5.867 7.049 1.00 0.00 H new ATOM 0 HB3 ASN A 179 -0.834 4.495 7.747 1.00 0.00 H new ATOM 0 HD21 ASN A 179 -1.772 7.582 10.086 1.00 0.00 H new ATOM 0 HD22 ASN A 179 -2.507 7.184 8.529 1.00 0.00 H new ATOM 841 N VAL A 180 0.734 3.823 5.517 1.00 0.00 N ATOM 842 CA VAL A 180 1.368 2.580 5.158 1.00 0.00 C ATOM 843 C VAL A 180 2.695 2.855 4.468 1.00 0.00 C ATOM 844 O VAL A 180 3.744 2.402 4.922 1.00 0.00 O ATOM 845 CB VAL A 180 0.428 1.687 4.305 1.00 0.00 C ATOM 846 CG1 VAL A 180 -1.032 1.968 4.626 1.00 0.00 C ATOM 847 CG2 VAL A 180 0.677 1.805 2.809 1.00 0.00 C ATOM 0 H VAL A 180 -0.113 4.033 4.989 1.00 0.00 H new ATOM 0 HA VAL A 180 1.577 2.016 6.067 1.00 0.00 H new ATOM 0 HB VAL A 180 0.662 0.658 4.579 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.669 1.329 4.014 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.219 1.764 5.680 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.257 3.013 4.414 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.014 1.155 2.273 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.522 2.837 2.495 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.702 1.508 2.586 1.00 0.00 H new ATOM 857 N MET A 181 2.652 3.635 3.394 1.00 0.00 N ATOM 858 CA MET A 181 3.863 3.996 2.677 1.00 0.00 C ATOM 859 C MET A 181 4.897 4.539 3.656 1.00 0.00 C ATOM 860 O MET A 181 6.101 4.379 3.461 1.00 0.00 O ATOM 861 CB MET A 181 3.554 5.038 1.609 1.00 0.00 C ATOM 862 CG MET A 181 2.960 6.319 2.167 1.00 0.00 C ATOM 863 SD MET A 181 4.059 7.736 1.987 1.00 0.00 S ATOM 864 CE MET A 181 4.565 7.551 0.282 1.00 0.00 C ATOM 0 H MET A 181 1.795 4.027 3.004 1.00 0.00 H new ATOM 0 HA MET A 181 4.264 3.108 2.189 1.00 0.00 H new ATOM 0 HB2 MET A 181 4.471 5.277 1.070 1.00 0.00 H new ATOM 0 HB3 MET A 181 2.860 4.610 0.885 1.00 0.00 H new ATOM 0 HG2 MET A 181 2.019 6.529 1.659 1.00 0.00 H new ATOM 0 HG3 MET A 181 2.728 6.177 3.223 1.00 0.00 H new ATOM 0 HE1 MET A 181 4.894 8.515 -0.107 1.00 0.00 H new ATOM 0 HE2 MET A 181 5.386 6.836 0.222 1.00 0.00 H new ATOM 0 HE3 MET A 181 3.724 7.189 -0.310 1.00 0.00 H new ATOM 874 N ALA A 182 4.409 5.168 4.723 1.00 0.00 N ATOM 875 CA ALA A 182 5.284 5.719 5.749 1.00 0.00 C ATOM 876 C ALA A 182 5.681 4.637 6.750 1.00 0.00 C ATOM 877 O ALA A 182 6.838 4.551 7.162 1.00 0.00 O ATOM 878 CB ALA A 182 4.604 6.879 6.459 1.00 0.00 C ATOM 0 H ALA A 182 3.414 5.307 4.897 1.00 0.00 H new ATOM 0 HA ALA A 182 6.189 6.091 5.269 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.271 