USER MOD reduce.3.24.130724 H: found=0, std=0, add=763, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 623 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 LYS NZ :NH3+ 165:sc= 1.21 (180deg=-0.158) USER MOD Set 1.2: A 183 SER OG : rot 180:sc= 0.0275 USER MOD Set 2.1: A 121 THR OG1 : rot 180:sc= -0.214 USER MOD Set 2.2: A 143 CYS SG : rot -92:sc= 0.365 USER MOD Set 2.3: A 144 SER OG : rot 25:sc= 0.455 USER MOD Set 2.4: A 148 MET CE :methyl -178:sc= -1.98 (180deg=-2.1) USER MOD Set 3.1: A 128 SER OG : rot 108:sc= 1.47 USER MOD Set 3.2: A 136 CYS SG : rot -20:sc= 0.861 USER MOD Set 4.1: A 103 TYR OH : rot 30:sc= 0.704 USER MOD Set 4.2: A 169 LYS NZ :NH3+ 173:sc= 1.31 (180deg=0.365) USER MOD Single : A 108 LYS NZ :NH3+ 167:sc= -0.0309 (180deg=-0.239) USER MOD Single : A 111 GLN : amide:sc= -1.79! C(o=-1.8!,f=-5!) USER MOD Single : A 115 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.11) USER MOD Single : A 116 THR OG1 : rot -82:sc= 0.377 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 130 CYS SG : rot 111:sc= -0.494 USER MOD Single : A 133 ASN : amide:sc= 0.924 K(o=0.92,f=0) USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 141 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 145 THR OG1 : rot 180:sc= -4.61! USER MOD Single : A 146 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0175) USER MOD Single : A 149 MET CE :methyl 166:sc= -0.013 (180deg=-0.349) USER MOD Single : A 154 LYS NZ :NH3+ 165:sc= 1.26 (180deg=1.08) USER MOD Single : A 158 CYS SG : rot -110:sc= -5.21! USER MOD Single : A 162 SER OG : rot 108:sc= -0.264 USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 ASN : amide:sc= -3.25! K(o=-3.3!,f=-0.084) USER MOD Single : A 177 LYS NZ :NH3+ 170:sc= -1.79! (180deg=-1.84!) USER MOD Single : A 180 ASN : amide:sc= -0.258 K(o=-0.26,f=-9.1!) USER MOD Single : A 181 LYS NZ :NH3+ 161:sc= -0.0856 (180deg=-0.466) USER MOD ----------------------------------------------------------------- ATOM 86 N LEU A 100 -12.303 10.717 -0.011 1.00 0.00 N ATOM 87 CA LEU A 100 -10.864 10.710 0.207 1.00 0.00 C ATOM 88 C LEU A 100 -10.590 10.387 1.676 1.00 0.00 C ATOM 89 O LEU A 100 -9.587 9.752 2.027 1.00 0.00 O ATOM 90 CB LEU A 100 -10.291 12.096 -0.142 1.00 0.00 C ATOM 91 CG LEU A 100 -8.989 12.139 -0.933 1.00 0.00 C ATOM 92 CD1 LEU A 100 -7.944 11.267 -0.300 1.00 0.00 C ATOM 93 CD2 LEU A 100 -9.257 11.740 -2.360 1.00 0.00 C ATOM 0 HA LEU A 100 -10.391 9.959 -0.426 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.047 12.640 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -10.137 12.641 0.789 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.598 13.156 -0.925 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.026 11.317 -0.885 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -7.747 11.613 0.715 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.299 10.237 -0.269 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.327 11.770 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -9.664 10.729 -2.385 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -9.974 12.431 -2.802 1.00 0.00 H new ATOM 104 N GLU A 101 -11.494 10.835 2.531 1.00 0.00 N ATOM 105 CA GLU A 101 -11.465 10.467 3.935 1.00 0.00 C ATOM 106 C GLU A 101 -11.577 8.953 4.073 1.00 0.00 C ATOM 107 O GLU A 101 -10.956 8.346 4.948 1.00 0.00 O ATOM 108 CB GLU A 101 -12.589 11.167 4.681 1.00 0.00 C ATOM 109 CG GLU A 101 -12.342 12.655 4.885 1.00 0.00 C ATOM 110 CD GLU A 101 -13.415 13.328 5.717 1.00 0.00 C ATOM 111 OE1 GLU A 101 -13.565 12.971 6.905 1.00 0.00 O ATOM 112 OE2 GLU A 101 -14.095 14.240 5.196 1.00 0.00 O ATOM 0 H GLU A 101 -12.260 11.457 2.275 1.00 0.00 H new ATOM 0 HA GLU A 101 -10.519 10.784 4.373 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -13.520 11.033 4.130 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.722 10.691 5.653 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -11.375 12.794 5.369 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -12.285 13.144 3.913 1.00 0.00 H new ATOM 117 N GLU A 102 -12.359 8.348 3.184 1.00 0.00 N ATOM 118 CA GLU A 102 -12.470 6.901 3.121 1.00 0.00 C ATOM 119 C GLU A 102 -11.201 6.276 2.568 1.00 0.00 C ATOM 120 O GLU A 102 -10.957 5.110 2.792 1.00 0.00 O ATOM 121 CB GLU A 102 -13.618 6.459 2.238 1.00 0.00 C ATOM 122 CG GLU A 102 -14.991 6.794 2.771 1.00 0.00 C ATOM 123 CD GLU A 102 -16.062 6.590 1.722 1.00 0.00 C ATOM 124 OE1 GLU A 102 -15.718 6.190 0.590 1.00 0.00 O ATOM 125 OE2 GLU A 102 -17.253 6.830 2.014 1.00 0.00 O ATOM 0 H GLU A 102 -12.926 8.843 2.496 1.00 0.00 H new ATOM 0 HA GLU A 102 -12.644 6.569 4.145 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.502 6.920 1.257 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -13.553 5.381 2.093 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -15.207 6.170 3.638 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -15.007 7.829 3.111 1.00 0.00 H new ATOM 130 N TYR A 103 -10.423 7.030 1.801 1.00 0.00 N ATOM 131 CA TYR A 103 -9.139 6.529 1.309 1.00 0.00 C ATOM 132 C TYR A 103 -8.267 6.139 2.492 1.00 0.00 C ATOM 133 O TYR A 103 -7.716 5.041 2.551 1.00 0.00 O ATOM 134 CB TYR A 103 -8.420 7.583 0.468 1.00 0.00 C ATOM 135 CG TYR A 103 -8.969 7.702 -0.928 1.00 0.00 C ATOM 136 CD1 TYR A 103 -10.149 7.081 -1.260 1.00 0.00 C ATOM 137 CD2 TYR A 103 -8.300 8.408 -1.913 1.00 0.00 C ATOM 138 CE1 TYR A 103 -10.663 7.150 -2.521 1.00 0.00 C ATOM 139 CE2 TYR A 103 -8.808 8.492 -3.190 1.00 0.00 C ATOM 140 CZ TYR A 103 -9.993 7.861 -3.490 1.00 0.00 C ATOM 141 OH TYR A 103 -10.498 7.936 -4.763 1.00 0.00 O ATOM 0 H TYR A 103 -10.652 7.980 1.507 1.00 0.00 H new ATOM 0 HA TYR A 103 -9.326 5.660 0.678 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -8.497 8.550 0.965 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -7.360 7.335 0.415 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -10.682 6.525 -0.504 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -7.368 8.899 -1.677 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -11.590 6.650 -2.758 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -8.280 9.049 -3.950 1.00 0.00 H new ATOM 0 HH TYR A 103 -11.476 7.880 -4.731 1.00 0.00 H new ATOM 150 N ARG A 104 -8.166 7.064 3.437 1.00 0.00 N ATOM 151 CA ARG A 104 -7.453 6.815 4.692 1.00 0.00 C ATOM 152 C ARG A 104 -8.157 5.740 5.528 1.00 0.00 C ATOM 153 O ARG A 104 -7.509 4.882 6.133 1.00 0.00 O ATOM 154 CB ARG A 104 -7.332 8.096 5.529 1.00 0.00 C ATOM 155 CG ARG A 104 -6.241 9.053 5.070 1.00 0.00 C ATOM 156 CD ARG A 104 -6.653 9.860 3.851 1.00 0.00 C ATOM 157 NE ARG A 104 -5.573 10.738 3.405 1.00 0.00 N ATOM 158 CZ ARG A 104 -5.751 11.890 2.761 1.00 0.00 C ATOM 159 NH1 ARG A 104 -6.974 12.356 2.544 1.00 0.00 N ATOM 160 NH2 ARG A 104 -4.696 12.592 2.365 1.00 0.00 N ATOM 0 H ARG A 104 -8.569 7.998 3.362 1.00 0.00 H new ATOM 0 HA ARG A 104 -6.456 6.466 4.423 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -8.288 8.619 5.508 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -7.142 7.820 6.566 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -5.991 9.733 5.885 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -5.339 8.487 4.839 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -6.933 9.184 3.043 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -7.535 10.456 4.088 1.00 0.00 H new ATOM 0 HE ARG A 104 -4.615 10.448 3.601 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -7.785 11.831 2.871 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -7.103 13.239 2.050 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -3.754 12.248 2.554 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -4.827 13.475 1.871 1.00 0.00 H new ATOM 171 N LEU A 105 -9.486 5.787 5.544 1.00 0.00 N ATOM 172 CA LEU A 105 -10.296 4.904 6.376 1.00 0.00 C ATOM 173 C LEU A 105 -10.151 3.459 5.909 1.00 0.00 C ATOM 174 O LEU A 105 -9.965 2.538 6.702 1.00 0.00 O ATOM 175 CB LEU A 105 -11.745 5.378 6.264 1.00 0.00 C ATOM 176 CG LEU A 105 -12.785 4.689 7.139 1.00 0.00 C ATOM 177 CD1 LEU A 105 -13.917 5.652 7.416 1.00 0.00 C ATOM 178 CD2 LEU A 105 -13.322 3.453 6.451 1.00 0.00 C ATOM 0 H LEU A 105 -10.032 6.439 4.980 1.00 0.00 H new ATOM 0 HA LEU A 105 -9.970 4.939 7.416 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -11.768 6.444 6.492 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -12.055 5.268 5.225 1.00 0.00 H new ATOM 0 HG LEU A 105 -12.318 4.387 8.077 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -14.665 5.164 8.042 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -13.529 6.531 7.932 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -14.375 5.956 6.475 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -14.063 2.974 7.090 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -13.786 3.735 5.506 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -12.504 2.758 6.260 1.00 0.00 H new ATOM 189 N LEU A 106 -10.223 3.305 4.604 1.00 0.00 N ATOM 190 CA LEU A 106 -10.120 2.030 3.922 1.00 0.00 C ATOM 191 C LEU A 106 -8.777 1.374 4.210 1.00 0.00 C ATOM 192 O LEU A 106 -8.690 0.160 4.395 1.00 0.00 O ATOM 193 CB LEU A 106 -10.282 2.293 2.432 1.00 0.00 C ATOM 194 CG LEU A 106 -10.327 1.087 1.520 1.00 0.00 C ATOM 195 CD1 LEU A 106 -11.469 0.206 1.918 1.00 0.00 C ATOM 196 CD2 LEU A 106 -10.458 1.525 0.081 1.00 0.00 C ATOM 0 H LEU A 106 -10.359 4.089 3.966 1.00 0.00 H new ATOM 0 HA LEU A 106 -10.894 1.348 4.273 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -11.201 2.861 2.287 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -9.459 2.930 2.110 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.399 0.523 1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -11.503 -0.664 1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.334 -0.122 2.949 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.403 0.761 1.834 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.489 0.648 -0.565 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -11.376 2.099 -0.042 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -9.603 2.145 -0.190 1.00 0.00 H new ATOM 207 N LEU A 107 -7.743 2.203 4.243 1.00 0.00 N ATOM 208 CA LEU A 107 -6.386 1.767 4.585 1.00 0.00 C ATOM 209 C LEU A 107 -6.389 1.056 5.924 1.00 0.00 C ATOM 210 O LEU A 107 -5.867 -0.050 6.058 1.00 0.00 O ATOM 211 CB LEU A 107 -5.439 2.963 4.655 1.00 0.00 C ATOM 212 CG LEU A 107 -4.191 2.845 3.796 1.00 0.00 C ATOM 213 CD1 LEU A 107 -3.392 1.612 4.162 1.00 0.00 C ATOM 214 CD2 LEU A 107 -4.577 2.807 2.342 1.00 0.00 C ATOM 0 H LEU A 107 -7.816 3.199 4.034 1.00 0.00 H new ATOM 0 HA LEU A 107 -6.042 1.084 3.808 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.985 3.858 4.355 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.136 3.107 5.692 1.00 0.00 H new ATOM 0 HG LEU A 107 -3.562 3.716 3.978 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -2.505 1.553 3.532 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -3.091 1.671 5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -4.005 0.723 4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -3.679 2.722 1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.223 1.948 2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -5.108 3.723 2.083 1.00 0.00 H new ATOM 225 N LYS A 108 -6.992 1.702 6.906 1.00 0.00 N ATOM 226 CA LYS A 108 -7.127 1.132 8.235 1.00 0.00 C ATOM 227 C LYS A 108 -8.021 -0.105 8.194 1.00 0.00 C ATOM 228 O LYS A 108 -7.849 -1.042 8.975 1.00 0.00 O ATOM 229 CB LYS A 108 -7.724 2.166 9.186 1.00 0.00 C ATOM 230 CG LYS A 108 -7.017 3.511 9.151 1.00 0.00 C ATOM 231 CD LYS A 108 -7.683 4.514 10.079 1.00 0.00 C ATOM 232 CE LYS A 108 -7.557 4.107 11.541 1.00 0.00 C ATOM 233 NZ LYS A 108 -6.136 4.027 11.980 1.00 0.00 N ATOM 0 H LYS A 108 -7.400 2.632 6.806 1.00 0.00 H new ATOM 0 HA LYS A 108 -6.139 0.842 8.592 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -8.775 2.312 8.936 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -7.689 1.774 10.202 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -5.974 3.383 9.440 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -7.020 3.898 8.132 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -7.232 5.496 9.936 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -8.737 4.606 9.817 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -8.088 4.826 12.164 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -8.037 3.140 11.