USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 555 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 223 ASN : amide:sc= -0.396 K(o=-0.35,f=-2.1!) USER MOD Set 1.2: A 224 ASN : amide:sc= 0.0483 K(o=-0.35,f=-2.1) USER MOD Set 2.1: A 215 THR OG1 : rot -173:sc= 0.17 USER MOD Set 2.2: A 218 SER OG : rot 103:sc= 0.163 USER MOD Set 3.1: A 204 TYR OH : rot 86:sc= 1.22 USER MOD Set 3.2: A 205 GLN : amide:sc= -0.136 K(o=1.1,f=-0.85!) USER MOD Set 4.1: A 191 LYS NZ :NH3+ -114:sc= 1.83 (180deg=-0.109) USER MOD Set 4.2: A 192 TYR OH : rot 143:sc= -0.907! USER MOD Set 5.1: A 184 THR OG1 : rot 180:sc= 0.0569 USER MOD Set 5.2: A 187 THR OG1 : rot 102:sc= 0.0503 USER MOD Single : A 164 ASN : amide:sc= -0.753 K(o=-0.75,f=-2.4!) USER MOD Single : A 168 LYS NZ :NH3+ -142:sc= -0.369 (180deg=-0.407) USER MOD Single : A 171 ASN : amide:sc= -1.49! C(o=-1.5!,f=-2.4!) USER MOD Single : A 173 THR OG1 : rot 180:sc= -0.27 USER MOD Single : A 189 LYS NZ :NH3+ -159:sc= -1.67 (180deg=-2.94) USER MOD Single : A 190 SER OG : rot 71:sc= 0.14 USER MOD Single : A 196 GLN : amide:sc= -0.0256 X(o=-0.026,f=-0.47) USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 199 GLN : amide:sc= -0.0106 K(o=-0.011,f=-1.2) USER MOD Single : A 200 MET CE :methyl -134:sc= -0.938 (180deg=-3.04!) USER MOD Single : A 201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 210 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 220 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0 USER MOD Single : A 225 CYS SG : rot -170:sc= -0.498 USER MOD Single : A 228 HIS : no HD1:sc= -0.35 X(o=-0.35,f=0.0013) USER MOD Single : A 229 CYS SG : rot 180:sc= -0.592 USER MOD Single : A 230 HIS : no HD1:sc= -0.627 X(o=-0.63,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 162 1.257 -16.035 3.722 1.00 0.00 N ATOM 60 CA GLY A 162 1.622 -14.923 2.864 1.00 0.00 C ATOM 61 C GLY A 162 2.745 -14.088 3.445 1.00 0.00 C ATOM 62 O GLY A 162 3.307 -14.429 4.487 1.00 0.00 O ATOM 0 HA2 GLY A 162 1.924 -15.304 1.889 1.00 0.00 H new ATOM 0 HA3 GLY A 162 0.749 -14.291 2.703 1.00 0.00 H new ATOM 66 N ILE A 163 3.075 -12.991 2.771 1.00 0.00 N ATOM 67 CA ILE A 163 4.139 -12.105 3.227 1.00 0.00 C ATOM 68 C ILE A 163 3.572 -10.796 3.764 1.00 0.00 C ATOM 69 O ILE A 163 2.648 -10.225 3.186 1.00 0.00 O ATOM 70 CB ILE A 163 5.136 -11.794 2.095 1.00 0.00 C ATOM 71 CG1 ILE A 163 4.409 -11.163 0.905 1.00 0.00 C ATOM 72 CG2 ILE A 