7.280 7.223 1.00 0.00 H new ATOM 0 HB2 ALA A 182 4.369 7.660 5.736 1.00 0.00 H new ATOM 0 HB3 ALA A 182 3.684 6.530 6.928 1.00 0.00 H new ATOM 884 N LYS A 183 4.709 3.814 7.138 1.00 0.00 N ATOM 885 CA LYS A 183 4.945 2.735 8.090 1.00 0.00 C ATOM 886 C LYS A 183 5.869 1.670 7.504 1.00 0.00 C ATOM 887 O LYS A 183 6.862 1.297 8.129 1.00 0.00 O ATOM 888 CB LYS A 183 3.616 2.097 8.516 1.00 0.00 C ATOM 889 CG LYS A 183 2.835 2.887 9.562 1.00 0.00 C ATOM 890 CD LYS A 183 3.740 3.496 10.618 1.00 0.00 C ATOM 891 CE LYS A 183 4.635 2.448 11.260 1.00 0.00 C ATOM 892 NZ LYS A 183 5.536 3.039 12.287 1.00 0.00 N ATOM 0 H LYS A 183 3.747 3.876 6.805 1.00 0.00 H new ATOM 0 HA LYS A 183 5.432 3.165 8.965 1.00 0.00 H new ATOM 0 HB2 LYS A 183 2.989 1.972 7.633 1.00 0.00 H new ATOM 0 HB3 LYS A 183 3.817 1.100 8.909 1.00 0.00 H new ATOM 0 HG2 LYS A 183 2.271 3.679 9.069 1.00 0.00 H new ATOM 0 HG3 LYS A 183 2.110 2.231 10.043 1.00 0.00 H new ATOM 0 HD2 LYS A 183 4.356 4.273 10.166 1.00 0.00 H new ATOM 0 HD3 LYS A 183 3.133 3.976 11.385 1.00 0.00 H new ATOM 0 HE2 LYS A 183 4.018 1.676 11.720 1.00 0.00 H new ATOM 0 HE3 LYS A 183 5.233 1.961 10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 6.129 2.291 12.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 6.143 3.757 11.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 4.966 3.482 13.036 1.00 0.00 H new ATOM 906 N MET A 184 5.546 1.177 6.307 1.00 0.00 N ATOM 907 CA MET A 184 6.375 0.153 5.672 1.00 0.00 C ATOM 908 C MET A 184 7.769 0.687 5.329 1.00 0.00 C ATOM 909 O MET A 184 8.658 -0.085 4.968 1.00 0.00 O ATOM 910 CB MET A 184 5.700 -0.411 4.416 1.00 0.00 C ATOM 911 CG MET A 184 5.137 0.642 3.478 1.00 0.00 C ATOM 912 SD MET A 184 5.427 0.247 1.744 1.00 0.00 S ATOM 913 CE MET A 184 4.968 -1.482 1.715 1.00 0.00 C ATOM 0 H MET A 184 4.730 1.464 5.766 1.00 0.00 H new ATOM 0 HA MET A 184 6.490 -0.655 6.394 1.00 0.00 H new ATOM 0 HB2 MET A 184 6.424 -1.016 3.870 1.00 0.00 H new ATOM 0 HB3 MET A 184 4.893 -1.077 4.721 1.00 0.00 H new ATOM 0 HG2 MET A 184 4.065 0.742 3.650 1.00 0.00 H new ATOM 0 HG3 MET A 184 5.588 1.607 3.708 1.00 0.00 H new ATOM 0 HE1 MET A 184 5.855 -2.091 1.539 1.00 0.00 H new ATOM 0 HE2 MET A 184 4.524 -1.757 2.672 1.00 0.00 H new ATOM 0 HE3 MET A 184 4.246 -1.653 0.917 1.00 0.00 H new ATOM 923 N LYS A 185 7.961 2.006 5.458 1.00 0.00 N ATOM 924 CA LYS A 185 9.250 2.646 5.179 1.00 0.00 C ATOM 925 C LYS A 185 9.407 2.976 3.700 