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -6.096 3.966 13.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -5.692 3.183 11.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -5.627 4.877 11.663 1.00 0.00 H new ATOM 243 N ARG A 109 -8.984 -0.086 7.284 1.00 0.00 N ATOM 244 CA ARG A 109 -9.992 -1.128 7.199 1.00 0.00 C ATOM 245 C ARG A 109 -9.459 -2.448 6.656 1.00 0.00 C ATOM 246 O ARG A 109 -9.583 -3.478 7.317 1.00 0.00 O ATOM 247 CB ARG A 109 -11.151 -0.652 6.340 1.00 0.00 C ATOM 248 CG ARG A 109 -12.146 0.207 7.084 1.00 0.00 C ATOM 249 CD ARG A 109 -12.856 -0.614 8.125 1.00 0.00 C ATOM 250 NE ARG A 109 -13.721 0.188 8.983 1.00 0.00 N ATOM 251 CZ ARG A 109 -14.672 -0.323 9.760 1.00 0.00 C ATOM 252 NH1 ARG A 109 -14.936 -1.622 9.727 1.00 0.00 N ATOM 253 NH2 ARG A 109 -15.368 0.471 10.564 1.00 0.00 N ATOM 0 H ARG A 109 -9.087 0.651 6.586 1.00 0.00 H new ATOM 0 HA ARG A 109 -10.324 -1.322 8.219 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -10.757 -0.087 5.495 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -11.668 -1.520 5.930 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -11.634 1.045 7.557 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -12.869 0.628 6.386 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -13.452 -1.382 7.632 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -12.118 -1.129 8.740 1.00 0.00 H new ATOM 0 HE ARG A 109 -13.589 1.199 8.987 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -14.409 -2.234 9.104 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -15.666 -2.009 10.325 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -15.173 1.472 10.586 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -16.098 0.080 11.160 1.00 0.00 H new ATOM 264 N LEU A 110 -8.853 -2.445 5.473 1.00 0.00 N ATOM 265 CA LEU A 110 -8.443 -3.716 4.882 1.00 0.00 C ATOM 266 C LEU A 110 -6.996 -4.055 5.176 1.00 0.00 C ATOM 267 O LEU A 110 -6.330 -4.685 4.361 1.00 0.00 O ATOM 268 CB LEU A 110 -8.687 -3.785 3.375 1.00 0.00 C ATOM 269 CG LEU A 110 -10.112 -4.131 2.963 1.00 0.00 C ATOM 270 CD1 LEU A 110 -10.994 -2.927 3.149 1.00 0.00 C ATOM 271 CD2 LEU A 110 -10.152 -4.611 1.527 1.00 0.00 C ATOM 0 H LEU A 110 -8.641 -1.613 4.922 1.00 0.00 H new ATOM 0 HA LEU A 110 -9.080 -4.460 5.361 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.423 -2.823 2.936 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -8.012 -4.527 2.948 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.479 -4.940 3.594 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -12.014 -3.174 2.854 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -10.982 -2.625 4.196 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -10.626 -2.108 2.531 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -11.179 -4.853 1.253 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -9.776 -3.826 0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -9.530 -5.500 1.423 1.00 0.00 H new ATOM 282 N GLN A 111 -6.518 -3.660 6.346 1.00 0.00 N ATOM 283 CA GLN A 111 -5.178 -4.033 6.787 1.00 0.00 C ATOM 284 C GLN A 111 -4.962 -5.559 6.784 1.00 0.00 C ATOM 285 O GLN A 111 -3.911 -6.019 6.347 1.00 0.00 O ATOM 286 CB GLN A 111 -4.880 -3.475 8.179 1.00 0.00 C ATOM 287 CG GLN A 111 -4.750 -1.963 8.220 1.00 0.00 C ATOM 288 CD GLN A 111 -4.344 -1.449 9.586 1.00 0.00 C ATOM 289 OE1 GLN A 111 -4.713 -0.345 9.985 1.00 0.00 O ATOM 290 NE2 GLN A 111 -3.574 -2.242 10.316 1.00 0.00 N ATOM 0 H GLN A 111 -7.035 -3.082 7.008 1.00 0.00 H new ATOM 0 HA GLN A 111 -4.486 -3.595 6.068 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -5.674 -3.780 8.860 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -3.956 -3.920 8.548 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -4.013 -1.646 7.483 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -5.701 -1.513 7.934 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -3.288 -3.151 9.952 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -3.267 -1.944 11.242 1.00 0.00 H new ATOM 297 N PRO A 112 -5.929 -6.382 7.267 1.00 0.00 N ATOM 298 CA PRO A 112 -5.752 -7.837 7.313 1.00 0.00 C ATOM 299 C PRO A 112 -5.671 -8.465 5.922 1.00 0.00 C ATOM 300 O PRO A 112 -4.797 -9.291 5.646 1.00 0.00 O ATOM 301 CB PRO A 112 -6.996 -8.314 8.065 1.00 0.00 C ATOM 302 CG PRO A 112 -8.004 -7.277 7.771 1.00 0.00 C ATOM 303 CD PRO A 112 -7.249 -5.997 7.804 1.00 0.00 C ATOM 0 HA PRO A 112 -4.815 -8.124 7.791 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -7.320 -9.296 7.720 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -6.809 -8.398 9.136 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -8.466 -7.439 6.797 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -8.806 -7.283 8.510 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -7.726 -5.230 7.194 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -7.173 -5.598 8.815 1.00 0.00 H new ATOM 308 N GLU A 113 -6.562 -8.062 5.031 1.00 0.00 N ATOM 309 CA GLU A 113 -6.529 -8.584 3.679 1.00 0.00 C ATOM 310 C GLU A 113 -5.326 -8.023 2.954 1.00 0.00 C ATOM 311 O GLU A 113 -4.791 -8.639 2.048 1.00 0.00 O ATOM 312 CB GLU A 113 -7.818 -8.285 2.931 1.00 0.00 C ATOM 313 CG GLU A 113 -9.017 -8.959 3.562 1.00 0.00 C ATOM 314 CD GLU A 113 -8.804 -10.443 3.791 1.00 0.00 C ATOM 315 OE1 GLU A 113 -8.974 -11.231 2.839 1.00 0.00 O ATOM 316 OE2 GLU A 113 -8.474 -10.830 4.934 1.00 0.00 O ATOM 0 H GLU A 113 -7.304 -7.387 5.216 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.441 -9.669 3.724 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -7.980 -7.207 2.907 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -7.721 -8.615 1.897 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -9.239 -8.477 4.514 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.887 -8.816 2.921 1.00 0.00 H new ATOM 321 N PHE A 114 -4.882 -6.859 3.385 1.00 0.00 N ATOM 322 CA PHE A 114 -3.673 -6.275 2.854 1.00 0.00 C ATOM 323 C PHE A 114 -2.484 -7.128 3.245 1.00 0.00 C ATOM 324 O PHE A 114 -1.703 -7.552 2.402 1.00 0.00 O ATOM 325 CB PHE A 114 -3.483 -4.875 3.409 1.00 0.00 C ATOM 326 CG PHE A 114 -2.505 -4.060 2.634 1.00 0.00 C ATOM 327 CD1 PHE A 114 -1.166 -4.234 2.847 1.00 0.00 C ATOM 328 CD2 PHE A 114 -2.922 -3.135 1.695 1.00 0.00 C ATOM 329 CE1 PHE A 114 -0.232 -3.505 2.141 1.00 0.00 C ATOM 330 CE2 PHE A 114 -1.999 -2.399 0.981 1.00 0.00 C ATOM 331 CZ PHE A 114 -0.652 -2.585 1.204 1.00 0.00 C ATOM 0 H PHE A 114 -5.343 -6.300 4.103 1.00 0.00 H new ATOM 0 HA PHE A 114 -3.753 -6.225 1.768 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -4.445 -4.362 3.419 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.148 -4.945 4.444 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -0.834 -4.954 3.580 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -3.977 -2.988 1.519 1.00 0.00 H new ATOM 0 HE1 PHE A 114 0.822 -3.654 2.321 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -2.332 -1.678 0.249 1.00 0.00 H new ATOM 0 HZ PHE A 114 0.073 -2.011 0.646 1.00 0.00 H new ATOM 340 N LYS A 115 -2.386 -7.421 4.528 1.00 0.00 N ATOM 341 CA LYS A 115 -1.230 -8.112 5.057 1.00 0.00 C ATOM 342 C LYS A 115 -1.148 -9.541 4.517 1.00 0.00 C ATOM 343 O LYS A 115 -0.101 -10.180 4.580 1.00 0.00 O ATOM 344 CB LYS A 115 -1.264 -8.115 6.589 1.00 0.00 C ATOM 345 CG LYS A 115 -2.301 -9.041 7.185 1.00 0.00 C ATOM 346 CD LYS A 115 -2.331 -8.944 8.700 1.00 0.00 C ATOM 347 CE LYS A 115 -1.080 -9.535 9.325 1.00 0.00 C ATOM 348 NZ LYS A 115 -0.992 -9.232 10.775 1.00 0.00 N ATOM 0 H LYS A 115 -3.096 -7.190 5.223 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.337 -7.579 4.730 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -0.281 -8.401 6.962 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.455 -7.101 6.939 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.284 -8.794 6.784 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.086 -10.068 6.890 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.427 -7.899 8.996 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -3.209 -9.465 9.081 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.076 -10.615 9.179 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.199 -9.141 8.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -0.234 -9.801 11.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -0.783 -8.222 10.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.897 -9.461 11.233 1.00 0.00 H new ATOM 358 N THR A 116 -2.260 -10.034 3.987 1.00 0.00 N ATOM 359 CA THR A 116 -2.324 -11.396 3.486 1.00 0.00 C ATOM 360 C THR A 116 -2.264 -11.469 1.957 1.00 0.00 C ATOM 361 O THR A 116 -1.623 -12.356 1.396 1.00 0.00 O ATOM 362 CB THR A 116 -3.599 -12.090 3.997 1.00 0.00 C ATOM 363 OG1 THR A 116 -4.749 -11.293 3.685 1.00 0.00 O ATOM 364 CG2 THR A 116 -3.525 -12.284 5.501 1.00 0.00 C ATOM 0 H THR A 116 -3.129 -9.509 3.894 1.00 0.00 H new ATOM 0 HA THR A 116 -1.444 -11.915 3.865 1.00 0.00 H new ATOM 0 HB THR A 116 -3.682 -13.062 3.510 1.00 0.00 H new ATOM 0 HG1 THR A 116 -4.849 -10.586 4.356 1.00 0.00 H new ATOM 0 HG21 THR A 116 -4.433 -12.776 5.850 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.661 -12.901 5.746 1.00 0.00 H new ATOM 0 HG23 THR A 116 -3.428 -11.314 5.989 1.00 0.00 H new ATOM 372 N ARG A 117 -2.911 -10.529 1.291 1.00 0.00 N ATOM 373 CA ARG A 117 -2.993 -10.534 -0.173 1.00 0.00 C ATOM 374 C ARG A 117 -1.826 -9.796 -0.796 1.00 0.00 C ATOM 375 O ARG A 117 -1.415 -10.083 -1.919 1.00 0.00 O ATOM 376 CB ARG A 117 -4.287 -9.866 -0.637 1.00 0.00 C ATOM 377 CG ARG A 117 -5.538 -10.503 -0.073 1.00 0.00 C ATOM 378 CD ARG A 117 -6.010 -11.665 -0.925 1.00 0.00 C ATOM 379 NE ARG A 117 -5.013 -12.729 -1.019 1.00 0.00 N ATOM 380 CZ ARG A 117 -5.177 -13.952 -0.519 1.00 0.00 C ATOM 381 NH1 ARG A 117 -6.306 -14.282 0.097 1.00 0.00 N ATOM 382 NH2 ARG A 117 -4.205 -14.845 -0.638 1.00 0.00 N ATOM 0 H ARG A 117 -3.391 -9.747 1.736 1.00 0.00 H new ATOM 0 HA ARG A 117 -2.970 -11.576 -0.492 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -4.265 -8.814 -0.351 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -4.332 -9.899 -1.726 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -5.343 -10.851 0.941 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -6.329 -9.756 -0.007 