163 5.865 -13.059 1.668 1.00 0.00 C ATOM 73 CD1 ILE A 163 5.321 -10.844 -0.259 1.00 0.00 C ATOM 0 H ILE A 163 2.621 -12.695 1.907 1.00 0.00 H new ATOM 0 HA ILE A 163 4.663 -12.627 4.028 1.00 0.00 H new ATOM 0 HB ILE A 163 5.873 -11.082 2.466 1.00 0.00 H new ATOM 0 HG12 ILE A 163 3.625 -11.841 0.567 1.00 0.00 H new ATOM 0 HG13 ILE A 163 3.918 -10.247 1.233 1.00 0.00 H new ATOM 0 HG21 ILE A 163 6.566 -12.822 0.867 1.00 0.00 H new ATOM 0 HG22 ILE A 163 6.410 -13.469 2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 163 5.142 -13.793 1.312 1.00 0.00 H new ATOM 0 HD11 ILE A 163 4.739 -10.400 -1.066 1.00 0.00 H new ATOM 0 HD12 ILE A 163 6.090 -10.142 0.063 1.00 0.00 H new ATOM 0 HD13 ILE A 163 5.792 -11.761 -0.614 1.00 0.00 H new ATOM 85 N ASN A 164 4.133 -10.325 4.873 1.00 0.00 N ATOM 86 CA ASN A 164 3.684 -9.081 5.488 1.00 0.00 C ATOM 87 C ASN A 164 4.432 -7.886 4.907 1.00 0.00 C ATOM 88 O ASN A 164 5.642 -7.942 4.691 1.00 0.00 O ATOM 89 CB ASN A 164 3.885 -9.136 7.004 1.00 0.00 C ATOM 90 CG ASN A 164 2.933 -10.103 7.680 1.00 0.00 C ATOM 91 OD1 ASN A 164 2.692 -11.204 7.183 1.00 0.00 O ATOM 92 ND2 ASN A 164 2.385 -9.695 8.818 1.00 0.00 N ATOM 0 H ASN A 164 4.899 -10.786 5.364 1.00 0.00 H new ATOM 0 HA ASN A 164 2.622 -8.961 5.273 1.00 0.00 H new ATOM 0 HB2 ASN A 164 4.912 -9.430 7.221 1.00 0.00 H new ATOM 0 HB3 ASN A 164 3.744 -8.140 7.423 1.00 0.00 H new ATOM 0 HD21 ASN A 164 1.735 -10.302 9.318 1.00 0.00 H new ATOM 0 HD22 ASN A 164 2.614 -8.774 9.193 1.00 0.00 H new ATOM 99 N VAL A 165 3.703 -6.803 4.657 1.00 0.00 N ATOM 100 CA VAL A 165 4.297 -5.592 4.102 1.00 0.00 C ATOM 101 C VAL A 165 3.945 -4.372 4.945 1.00 0.00 C ATOM 102 O VAL A 165 2.789 -4.176 5.320 1.00 0.00 O ATOM 103 CB VAL A 165 3.833 -5.352 2.653 1.00 0.00 C ATOM 104 CG1 VAL A 165 4.688 -4.283 1.989 1.00 0.00 C ATOM 105 CG2 VAL A 165 3.876 -6.649 1.859 1.00 0.00 C ATOM 0 H VAL A 165 2.700 -6.739 4.830 1.00 0.00 H new ATOM 0 HA VAL A 165 5.377 -5.737 4.110 1.00 0.00 H new ATOM 0 HB VAL A 165 2.802 -4.998 2.673 1.00 0.00 H new ATOM 0 HG11 VAL A 165 4.346 -4.127 0.966 1.00 0.00 H new ATOM 0 HG12 VAL A 165 4.602 -3.350 2.547 1.00 0.00 H new ATOM 0 HG13 VAL A 165 5.729 -4.605 1.978 1.00 0.00 H new ATOM 0 HG21 VAL A 165 3.545 -6.461 0.838 1.00 0.00 H new ATOM 0 HG22 VAL A 165 4.896 -7.034 1.845 1.00 0.00 H new ATOM 0 HG23 VAL A 165 3.218 -7.383 2.325 1.00 0.00 H new ATOM 115 N ARG A 166 4.950 -3.553 