1.00 0.00 C ATOM 926 O LYS A 185 10.524 3.038 3.187 1.00 0.00 O ATOM 927 CB LYS A 185 10.419 1.771 5.646 1.00 0.00 C ATOM 928 CG LYS A 185 10.191 1.127 7.004 1.00 0.00 C ATOM 929 CD LYS A 185 10.562 -0.347 6.991 1.00 0.00 C ATOM 930 CE LYS A 185 11.570 -0.677 8.080 1.00 0.00 C ATOM 931 NZ LYS A 185 10.956 -1.463 9.185 1.00 0.00 N ATOM 0 H LYS A 185 7.232 2.654 5.757 1.00 0.00 H new ATOM 0 HA LYS A 185 9.266 3.580 5.741 1.00 0.00 H new ATOM 0 HB2 LYS A 185 10.595 0.989 4.907 1.00 0.00 H new ATOM 0 HB3 LYS A 185 11.323 2.379 5.688 1.00 0.00 H new ATOM 0 HG2 LYS A 185 10.783 1.646 7.758 1.00 0.00 H new ATOM 0 HG3 LYS A 185 9.145 1.237 7.289 1.00 0.00 H new ATOM 0 HD2 LYS A 185 9.665 -0.950 7.129 1.00 0.00 H new ATOM 0 HD3 LYS A 185 10.977 -0.610 6.018 1.00 0.00 H new ATOM 0 HE2 LYS A 185 12.398 -1.241 7.650 1.00 0.00 H new ATOM 0 HE3 LYS A 185 11.988 0.247 8.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 11.467 -1.274 10.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 9.959 -1.187 9.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 11.012 -2.477 8.962 1.00 0.00 H new ATOM 945 N ALA A 186 8.289 3.202 3.019 1.00 0.00 N ATOM 946 CA ALA A 186 8.327 3.542 1.603 1.00 0.00 C ATOM 947 C ALA A 186 8.679 5.012 1.408 1.00 0.00 C ATOM 948 O ALA A 186 9.198 5.665 2.314 1.00 0.00 O ATOM 949 CB ALA A 186 6.996 3.232 0.938 1.00 0.00 C ATOM 0 H ALA A 186 7.353 3.156 3.421 1.00 0.00 H new ATOM 0 HA ALA A 186 9.101 2.934 1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 186 7.048 3.494 -0.119 1.00 0.00 H new ATOM 0 HB2 ALA A 186 6.778 2.169 1.038 1.00 0.00 H new ATOM 0 HB3 ALA A 186 6.206 3.811 1.417 1.00 0.00 H new ATOM 955 N LYS A 187 8.387 5.524 0.221 1.00 0.00 N ATOM 956 CA LYS A 187 8.662 6.915 -0.106 1.00 0.00 C ATOM 957 C LYS A 187 7.501 7.515 -0.889 1.00 0.00 C ATOM 958 O LYS A 187 7.054 8.628 -0.610 1.00 0.00 O ATOM 959 CB LYS A 187 9.956 7.019 -0.916 1.00 0.00 C ATOM 960 CG LYS A 187 10.889 8.110 -0.424 1.00 0.00 C ATOM 961 CD LYS A 187 10.190 9.459 -0.372 1.00 0.00 C ATOM 962 CE LYS A 187 10.429 10.260 -1.641 1.00 0.00 C ATOM 963 NZ LYS A 187 11.518 11.262 -1.470 1.00 0.00 N ATOM 0 H LYS A 187 7.957 4.993 -0.536 1.00 0.00 H new ATOM 0 HA LYS A 187 8.781 7.475 0.822 1.00 0.00 H new ATOM 0 HB2 LYS A 187 10.477 6.062 -0.879 1.00 0.00 H new ATOM 0 HB3 LYS A 187 9.708 7.207 -1.961 1.00 0.00 H new ATOM 0 HG2 LYS A 187 11.260 7.853 0.568 1.00 0.00 H new ATOM 0 HG3 LYS A 187 11.756 8.173 -1.082 1.00 0.00 H new ATOM 0 HD2 LYS A 187 9.119 9.310 -0.231 1.00 0.00 H new ATOM 0 HD3 LYS A 187 10.549 10.023 0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 187 10.684 9.582 -2.455 1.00 0.00 H new ATOM 0 HE3 LYS A 187 9.509 10.769 -1.