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -6.931 -12.070 -0.504 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -6.248 -11.305 -1.926 1.00 0.00 H new ATOM 0 HE ARG A 117 -4.136 -12.522 -1.498 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -7.056 -13.596 0.190 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -6.424 -15.221 0.477 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -3.337 -14.594 -1.111 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -4.325 -15.783 -0.257 1.00 0.00 H new ATOM 393 N ILE A 118 -1.304 -8.843 -0.062 1.00 0.00 N ATOM 394 CA ILE A 118 -0.307 -7.933 -0.595 1.00 0.00 C ATOM 395 C ILE A 118 1.108 -8.457 -0.449 1.00 0.00 C ATOM 396 O ILE A 118 1.569 -8.763 0.653 1.00 0.00 O ATOM 397 CB ILE A 118 -0.401 -6.554 0.081 1.00 0.00 C ATOM 398 CG1 ILE A 118 -1.669 -5.831 -0.319 1.00 0.00 C ATOM 399 CG2 ILE A 118 0.787 -5.703 -0.240 1.00 0.00 C ATOM 400 CD1 ILE A 118 -2.163 -6.144 -1.716 1.00 0.00 C ATOM 0 H ILE A 118 -1.552 -8.673 0.913 1.00 0.00 H new ATOM 0 HA ILE A 118 -0.525 -7.843 -1.659 1.00 0.00 H new ATOM 0 HB ILE A 118 -0.421 -6.730 1.157 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -2.454 -6.082 0.394 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -1.499 -4.757 -0.241 1.00 0.00 H new ATOM 0 HG21 ILE A 118 0.687 -4.737 0.254 1.00 0.00 H new ATOM 0 HG22 ILE A 118 1.694 -6.197 0.110 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.848 -5.555 -1.318 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -3.075 -5.581 -1.914 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.400 -5.866 -2.443 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -2.370 -7.211 -1.798 1.00 0.00 H new ATOM 411 N ILE A 119 1.774 -8.597 -1.581 1.00 0.00 N ATOM 412 CA ILE A 119 3.202 -8.709 -1.609 1.00 0.00 C ATOM 413 C ILE A 119 3.819 -7.326 -1.773 1.00 0.00 C ATOM 414 O ILE A 119 3.696 -6.697 -2.823 1.00 0.00 O ATOM 415 CB ILE A 119 3.684 -9.644 -2.732 1.00 0.00 C ATOM 416 CG1 ILE A 119 3.431 -11.095 -2.355 1.00 0.00 C ATOM 417 CG2 ILE A 119 5.152 -9.426 -3.013 1.00 0.00 C ATOM 418 CD1 ILE A 119 3.769 -11.395 -0.919 1.00 0.00 C ATOM 0 H ILE A 119 1.332 -8.635 -2.499 1.00 0.00 H new ATOM 0 HA ILE A 119 3.524 -9.146 -0.664 1.00 0.00 H new ATOM 0 HB ILE A 119 3.122 -9.413 -3.637 1.00 0.00 H new ATOM 0 HG12 ILE A 119 2.383 -11.334 -2.534 1.00 0.00 H new ATOM 0 HG13 ILE A 119 4.021 -11.742 -3.005 1.00 0.00 H new ATOM 0 HG21 ILE A 119 5.473 -10.097 -3.810 1.00 0.00 H new ATOM 0 HG22 ILE A 119 5.314 -8.393 -3.321 1.00 0.00 H new ATOM 0 HG23 ILE A 119 5.729 -9.631 -2.112 1.00 0.00 H new ATOM 0 HD11 ILE A 119 3.568 -12.446 -0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 119 4.824 -11.186 -0.742 1.00 0.00 H new ATOM 0 HD13 ILE A 119 3.161 -10.771 -0.264 1.00 0.00 H new ATOM 429 N PRO A 120 4.476 -6.842 -0.714 1.00 0.00 N ATOM 430 CA PRO A 120 5.056 -5.493 -0.657 1.00 0.00 C ATOM 431 C PRO A 120 6.177 -5.253 -1.654 1.00 0.00 C ATOM 432 O PRO A 120 6.709 -4.155 -1.718 1.00 0.00 O ATOM 433 CB PRO A 120 5.577 -5.377 0.775 1.00 0.00 C ATOM 434 CG PRO A 120 5.722 -6.772 1.255 1.00 0.00 C ATOM 435 CD PRO A 120 4.679 -7.577 0.541 1.00 0.00 C ATOM 0 HA PRO A 120 4.308 -4.745 -0.922 1.00 0.00 H new ATOM 0 HB2 PRO A 120 6.531 -4.850 0.805 1.00 0.00 H new ATOM 0 HB3 PRO A 120 4.883 -4.816 1.401 1.00 0.00 H new ATOM 0 HG2 PRO A 120 6.720 -7.154 1.042 1.00 0.00 H new ATOM 0 HG3 PRO A 120 5.583 -6.827 2.335 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.016 -8.598 0.358 1.00 0.00 H new ATOM 0 HD3 PRO A 120 3.758 -7.644 1.120 1.00 0.00 H new ATOM 440 N THR A 121 6.565 -6.267 -2.406 1.00 0.00 N ATOM 441 CA THR A 121 7.511 -6.063 -3.480 1.00 0.00 C ATOM 442 C THR A 121 6.792 -5.769 -4.792 1.00 0.00 C ATOM 443 O THR A 121 7.412 -5.302 -5.747 1.00 0.00 O ATOM 444 CB THR A 121 8.435 -7.272 -3.649 1.00 0.00 C ATOM 445 OG1 THR A 121 7.703 -8.401 -4.124 1.00 0.00 O ATOM 446 CG2 THR A 121 9.076 -7.616 -2.336 1.00 0.00 C ATOM 0 H THR A 121 6.242 -7.228 -2.293 1.00 0.00 H new ATOM 0 HA THR A 121 8.122 -5.200 -3.214 1.00 0.00 H new ATOM 0 HB THR A 121 9.204 -7.015 -4.377 1.00 0.00 H new ATOM 0 HG1 THR A 121 8.309 -9.164 -4.228 1.00 0.00 H new ATOM 0 HG21 THR A 121 9.732 -8.477 -2.466 1.00 0.00 H new ATOM 0 HG22 THR A 121 9.659 -6.766 -1.982 1.00 0.00 H new ATOM 0 HG23 THR A 121 8.303 -7.855 -1.605 1.00 0.00 H new ATOM 454 N ASP A 122 5.485 -6.038 -4.854 1.00 0.00 N ATOM 455 CA ASP A 122 4.743 -5.758 -6.088 1.00 0.00 C ATOM 456 C ASP A 122 4.027 -4.407 -6.021 1.00 0.00 C ATOM 457 O ASP A 122 4.418 -3.475 -6.730 1.00 0.00 O ATOM 458 CB ASP A 122 3.732 -6.861 -6.461 1.00 0.00 C ATOM 459 CG ASP A 122 4.333 -8.250 -6.524 1.00 0.00 C ATOM 460 OD1 ASP A 122 5.286 -8.464 -7.302 1.00 0.00 O ATOM 461 OD2 ASP A 122 3.827 -9.147 -5.823 1.00 0.00 O ATOM 0 H ASP A 122 4.933 -6.435 -4.094 1.00 0.00 H new ATOM 0 HA ASP A 122 5.498 -5.729 -6.874 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.922 -6.859 -5.732 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.290 -6.623 -7.429 1.00 0.00 H new ATOM 465 N ILE A 123 3.018 -4.272 -5.144 1.00 0.00 N ATOM 466 CA ILE A 123 2.185 -3.051 -5.115 1.00 0.00 C ATOM 467 C ILE A 123 3.026 -1.801 -4.853 1.00 0.00 C ATOM 468 O ILE A 123 2.634 -0.683 -5.188 1.00 0.00 O ATOM 469 CB ILE A 123 1.025 -3.080 -4.073 1.00 0.00 C ATOM 470 CG1 ILE A 123 1.543 -2.885 -2.655 1.00 0.00 C ATOM 471 CG2 ILE A 123 0.213 -4.363 -4.156 1.00 0.00 C ATOM 472 CD1 ILE A 123 2.487 -3.967 -2.229 1.00 0.00 C ATOM 0 H ILE A 123 2.760 -4.979 -4.455 1.00 0.00 H new ATOM 0 HA ILE A 123 1.737 -3.018 -6.108 1.00 0.00 H new ATOM 0 HB ILE A 123 0.368 -2.247 -4.323 1.00 0.00 H new ATOM 0 HG12 ILE A 123 2.047 -1.921 -2.586 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.699 -2.853 -1.966 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.583 -4.338 -3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -0.223 -4.454 -5.151 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.862 -5.217 -3.965 1.00 0.00 H new ATOM 0 HD11 ILE A 123 2.824 -3.776 -1.210 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.978 -4.930 -2.268 1.00 0.00 H new ATOM 0 HD13 ILE A 123 3.347 -3.984 -2.898 1.00 0.00 H new ATOM 483 N ILE A 124 4.188 -2.017 -4.258 1.00 0.00 N ATOM 484 CA ILE A 124 5.111 -0.963 -3.900 1.00 0.00 C ATOM 485 C ILE A 124 5.548 -0.168 -5.131 1.00 0.00 C ATOM 486 O ILE A 124 5.920 0.983 -5.019 1.00 0.00 O ATOM 487 CB ILE A 124 6.351 -1.563 -3.198 1.00 0.00 C ATOM 488 CG1 ILE A 124 7.273 -0.474 -2.656 1.00 0.00 C ATOM 489 CG2 ILE A 124 7.105 -2.488 -4.133 1.00 0.00 C ATOM 490 CD1 ILE A 124 6.726 0.204 -1.426 1.00 0.00 C ATOM 0 H ILE A 124 4.518 -2.949 -4.007 1.00 0.00 H new ATOM 0 HA ILE A 124 4.599 -0.283 -3.219 1.00 0.00 H new ATOM 0 HB ILE A 124 5.996 -2.146 -2.349 1.00 0.00 H new ATOM 0 HG12 ILE A 124 8.244 -0.911 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 124 7.439 0.273 -3.432 1.00 0.00 H new ATOM 0 HG21 ILE A 124 7.973 -2.898 -3.617 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.451 -3.302 -4.445 1.00 0.00 H new ATOM 0 HG23 ILE A 124 7.434 -1.930 -5.010 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.427 0.968 -1.089 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.769 0.669 -1.662 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.586 -0.534 -0.636 1.00 0.00 H new ATOM 501 N SER A 125 5.496 -0.791 -6.300 1.00 0.00 N ATOM 502 CA SER A 125 5.887 -0.130 -7.540 1.00 0.00 C ATOM 503 C SER A 125 4.917 0.992 -7.876 1.00 0.00 C ATOM 504 O SER A 125 5.328 2.124 -8.143 1.00 0.00 O ATOM 505 CB SER A 125 5.932 -1.143 -8.686 1.00 0.00 C ATOM 506 OG SER A 125 6.583 -0.609 -9.825 1.00 0.00 O ATOM 0 H SER A 125 5.186 -1.756 -6.417 1.00 0.00 H new ATOM 0 HA SER A 125 6.880 0.298 -7.404 1.00 0.00 H new ATOM 0 HB2 SER A 125 6.451 -2.043 -8.357 1.00 0.00 H new ATOM 0 HB3 SER A 125 4.917 -1.439 -8.951 1.00 0.00 H new ATOM 0 HG SER A 125 6.597 -1.281 -10.539 1.00 0.00 H new ATOM 511 N ASP A 126 3.635 0.672 -7.843 1.00 0.00 N ATOM 512 CA ASP A 126 2.596 1.639 -8.132 1.00 0.00 C ATOM 513 C ASP A 126 2.530 2.640 -6.998 1.00 0.00 C ATOM 514 O ASP A 126 2.479 3.847 -7.216 1.00 0.00 O ATOM 515 CB ASP A 126 1.254 0.926 -8.319 1.00 0.00 C ATOM 516 CG ASP A 126 1.102 0.319 -9.701 1.00 0.00 C ATOM 517 OD1 ASP A 126 2.033 -0.379 -10.160 1.00 0.00 O ATOM 518 OD2 ASP A 126 0.047 0.525 -10.337 1.00 0.00 O ATOM 0 H ASP A 126 3.289 -0.260 -7.616 1.00 0.00 H new ATOM 0 HA ASP A 126 2.823 2.168 -9.058 1.00 0.00 H new ATOM 0 HB2 ASP A 126 1.156 0.141 -7.569 1.00 0.00 H new ATOM 0 HB3 ASP A 126 0.444 1.634 -8.146 1.00 0.00 H new ATOM 522 N LEU A 127 2.587 2.119 -5.781 1.00 0.00 N ATOM 523 CA LEU A 127 2.628 2.950 -4.592 1.00 0.00 C ATOM 524 C LEU A 127 3.816 3.911 -4.630 1.00 0.00 C ATOM 525 O LEU A 127 3.673 5.087 -4.317 1.00 0.00 O ATOM 526 CB LEU A 127 2.699 2.080 -3.336 1.00 0.00 C ATOM 527 CG LEU A 127 3.471 2.707 -2.174 1.00 0.00 C ATOM 528 CD1 LEU A 127 2.815 3.993 -1.708 1.00 0.00 C ATOM 529 CD2 LEU A 127 3.590 1.733 -1.023 1.00 0.00 C ATOM 0 H LEU A 127 2.606 1.117 -5.593 1.00 0.00 H new ATOM 0 HA LEU A 127 1.712 3.540 -4.565 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.684 1.859 -3.005 1.00 0.00 H new ATOM 0 HB3 LEU A 127 3.165 1.129 -3.594 1.00 0.00 H new ATOM 0 HG LEU A 127 4.472 2.947 -2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 127 3.387 4.414 -0.881 1.00 0.00 H new ATOM 0 HD12 LEU A 127 2.788 4.707 -2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.798 3.783 -1.376 1.00 0.00 H new ATOM 0 HD21 LEU A 127 4.143 2.199 -0.207 1.00 0.00 H new ATOM 0 HD22 LEU A 127 2.594 1.457 -0.676 1.00 0.00 H new ATOM 0 HD23 LEU A 127 4.119 0.840 -1.355 1.00 0.00 H new ATOM 540 N SER A 128 4.986 3.402 -4.993 1.00 0.00 N ATOM 541 CA SER A 128 6.213 4.205 -5.037 1.00 0.00 C ATOM 542 C SER A 128 6.057 5.454 -5.909 1.00 0.00 C ATOM 543 O SER A 128 6.892 6.357 -5.858 1.00 0.00 O ATOM 544 CB SER A 128 7.388 3.365 -5.547 1.00 0.00 C ATOM 545 OG SER A 128 8.635 3.988 -5.274 1.00 0.00 O ATOM 0 H SER A 128 5.117 2.428 -5.265 1.00 0.00 H new ATOM 0 HA SER A 128 6.413 4.532 -4.017 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.362 2.381 -5.079 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.286 3.210 -6.621 1.00 0.00 H new ATOM 0 HG SER A 128 9.094 3.502 -4.557 1.00 0.00 H new ATOM 550 N GLU A 129 4.998 5.509 -6.711 1.00 0.00 N ATOM 551 CA GLU A 129 4.717 6.706 -7.492 1.00 0.00 C ATOM 552 C GLU A 129 4.161 7.821 -6.599 1.00 0.00 C ATOM 553 O GLU A 129 4.178 8.994 -6.970 1.00 0.00 O ATOM 554 CB GLU A 129 3.755 6.393 -8.634 1.00 0.00 C ATOM 555 CG GLU A 129 4.341 5.442 -9.667 1.00 0.00 C ATOM 556 CD GLU A 129 3.452 5.269 -10.879 1.00 0.00 C ATOM 557 OE1 GLU A 129 3.309 6.238 -11.659 1.00 0.00 O ATOM 558 OE2 GLU A 129 2.907 4.161 -11.074 1.00 0.00 O ATOM 0 H GLU A 129 4.329 4.749 -6.836 1.00 0.00 H new ATOM 0 HA GLU A 129 5.654 7.057 -7.925 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.844 5.957 -8.224 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.470 7.323 -9.126 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.314 5.815 -9.987 1.00 0.00 H new ATOM 0 HG3 GLU A 129 4.509 4.470 -9.204 1.00 0.00 H new ATOM 563 N CYS A 130 3.682 7.446 -5.419 1.00 0.00 N ATOM 564 CA CYS A 130 3.197 8.402 -4.439 1.00 0.00 C ATOM 565 C CYS A 130 4.046 8.366 -3.163 1.00 0.00 C ATOM 566 O CYS A 130 4.032 9.308 -2.369 1.00 0.00 O ATOM 567 CB CYS A 130 1.733 8.115 -4.116 1.00 0.00 C ATOM 568 SG CYS A 130 0.595 8.514 -5.461 1.00 0.00 S ATOM 0 H CYS A 130 3.620 6.473 -5.118 1.00 0.00 H new ATOM 0 HA CYS A 130 3.279 9.402 -4.864 1.00 0.00 H new ATOM 0 HB2 CYS A 130 1.627 7.060 -3.864 1.00 0.00 H new ATOM 0 HB3 CYS A 130 1.448 8.684 -3.231 1.00 0.00 H new ATOM 0 HG CYS A 130 0.103 7.416 -5.953 1.00 0.00 H new ATOM 573 N LEU A 131 4.771 7.272 -2.961 1.00 0.00 N ATOM 574 CA LEU A 131 5.630 7.126 -1.792 1.00 0.00 C ATOM 575 C LEU A 131 7.054 7.533 -2.076 1.00 0.00 C ATOM 576 O LEU A 131 7.508 7.558 -3.220 1.00 0.00 O ATOM 577 CB LEU A 131 5.611 5.692 -1.304 1.00 0.00 C ATOM 578 CG LEU A 131 6.214 5.470 0.079 1.00 0.00 C ATOM 579 CD1 LEU A 131 5.357 6.106 1.157 1.00 0.00 C ATOM 580 CD2 LEU A 131 6.398 3.988 0.334 1.00 0.00 C ATOM 0 H LEU A 131 4.781 6.471 -3.593 1.00 0.00 H new ATOM 0 HA LEU A 131 5.236 7.790 -1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 131 4.579 5.342 -1.293 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.150 5.073 -2.022 1.00 0.00 H new ATOM 0 HG LEU A 131 7.191 5.952 0.112 1.00 0.00 H new ATOM 0 HD11 LEU A 131 5.811 5.932 2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.283 7.179 0.977 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.360 5.665 1.137 1.00 0.00 H new ATOM 0 HD21 LEU A 131 6.829 3.840 1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.432 3.487 0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 131 7.066 3.569 -0.419 1.00 0.00 H new ATOM 591 N ILE A 132 7.742 7.845 -0.999 1.00 0.00 N ATOM 592 CA ILE A 132 9.112 8.265 -1.055 1.00 0.00 C ATOM 593 C ILE A 132 10.067 7.099 -0.823 1.00 0.00 C ATOM 594 O ILE A 132 9.692 6.088 -0.225 1.00 0.00 O ATOM 595 CB ILE A 132 9.383 9.404 -0.049 1.00 0.00 C ATOM 596 CG1 ILE A 132 8.907 9.024 1.353 1.00 0.00 C ATOM 597 CG2 ILE A 132 8.689 10.674 -0.503 1.00 0.00 C ATOM 598 CD1 ILE A 132 9.933 8.277 2.174 1.00 0.00 C ATOM 0 H ILE A 132 7.356 7.812 -0.055 1.00 0.00 H new ATOM 0 HA ILE A 132 9.295 8.646 -2.060 1.00 0.00 H new ATOM 0 HB ILE A 132 10.459 9.574 -0.010 1.00 0.00 H new ATOM 0 HG12 ILE A 132 8.622 9.931 1.886 1.00 0.00 H new ATOM 0 HG13 ILE A 132 8.010 8.410 1.266 1.00 0.00 H new ATOM 0 HG21 ILE A 132 8.886 11.472 0.213 1.00 0.00 H new ATOM 0 HG22 ILE A 132 9.067 10.965 -1.483 1.00 0.00 H new ATOM 0 HG23 ILE A 132 7.615 10.499 -0.565 1.00 0.00 H new ATOM 0 HD11 ILE A 132 9.516 8.045 3.154 1.00 0.00 H new ATOM 0 HD12 ILE A 132 10.202 7.351 1.666 1.00 0.00 H new ATOM 0 HD13 ILE A 132 10.822 8.895 2.295 1.00 0.00 H new ATOM 609 N ASN A 133 11.285 7.259 -1.289 1.00 0.00 N ATOM 610 CA ASN A 133 12.297 6.191 -1.283 1.00 0.00 C ATOM 611 C ASN A 133 12.479 5.532 0.078 1.00 0.00 C ATOM 612 O ASN A 133 12.411 4.312 0.177 1.00 0.00 O ATOM 613 CB ASN A 133 13.640 6.742 -1.756 1.00 0.00 C ATOM 614 CG ASN A 133 13.864 6.522 -3.237 1.00 0.00 C ATOM 615 OD1 ASN A 133 13.457 7.334 -4.068 1.00 0.00 O ATOM 616 ND2 ASN A 133 14.529 5.431 -3.573 1.00 0.00 N ATOM 0 H ASN A 133 11.618 8.136 -1.689 1.00 0.00 H new ATOM 0 HA ASN A 133 11.931 5.423 -1.964 1.00 0.00 H new ATOM 0 HB2 ASN A 133 13.689 7.809 -1.538 1.00 0.00 H new ATOM 0 HB3 ASN A 133 14.443 6.265 -1.195 1.00 0.00 H new ATOM 0 HD21 ASN A 133 14.724 5.234 -4.555 1.00 0.00 H new ATOM 0 HD22 ASN A 133 14.848 4.785 -2.851 1.00 0.00 H new ATOM 622 N GLN A 134 12.663 6.331 1.121 1.00 0.00 N ATOM 623 CA GLN A 134 13.039 5.807 2.437 1.00 0.00 C ATOM 624 C GLN A 134 12.110 4.691 2.910 1.00 0.00 C ATOM 625 O GLN A 134 12.563 3.597 3.250 1.00 0.00 O ATOM 626 CB GLN A 134 13.046 6.933 3.460 1.00 0.00 C ATOM 627 CG GLN A 134 14.122 7.957 3.202 1.00 0.00 C ATOM 628 CD GLN A 134 13.922 9.231 3.998 1.00 0.00 C ATOM 629 OE1 GLN A 134 13.370 9.214 5.098 1.00 0.00 O ATOM 630 NE2 GLN A 134 14.365 10.344 3.444 1.00 0.00 N ATOM 0 H GLN A 134 12.559 7.345 1.086 1.00 0.00 H new ATOM 0 HA GLN A 134 14.038 5.381 2.339 1.00 0.00 H new ATOM 0 HB2 GLN A 134 12.074 7.426 3.456 1.00 0.00 H new ATOM 0 HB3 GLN A 134 13.185 6.511 4.455 1.00 0.00 H new ATOM 0 HG2 GLN A 134 15.093 7.528 3.450 1.00 0.00 H new ATOM 0 HG3 GLN A 134 14.141 8.197 2.139 1.00 0.00 H new ATOM 0 HE21 GLN A 134 14.817 10.314 2.530 1.00 0.00 H new ATOM 0 HE22 GLN A 134 14.255 11.234 3.930 1.00 0.00 H new ATOM 637 N GLU A 135 10.819 4.967 2.933 1.00 0.00 N ATOM 638 CA GLU A 135 9.843 3.988 3.387 1.00 0.00 C ATOM 639 C GLU A 135 9.591 2.932 2.318 1.00 0.00 C ATOM 640 O GLU A 135 9.339 1.770 2.632 1.00 0.00 O ATOM 641 CB GLU A 135 8.550 4.695 3.775 1.00 0.00 C ATOM 642 CG GLU A 135 8.766 5.725 4.862 1.00 0.00 C ATOM 643 CD GLU A 135 7.514 6.494 5.213 1.00 0.00 C ATOM 644 OE1 GLU A 135 6.736 6.006 6.058 1.00 0.00 O ATOM 645 OE2 GLU A 135 7.322 7.605 4.672 1.00 0.00 O ATOM 0 H GLU A 135 10.420 5.860 2.643 1.00 0.00 H new ATOM 0 HA GLU A 135 10.239 3.476 4.264 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.125 5.180 2.896 1.00 0.00 H new ATOM 0 HB3 GLU A 135 7.823 3.958 4.115 1.00 0.00 H new ATOM 0 HG2 GLU A 135 9.141 5.227 5.756 1.00 0.00 H new ATOM 0 HG3 GLU A 135 9.537 6.426 4.541 1.00 0.00 H new ATOM 650 N CYS A 136 9.682 3.340 1.057 1.00 0.00 N ATOM 651 CA CYS A 136 9.508 2.425 -0.066 1.00 0.00 C ATOM 652 C CYS A 136 10.517 1.287 0.020 1.00 0.00 C ATOM 653 O CYS A 136 10.166 0.108 -0.065 1.00 0.00 O ATOM 654 CB CYS A 136 9.685 3.185 -1.385 1.00 0.00 C ATOM 655 SG CYS A 136 9.464 2.184 -2.873 1.00 0.00 S ATOM 0 H CYS A 136 9.876 4.304 0.786 1.00 0.00 H new ATOM 0 HA CYS A 136 8.503 2.004 -0.027 1.00 0.00 H new ATOM 0 HB2 CYS A 136 8.974 4.010 -1.411 1.00 0.00 H new ATOM 0 HB3 CYS A 136 10.683 3.624 -1.404 1.00 0.00 H new ATOM 0 HG CYS A 136 9.615 0.927 -2.577 1.00 0.00 H new ATOM 660 N GLU A 137 11.768 1.657 0.226 1.00 0.00 N ATOM 661 CA GLU A 137 12.853 0.705 0.294 1.00 0.00 C ATOM 662 C GLU A 137 12.821 -0.046 1.623 1.00 0.00 C ATOM 663 O GLU A 137 13.289 -1.181 1.716 1.00 0.00 O ATOM 664 CB GLU A 137 14.183 1.432 0.102 1.00 0.00 C ATOM 665 CG GLU A 137 14.260 2.209 -1.210 1.00 0.00 C ATOM 666 CD GLU A 137 15.578 2.931 -1.384 1.00 0.00 C ATOM 667 OE1 GLU A 137 16.604 2.262 -1.631 1.00 0.00 O ATOM 668 OE2 GLU A 137 15.594 4.175 -1.292 1.00 0.00 O ATOM 0 H GLU A 137 12.057 2.627 0.350 1.00 0.00 H new ATOM 0 HA GLU A 137 12.740 -0.030 -0.503 1.00 0.00 H new ATOM 0 HB2 GLU A 137 14.337 2.120 0.934 1.00 0.00 H new ATOM 0 HB3 GLU A 137 14.995 0.705 0.135 1.00 0.00 H new ATOM 0 HG2 GLU A 137 14.114 1.522 -2.044 1.00 0.00 H new ATOM 0 HG3 GLU A 137 13.446 2.933 -1.247 1.00 0.00 H new ATOM 673 N GLU A 138 12.257 0.593 2.645 1.00 0.00 N ATOM 674 CA GLU A 138 12.117 -0.029 3.958 1.00 0.00 C ATOM 675 C GLU A 138 11.123 -1.184 3.884 1.00 0.00 C ATOM 676 O GLU A 138 11.364 -2.264 4.410 1.00 0.00 O ATOM 677 CB GLU A 138 11.641 0.997 4.993 1.00 0.00 C ATOM 678 CG GLU A 138 12.002 0.629 6.423 1.00 0.00 C ATOM 679 CD GLU A 138 11.765 1.765 7.395 1.00 0.00 C ATOM 680 OE1 GLU A 138 10.601 1.993 7.781 1.00 0.00 O ATOM 681 OE2 GLU A 138 12.749 2.429 7.784 1.00 0.00 O ATOM 0 H GLU A 138 11.889 1.543 2.588 1.00 0.00 H new ATOM 0 HA GLU A 138 13.091 -0.410 4.265 1.00 0.00 H new ATOM 0 HB2 GLU A 138 12.075 1.968 4.756 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.559 1.104 4.916 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.414 -0.236 6.731 1.00 0.00 H new ATOM 0 HG3 GLU A 138 13.050 0.333 6.464 1.00 0.00 H new ATOM 686 N ILE A 139 10.012 -0.947 3.212 1.00 0.00 N ATOM 687 CA ILE A 139 8.990 -1.969 3.017 1.00 0.00 C ATOM 688 C ILE A 139 9.549 -3.143 2.207 1.00 0.00 C ATOM 689 O ILE A 139 9.274 -4.311 2.502 1.00 0.00 O ATOM 690 CB ILE A 139 7.753 -1.352 2.321 1.00 0.00 C ATOM 691 CG1 ILE A 139 6.757 -0.793 3.348 1.00 0.00 C ATOM 692 CG2 ILE A 139 7.074 -2.348 1.420 1.00 0.00 C ATOM 693 CD1 ILE A 139 7.376 0.045 4.452 1.00 0.00 C ATOM 0 H ILE A 139 9.789 -0.047 2.786 1.00 0.00 H new ATOM 0 HA ILE A 139 8.683 -2.353 3.990 1.00 0.00 H new ATOM 0 HB ILE A 139 8.109 -0.526 1.705 1.00 0.00 H new ATOM 0 HG12 ILE A 139 6.019 -0.187 2.823 1.00 0.00 H new ATOM 0 HG13 ILE A 139 6.221 -1.626 3.802 1.00 0.00 H new ATOM 0 HG21 ILE A 139 6.210 -1.881 0.948 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.773 -2.679 0.652 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.747 -3.206 2.007 1.00 0.00 H new ATOM 0 HD11 ILE A 139 6.594 0.394 5.126 1.00 0.00 H new ATOM 0 HD12 ILE A 139 8.092 -0.559 5.009 1.00 0.00 H new ATOM 0 HD13 ILE A 139 7.887 0.903 4.015 1.00 0.00 H new ATOM 704 N LEU A 140 10.362 -2.819 1.210 1.00 0.00 N ATOM 705 CA LEU A 140 11.032 -3.828 0.392 1.00 0.00 C ATOM 706 C LEU A 140 12.016 -4.608 1.257 1.00 0.00 C ATOM 707 O LEU A 140 12.291 -5.783 1.022 1.00 0.00 O ATOM 708 CB LEU A 140 11.778 -3.146 -0.756 1.00 0.00 C ATOM 709 CG LEU A 140 11.757 -3.860 -2.112 1.00 0.00 C ATOM 710 CD1 LEU A 140 12.376 -5.237 -2.025 1.00 0.00 C ATOM 711 CD2 LEU A 140 10.355 -3.932 -2.651 1.00 0.00 C ATOM 0 H LEU A 140 10.576 -1.858 0.945 1.00 0.00 H new ATOM 0 HA LEU A 140 10.292 -4.513 -0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 140 11.358 -2.149 -0.890 1.00 0.00 H new ATOM 0 HB3 LEU A 140 12.818 -3.016 -0.456 1.00 0.00 H new ATOM 0 HG LEU A 140 12.362 -3.275 -2.805 1.00 0.00 H new ATOM 0 HD11 LEU A 140 12.343 -5.713 -3.005 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.412 -5.150 -1.698 1.00 0.00 H new ATOM 0 HD13 LEU A 140 11.819 -5.842 -1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 140 10.361 -4.442 -3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 140 9.725 -4.482 -1.953 1.00 0.00 H new ATOM 0 HD23 LEU A 140 9.962 -2.923 -2.777 1.00 0.00 H new ATOM 722 N GLN A 141 12.535 -3.937 2.267 1.00 0.00 N ATOM 723 CA GLN A 141 13.488 -4.535 3.183 1.00 0.00 C ATOM 724 C GLN A 141 12.799 -5.529 4.087 1.00 0.00 C ATOM 725 O GLN A 141 13.231 -6.667 4.235 1.00 0.00 O ATOM 726 CB GLN A 141 14.139 -3.449 4.028 1.00 0.00 C ATOM 727 CG GLN A 141 15.266 -3.949 4.903 1.00 0.00 C ATOM 728 CD GLN A 141 15.967 -2.826 5.639 1.00 0.00 C ATOM 729 OE1 GLN A 141 15.366 -1.794 5.943 1.00 0.00 O ATOM 730 NE2 GLN A 141 17.241 -3.018 5.935 1.00 0.00 N ATOM 0 H GLN A 141 12.309 -2.965 2.476 1.00 0.00 H new ATOM 0 HA GLN A 141 14.250 -5.055 2.602 1.00 0.00 H new ATOM 0 HB2 GLN A 141 14.522 -2.670 3.369 1.00 0.00 H new ATOM 0 HB3 GLN A 141 13.379 -2.988 4.659 1.00 0.00 H new ATOM 0 HG2 GLN A 141 14.872 -4.663 5.626 1.00 0.00 H new ATOM 0 HG3 GLN A 141 15.990 -4.484 4.288 1.00 0.00 H new ATOM 0 HE21 GLN A 141 17.702 -3.887 5.665 1.00 0.00 H new ATOM 0 HE22 GLN A 141 17.763 -2.297 6.433 1.00 0.00 H new ATOM 737 N ILE A 142 11.717 -5.089 4.679 1.00 0.00 N ATOM 738 CA ILE A 142 11.021 -5.890 5.665 1.00 0.00 C ATOM 739 C ILE A 142 10.271 -7.065 5.032 1.00 0.00 C ATOM 740 O ILE A 142 10.069 -8.084 5.684 1.00 0.00 O ATOM 741 CB ILE A 142 10.083 -5.009 6.543 1.00 0.00 C ATOM 742 CG1 ILE A 142 10.874 -4.299 7.651 1.00 0.00 C ATOM 743 CG2 ILE A 142 8.964 -5.817 7.164 1.00 0.00 C ATOM 744 CD1 ILE A 142 11.878 -3.283 7.153 1.00 0.00 C ATOM 0 H ILE A 142 11.295 -4.178 4.497 1.00 0.00 H new ATOM 0 HA ILE A 142 11.776 -6.324 6.320 1.00 0.00 H new ATOM 0 HB ILE A 142 9.642 -4.265 5.879 1.00 0.00 H new ATOM 0 HG12 ILE A 142 10.172 -3.800 8.318 1.00 0.00 H new ATOM 0 HG13 ILE A 142 11.398 -5.049 8.243 1.00 0.00 H new ATOM 0 HG21 ILE A 142 8.335 -5.163 7.768 1.00 0.00 H new ATOM 0 HG22 ILE A 142 8.364 -6.273 6.376 1.00 0.00 H new ATOM 0 HG23 ILE A 142 9.387 -6.598 7.796 1.00 0.00 H new ATOM 0 HD11 ILE A 142 12.390 -2.831 8.002 1.00 0.00 H new ATOM 0 HD12 ILE A 142 12.607 -3.777 6.510 1.00 0.00 H new ATOM 0 HD13 ILE A 142 11.361 -2.508 6.587 1.00 0.00 H new ATOM 755 N CYS A 143 9.903 -6.953 3.756 1.00 0.00 N ATOM 756 CA CYS A 143 9.338 -8.088 3.015 1.00 0.00 C ATOM 757 C CYS A 143 10.306 -9.259 3.066 1.00 0.00 C ATOM 758 O CYS A 143 9.935 -10.426 2.939 1.00 0.00 O ATOM 759 CB CYS A 143 9.107 -7.702 1.560 1.00 0.00 C ATOM 760 SG CYS A 143 10.530 -7.984 0.484 1.00 0.00 S ATOM 0 H CYS A 143 9.984 -6.093 3.213 1.00 0.00 H new ATOM 0 HA CYS A 143 8.388 -8.368 3.471 1.00 0.00 H new ATOM 0 HB2 CYS A 143 8.258 -8.268 1.176 1.00 0.00 H new ATOM 0 HB3 CYS A 143 8.835 -6.648 1.514 1.00 0.00 H new ATOM 0 HG CYS A 143 11.250 -6.903 0.425 1.00 0.00 H new ATOM 765 N SER A 144 11.550 -8.896 3.262 1.00 0.00 N ATOM 766 CA SER A 144 12.657 -9.822 3.319 1.00 0.00 C ATOM 767 C SER A 144 12.942 -10.216 4.758 1.00 0.00 C ATOM 768 O SER A 144 12.833 -11.385 5.135 1.00 0.00 O ATOM 769 CB SER A 144 13.884 -9.143 2.738 1.00 0.00 C ATOM 770 OG SER A 144 13.666 -8.746 1.390 1.00 0.00 O ATOM 0 H SER A 144 11.829 -7.923 3.390 1.00 0.00 H new ATOM 0 HA SER A 144 12.409 -10.719 2.751 1.00 0.00 H new ATOM 0 HB2 SER A 144 14.138 -8.270 3.340 1.00 0.00 H new ATOM 0 HB3 SER A 144 14.735 -9.822 2.786 1.00 0.00 H new ATOM 0 HG SER A 144 12.707 -8.616 1.238 1.00 0.00 H new ATOM 775 N THR A 145 13.274 -9.209 5.550 1.00 0.00 N ATOM 776 CA THR A 145 13.747 -9.390 6.906 1.00 0.00 C ATOM 777 C THR A 145 12.675 -9.976 7.818 1.00 0.00 C ATOM 778 O THR A 145 12.834 -11.057 8.388 1.00 0.00 O ATOM 779 CB THR A 145 14.221 -8.042 7.455 1.00 0.00 C ATOM 780 OG1 THR A 145 13.163 -7.076 7.396 1.00 0.00 O ATOM 781 CG2 THR A 145 15.385 -7.556 6.629 1.00 0.00 C ATOM 0 H THR A 145 13.221 -8.232 5.262 1.00 0.00 H new ATOM 0 HA THR A 145 14.572 -10.102 6.883 1.00 0.00 H new ATOM 0 HB THR A 145 14.523 -8.169 8.495 1.00 0.00 H new ATOM 0 HG1 THR A 145 13.481 -6.220 7.752 1.00 0.00 H new ATOM 0 HG21 THR A 145 15.729 -6.596 7.014 1.00 0.00 H new ATOM 0 HG22 THR A 145 16.198 -8.281 6.684 1.00 0.00 H new ATOM 0 HG23 THR A 145 15.072 -7.440 5.592 1.00 0.00 H new ATOM 789 N LYS A 146 11.587 -9.242 7.944 1.00 0.00 N ATOM 790 CA LYS A 146 10.468 -9.628 8.779 1.00 0.00 C ATOM 791 C LYS A 146 9.561 -10.613 8.072 1.00 0.00 C ATOM 792 O LYS A 146 9.099 -11.595 8.653 1.00 0.00 O ATOM 793 CB LYS A 146 9.685 -8.391 9.134 1.00 0.00 C ATOM 794 CG LYS A 146 10.187 -7.687 10.364 1.00 0.00 C ATOM 795 CD LYS A 146 11.644 -7.331 10.242 1.00 0.00 C ATOM 796 CE LYS A 146 12.000 -6.119 11.084 1.00 0.00 C ATOM 797 NZ LYS A 146 11.773 -6.361 12.533 1.00 0.00 N ATOM 0 H LYS A 146 11.454 -8.352 7.464 1.00 0.00 H new ATOM 0 HA LYS A 146 10.853 -10.113 9.676 1.00 0.00 H new ATOM 0 HB2 LYS A 146 9.716 -7.699 8.293 1.00 0.00 H new ATOM 0 HB3 LYS A 146 8.640 -8.664 9.284 1.00 0.00 H new ATOM 0 HG2 LYS A 146 9.603 -6.782 10.530 1.00 0.00 H new ATOM 0 HG3 LYS A 146 10.039 -8.325 11.235 1.00 0.00 H new ATOM 0 HD2 LYS A 146 12.253 -8.180 10.552 1.00 0.00 H new ATOM 0 HD3 LYS A 146 11.883 -7.131 9.198 1.00 0.00 H new ATOM 0 HE2 LYS A 146 13.045 -5.858 10.920 1.00 0.00 H new ATOM 0 HE3 LYS A 146 11.404 -5.266 10.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 12.092 -5.534 13.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 10.759 -6.518 12.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 12.309 -7.200 12.833 1.00 0.00 H new ATOM 807 N GLY A 147 9.318 -10.333 6.811 1.00 0.00 N ATOM 808 CA GLY A 147 8.416 -11.131 6.024 1.00 0.00 C ATOM 809 C GLY A 147 7.564 -10.256 5.139 1.00 0.00 C ATOM 810 O GLY A 147 7.353 -9.086 5.442 1.00 0.00 O ATOM 0 H GLY A 147 9.738 -9.551 6.309 1.00 0.00 H new ATOM 0 HA2 GLY A 147 8.983 -11.833 5.412 1.00 0.00 H new ATOM 0 HA3 GLY A 147 7.779 -11.723 6.681 1.00 0.00 H new ATOM 814 N MET A 148 7.101 -10.809 4.035 1.00 0.00 N ATOM 815 CA MET A 148 6.265 -10.076 3.088 1.00 0.00 C ATOM 816 C MET A 148 5.034 -9.494 3.775 1.00 0.00 C ATOM 817 O MET A 148 4.685 -8.342 3.560 1.00 0.00 O ATOM 818 CB MET A 148 5.849 -10.978 1.926 1.00 0.00 C ATOM 819 CG MET A 148 7.026 -11.690 1.285 1.00 0.00 C ATOM 820 SD MET A 148 6.900 -11.854 -0.495 1.00 0.00 S ATOM 821 CE MET A 148 7.799 -10.386 -0.979 1.00 0.00 C ATOM 0 H MET A 148 7.289 -11.774 3.765 1.00 0.00 H new ATOM 0 HA MET A 148 6.855 -9.249 2.694 1.00 0.00 H new ATOM 0 HB2 MET A 148 5.134 -11.718 2.284 1.00 0.00 H new ATOM 0 HB3 MET A 148 5.338 -10.379 1.172 1.00 0.00 H new ATOM 0 HG2 MET A 148 7.940 -11.147 1.525 1.00 0.00 H new ATOM 0 HG3 MET A 148 7.120 -12.683 1.725 1.00 0.00 H new ATOM 0 HE1 MET A 148 7.795 -10.299 -2.066 1.00 0.00 H new ATOM 0 HE2 MET A 148 7.323 -9.508 -0.543 1.00 0.00 H new ATOM 0 HE3 MET A 148 8.827 -10.455 -0.624 1.00 0.00 H new ATOM 829 N MET A 149 4.397 -10.288 4.618 1.00 0.00 N ATOM 830 CA MET A 149 3.245 -9.821 5.386 1.00 0.00 C ATOM 831 C MET A 149 3.628 -8.645 6.279 1.00 0.00 C ATOM 832 O MET A 149 2.849 -7.712 6.449 1.00 0.00 O ATOM 833 CB MET A 149 2.680 -10.957 6.233 1.00 0.00 C ATOM 834 CG MET A 149 2.181 -12.141 5.418 1.00 0.00 C ATOM 835 SD MET A 149 1.650 -13.522 6.447 1.00 0.00 S ATOM 836 CE MET A 149 0.166 -12.826 7.161 1.00 0.00 C ATOM 0 H MET A 149 4.654 -11.260 4.791 1.00 0.00 H new ATOM 0 HA MET A 149 2.481 -9.486 4.684 1.00 0.00 H new ATOM 0 HB2 MET A 149 3.451 -11.302 6.923 1.00 0.00 H new ATOM 0 HB3 MET A 149 1.859 -10.573 6.838 1.00 0.00 H new ATOM 0 HG2 MET A 149 1.349 -11.820 4.791 1.00 0.00 H new ATOM 0 HG3 MET A 149 2.974 -12.476 4.749 1.00 0.00 H new ATOM 0 HE1 MET A 149 -0.421 -13.619 7.624 1.00 0.00 H new ATOM 0 HE2 MET A 149 0.437 -12.087 7.915 1.00 0.00 H new ATOM 0 HE3 MET A 149 -0.424 -12.347 6.379 1.00 0.00 H new ATOM 844 N ALA A 150 4.841 -8.678 6.821 1.00 0.00 N ATOM 845 CA ALA A 150 5.321 -7.607 7.681 1.00 0.00 C ATOM 846 C ALA A 150 5.646 -6.369 6.859 1.00 0.00 C ATOM 847 O ALA A 150 5.376 -5.244 7.276 1.00 0.00 O ATOM 848 CB ALA A 150 6.532 -8.068 8.471 1.00 0.00 C ATOM 0 H ALA A 150 5.508 -9.436 6.679 1.00 0.00 H new ATOM 0 HA ALA A 150 4.533 -7.346 8.387 1.00 0.00 H new ATOM 0 HB1 ALA A 150 6.880 -7.256 9.110 1.00 0.00 H new ATOM 0 HB2 ALA A 150 6.259 -8.924 9.088 1.00 0.00 H new ATOM 0 HB3 ALA A 150 7.327 -8.355 7.783 1.00 0.00 H new ATOM 854 N GLY A 151 6.226 -6.588 5.687 1.00 0.00 N ATOM 855 CA GLY A 151 6.498 -5.497 4.774 1.00 0.00 C ATOM 856 C GLY A 151 5.219 -4.851 4.298 1.00 0.00 C ATOM 857 O GLY A 151 5.153 -3.637 4.124 1.00 0.00 O ATOM 0 H GLY A 151 6.514 -7.507 5.351 1.00 0.00 H new ATOM 0 HA2 GLY A 151 7.122 -4.753 5.268 1.00 0.00 H new ATOM 0 HA3 GLY A 151 7.062 -5.868 3.918 1.00 0.00 H new ATOM 861 N ALA A 152 4.192 -5.668 4.105 1.00 0.00 N ATOM 862 CA ALA A 152 2.882 -5.166 3.734 1.00 0.00 C ATOM 863 C ALA A 152 2.285 -4.379 4.886 1.00 0.00 C ATOM 864 O ALA A 152 1.701 -3.311 4.694 1.00 0.00 O ATOM 865 CB ALA A 152 1.950 -6.302 3.338 1.00 0.00 C ATOM 0 H ALA A 152 4.244 -6.682 4.200 1.00 0.00 H new ATOM 0 HA ALA A 152 3.000 -4.510 2.871 1.00 0.00 H new ATOM 0 HB1 ALA A 152 0.976 -5.895 3.065 1.00 0.00 H new ATOM 0 HB2 ALA A 152 2.371 -6.838 2.487 1.00 0.00 H new ATOM 0 HB3 ALA A 152 1.835 -6.987 4.178 1.00 0.00 H new ATOM 871 N GLU A 153 2.451 -4.904 6.097 1.00 0.00 N ATOM 872 CA GLU A 153 1.968 -4.219 7.281 1.00 0.00 C ATOM 873 C GLU A 153 2.674 -2.871 7.447 1.00 0.00 C ATOM 874 O GLU A 153 2.083 -1.890 7.906 1.00 0.00 O ATOM 875 CB GLU A 153 2.153 -5.066 8.542 1.00 0.00 C ATOM 876 CG GLU A 153 1.196 -6.243 8.628 1.00 0.00 C ATOM 877 CD GLU A 153 1.154 -6.858 10.010 1.00 0.00 C ATOM 878 OE1 GLU A 153 2.173 -7.427 10.444 1.00 0.00 O ATOM 879 OE2 GLU A 153 0.095 -6.777 10.671 1.00 0.00 O ATOM 0 H GLU A 153 2.913 -5.795 6.278 1.00 0.00 H new ATOM 0 HA GLU A 153 0.900 -4.050 7.145 1.00 0.00 H new ATOM 0 HB2 GLU A 153 3.177 -5.438 8.573 1.00 0.00 H new ATOM 0 HB3 GLU A 153 2.017 -4.433 9.419 1.00 0.00 H new ATOM 0 HG2 GLU A 153 0.195 -5.914 8.350 1.00 0.00 H new ATOM 0 HG3 GLU A 153 1.494 -7.002 7.905 1.00 0.00 H new ATOM 884 N LYS A 154 3.945 -2.837 7.058 1.00 0.00 N ATOM 885 CA LYS A 154 4.736 -1.609 7.062 1.00 0.00 C ATOM 886 C LYS A 154 4.242 -0.654 5.990 1.00 0.00 C ATOM 887 O LYS A 154 4.380 0.562 6.091 1.00 0.00 O ATOM 888 CB LYS A 154 6.207 -1.924 6.791 1.00 0.00 C ATOM 889 CG LYS A 154 7.065 -2.019 8.032 1.00 0.00 C ATOM 890 CD LYS A 154 7.128 -0.694 8.774 1.00 0.00 C ATOM 891 CE LYS A 154 7.862 0.377 7.981 1.00 0.00 C ATOM 892 NZ LYS A 154 8.045 1.616 8.782 1.00 0.00 N ATOM 0 H LYS A 154 4.455 -3.658 6.732 1.00 0.00 H new ATOM 0 HA LYS A 154 4.630 -1.146 8.043 1.00 0.00 H new ATOM 0 HB2 LYS A 154 6.270 -2.867 6.248 1.00 0.00 H new ATOM 0 HB3 LYS A 154 6.617 -1.153 6.139 1.00 0.00 H new ATOM 0 HG2 LYS A 154 6.665 -2.788 8.693 1.00 0.00 H new ATOM 0 HG3 LYS A 154 8.073 -2.329 7.755 1.00 0.00 H new ATOM 0 HD2 LYS A 154 6.116 -0.353 8.991 1.00 0.00 H new ATOM 0 HD3 LYS A 154 7.627 -0.840 9.732 1.00 0.00 H new ATOM 0 HE2 LYS A 154 8.835 -0.003 7.668 1.00 0.00 H new ATOM 0 HE3 LYS A 154 7.303 0.608 7.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 8.755 2.223 8.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 7.141 2.126 8.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 8.368 1.366 9.739 1.00 0.00 H new ATOM 902 N LEU A 155 3.673 -1.228 4.960 1.00 0.00 N ATOM 903 CA LEU A 155 3.256 -0.478 3.799 1.00 0.00 C ATOM 904 C LEU A 155 1.979 0.304 4.091 1.00 0.00 C ATOM 905 O LEU A 155 1.783 1.394 3.564 1.00 0.00 O ATOM 906 CB LEU A 155 3.072 -1.461 2.643 1.00 0.00 C ATOM 907 CG LEU A 155 3.054 -0.872 1.240 1.00 0.00 C ATOM 908 CD1 LEU A 155 3.327 -1.955 0.227 1.00 0.00 C ATOM 909 CD2 LEU A 155 1.724 -0.230 0.948 1.00 0.00 C ATOM 0 H LEU A 155 3.485 -2.229 4.901 1.00 0.00 H new ATOM 0 HA LEU A 155 4.013 0.258 3.528 1.00 0.00 H new ATOM 0 HB2 LEU A 155 3.874 -2.198 2.692 1.00 0.00 H new ATOM 0 HB3 LEU A 155 2.136 -1.998 2.799 1.00 0.00 H new ATOM 0 HG LEU A 155 3.830 -0.109 1.177 1.00 0.00 H new ATOM 0 HD11 LEU A 155 3.313 -1.527 -0.776 1.00 0.00 H new ATOM 0 HD12 LEU A 155 4.305 -2.395 0.420 1.00 0.00 H new ATOM 0 HD13 LEU A 155 2.561 -2.726 0.303 1.00 0.00 H new ATOM 0 HD21 LEU A 155 1.734 0.184 -0.060 1.00 0.00 H new ATOM 0 HD22 LEU A 155 0.934 -0.977 1.026 1.00 0.00 H new ATOM 0 HD23 LEU A 155 1.540 0.568 1.667 1.00 0.00 H new ATOM 920 N VAL A 156 1.123 -0.228 4.955 1.00 0.00 N ATOM 921 CA VAL A 156 -0.137 0.444 5.251 1.00 0.00 C ATOM 922 C VAL A 156 0.120 1.717 6.047 1.00 0.00 C ATOM 923 O VAL A 156 -0.490 2.755 5.790 1.00 0.00 O ATOM 924 CB VAL A 156 -1.147 -0.478 5.973 1.00 0.00 C ATOM 925 CG1 VAL A 156 -0.986 -1.902 5.495 1.00 0.00 C ATOM 926 CG2 VAL A 156 -1.009 -0.381 7.469 1.00 0.00 C ATOM 0 H VAL A 156 1.273 -1.105 5.454 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.596 0.712 4.299 1.00 0.00 H new ATOM 0 HB VAL A 156 -2.154 -0.144 5.724 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -1.702 -2.542 6.010 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -1.166 -1.948 4.421 1.00 0.00 H new ATOM 0 HG13 VAL A 156 0.026 -2.245 5.708 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.734 -1.042 7.945 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.001 -0.677 7.761 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -1.192 0.646 7.785 1.00 0.00 H new ATOM 936 N GLU A 157 1.054 1.644 6.987 1.00 0.00 N ATOM 937 CA GLU A 157 1.443 2.815 7.757 1.00 0.00 C ATOM 938 C GLU A 157 2.184 3.806 6.863 1.00 0.00 C ATOM 939 O GLU A 157 2.145 5.011 7.087 1.00 0.00 O ATOM 940 CB GLU A 157 2.275 2.421 8.974 1.00 0.00 C ATOM 941 CG GLU A 157 3.538 1.696 8.615 1.00 0.00 C ATOM 942 CD GLU A 157 4.399 1.368 9.816 1.00 0.00 C ATOM 943 OE1 GLU A 157 3.972 0.545 10.652 1.00 0.00 O ATOM 944 OE2 GLU A 157 5.506 1.937 9.937 1.00 0.00 O ATOM 0 H GLU A 157 1.553 0.789 7.233 1.00 0.00 H new ATOM 0 HA GLU A 157 0.543 3.303 8.131 1.00 0.00 H new ATOM 0 HB2 GLU A 157 2.527 3.318 9.540 1.00 0.00 H new ATOM 0 HB3 GLU A 157 1.674 1.789 9.628 1.00 0.00 H new ATOM 0 HG2 GLU A 157 3.284 0.772 8.095 1.00 0.00 H new ATOM 0 HG3 GLU A 157 4.114 2.306 7.919 1.00 0.00 H new ATOM 949 N CYS A 158 2.841 3.269 5.838 1.00 0.00 N ATOM 950 CA CYS A 158 3.544 4.073 4.839 1.00 0.00 C ATOM 951 C CYS A 158 2.543 4.917 4.064 1.00 0.00 C ATOM 952 O CYS A 158 2.719 6.125 3.891 1.00 0.00 O ATOM 953 CB CYS A 158 4.323 3.157 3.867 1.00 0.00 C ATOM 954 SG CYS A 158 3.794 3.251 2.140 1.00 0.00 S ATOM 0 H CYS A 158 2.902 2.264 5.676 1.00 0.00 H new ATOM 0 HA CYS A 158 4.252 4.728 5.346 1.00 0.00 H new ATOM 0 HB2 CYS A 158 5.382 3.411 3.922 1.00 0.00 H new ATOM 0 HB3 CYS A 158 4.225 2.126 4.206 1.00 0.00 H new ATOM 0 HG CYS A 158 3.199 2.144 1.808 1.00 0.00 H new ATOM 959 N LEU A 159 1.475 4.263 3.632 1.00 0.00 N ATOM 960 CA LEU A 159 0.451 4.889 2.819 1.00 0.00 C ATOM 961 C LEU A 159 -0.237 5.994 3.586 1.00 0.00 C ATOM 962 O LEU A 159 -0.512 7.069 3.057 1.00 0.00 O ATOM 963 CB LEU A 159 -0.567 3.835 2.393 1.00 0.00 C ATOM 964 CG LEU A 159 0.007 2.715 1.572 1.00 0.00 C ATOM 965 CD1 LEU A 159 -1.032 1.652 1.281 1.00 0.00 C ATOM 966 CD2 LEU A 159 0.554 3.282 0.302 1.00 0.00 C ATOM 0 H LEU A 159 1.297 3.280 3.838 1.00 0.00 H new ATOM 0 HA LEU A 159 0.917 5.327 1.936 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.032 3.415 3.285 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -1.357 4.321 1.821 1.00 0.00 H new ATOM 0 HG LEU A 159 0.806 2.234 2.136 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -0.583 0.857 0.685 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.401 1.238 2.219 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -1.861 2.095 0.729 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.974 2.479 -0.304 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.246 3.773 -0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 159 1.334 4.008 0.534 1.00 0.00 H new ATOM 977 N LEU A 160 -0.493 5.715 4.845 1.00 0.00 N ATOM 978 CA LEU A 160 -1.135 6.660 5.735 1.00 0.00 C ATOM 979 C LEU A 160 -0.310 7.940 5.908 1.00 0.00 C ATOM 980 O LEU A 160 -0.846 8.980 6.295 1.00 0.00 O ATOM 981 CB LEU A 160 -1.372 5.999 7.096 1.00 0.00 C ATOM 982 CG LEU A 160 -2.817 5.590 7.411 1.00 0.00 C ATOM 983 CD1 LEU A 160 -3.804 6.542 6.789 1.00 0.00 C ATOM 984 CD2 LEU A 160 -3.099 4.172 6.962 1.00 0.00 C ATOM 0 H LEU A 160 -0.261 4.823 5.283 1.00 0.00 H new ATOM 0 HA LEU A 160 -2.087 6.947 5.289 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -0.744 5.111 7.159 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -1.033 6.685 7.873 1.00 0.00 H new ATOM 0 HG LEU A 160 -2.935 5.635 8.494 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -4.818 6.224 7.031 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -3.636 7.546 7.178 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -3.673 6.546 5.707 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -4.131 3.913 7.200 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -2.944 4.093 5.886 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -2.425 3.487 7.477 1.00 0.00 H new ATOM 995 N ARG A 161 0.983 7.873 5.616 1.00 0.00 N ATOM 996 CA ARG A 161 1.852 9.039 5.754 1.00 0.00 C ATOM 997 C ARG A 161 1.947 9.803 4.438 1.00 0.00 C ATOM 998 O ARG A 161 2.468 10.917 4.392 1.00 0.00 O ATOM 999 CB ARG A 161 3.250 8.619 6.205 1.00 0.00 C ATOM 1000 CG ARG A 161 3.249 7.753 7.450 1.00 0.00 C ATOM 1001 CD ARG A 161 4.656 7.378 7.875 1.00 0.00 C ATOM 1002 NE ARG A 161 5.333 8.473 8.563 1.00 0.00 N ATOM 1003 CZ ARG A 161 6.656 8.578 8.674 1.00 0.00 C ATOM 1004 NH1 ARG A 161 7.446 7.731 8.032 1.00 0.00 N ATOM 1005 NH2 ARG A 161 7.187 9.552 9.400 1.00 0.00 N ATOM 0 H ARG A 161 1.452 7.030 5.284 1.00 0.00 H new ATOM 0 HA ARG A 161 1.416 9.692 6.510 1.00 0.00 H new ATOM 0 HB2 ARG A 161 3.737 8.076 5.395 1.00 0.00 H new ATOM 0 HB3 ARG A 161 3.846 9.512 6.394 1.00 0.00 H new ATOM 0 HG2 ARG A 161 2.753 8.284 8.262 1.00 0.00 H new ATOM 0 HG3 ARG A 161 2.672 6.847 7.263 1.00 0.00 H new ATOM 0 HD2 ARG A 161 4.616 6.508 8.531 1.00 0.00 H new ATOM 0 HD3 ARG A 161 5.234 7.089 6.997 1.00 0.00 H new ATOM 0 HE ARG A 161 4.758 9.202 8.984 1.00 0.00 H new ATOM 0 HH11 ARG A 161 7.041 6.997 7.451 1.00 0.00 H new ATOM 0 HH12 ARG A 161 8.459 7.813 8.118 1.00 0.00 H new ATOM 0 HH21 ARG A 161 6.582 10.222 9.875 1.00 0.00 H new ATOM 0 HH22 ARG A 161 8.200 9.631 9.484 1.00 0.00 H new ATOM 1016 N SER A 162 1.442 9.204 3.370 1.00 0.00 N ATOM 1017 CA SER A 162 1.509 9.817 2.055 1.00 0.00 C ATOM 1018 C SER A 162 0.344 10.780 1.861 1.00 0.00 C ATOM 1019 O SER A 162 -0.814 10.422 2.075 1.00 0.00 O ATOM 1020 CB SER A 162 1.504 8.741 0.967 1.00 0.00 C ATOM 1021 OG SER A 162 1.693 9.305 -0.322 1.00 0.00 O ATOM 0 H SER A 162 0.982 8.294 3.390 1.00 0.00 H new ATOM 0 HA SER A 162 2.439 10.381 1.978 1.00 0.00 H new ATOM 0 HB2 SER A 162 2.293 8.016 1.167 1.00 0.00 H new ATOM 0 HB3 SER A 162 0.558 8.199 0.993 1.00 0.00 H new ATOM 0 HG SER A 162 2.589 9.079 -0.650 1.00 0.00 H new ATOM 1026 N ASP A 163 0.656 12.008 1.471 1.00 0.00 N ATOM 1027 CA ASP A 163 -0.367 13.025 1.254 1.00 0.00 C ATOM 1028 C ASP A 163 -0.618 13.226 -0.237 1.00 0.00 C ATOM 1029 O ASP A 163 -0.787 14.348 -0.716 1.00 0.00 O ATOM 1030 CB ASP A 163 0.055 14.346 1.912 1.00 0.00 C ATOM 1031 CG ASP A 163 1.415 14.836 1.444 1.00 0.00 C ATOM 1032 OD1 ASP A 163 2.437 14.206 1.799 1.00 0.00 O ATOM 1033 OD2 ASP A 163 1.475 15.864 0.738 1.00 0.00 O ATOM 0 H ASP A 163 1.610 12.326 1.298 1.00 0.00 H new ATOM 0 HA ASP A 163 -1.296 12.687 1.712 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -0.694 15.108 1.696 1.00 0.00 H new ATOM 0 HB3 ASP A 163 0.075 14.216 2.994 1.00 0.00 H new ATOM 1037 N LYS A 164 -0.662 12.119 -0.961 1.00 0.00 N ATOM 1038 CA LYS A 164 -0.973 12.123 -2.373 1.00 0.00 C ATOM 1039 C LYS A 164 -2.465 11.919 -2.620 1.00 0.00 C ATOM 1040 O LYS A 164 -3.232 11.653 -1.696 1.00 0.00 O ATOM 1041 CB LYS A 164 -0.183 11.022 -3.065 1.00 0.00 C ATOM 1042 CG LYS A 164 1.160 11.489 -3.572 1.00 0.00 C ATOM 1043 CD LYS A 164 2.087 11.931 -2.459 1.00 0.00 C ATOM 1044 CE LYS A 164 3.414 12.427 -3.017 1.00 0.00 C ATOM 1045 NZ LYS A 164 4.308 12.955 -1.954 1.00 0.00 N ATOM 0 H LYS A 164 -0.481 11.190 -0.580 1.00 0.00 H new ATOM 0 HA LYS A 164 -0.698 13.096 -2.780 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -0.035 10.196 -2.369 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -0.766 10.634 -3.901 1.00 0.00 H new ATOM 0 HG2 LYS A 164 1.632 10.682 -4.133 1.00 0.00 H new ATOM 0 HG3 LYS A 164 1.013 12.316 -4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 164 1.613 12.724 -1.880 1.00 0.00 H new ATOM 0 HD3 LYS A 164 2.264 11.100 -1.777 1.00 0.00 H new ATOM 0 HE2 LYS A 164 3.915 11.611 -3.538 1.00 0.00 H new ATOM 0 HE3 LYS A 164 3.227 13.209 -3.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 5.199 13.281 -2.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 3.843 13.751 -1.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 4.509 12.203 -1.264 1.00 0.00 H new ATOM 1055 N GLU A 165 -2.871 12.091 -3.861 1.00 0.00 N ATOM 1056 CA GLU A 165 -4.187 11.699 -4.310 1.00 0.00 C ATOM 1057 C GLU A 165 -4.184 10.225 -4.647 1.00 0.00 C ATOM 1058 O GLU A 165 -5.008 9.461 -4.151 1.00 0.00 O ATOM 1059 CB GLU A 165 -4.574 12.554 -5.520 1.00 0.00 C ATOM 1060 CG GLU A 165 -5.642 11.933 -6.388 1.00 0.00 C ATOM 1061 CD GLU A 165 -6.026 12.811 -7.562 1.00 0.00 C ATOM 1062 OE1 GLU A 165 -6.832 13.745 -7.370 1.00 0.00 O ATOM 1063 OE2 GLU A 165 -5.518 12.576 -8.680 1.00 0.00 O ATOM 0 H GLU A 165 -2.292 12.509 -4.589 1.00 0.00 H new ATOM 0 HA GLU A 165 -4.925 11.861 -3.525 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -4.923 13.526 -5.170 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -3.686 12.733 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -5.289 10.971 -6.759 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -6.527 11.735 -5.783 1.00 0.00 H new ATOM 1068 N ASN A 166 -3.199 9.822 -5.427 1.00 0.00 N ATOM 1069 CA ASN A 166 -3.239 8.541 -6.102 1.00 0.00 C ATOM 1070 C ASN A 166 -2.796 7.371 -5.224 1.00 0.00 C ATOM 1071 O ASN A 166 -2.983 6.236 -5.622 1.00 0.00 O ATOM 1072 CB ASN A 166 -2.400 8.601 -7.364 1.00 0.00 C ATOM 1073 CG ASN A 166 -2.979 7.773 -8.499 1.00 0.00 C ATOM 1074 OD1 ASN A 166 -3.861 8.233 -9.225 1.00 0.00 O ATOM 1075 ND2 ASN A 166 -2.470 6.571 -8.689 1.00 0.00 N ATOM 0 H ASN A 166 -2.357 10.368 -5.609 1.00 0.00 H new ATOM 0 HA ASN A 166 -4.283 8.351 -6.352 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -2.311 9.638 -7.686 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -1.393 8.249 -7.142 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -2.806 5.990 -9.457 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -1.740 6.222 -8.068 1.00 0.00 H new ATOM 1081 N TRP A 167 -2.259 7.624 -4.023 1.00 0.00 N ATOM 1082 CA TRP A 167 -1.680 6.531 -3.216 1.00 0.00 C ATOM 1083 C TRP A 167 -2.675 5.370 -2.949 1.00 0.00 C ATOM 1084 O TRP A 167 -2.330 4.192 -3.159 1.00 0.00 O ATOM 1085 CB TRP A 167 -1.004 7.029 -1.913 1.00 0.00 C ATOM 1086 CG TRP A 167 -1.874 7.757 -0.929 1.00 0.00 C ATOM 1087 CD1 TRP A 167 -2.159 9.086 -0.914 1.00 0.00 C ATOM 1088 CD2 TRP A 167 -2.533 7.199 0.213 1.00 0.00 C ATOM 1089 NE1 TRP A 167 -2.969 9.386 0.155 1.00 0.00 N ATOM 1090 CE2 TRP A 167 -3.212 8.245 0.862 1.00 0.00 C ATOM 1091 CE3 TRP A 167 -2.622 5.916 0.742 1.00 0.00 C ATOM 1092 CZ2 TRP A 167 -3.967 8.044 2.016 1.00 0.00 C ATOM 1093 CZ3 TRP A 167 -3.370 5.721 1.883 1.00 0.00 C ATOM 1094 CH2 TRP A 167 -4.034 6.776 2.510 1.00 0.00 C ATOM 0 H TRP A 167 -2.211 8.548 -3.594 1.00 0.00 H new ATOM 0 HA TRP A 167 -0.886 6.114 -3.836 1.00 0.00 H new ATOM 0 HB2 TRP A 167 -0.568 6.168 -1.407 1.00 0.00 H new ATOM 0 HB3 TRP A 167 -0.180 7.687 -2.189 1.00 0.00 H new ATOM 0 HD1 TRP A 167 -1.801 9.803 -1.638 1.00 0.00 H new ATOM 0 HE1 TRP A 167 -3.330 10.312 0.383 1.00 0.00 H new ATOM 0 HE3 TRP A 167 -2.115 5.089 0.