5.239 1.00 0.00 N ATOM 116 CA ARG A 166 4.748 -2.351 6.039 1.00 0.00 C ATOM 117 C ARG A 166 4.569 -1.127 5.145 1.00 0.00 C ATOM 118 O ARG A 166 5.476 -0.749 4.403 1.00 0.00 O ATOM 119 CB ARG A 166 5.930 -2.137 6.985 1.00 0.00 C ATOM 120 CG ARG A 166 6.344 -3.391 7.737 1.00 0.00 C ATOM 121 CD ARG A 166 7.388 -3.085 8.799 1.00 0.00 C ATOM 122 NE ARG A 166 8.746 -3.141 8.265 1.00 0.00 N ATOM 123 CZ ARG A 166 9.775 -2.494 8.802 1.00 0.00 C ATOM 124 NH1 ARG A 166 9.601 -1.747 9.883 1.00 0.00 N ATOM 125 NH2 ARG A 166 10.980 -2.595 8.258 1.00 0.00 N ATOM 0 H ARG A 166 5.912 -3.700 4.935 1.00 0.00 H new ATOM 0 HA ARG A 166 3.841 -2.485 6.628 1.00 0.00 H new ATOM 0 HB2 ARG A 166 6.781 -1.770 6.412 1.00 0.00 H new ATOM 0 HB3 ARG A 166 5.672 -1.360 7.705 1.00 0.00 H new ATOM 0 HG2 ARG A 166 5.469 -3.841 8.205 1.00 0.00 H new ATOM 0 HG3 ARG A 166 6.742 -4.123 7.034 1.00 0.00 H new ATOM 0 HD2 ARG A 166 7.203 -2.094 9.214 1.00 0.00 H new ATOM 0 HD3 ARG A 166 7.291 -3.797 9.618 1.00 0.00 H new ATOM 0 HE ARG A 166 8.914 -3.708 7.434 1.00 0.00 H new ATOM 0 HH11 ARG A 166 8.676 -1.668 10.305 1.00 0.00 H new ATOM 0 HH12 ARG A 166 10.393 -1.251 10.293 1.00 0.00 H new ATOM 0 HH21 ARG A 166 11.118 -3.170 7.427 1.00 0.00 H new ATOM 0 HH22 ARG A 166 11.769 -2.098 8.671 1.00 0.00 H new ATOM 139 N LEU A 167 3.394 -0.512 5.221 1.00 0.00 N ATOM 140 CA LEU A 167 3.095 0.669 4.419 1.00 0.00 C ATOM 141 C LEU A 167 3.597 1.935 5.106 1.00 0.00 C ATOM 142 O LEU A 167 3.023 2.386 6.097 1.00 0.00 O ATOM 143 CB LEU A 167 1.590 0.773 4.169 1.00 0.00 C ATOM 144 CG LEU A 167 0.989 -0.281 3.239 1.00 0.00 C ATOM 145 CD1 LEU A 167 -0.523 -0.334 3.397 1.00 0.00 C ATOM 146 CD2 LEU A 167 1.366 0.006 1.793 1.00 0.00 C ATOM 0 H LEU A 167 2.633 -0.812 5.830 1.00 0.00 H new ATOM 0 HA LEU A 167 3.609 0.568 3.463 1.00 0.00 H new ATOM 0 HB2 LEU A 167 1.078 0.715 5.129 1.00 0.00 H new ATOM 0 HB3 LEU A 167 1.378 1.758 3.753 1.00 0.00 H new ATOM 0 HG LEU A 167 1.396 -1.254 3.514 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -0.933 -1.090 2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -0.772 -0.589 4.427 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -0.949 0.639 3.150 1.00 0.00 H new ATOM 0 HD21 LEU A 167 0.930 -0.754 1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 167 0.988 0.987 1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 167 2.451 -0.009 1.690 1.00 0.00 H new ATOM 158 N