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 187 11.649 11.787 -2.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 187 11.264 11.925 -0.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 187 12.403 10.774 -1.222 1.00 0.00 H new ATOM 977 N SER A 188 7.013 6.759 -1.865 1.00 0.00 N ATOM 978 CA SER A 188 5.896 7.189 -2.694 1.00 0.00 C ATOM 979 C SER A 188 5.210 5.980 -3.313 1.00 0.00 C ATOM 980 O SER A 188 5.643 4.845 -3.114 1.00 0.00 O ATOM 981 CB SER A 188 6.377 8.143 -3.789 1.00 0.00 C ATOM 982 OG SER A 188 5.332 9.001 -4.215 1.00 0.00 O ATOM 0 H SER A 188 7.378 5.837 -2.102 1.00 0.00 H new ATOM 0 HA SER A 188 5.180 7.719 -2.066 1.00 0.00 H new ATOM 0 HB2 SER A 188 7.211 8.738 -3.416 1.00 0.00 H new ATOM 0 HB3 SER A 188 6.749 7.569 -4.638 1.00 0.00 H new ATOM 0 HG SER A 188 5.666 9.602 -4.914 1.00 0.00 H new ATOM 988 N LEU A 189 4.143 6.220 -4.065 1.00 0.00 N ATOM 989 CA LEU A 189 3.414 5.134 -4.706 1.00 0.00 C ATOM 990 C LEU A 189 4.378 4.234 -5.473 1.00 0.00 C ATOM 991 O LEU A 189 4.498 3.045 -5.180 1.00 0.00 O ATOM 992 CB LEU A 189 2.339 5.688 -5.645 1.00 0.00 C ATOM 993 CG LEU A 189 0.916 5.668 -5.082 1.00 0.00 C ATOM 994 CD1 LEU A 189 0.507 4.250 -4.715 1.00 0.00 C ATOM 995 CD2 LEU A 189 0.808 6.586 -3.873 1.00 0.00 C ATOM 0 H LEU A 189 3.766 7.150 -4.245 1.00 0.00 H new ATOM 0 HA LEU A 189 2.922 4.543 -3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 189 2.597 6.715 -5.903 1.00 0.00 H new ATOM 0 HB3 LEU A 189 2.355 5.113 -6.571 1.00 0.00 H new ATOM 0 HG LEU A 189 0.236 6.032 -5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -0.508 4.256 -4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 189 0.545 3.619 -5.603 1.00 0.00 H new ATOM 0 HD13 LEU A 189 1.190 3.858 -3.962 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -0.211 6.559 -3.486 1.00 0.00 H new ATOM 0 HD22 LEU A 189 1.499 6.252 -3.099 1.00 0.00 H new ATOM 0 HD23 LEU A 189 1.058 7.605 -4.167 1.00 0.00 H new ATOM 1007 N PRO A 190 5.098 4.795 -6.457 1.00 0.00 N ATOM 1008 CA PRO A 190 6.066 4.039 -7.250 1.00 0.00 C ATOM 1009 C PRO A 190 6.946 3.138 -6.388 1.00 0.00 C ATOM 1010 O PRO A 190 7.036 1.934 -6.625 1.00 0.00 O ATOM 1011 CB PRO A 190 6.905 5.137 -7.899 1.00 