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 167 -4.479 8.862 2.500 1.00 0.00 H new ATOM 0 HZ3 TRP A 167 -3.444 4.728 2.302 1.00 0.00 H new ATOM 0 HH2 TRP A 167 -4.611 6.584 3.402 1.00 0.00 H new ATOM 1104 N PRO A 168 -3.936 5.630 -2.547 1.00 0.00 N ATOM 1105 CA PRO A 168 -4.862 4.550 -2.274 1.00 0.00 C ATOM 1106 C PRO A 168 -5.378 3.947 -3.570 1.00 0.00 C ATOM 1107 O PRO A 168 -5.910 2.839 -3.587 1.00 0.00 O ATOM 1108 CB PRO A 168 -5.982 5.205 -1.442 1.00 0.00 C ATOM 1109 CG PRO A 168 -5.579 6.633 -1.271 1.00 0.00 C ATOM 1110 CD PRO A 168 -4.577 6.932 -2.347 1.00 0.00 C ATOM 0 HA PRO A 168 -4.404 3.720 -1.736 1.00 0.00 H new ATOM 0 HB2 PRO A 168 -6.943 5.128 -1.951 1.00 0.00 H new ATOM 0 HB3 PRO A 168 -6.092 4.711 -0.476 1.00 0.00 H new ATOM 0 HG2 PRO A 168 -6.444 7.291 -1.354 1.00 0.00 H new ATOM 0 HG3 PRO A 168 -5.147 6.797 -0.284 1.00 0.00 H new ATOM 0 HD2 PRO A 168 -5.054 7.295 -3.258 1.00 0.00 H new ATOM 0 HD3 PRO A 168 -3.862 7.694 -2.037 1.00 0.00 H new ATOM 1115 N LYS A 169 -5.201 4.688 -4.656 1.00 0.00 N ATOM 1116 CA LYS A 169 -5.458 4.173 -5.991 1.00 0.00 C ATOM 1117 C LYS A 169 -4.367 3.197 -6.371 1.00 0.00 C ATOM 1118 O LYS A 169 -4.647 2.164 -6.961 1.00 0.00 O ATOM 1119 CB LYS A 169 -5.521 5.307 -7.019 1.00 0.00 C ATOM 1120 CG LYS A 169 -6.713 6.236 -6.859 1.00 0.00 C ATOM 1121 CD LYS A 169 -6.512 7.232 -5.725 1.00 0.00 C ATOM 1122 CE LYS A 169 -6.892 8.648 -6.138 1.00 0.00 C ATOM 1123 NZ LYS A 169 -8.349 8.776 -6.414 1.00 0.00 N ATOM 0 H LYS A 169 -4.878 5.655 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 169 -6.423 3.667 -5.986 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -4.606 5.895 -6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -5.546 4.873 -8.019 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -6.879 6.776 -7.791 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -7.609 5.646 -6.669 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -7.113 6.931 -4.867 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -5.470 7.214 -5.407 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -6.610 9.344 -5.348 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -6.328 8.930 -7.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -8.585 9.776 -6.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -8.592 8.222 -7.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -8.889 8.420 -5.600 1.00 0.00 H new ATOM 1133 N GLU A 170 -3.138 3.514 -5.972 1.00 0.00 N ATOM 1134 CA GLU A 170 -1.973 2.675 -6.264 1.00 0.00 C ATOM 1135 C GLU A 170 -2.223 1.264 -5.791 1.00 0.00 C ATOM 1136 O GLU A 170 -1.772 0.319 -6.413 1.00 0.00 O ATOM 1137 CB GLU A 170 -0.705 3.196 -5.567 1.00 0.00 C ATOM 1138 CG GLU A 170 -0.500 4.687 -5.679 1.00 0.00 C ATOM 1139 CD GLU A 170 -0.321 5.174 -7.106 1.00 0.00 C ATOM 1140 OE1 GLU A 170 -0.513 4.385 -8.049 1.00 0.00 O ATOM 1141 OE2 GLU A 170 -0.006 6.369 -7.288 1.00 0.00 O ATOM 0 H GLU A 170 -2.919 4.356 -5.439 1.00 0.00 H new ATOM 0 HA GLU A 170 -1.821 2.701 -7.343 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.748 2.926 -4.512 1.00 0.00 H new ATOM 0 HB3 GLU A 170 0.162 2.689 -5.991 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -1.355 5.197 -5.235 1.00 0.00 H new ATOM 0 HG3 GLU A 170 0.377 4.969 -5.096 1.00 0.00 H new ATOM 1146 N LEU A 171 -2.933 1.122 -4.681 1.00 0.00 N ATOM 1147 CA LEU A 171 -3.294 -0.216 -4.205 1.00 0.00 C ATOM 1148 C LEU A 171 -4.110 -0.996 -5.240 1.00 0.00 C ATOM 1149 O LEU A 171 -3.594 -1.931 -5.848 1.00 0.00 O ATOM 1150 CB LEU A 171 -4.045 -0.171 -2.883 1.00 0.00 C ATOM 1151 CG LEU A 171 -3.168 0.078 -1.660 1.00 0.00 C ATOM 1152 CD1 LEU A 171 -2.588 1.466 -1.710 1.00 0.00 C ATOM 1153 CD2 LEU A 171 -3.955 -0.120 -0.389 1.00 0.00 C ATOM 0 H LEU A 171 -3.266 1.893 -4.102 1.00 0.00 H new ATOM 0 HA LEU A 171 -2.351 -0.740 -4.046 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -4.801 0.612 -2.937 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -4.573 -1.115 -2.748 1.00 0.00 H new ATOM 0 HG LEU A 171 -2.351 -0.643 -1.669 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -1.964 1.631 -0.832 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -1.983 1.576 -2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -3.396 2.198 -1.724 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -3.310 0.063 0.471 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -4.793 0.576 -0.368 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -4.331 -1.142 -0.350 1.00 0.00 H new ATOM 1164 N LYS A 172 -5.371 -0.612 -5.464 1.00 0.00 N ATOM 1165 CA LYS A 172 -6.230 -1.361 -6.387 1.00 0.00 C ATOM 1166 C LYS A 172 -5.607 -1.402 -7.775 1.00 0.00 C ATOM 1167 O LYS A 172 -5.642 -2.422 -8.467 1.00 0.00 O ATOM 1168 CB LYS A 172 -7.628 -0.748 -6.480 1.00 0.00 C ATOM 1169 CG LYS A 172 -8.509 -1.414 -7.520 1.00 0.00 C ATOM 1170 CD LYS A 172 -9.889 -0.784 -7.577 1.00 0.00 C ATOM 1171 CE LYS A 172 -10.756 -1.438 -8.643 1.00 0.00 C ATOM 1172 NZ LYS A 172 -10.902 -2.903 -8.424 1.00 0.00 N ATOM 0 H LYS A 172 -5.813 0.197 -5.028 1.00 0.00 H new ATOM 0 HA LYS A 172 -6.323 -2.373 -5.994 1.00 0.00 H new ATOM 0 HB2 LYS A 172 -8.113 -0.817 -5.506 1.00 0.00 H new ATOM 0 HB3 LYS A 172 -7.537 0.312 -6.717 1.00 0.00 H new ATOM 0 HG2 LYS A 172 -8.035 -1.340 -8.499 1.00 0.00 H new ATOM 0 HG3 LYS A 172 -8.603 -2.475 -7.291 1.00 0.00 H new ATOM 0 HD2 LYS A 172 -10.373 -0.877 -6.605 1.00 0.00 H new ATOM 0 HD3 LYS A 172 -9.795 0.282 -7.786 1.00 0.00 H new ATOM 0 HE2 LYS A 172 -11.741 -0.972 -8.644 1.00 0.00 H new ATOM 0 HE3 LYS A 172 -10.318 -1.260 -9.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 172 -11.687 -3.264 -9.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 172 -10.021 -3.384 -8.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 172 -11.101 -3.086 -7.420 1.00 0.00 H new ATOM 1182 N LEU A 173 -5.030 -0.277 -8.156 1.00 0.00 N ATOM 1183 CA LEU A 173 -4.373 -0.125 -9.437 1.00 0.00 C ATOM 1184 C LEU A 173 -3.241 -1.141 -9.582 1.00 0.00 C ATOM 1185 O LEU A 173 -3.107 -1.803 -10.611 1.00 0.00 O ATOM 1186 CB LEU A 173 -3.838 1.302 -9.556 1.00 0.00 C ATOM 1187 CG LEU A 173 -4.381 2.122 -10.723 1.00 0.00 C ATOM 1188 CD1 LEU A 173 -3.773 3.495 -10.705 1.00 0.00 C ATOM 1189 CD2 LEU A 173 -4.127 1.430 -12.051 1.00 0.00 C ATOM 0 H LEU A 173 -5.005 0.563 -7.578 1.00 0.00 H new ATOM 0 HA LEU A 173 -5.089 -0.309 -10.238 1.00 0.00 H new ATOM 0 HB2 LEU A 173 -4.061 1.832 -8.630 1.00 0.00 H new ATOM 0 HB3 LEU A 173 -2.752 1.256 -9.643 1.00 0.00 H new ATOM 0 HG LEU A 173 -5.461 2.214 -10.609 1.00 0.00 H new ATOM 0 HD11 LEU A 173 -4.164 4.077 -11.540 1.00 0.00 H new ATOM 0 HD12 LEU A 173 -4.024 3.992 -9.768 1.00 0.00 H new ATOM 0 HD13 LEU A 173 -2.690 3.414 -10.794 1.00 0.00 H new ATOM 0 HD21 LEU A 173 -4.526 2.040 -12.861 1.00 0.00 H new ATOM 0 HD22 LEU A 173 -3.055 1.296 -12.192 1.00 0.00 H new ATOM 0 HD23 LEU A 173 -4.618 0.457 -12.054 1.00 0.00 H new ATOM 1200 N ALA A 174 -2.443 -1.288 -8.541 1.00 0.00 N ATOM 1201 CA ALA A 174 -1.333 -2.226 -8.568 1.00 0.00 C ATOM 1202 C ALA A 174 -1.845 -3.635 -8.784 1.00 0.00 C ATOM 1203 O ALA A 174 -1.391 -4.337 -9.680 1.00 0.00 O ATOM 1204 CB ALA A 174 -0.536 -2.162 -7.282 1.00 0.00 C ATOM 0 H ALA A 174 -2.541 -0.772 -7.667 1.00 0.00 H new ATOM 0 HA ALA A 174 -0.678 -1.950 -9.394 1.00 0.00 H new ATOM 0 HB1 ALA A 174 0.288 -2.874 -7.329 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -0.139 -1.155 -7.150 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -1.183 -2.411 -6.440 1.00 0.00 H new ATOM 1210 N LEU A 175 -2.837 -4.019 -7.995 1.00 0.00 N ATOM 1211 CA LEU A 175 -3.392 -5.365 -8.056 1.00 0.00 C ATOM 1212 C LEU A 175 -4.197 -5.590 -9.324 1.00 0.00 C ATOM 1213 O LEU A 175 -4.658 -6.693 -9.575 1.00 0.00 O ATOM 1214 CB LEU A 175 -4.240 -5.694 -6.828 1.00 0.00 C ATOM 1215 CG LEU A 175 -3.461 -5.896 -5.527 1.00 0.00 C ATOM 1216 CD1 LEU A 175 -2.044 -6.378 -5.799 1.00 0.00 C ATOM 1217 CD2 LEU A 175 -3.445 -4.622 -4.719 1.00 0.00 C ATOM 0 H LEU A 175 -3.277 -3.415 -7.301 1.00 0.00 H new ATOM 0 HA LEU A 175 -2.539 -6.044 -8.069 1.00 0.00 H new ATOM 0 HB2 LEU A 175 -4.960 -4.890 -6.679 1.00 0.00 H new ATOM 0 HB3 LEU A 175 -4.811 -6.599 -7.034 1.00 0.00 H new ATOM 0 HG LEU A 175 -3.968 -6.669 -4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 175 -1.517 -6.512 -4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 175 -2.079 -7.328 -6.332 1.00 0.00 H new ATOM 0 HD13 LEU A 175 -1.519 -5.640 -6.406 1.00 0.00 H new ATOM 0 HD21 LEU A 175 -2.887 -4.783 -3.797 1.00 0.00 H new ATOM 0 HD22 LEU A 175 -2.969 -3.830 -5.298 1.00 0.00 H new ATOM 0 HD23 LEU A 175 -4.467 -4.331 -4.478 1.00 0.00 H new ATOM 1228 N GLU A 176 -4.421 -4.547 -10.093 1.00 0.00 N ATOM 1229 CA GLU A 176 -5.039 -4.711 -11.398 1.00 0.00 C ATOM 1230 C GLU A 176 -3.977 -5.156 -12.408 1.00 0.00 C ATOM 1231 O GLU A 176 -4.256 -5.951 -13.297 1.00 0.00 O ATOM 1232 CB GLU A 176 -5.745 -3.408 -11.826 1.00 0.00 C ATOM 1233 CG GLU A 176 -4.911 -2.469 -12.693 1.00 0.00 C ATOM 1234 CD GLU A 176 -5.257 -2.554 -14.165 1.00 0.00 C ATOM 1235 OE1 GLU A 176 -4.691 -3.414 -14.866 1.00 0.00 O ATOM 1236 OE2 GLU A 176 -6.094 -1.749 -14.629 1.00 0.00 O ATOM 0 H GLU A 176 -4.189 -3.585 -9.845 1.00 0.00 H new ATOM 0 HA GLU A 176 -5.806 -5.485 -11.353 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -6.653 -3.668 -12.370 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -6.054 -2.870 -10.930 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -5.055 -1.444 -12.351 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -3.855 -2.704 -12.560 1.00 0.00 H new ATOM 1241 N LYS A 177 -2.752 -4.660 -12.244 1.00 0.00 N ATOM 1242 CA LYS A 177 -1.628 -5.113 -13.056 1.00 0.00 C ATOM 1243 C LYS A 177 -1.105 -6.455 -12.561 1.00 0.00 C ATOM 1244 O LYS A 177 -0.896 -7.389 -13.333 1.00 0.00 O ATOM 1245 CB LYS A 177 -0.504 -4.084 -13.004 1.00 0.00 C ATOM 1246 CG LYS A 177 -0.535 -3.103 -14.147 1.00 0.00 C ATOM 1247 CD LYS A 177 -1.727 -2.168 -14.065 1.00 0.00 C ATOM 1248 CE LYS A 177 -1.509 -1.009 -13.098 1.00 0.00 C ATOM 1249 NZ LYS A 177 -0.796 -1.401 -11.854 1.00 0.00 N ATOM 0 H LYS A 177 -2.514 -3.945 -11.556 1.00 0.00 H new ATOM 0 HA LYS A 177 -1.976 -5.230 -14.082 1.00 0.00 H new ATOM 0 HB2 LYS A 177 -0.567 -3.536 -12.064 1.00 0.00 H new ATOM 0 HB3 LYS A 177 0.454 -4.604 -13.007 1.00 0.00 H new ATOM 0 HG2 LYS A 177 0.385 -2.518 -14.147 1.00 0.00 H new ATOM 0 HG3 LYS A 177 -0.566 -3.648 -15.091 1.00 0.00 H new ATOM 0 HD2 LYS A 177 -1.939 -1.771 -15.058 1.00 0.00 H new ATOM 0 HD3 LYS A 177 -2.605 -2.734 -13.753 1.00 0.00 H new ATOM 0 HE2 LYS A 177 -0.941 -0.227 -13.602 1.00 0.00 H new ATOM 0 HE3 LYS A 177 -2.476 -0.580 -12.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 -0.531 -0.548 -11.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 -1.419 -1.994 -11.