LYS A 168 4.672 2.505 4.572 1.00 0.00 N ATOM 159 CA LYS A 168 5.250 3.722 5.130 1.00 0.00 C ATOM 160 C LYS A 168 4.790 4.950 4.352 1.00 0.00 C ATOM 161 O LYS A 168 4.894 4.996 3.126 1.00 0.00 O ATOM 162 CB LYS A 168 6.778 3.638 5.114 1.00 0.00 C ATOM 163 CG LYS A 168 7.454 4.677 5.993 1.00 0.00 C ATOM 164 CD LYS A 168 7.743 5.955 5.225 1.00 0.00 C ATOM 165 CE LYS A 168 8.934 6.699 5.809 1.00 0.00 C ATOM 166 NZ LYS A 168 8.571 7.441 7.048 1.00 0.00 N ATOM 0 H LYS A 168 5.161 2.143 3.753 1.00 0.00 H new ATOM 0 HA LYS A 168 4.907 3.818 6.160 1.00 0.00 H new ATOM 0 HB2 LYS A 168 7.082 2.644 5.442 1.00 0.00 H new ATOM 0 HB3 LYS A 168 7.129 3.757 4.089 1.00 0.00 H new ATOM 0 HG2 LYS A 168 6.816 4.902 6.848 1.00 0.00 H new ATOM 0 HG3 LYS A 168 8.385 4.270 6.388 1.00 0.00 H new ATOM 0 HD2 LYS A 168 7.939 5.716 4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 168 6.864 6.600 5.245 1.00 0.00 H new ATOM 0 HE2 LYS A 168 9.732 5.990 6.031 1.00 0.00 H new ATOM 0 HE3 LYS A 168 9.325 7.397 5.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 9.073 8.351 7.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 7.545 7.611 7.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 8.841 6.879 7.881 1.00 0.00 H new ATOM 180 N PHE A 169 4.281 5.945 5.072 1.00 0.00 N ATOM 181 CA PHE A 169 3.805 7.174 4.449 1.00 0.00 C ATOM 182 C PHE A 169 4.757 8.332 4.733 1.00 0.00 C ATOM 183 O PHE A 169 5.536 8.291 5.687 1.00 0.00 O ATOM 184 CB PHE A 169 2.402 7.517 4.954 1.00 0.00 C ATOM 185 CG PHE A 169 1.488 6.328 5.038 1.00 0.00 C ATOM 186 CD1 PHE A 169 1.603 5.420 6.079 1.00 0.00 C ATOM 187 CD2 PHE A 169 0.513 6.118 4.076 1.00 0.00 C ATOM 188 CE1 PHE A 169 0.764 4.325 6.157 1.00 0.00 C ATOM 189 CE2 PHE A 169 -0.329 5.024 4.150 1.00 0.00 C ATOM 190 CZ PHE A 169 -0.204 4.128 5.193 1.00 0.00 C ATOM 0 H PHE A 169 4.188 5.924 6.088 1.00 0.00 H new ATOM 0 HA PHE A 169 3.767 7.014 3.371 1.00 0.00 H new ATOM 0 HB2 PHE A 169 2.481 7.975 5.940 1.00 0.00 H new ATOM 0 HB3 PHE A 169 1.958 8.261 4.292 1.00 0.00 H new ATOM 0 HD1 PHE A 169 2.357 5.570 6.838 1.00 0.00 H new ATOM 0 HD2 PHE A 169 0.410 6.817 3.259 1.00 0.00 H new ATOM 0 HE1 PHE A 169 0.866 3.624 6.972 1.00 0.00 H new ATOM 0 HE2 PHE A 169 -1.084 4.870 3.393 1.00 0.00 H new ATOM 0 HZ PHE A 169 -0.863 3.274 5.254 1.00 0.00 H new ATOM 200 N LEU A 170 4.689 9.364 3.900 1.00 0.00 N ATOM 201 CA LEU A 170 5.545 10.534 4.060 1.00 0.00 C ATOM 