0.00 C ATOM 1012 CG PRO A 190 5.967 6.282 -8.048 1.00 0.00 C ATOM 1013 CD PRO A 190 5.038 6.214 -6.865 1.00 0.00 C ATOM 0 HA PRO A 190 5.583 3.367 -7.960 1.00 0.00 H new ATOM 0 HB2 PRO A 190 7.760 5.403 -7.278 1.00 0.00 H new ATOM 0 HB3 PRO A 190 7.299 4.818 -8.864 1.00 0.00 H new ATOM 0 HG2 PRO A 190 6.507 7.229 -8.066 1.00 0.00 H new ATOM 0 HG3 PRO A 190 5.413 6.213 -8.984 1.00 0.00 H new ATOM 0 HD2 PRO A 190 5.362 6.876 -6.062 1.00 0.00 H new ATOM 0 HD3 PRO A 190 4.024 6.511 -7.134 1.00 0.00 H new ATOM 1021 N HIS A 191 7.598 3.729 -5.390 1.00 0.00 N ATOM 1022 CA HIS A 191 8.475 2.975 -4.499 1.00 0.00 C ATOM 1023 C HIS A 191 7.693 1.967 -3.671 1.00 0.00 C ATOM 1024 O HIS A 191 7.813 0.760 -3.876 1.00 0.00 O ATOM 1025 CB HIS A 191 9.249 3.913 -3.573 1.00 0.00 C ATOM 1026 CG HIS A 191 10.206 3.192 -2.676 1.00 0.00 C ATOM 1027 ND1 HIS A 191 10.202 3.325 -1.304 1.00 0.00 N ATOM 1028 CD2 HIS A 191 11.196 2.314 -2.962 1.00 0.00 C ATOM 1029 CE1 HIS A 191 11.147 2.562 -0.786 1.00 0.00 C ATOM 1030 NE2 HIS A 191 11.765 1.938 -1.771 1.00 0.00 N ATOM 0 H HIS A 191 7.536 4.725 -5.178 1.00 0.00 H new ATOM 0 HA HIS A 191 9.182 2.432 -5.126 1.00 0.00 H new ATOM 0 HB2 HIS A 191 9.799 4.636 -4.175 1.00 0.00 H new ATOM 0 HB3 HIS A 191 8.543 4.477 -2.963 1.00 0.00 H new ATOM 0 HD2 HIS A 191 11.485 1.973 -3.945 1.00 0.00 H new ATOM 0 HE1 HIS A 191 11.375 2.465 0.265 1.00 0.00 H new ATOM 0 HE2 HIS A 191 12.540 1.283 -1.665 1.00 0.00 H new ATOM 1039 N LEU A 192 6.891 2.466 -2.730 1.00 0.00 N ATOM 1040 CA LEU A 192 6.091 1.603 -1.865 1.00 0.00 C ATOM 1041 C LEU A 192 5.448 0.469 -2.671 1.00 0.00 C ATOM 1042 O LEU A 192 5.486 -0.695 -2.272 1.00 0.00 O ATOM 1043 CB LEU A 192 5.041 2.446 -1.116 1.00 0.00 C ATOM 1044 CG LEU A 192 3.612 2.399 -1.662 1.00 0.00 C ATOM 1045 CD1 LEU A 192 2.897 1.172 -1.131 1.00 0.00 C ATOM 1046 CD2 LEU A 192 2.853 3.662 -1.295 1.00 0.00 C ATOM 0 H LEU A 192 6.779 3.463 -2.548 1.00 0.00 H new ATOM 0 HA LEU A 192 6.740 1.136 -1.124 1.00 0.00 H new ATOM 0 HB2 LEU A 192 5.020 2.120 -0.076 1.00 0.00 H new ATOM 0 HB3 LEU A 192 5.373 3.484 -1.117 1.00 0.00 H new ATOM 0 HG LEU A 192 3.655 2.338 -2.749 1.00 0.00 H new ATOM 0 HD11 LEU A 192 1.881 1.145 -1.524 1.00 0.00 H new ATOM 0 HD12 LEU A 192 3.431 0.275 -1.445 1.00 0.00 H new ATOM 0 HD13 LEU A 192 2.864 1.213 -0.042 1.00 0.00 H new ATOM 0 HD21 LEU A 192 1.840 3.606 -1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 192 2.811 3.759 -0.210 1.00 