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 0.062 -1.936 -12.099 1.00 0.00 H new ATOM 1259 N GLU A 178 -0.926 -6.530 -11.256 1.00 0.00 N ATOM 1260 CA GLU A 178 -0.464 -7.743 -10.585 1.00 0.00 C ATOM 1261 C GLU A 178 -1.602 -8.760 -10.497 1.00 0.00 C ATOM 1262 O GLU A 178 -1.388 -9.933 -10.192 1.00 0.00 O ATOM 1263 CB GLU A 178 0.060 -7.366 -9.192 1.00 0.00 C ATOM 1264 CG GLU A 178 1.166 -6.335 -9.254 1.00 0.00 C ATOM 1265 CD GLU A 178 1.221 -5.474 -8.019 1.00 0.00 C ATOM 1266 OE1 GLU A 178 0.911 -5.982 -6.922 1.00 0.00 O ATOM 1267 OE2 GLU A 178 1.569 -4.282 -8.152 1.00 0.00 O ATOM 0 H GLU A 178 -1.097 -5.749 -10.622 1.00 0.00 H new ATOM 0 HA GLU A 178 0.344 -8.204 -11.153 1.00 0.00 H new ATOM 0 HB2 GLU A 178 -0.762 -6.978 -8.590 1.00 0.00 H new ATOM 0 HB3 GLU A 178 0.428 -8.261 -8.690 1.00 0.00 H new ATOM 0 HG2 GLU A 178 2.123 -6.841 -9.384 1.00 0.00 H new ATOM 0 HG3 GLU A 178 1.019 -5.701 -10.129 1.00 0.00 H new ATOM 1272 N ARG A 179 -2.819 -8.275 -10.762 1.00 0.00 N ATOM 1273 CA ARG A 179 -4.011 -9.118 -10.910 1.00 0.00 C ATOM 1274 C ARG A 179 -4.329 -9.903 -9.639 1.00 0.00 C ATOM 1275 O ARG A 179 -4.903 -10.990 -9.696 1.00 0.00 O ATOM 1276 CB ARG A 179 -3.855 -10.075 -12.088 1.00 0.00 C ATOM 1277 CG ARG A 179 -3.880 -9.391 -13.443 1.00 0.00 C ATOM 1278 CD ARG A 179 -5.232 -8.760 -13.727 1.00 0.00 C ATOM 1279 NE ARG A 179 -6.314 -9.743 -13.709 1.00 0.00 N ATOM 1280 CZ ARG A 179 -7.606 -9.425 -13.669 1.00 0.00 C ATOM 1281 NH1 ARG A 179 -7.978 -8.151 -13.653 1.00 0.00 N ATOM 1282 NH2 ARG A 179 -8.527 -10.383 -13.658 1.00 0.00 N ATOM 0 H ARG A 179 -3.007 -7.279 -10.881 1.00 0.00 H new ATOM 0 HA ARG A 179 -4.848 -8.446 -11.101 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -2.915 -10.616 -11.982 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -4.654 -10.815 -12.051 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -3.106 -8.625 -13.478 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -3.646 -10.117 -14.222 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -5.433 -7.987 -12.986 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -5.205 -8.269 -14.700 1.00 0.00 H new ATOM 0 HE ARG A 179 -6.064 -10.732 -13.728 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -7.273 -7.414 -13.671 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -8.968 -7.909 -13.622 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -8.244 -11.363 -13.680 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -9.517 -10.139 -13.627 1.00 0.00 H new ATOM 1293 N ASN A 180 -3.970 -9.343 -8.496 1.00 0.00 N ATOM 1294 CA ASN A 180 -4.221 -9.995 -7.217 1.00 0.00 C ATOM 1295 C ASN A 180 -5.646 -9.716 -6.758 1.00 0.00 C ATOM 1296 O ASN A 180 -6.220 -8.663 -7.051 1.00 0.00 O ATOM 1297 CB ASN A 180 -3.230 -9.503 -6.164 1.00 0.00 C ATOM 1298 CG ASN A 180 -3.393 -10.202 -4.826 1.00 0.00 C ATOM 1299 OD1 ASN A 180 -4.174 -9.767 -3.979 1.00 0.00 O ATOM 1300 ND2 ASN A 180 -2.661 -11.283 -4.629 1.00 0.00 N ATOM 0 H ASN A 180 -3.504 -8.439 -8.425 1.00 0.00 H new ATOM 0 HA ASN A 180 -4.092 -11.070 -7.345 1.00 0.00 H new ATOM 0 HB2 ASN A 180 -2.214 -9.658 -6.528 1.00 0.00 H new ATOM 0 HB3 ASN A 180 -3.358 -8.430 -6.025 1.00 0.00 H new ATOM 0 HD21 ASN A 180 -2.730 -11.792 -3.748 1.00 0.00 H new ATOM 0 HD22 ASN A 180 -2.026 -11.609 -5.358 1.00 0.00 H new ATOM 1306 N LYS A 181 -6.199 -10.685 -6.034 1.00 0.00 N ATOM 1307 CA LYS A 181 -7.581 -10.654 -5.563 1.00 0.00 C ATOM 1308 C LYS A 181 -7.903 -9.389 -4.771 1.00 0.00 C ATOM 1309 O LYS A 181 -9.062 -8.975 -4.706 1.00 0.00 O ATOM 1310 CB LYS A 181 -7.838 -11.870 -4.675 1.00 0.00 C ATOM 1311 CG LYS A 181 -9.265 -11.965 -4.170 1.00 0.00 C ATOM 1312 CD LYS A 181 -9.310 -12.463 -2.738 1.00 0.00 C ATOM 1313 CE LYS A 181 -10.730 -12.789 -2.307 1.00 0.00 C ATOM 1314 NZ LYS A 181 -11.323 -13.882 -3.122 1.00 0.00 N ATOM 0 H LYS A 181 -5.693 -11.525 -5.754 1.00 0.00 H new ATOM 0 HA LYS A 181 -8.223 -10.667 -6.444 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -7.599 -12.774 -5.234 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -7.161 -11.835 -3.821 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -9.741 -10.986 -4.232 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -9.836 -12.638 -4.810 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -8.686 -13.351 -2.641 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -8.892 -11.706 -2.075 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -10.732 -13.078 -1.256 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -11.349 -11.896 -2.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -12.134 -14.291 -2.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -11.642 -13.500 -4.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -10.609 -14.620 -3.285 1.00 0.00 H new ATOM 1324 N PHE A 182 -6.882 -8.781 -4.173 1.00 0.00 N ATOM 1325 CA PHE A 182 -7.079 -7.629 -3.299 1.00 0.00 C ATOM 1326 C PHE A 182 -7.805 -6.493 -4.021 1.00 0.00 C ATOM 1327 O PHE A 182 -8.505 -5.701 -3.393 1.00 0.00 O ATOM 1328 CB PHE A 182 -5.740 -7.112 -2.766 1.00 0.00 C ATOM 1329 CG PHE A 182 -5.898 -6.181 -1.604 1.00 0.00 C ATOM 1330 CD1 PHE A 182 -6.304 -6.672 -0.384 1.00 0.00 C ATOM 1331 CD2 PHE A 182 -5.646 -4.825 -1.731 1.00 0.00 C ATOM 1332 CE1 PHE A 182 -6.462 -5.830 0.698 1.00 0.00 C ATOM 1333 CE2 PHE A 182 -5.799 -3.976 -0.653 1.00 0.00 C ATOM 1334 CZ PHE A 182 -6.207 -4.480 0.564 1.00 0.00 C ATOM 0 H PHE A 182 -5.909 -9.068 -4.278 1.00 0.00 H new ATOM 0 HA PHE A 182 -7.696 -7.965 -2.465 1.00 0.00 H new ATOM 0 HB2 PHE A 182 -5.122 -7.959 -2.466 1.00 0.00 H new ATOM 0 HB3 PHE A 182 -5.209 -6.598 -3.568 1.00 0.00 H new ATOM 0 HD1 PHE A 182 -6.501 -7.728 -0.272 1.00 0.00 H new ATOM 0 HD2 PHE A 182 -5.327 -4.428 -2.683 1.00 0.00 H new ATOM 0 HE1 PHE A 182 -6.785 -6.227 1.649 1.00 0.00 H new ATOM 0 HE2 PHE A 182 -5.600 -2.920 -0.763 1.00 0.00 H new ATOM 0 HZ PHE A 182 -6.327 -3.820 1.410 1.00 0.00 H new ATOM 1343 N SER A 183 -7.649 -6.430 -5.341 1.00 0.00 N ATOM 1344 CA SER A 183 -8.263 -5.378 -6.145 1.00 0.00 C ATOM 1345 C SER A 183 -9.786 -5.382 -5.997 1.00 0.00 C ATOM 1346 O SER A 183 -10.429 -4.335 -6.081 1.00 0.00 O ATOM 1347 CB SER A 183 -7.882 -5.549 -7.617 1.00 0.00 C ATOM 1348 OG SER A 183 -8.417 -4.507 -8.417 1.00 0.00 O ATOM 0 H SER A 183 -7.099 -7.100 -5.879 1.00 0.00 H new ATOM 0 HA SER A 183 -7.889 -4.420 -5.784 1.00 0.00 H new ATOM 0 HB2 SER A 183 -6.796 -5.562 -7.714 1.00 0.00 H new ATOM 0 HB3 SER A 183 -8.246 -6.511 -7.979 1.00 0.00 H new ATOM 0 HG SER A 183 -8.155 -4.644 -9.351 1.00 0.00 H new ATOM 1353 N GLU A 184 -10.357 -6.557 -5.766 1.00 0.00 N ATOM 1354 CA GLU A 184 -11.801 -6.689 -5.643 1.00 0.00 C ATOM 1355 C GLU A 184 -12.284 -6.251 -4.266 1.00 0.00 C ATOM 1356 O GLU A 184 -13.430 -5.830 -4.100 1.00 0.00 O ATOM 1357 CB GLU A 184 -12.225 -8.128 -5.913 1.00 0.00 C ATOM 1358 CG GLU A 184 -12.132 -8.504 -7.377 1.00 0.00 C ATOM 1359 CD GLU A 184 -13.048 -7.668 -8.242 1.00 0.00 C ATOM 1360 OE1 GLU A 184 -14.262 -7.619 -7.957 1.00 0.00 O ATOM 1361 OE2 GLU A 184 -12.560 -7.052 -9.211 1.00 0.00 O ATOM 0 H GLU A 184 -9.842 -7.431 -5.660 1.00 0.00 H new ATOM 0 HA GLU A 184 -12.260 -6.035 -6.385 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -11.598 -8.802 -5.329 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -13.250 -8.270 -5.571 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -11.103 -8.382 -7.717 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -12.384 -9.558 -7.496 1.00 0.00 H new ATOM 1366 N LEU A 185 -11.401 -6.343 -3.284 1.00 0.00 N ATOM 1367 CA LEU A 185 -11.750 -6.007 -1.912 1.00 0.00 C ATOM 1368 C LEU A 185 -11.523 -4.524 -1.660 1.00 0.00 C ATOM 1369 O LEU A 185 -12.291 -3.873 -0.952 1.00 0.00 O ATOM 1370 CB LEU A 185 -10.907 -6.820 -0.932 1.00 0.00 C ATOM 1371 CG LEU A 185 -10.640 -8.277 -1.314 1.00 0.00 C ATOM 1372 CD1 LEU A 185 -9.707 -8.922 -0.299 1.00 0.00 C ATOM 1373 CD2 LEU A 185 -11.943 -9.053 -1.399 1.00 0.00 C ATOM 0 H LEU A 185 -10.436 -6.648 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 185 -12.803 -6.244 -1.760 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -9.948 -6.318 -0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -11.402 -6.806 0.039 1.00 0.00 H new ATOM 0 HG LEU A 185 -10.163 -8.297 -2.294 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -9.524 -9.959 -0.581 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -8.762 -8.379 -0.277 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -10.166 -8.890 0.689 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -11.733 -10.087 -1.672 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -12.445 -9.027 -0.432 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -12.587 -8.602 -2.154 1.00 0.00 H new ATOM 1384 N TRP A 186 -10.459 -4.005 -2.249 1.00 0.00 N ATOM 1385 CA TRP A 186 -10.066 -2.616 -2.057 1.00 0.00 C ATOM 1386 C TRP A 186 -11.042 -1.675 -2.768 1.00 0.00 C ATOM 1387 O TRP A 186 -11.273 -1.809 -3.971 1.00 0.00 O ATOM 1388 CB TRP A 186 -8.646 -2.412 -2.598 1.00 0.00 C ATOM 1389 CG TRP A 186 -8.041 -1.128 -2.145 1.00 0.00 C ATOM 1390 CD1 TRP A 186 -7.617 -0.088 -2.915 1.00 0.00 C ATOM 1391 CD2 TRP A 186 -7.815 -0.752 -0.796 1.00 0.00 C ATOM 1392 NE1 TRP A 186 -7.147 0.925 -2.114 1.00 0.00 N ATOM 1393 CE2 TRP A 186 -7.260 0.539 -0.805 1.00 0.00 C ATOM 1394 CE3 TRP A 186 -8.038 -1.388 0.421 1.00 0.00 C ATOM 1395 CZ2 TRP A 186 -6.926 1.204 0.372 1.00 0.00 C ATOM 1396 CZ3 TRP A 186 -7.708 -0.728 1.576 1.00 0.00 C ATOM 1397 CH2 TRP A 186 -7.163 0.548 1.541 1.00 0.00 C ATOM 0 H TRP A 186 -9.845 -4.530 -2.871 1.00 0.00 H new ATOM 0 HA TRP A 186 -10.087 -2.385 -0.992 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -8.015 -3.241 -2.276 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -8.669 -2.434 -3.688 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -7.646 -0.063 -3.994 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -6.775 1.817 -2.441 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -8.462 -2.381 0.455 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -6.498 2.196 0.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -7.875 -1.209 2.529 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -6.919 1.037 2.473 1.00 0.00 H new ATOM 1407 N ILE A 187 -11.612 -0.726 -2.028 1.00 0.00 N ATOM 1408 CA ILE A 187 -12.631 0.163 -2.587 1.00 0.00 C ATOM 1409 C ILE A 187 -12.104 1.594 -2.787 1.00 0.00 C ATOM 1410 O ILE A 187 -12.428 2.503 -2.020 1.00 0.00 O ATOM 1411 CB ILE A 187 -13.879 0.197 -1.678 1.00 0.00 C ATOM 1412 CG1 ILE A 187 -14.281 -1.225 -1.290 1.00 0.00 C ATOM 1413 CG2 ILE A 187 -15.040 0.889 -2.377 1.00 0.00 C ATOM 1414 CD1 ILE A 187 -15.539 -1.287 -0.465 1.00 0.00 C ATOM 0 H ILE A 187 -11.389 -0.553 -1.048 1.00 0.00 H new ATOM 0 HA ILE A 187 -12.899 -0.238 -3.564 1.00 0.00 H new ATOM 0 HB ILE A 187 -13.632 0.761 -0.779 1.00 0.00 H new ATOM 0 HG12 ILE A 187 -14.420 -1.815 -2.196 1.00 0.00 H new ATOM 0 HG13 ILE A 187 -13.466 -1.685 -0.731 1.00 0.00 H new ATOM 0 HG21 ILE A 187 -15.907 0.901 -1.717 1.00 0.00 H new ATOM 0 HG22 ILE A 187 -14.758 1.913 -2.624 1.00 0.00 H new ATOM 0 HG23 ILE A 187 -15.287 0.350 -3.292 1.00 0.00 H new ATOM 0 HD11 ILE A 187 -15.766 -2.326 -0.225 1.00 0.00 H new ATOM 0 HD12 ILE A 187 -15.397 -0.724 0.458 1.00 0.00 H new ATOM 0 HD13 ILE A 187 -16.366 -0.856 -1.029 1.00 0.00 H new ATOM 1425 N VAL A 188 -11.296 1.792 -3.821 1.00 0.00 N ATOM 1426 CA VAL A 188 -10.779 3.122 -4.144 1.00 0.00 C ATOM 1427 C VAL A 188 -11.341 3.574 -5.495 1.00 0.00 C ATOM 1428 O VAL A 188 -11.695 2.744 -6.332 1.00 0.00 O ATOM 1429 CB VAL A 188 -9.229 3.140 -4.186 1.00 0.00 C ATOM 1430 CG1 VAL A 188 -8.695 2.356 -5.374 1.00 0.00 C ATOM 1431 CG2 VAL A 188 -8.711 4.569 -4.205 1.00 0.00 C ATOM 0 H VAL A 188 -10.983 1.053 -4.451 1.00 0.00 H new ATOM 0 HA VAL A 188 -11.097 3.808 -3.359 1.00 0.00 H new ATOM 0 HB VAL A 188 -8.866 2.653 -3.281 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -7.606 2.390 -5.372 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -9.026 1.320 -5.305 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -9.070 2.796 -6.298 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -7.621 4.561 -4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -9.094 5.083 -5.087 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -9.046 5.089 -3.308 1.00 0.00 H new