202 C LEU A 170 5.257 11.243 5.379 1.00 0.00 C ATOM 203 O LEU A 170 5.969 12.169 5.766 1.00 0.00 O ATOM 204 CB LEU A 170 5.342 11.503 2.893 1.00 0.00 C ATOM 205 CG LEU A 170 5.820 11.015 1.525 1.00 0.00 C ATOM 206 CD1 LEU A 170 5.175 11.827 0.413 1.00 0.00 C ATOM 207 CD2 LEU A 170 7.337 11.091 1.432 1.00 0.00 C ATOM 0 H LEU A 170 4.050 9.415 3.107 1.00 0.00 H new ATOM 0 HA LEU A 170 6.581 10.196 4.068 1.00 0.00 H new ATOM 0 HB2 LEU A 170 4.280 11.738 2.822 1.00 0.00 H new ATOM 0 HB3 LEU A 170 5.859 12.434 3.126 1.00 0.00 H new ATOM 0 HG LEU A 170 5.520 9.974 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 170 5.527 11.465 -0.553 1.00 0.00 H new ATOM 0 HD12 LEU A 170 4.091 11.721 0.467 1.00 0.00 H new ATOM 0 HD13 LEU A 170 5.443 12.877 0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 170 7.659 10.740 0.452 1.00 0.00 H new ATOM 0 HD22 LEU A 170 7.659 12.123 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 170 7.781 10.465 2.206 1.00 0.00 H new ATOM 219 N ASN A 171 4.210 10.799 6.067 1.00 0.00 N ATOM 220 CA ASN A 171 3.829 11.390 7.345 1.00 0.00 C ATOM 221 C ASN A 171 4.645 10.791 8.486 1.00 0.00 C ATOM 222 O ASN A 171 4.269 10.898 9.654 1.00 0.00 O ATOM 223 CB ASN A 171 2.336 11.178 7.604 1.00 0.00 C ATOM 224 CG ASN A 171 1.915 11.652 8.981 1.00 0.00 C ATOM 225 OD1 ASN A 171 2.451 12.628 9.505 1.00 0.00 O ATOM 226 ND2 ASN A 171 0.950 10.959 9.576 1.00 0.00 N ATOM 0 H ASN A 171 3.611 10.032 5.761 1.00 0.00 H new ATOM 0 HA ASN A 171 4.034 12.459 7.298 1.00 0.00 H new ATOM 0 HB2 ASN A 171 1.760 11.711 6.848 1.00 0.00 H new ATOM 0 HB3 ASN A 171 2.099 10.119 7.499 1.00 0.00 H new ATOM 0 HD21 ASN A 171 0.626 11.230 10.504 1.00 0.00 H new ATOM 0 HD22 ASN A 171 0.534 10.156 9.104 1.00 0.00 H new ATOM 233 N ASP A 172 5.762 10.161 8.140 1.00 0.00 N ATOM 234 CA ASP A 172 6.632 9.546 9.136 1.00 0.00 C ATOM 235 C ASP A 172 5.887 8.469 9.918 1.00 0.00 C ATOM 236 O ASP A 172 6.213 8.186 11.072 1.00 0.00 O ATOM 237 CB ASP A 172 7.176 10.606 10.094 1.00 0.00 C ATOM 238 CG ASP A 172 8.365 11.351 9.519 1.00 0.00 C ATOM 239 OD1 ASP A 172 9.504 10.862 9.675 1.00 0.00 O ATOM 240 OD2 ASP A 172 8.156 12.423 8.914 1.00 0.00 O ATOM 0 H ASP A 172 6.086 10.063 7.178 1.00 0.00 H new ATOM 0 HA ASP A 172 7.466 9.078 8.614 1.00 0.00 H new ATOM 0 HB2 ASP A 172 6.385 11.318 10.331 1.00 0.00 H new ATOM 0 HB3 ASP A 172 7.467 10.130 11.030 1.00 0.00 H new ATOM 245 N THR A 173 4.883 