0.00 H new ATOM 0 HD23 LEU A 192 3.362 4.528 -1.718 1.00 0.00 H new ATOM 1058 N VAL A 193 4.881 0.826 -3.817 1.00 0.00 N ATOM 1059 CA VAL A 193 4.249 -0.141 -4.703 1.00 0.00 C ATOM 1060 C VAL A 193 5.265 -1.181 -5.169 1.00 0.00 C ATOM 1061 O VAL A 193 5.043 -2.382 -5.036 1.00 0.00 O ATOM 1062 CB VAL A 193 3.627 0.555 -5.936 1.00 0.00 C ATOM 1063 CG1 VAL A 193 3.217 -0.460 -6.997 1.00 0.00 C ATOM 1064 CG2 VAL A 193 2.438 1.404 -5.523 1.00 0.00 C ATOM 0 H VAL A 193 4.847 1.787 -4.156 1.00 0.00 H new ATOM 0 HA VAL A 193 3.456 -0.634 -4.141 1.00 0.00 H new ATOM 0 HB VAL A 193 4.386 1.205 -6.372 1.00 0.00 H new ATOM 0 HG11 VAL A 193 2.783 0.061 -7.851 1.00 0.00 H new ATOM 0 HG12 VAL A 193 4.093 -1.021 -7.321 1.00 0.00 H new ATOM 0 HG13 VAL A 193 2.481 -1.146 -6.579 1.00 0.00 H new ATOM 0 HG21 VAL A 193 2.012 1.887 -6.403 1.00 0.00 H new ATOM 0 HG22 VAL A 193 1.684 0.771 -5.056 1.00 0.00 H new ATOM 0 HG23 VAL A 193 2.763 2.165 -4.813 1.00 0.00 H new ATOM 1074 N ARG A 194 6.380 -0.707 -5.718 1.00 0.00 N ATOM 1075 CA ARG A 194 7.427 -1.601 -6.204 1.00 0.00 C ATOM 1076 C ARG A 194 7.780 -2.631 -5.146 1.00 0.00 C ATOM 1077 O ARG A 194 7.869 -3.822 -5.436 1.00 0.00 O ATOM 1078 CB ARG A 194 8.668 -0.806 -6.610 1.00 0.00 C ATOM 1079 CG ARG A 194 8.577 -0.204 -8.003 1.00 0.00 C ATOM 1080 CD ARG A 194 9.801 0.635 -8.327 1.00 0.00 C ATOM 1081 NE ARG A 194 9.540 1.600 -9.391 1.00 0.00 N ATOM 1082 CZ ARG A 194 10.496 2.192 -10.100 1.00 0.00 C ATOM 1083 NH1 ARG A 194 11.771 1.917 -9.857 1.00 0.00 N ATOM 1084 NH2 ARG A 194 10.179 3.058 -11.053 1.00 0.00 N ATOM 0 H ARG A 194 6.581 0.286 -5.837 1.00 0.00 H new ATOM 0 HA ARG A 194 7.050 -2.123 -7.083 1.00 0.00 H new ATOM 0 HB2 ARG A 194 8.829 -0.006 -5.887 1.00 0.00 H new ATOM 0 HB3 ARG A 194 9.539 -1.459 -6.562 1.00 0.00 H new ATOM 0 HG2 ARG A 194 8.476 -1.001 -8.739 1.00 0.00 H new ATOM 0 HG3 ARG A 194 7.682 0.413 -8.076 1.00 0.00 H new ATOM 0 HD2 ARG A 194 10.125 1.164 -7.431 1.00 0.00 H new ATOM 0 HD3 ARG A 194 10.620 -0.020 -8.625 1.00 0.00 H new ATOM 0 HE ARG A 194 8.570 1.833 -9.602 1.00 0.00 H new ATOM 0 HH11 ARG A 194 12.019 1.251 -9.125 1.00 0.00 H new ATOM 0 HH12 ARG A 194 12.504 2.372 -10.402 1.00 0.00 H new ATOM 0 HH21 ARG A 194 9.200 3.271 -11.243 1.00 0.00 H new ATOM 0 HH22 ARG A 194 10.914 3.511 -11.596 1.00 0.00 H new ATOM 1098 N MET A 195 7.948 -2.175 -3.913 1.00 0.00 N ATOM 1099 CA MET A 195 8.248 -3.083 -2.822 1.00 0.00 C ATOM 1100 C MET A 195 