7.871 9.284 1.00 0.00 N ATOM 246 CA THR A 173 4.090 6.827 9.920 1.00 0.00 C ATOM 247 C THR A 173 4.153 5.527 9.127 1.00 0.00 C ATOM 248 O THR A 173 4.700 5.489 8.025 1.00 0.00 O ATOM 249 CB THR A 173 2.617 7.254 10.070 1.00 0.00 C ATOM 250 OG1 THR A 173 1.900 6.278 10.834 1.00 0.00 O ATOM 251 CG2 THR A 173 1.961 7.420 8.707 1.00 0.00 C ATOM 0 H THR A 173 4.600 8.093 8.329 1.00 0.00 H new ATOM 0 HA THR A 173 4.517 6.665 10.910 1.00 0.00 H new ATOM 0 HB THR A 173 2.590 8.212 10.588 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.965 6.557 10.926 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.922 7.722 8.838 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.492 8.184 8.138 1.00 0.00 H new ATOM 0 HG23 THR A 173 1.999 6.474 8.167 1.00 0.00 H new ATOM 259 N GLU A 174 3.589 4.466 9.694 1.00 0.00 N ATOM 260 CA GLU A 174 3.582 3.163 9.037 1.00 0.00 C ATOM 261 C GLU A 174 2.276 2.423 9.311 1.00 0.00 C ATOM 262 O GLU A 174 1.634 2.637 10.339 1.00 0.00 O ATOM 263 CB GLU A 174 4.768 2.322 9.513 1.00 0.00 C ATOM 264 CG GLU A 174 6.082 2.689 8.845 1.00 0.00 C ATOM 265 CD GLU A 174 7.285 2.390 9.719 1.00 0.00 C ATOM 266 OE1 GLU A 174 7.510 1.202 10.033 1.00 0.00 O ATOM 267 OE2 GLU A 174 8.001 3.344 10.089 1.00 0.00 O ATOM 0 H GLU A 174 3.131 4.482 10.605 1.00 0.00 H new ATOM 0 HA GLU A 174 3.669 3.325 7.963 1.00 0.00 H new ATOM 0 HB2 GLU A 174 4.874 2.437 10.592 1.00 0.00 H new ATOM 0 HB3 GLU A 174 4.556 1.270 9.324 1.00 0.00 H new ATOM 0 HG2 GLU A 174 6.174 2.141 7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 174 6.074 3.750 8.595 1.00 0.00 H new ATOM 274 N GLU A 175 1.891 1.553 8.383 1.00 0.00 N ATOM 275 CA GLU A 175 0.661 0.782 8.524 1.00 0.00 C ATOM 276 C GLU A 175 0.899 -0.688 8.190 1.00 0.00 C ATOM 277 O GLU A 175 1.554 -1.014 7.199 1.00 0.00 O ATOM 278 CB GLU A 175 -0.431 1.352 7.616 1.00 0.00 C ATOM 279 CG GLU A 175 -1.709 0.529 7.611 1.00 0.00 C ATOM 280 CD GLU A 175 -2.570 0.798 6.392 1.00 0.00 C ATOM 281 OE1 GLU A 175 -3.046 1.942 6.241 1.00 0.00 O ATOM 282 OE2 GLU A 175 -2.769 -0.138 5.589 1.00 0.00 O ATOM 0 H GLU A 175 2.412 1.364 7.527 1.00 0.00 H new ATOM 0 HA GLU A 175 0.335 0.853 9.562 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -0.664 2.368 7.936 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -0.047 1.418 6.598 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -1.455 -0.530 7.645 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -2.282 0.749 8.512 1.00 0.00 H new ATOM 289 N LEU A 176 0.363 -1.572 9.025 1.00 0.00 N ATOM 290 CA LEU A 176 0.517 -3.008 8.820 1.00 0.00 C ATOM 291 C LEU A 176 -0.394 -3.499 7.700 1.00 0.00 C ATOM 292 O LEU A 176 -1.616 -3.377 7.782 1.00 0.00 O ATOM 293 CB LEU A 176 0.207 -3.764 10.114 1.00 0.00 C ATOM 294 CG LEU A 176 0.584 -5.246 10.132 1.00 0.00 C ATOM 295 CD1 LEU A 176 2.031 -5.434 9.704 1.00 0.00 C ATOM 296 CD2 LEU A 176 0.354 -5.837 11.515 1.00 0.00 C ATOM 0 H LEU A 176 -0.182 -1.320 9.850 1.00 0.00 H new ATOM 0 HA LEU A 176 1.551 -3.200 8.533 1.00 0.00 H new ATOM 0 HB2 LEU A 176 0.726 -3.268 10.934 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -0.861 -3.679 10.314 1.00 0.00 H new ATOM 0 HG LEU A 176 -0.054 -5.773 9.422 1.00 0.00 H new ATOM 0 HD11 LEU A 176 2.281 -6.495 9.723 1.00 0.00 H new ATOM 0 HD12 LEU A 176 2.165 -5.048 8.694 1.00 0.00 H new ATOM 0 HD13 LEU A 176 2.686 -4.895 10.388 1.00 0.00 H new ATOM 0 HD21 LEU A 176 0.627 -6.892 11.510 1.00 0.00 H new ATOM 0 HD22 LEU A 176 0.967 -5.307 12.244 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -0.698 -5.736 11.784 1.00 0.00 H new ATOM 308 N ALA A 177 0.209 -4.057 6.655 1.00 0.00 N ATOM 309 CA ALA A 177 -0.549 -4.571 5.521 1.00 0.00 C ATOM 310 C ALA A 177 0.088 -5.840 4.965 1.00 0.00 C ATOM 311 O ALA A 177 1.241 -5.831 4.533 1.00 0.00 O ATOM 312 CB ALA A 177 -0.654 -3.511 4.433 1.00 0.00 C ATOM 0 H ALA A 177 1.220 -4.164 6.570 1.00 0.00 H new ATOM 0 HA ALA A 177 -1.551 -4.821 5.869 1.00 0.00 H new ATOM 0 HB1 ALA A 177 -1.222 -3.908 3.592 1.00 0.00 H new ATOM 0 HB2 ALA A 177 -1.160 -2.631 4.830 1.00 0.00 H new ATOM 0 HB3 ALA A 177 0.345 -3.234 4.097 1.00 0.00 H new ATOM 318 N VAL A 178 -0.670 -6.932 4.980 1.00 0.00 N ATOM 319 CA VAL A 178 -0.180 -8.210 4.477 1.00 0.00 C ATOM 320 C VAL A 178 -0.475 -8.364 2.989 1.00 0.00 C ATOM 321 O VAL A 178 -1.628 -8.305 2.565 1.00 0.00 O ATOM 322 CB VAL A 178 -0.809 -9.391 5.239 1.00 0.00 C ATOM 323 CG1 VAL A 178 -0.320 -10.715 4.669 1.00 0.00 C ATOM 324 CG2 VAL A 178 -0.496 -9.293 6.724 1.00 0.00 C ATOM 0 H VAL A 178 -1.626 -6.957 5.335 1.00 0.00 H new ATOM 0 HA VAL A 178 0.899 -8.220 4.633 1.00 0.00 H new ATOM 0 HB VAL A 178 -1.891 -9.347 5.115 1.00 0.00 H new ATOM 0 HG11 VAL A 178 -0.775 -11.538 5.220 1.00 0.00 H new ATOM 0 HG12 VAL A 178 -0.599 -10.784 3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 178 0.765 -10.772 