7.074 -4.037 -2.643 1.00 0.00 C ATOM 1101 O MET A 195 7.242 -5.190 -2.244 1.00 0.00 O ATOM 1102 CB MET A 195 8.518 -2.307 -1.531 1.00 0.00 C ATOM 1103 CG MET A 195 9.383 -1.078 -1.736 1.00 0.00 C ATOM 1104 SD MET A 195 9.873 -0.309 -0.182 1.00 0.00 S ATOM 1105 CE MET A 195 8.269 0.046 0.529 1.00 0.00 C ATOM 0 H MET A 195 7.882 -1.192 -3.647 1.00 0.00 H new ATOM 0 HA MET A 195 9.148 -3.652 -3.057 1.00 0.00 H new ATOM 0 HB2 MET A 195 7.567 -2.004 -1.093 1.00 0.00 H new ATOM 0 HB3 MET A 195 9.004 -2.968 -0.813 1.00 0.00 H new ATOM 0 HG2 MET A 195 10.275 -1.356 -2.297 1.00 0.00 H new ATOM 0 HG3 MET A 195 8.839 -0.352 -2.341 1.00 0.00 H new ATOM 0 HE1 MET A 195 8.395 0.650 1.427 1.00 0.00 H new ATOM 0 HE2 MET A 195 7.663 0.592 -0.194 1.00 0.00 H new ATOM 0 HE3 MET A 195 7.771 -0.888 0.787 1.00 0.00 H new ATOM 1115 N ALA A 196 5.882 -3.541 -2.972 1.00 0.00 N ATOM 1116 CA ALA A 196 4.662 -4.327 -2.887 1.00 0.00 C ATOM 1117 C ALA A 196 4.711 -5.478 -3.881 1.00 0.00 C ATOM 1118 O ALA A 196 4.331 -6.605 -3.565 1.00 0.00 O ATOM 1119 CB ALA A 196 3.456 -3.440 -3.159 1.00 0.00 C ATOM 0 H ALA A 196 5.740 -2.587 -3.303 1.00 0.00 H new ATOM 0 HA ALA A 196 4.573 -4.741 -1.883 1.00 0.00 H new ATOM 0 HB1 ALA A 196 2.545 -4.035 -3.094 1.00 0.00 H new ATOM 0 HB2 ALA A 196 3.420 -2.639 -2.421 1.00 0.00 H new ATOM 0 HB3 ALA A 196 3.538 -3.010 -4.157 1.00 0.00 H new ATOM 1125 N LEU A 197 5.211 -5.187 -5.078 1.00 0.00 N ATOM 1126 CA LEU A 197 5.344 -6.206 -6.114 1.00 0.00 C ATOM 1127 C LEU A 197 6.598 -7.013 -5.854 1.00 0.00 C ATOM 1128 O LEU A 197 6.636 -8.221 -6.086 1.00 0.00 O ATOM 1129 CB LEU A 197 5.396 -5.609 -7.525 1.00 0.00 C ATOM 1130 CG LEU A 197 5.126 -4.119 -7.612 1.00 0.00 C ATOM 1131 CD1 LEU A 197 5.326 -3.618 -9.034 1.00 0.00 C ATOM 1132 CD2 LEU A 197 3.721 -3.811 -7.120 1.00 0.00 C ATOM 0 H LEU A 197 5.530 -4.258 -5.354 1.00 0.00 H new ATOM 0 HA LEU A 197 4.460 -6.842 -6.070 1.00 0.00 H new ATOM 0 HB2 LEU A 197 6.380 -5.808 -7.949 1.00 0.00 H new ATOM 0 HB3 LEU A 197 4.669 -6.130 -8.148 1.00 0.00 H new ATOM 0 HG LEU A 197 5.837 -3.598 -6.971 1.00 0.00 H new ATOM 0 HD11 LEU A 197 5.127 -2.547 -9.074 1.00 0.00 H new ATOM 0 HD12 LEU A 197 6.353 -3.808 -9.346 1.00 0.00 H new ATOM 0 HD13 LEU A 197 4.641 -4.139 -9.703 1.00 0.00 H new ATOM 0 HD21 LEU A 197 3.539 -2.738 -7.187 1.00 0.00 H new ATOM 0 HD22 LEU A 197 2.995 -4.342 -7.736 1.00 0.00 H new ATOM 0 HD23 LEU A 197 3.620 -4.132 -6.083 1.00 0.00 H new ATOM 1144 N ALA A 198 7.621 -6.335 -5.338 1.00 0.00 N ATOM 1145 CA ALA A 198 8.871 -6.994 -5.007 1.00 0.00 C ATOM 1146 C ALA A 198 8.576 -8.201 -4.128 1.00 0.00 C ATOM 1147 O ALA A 198 9.266 -9.218 -4.177 1.00 0.00 O ATOM 1148 CB ALA A 198 9.816 -6.032 -4.299 1.00 0.00 C ATOM 0 H ALA A 198 7.604 -5.334 -5.143 1.00 0.00 H new ATOM 0 HA ALA A 198 9.360 -7.323 -5.924 1.00 0.00 H new ATOM 0 HB1 ALA A 198 10.747 -6.546 -4.060 1.00 0.00 H new ATOM 0 HB2 ALA A 198 10.027 -5.184 -4.950 1.00 0.00 H new ATOM 0 HB3 ALA A 198 9.351 -5.676 -3.379 1.00 0.00 H new ATOM 1154 N GLY A 199 7.508 -8.069 -3.345 1.00 0.00 N ATOM 1155 CA GLY A 199 7.076 -9.144 -2.473 1.00 0.00 C ATOM 1156 C GLY A 199 5.906 -9.906 -3.069 1.00 0.00 C ATOM 1157 O GLY A 199 5.075 -10.456 -2.352 1.00 0.00 O ATOM 0 H GLY A 199 6.931 -7.229 -3.301 1.00 0.00 H new ATOM 0 HA2 GLY A 199 7.906 -9.828 -2.298 1.00 0.00 H new ATOM 0 HA3 GLY A 199 6.790 -8.735 -1.504 1.00 0.00 H new ATOM 1161 N GLY A 200 5.833 -9.921 -4.397 1.00 0.00 N ATOM 1162 CA GLY A 200 4.748 -10.602 -5.084 1.00 0.00 C ATOM 1163 C GLY A 200 3.403 -10.339 -4.441 1.00 0.00 C ATOM 1164 O GLY A 200 2.491 -11.163 -4.519 1.00 0.00 O ATOM 0 H GLY A 200 6.510 -9.471 -5.013 1.00 0.00 H new ATOM 0 HA2 GLY A 200 4.720 -10.278 -6.124 1.00 0.00 H new ATOM 0 HA3 GLY A 200 4.942 -11.675 -5.090 1.00 0.00 H new ATOM 1168 N PHE A 201 3.286 -9.179 -3.804 1.00 0.00 N ATOM 1169 CA PHE A 201 2.047 -8.790 -3.138 1.00 0.00 C ATOM 1170 C PHE A 201 1.038 -8.200 -4.124 1.00 0.00 C ATOM 1171 O PHE A 201 -0.020 -7.717 -3.721 1.00 0.00 O ATOM 1172 CB PHE A 201 2.343 -7.776 -2.032 1.00 0.00 C ATOM 1173 CG PHE A 201 1.362 -7.824 -0.896 1.00 0.00 C ATOM 1174 CD1 PHE A 201 1.423 -8.851 0.055 1.00 0.00 C ATOM 1175 CD2 PHE A 201 0.370 -6.842 -0.770 1.00 0.00 C ATOM 1176 CE1 PHE A 201 0.511 -8.898 1.114 1.00 0.00 C ATOM 1177 CE2 PHE A 201 -0.546 -6.883 0.287 1.00 0.00 C ATOM 1178 CZ PHE A 201 -0.475 -7.913 1.229 1.00 0.00 C ATOM 0 H PHE A 201 4.035 -8.490 -3.734 1.00 0.00 H new ATOM 0 HA PHE A 201 1.608 -9.688 -2.704 1.00 0.00 H new ATOM 0 HB2 PHE A 201 3.345 -7.956 -1.644 1.00 0.00 H new ATOM 0 HB3 PHE A 201 2.342 -6.773 -2.460 1.00 0.00 H new ATOM 0 HD1 PHE A 201 2.182 -9.614 -0.031 1.00 0.00 H new ATOM 0 HD2 PHE A 201 0.312 -6.045 -1.497 1.00 0.00 H new ATOM 0 HE1 PHE A 201 0.568 -9.694 1.842 1.00 0.00 H new ATOM 0 HE2 PHE A 201 -1.306 -6.121 0.375 1.00 0.00 H new ATOM 0 HZ PHE A 201 -1.181 -7.948 2.045 1.00 0.00 H new