4.761 1.00 0.00 H new ATOM 0 HG21 VAL A 178 -0.948 -10.135 7.247 1.00 0.00 H new ATOM 0 HG22 VAL A 178 0.584 -9.312 6.870 1.00 0.00 H new ATOM 0 HG23 VAL A 178 -0.899 -8.361 7.120 1.00 0.00 H new ATOM 334 N ALA A 179 0.577 -8.563 2.201 1.00 0.00 N ATOM 335 CA ALA A 179 0.431 -8.728 0.760 1.00 0.00 C ATOM 336 C ALA A 179 0.979 -10.076 0.304 1.00 0.00 C ATOM 337 O ALA A 179 1.802 -10.686 0.988 1.00 0.00 O ATOM 338 CB ALA A 179 1.131 -7.595 0.024 1.00 0.00 C ATOM 0 H ALA A 179 1.539 -8.614 2.536 1.00 0.00 H new ATOM 0 HA ALA A 179 -0.632 -8.698 0.522 1.00 0.00 H new ATOM 0 HB1 ALA A 179 1.013 -7.732 -1.051 1.00 0.00 H new ATOM 0 HB2 ALA A 179 0.690 -6.643 0.319 1.00 0.00 H new ATOM 0 HB3 ALA A 179 2.191 -7.598 0.276 1.00 0.00 H new ATOM 344 N ARG A 180 0.519 -10.536 -0.855 1.00 0.00 N ATOM 345 CA ARG A 180 0.962 -11.813 -1.401 1.00 0.00 C ATOM 346 C ARG A 180 1.826 -11.604 -2.641 1.00 0.00 C ATOM 347 O ARG A 180 1.707 -10.604 -3.349 1.00 0.00 O ATOM 348 CB ARG A 180 -0.243 -12.690 -1.748 1.00 0.00 C ATOM 349 CG ARG A 180 -1.047 -13.128 -0.534 1.00 0.00 C ATOM 350 CD ARG A 180 -1.788 -14.429 -0.798 1.00 0.00 C ATOM 351 NE ARG A 180 -3.072 -14.204 -1.456 1.00 0.00 N ATOM 352 CZ ARG A 180 -3.885 -15.183 -1.837 1.00 0.00 C ATOM 353 NH1 ARG A 180 -3.548 -16.448 -1.627 1.00 0.00 N ATOM 354 NH2 ARG A 180 -5.037 -14.898 -2.430 1.00 0.00 N ATOM 0 H ARG A 180 -0.161 -10.043 -1.434 1.00 0.00 H new ATOM 0 HA ARG A 180 1.562 -12.315 -0.642 1.00 0.00 H new ATOM 0 HB2 ARG A 180 -0.896 -12.143 -2.428 1.00 0.00 H new ATOM 0 HB3 ARG A 180 0.104 -13.575 -2.282 1.00 0.00 H new ATOM 0 HG2 ARG A 180 -0.381 -13.254 0.319 1.00 0.00 H new ATOM 0 HG3 ARG A 180 -1.761 -12.348 -0.268 1.00 0.00 H new ATOM 0 HD2 ARG A 180 -1.171 -15.078 -1.420 1.00 0.00 H new ATOM 0 HD3 ARG A 180 -1.950 -14.951 0.145 1.00 0.00 H new ATOM 0 HE ARG A 180 -3.361 -13.242 -1.633 1.00 0.00 H new ATOM 0 HH11 ARG A 180 -2.663 -16.671 -1.172 1.00 0.00 H new ATOM 0 HH12 ARG A 180 -4.174 -17.198 -1.920 1.00 0.00 H new ATOM 0 HH21 ARG A 180 -5.299 -13.926 -2.594 1.00 0.00 H new ATOM 0 HH22 ARG A 180 -5.660 -15.651 -2.722 1.00 0.00 H new ATOM 368 N PRO A 181 2.718 -12.568 -2.910 1.00 0.00 N ATOM 369 CA PRO A 181 3.620 -12.512 -4.065 1.00 0.00 C ATOM 370 C PRO A 181 2.881 -12.691 -5.387 1.00 0.00 C ATOM 371 O PRO A 181 3.459 -12.517 -6.459 1.00 0.00 O ATOM 372 CB PRO A 181 4.576 -13.683 -3.825 1.00 0.00 C ATOM 373 CG PRO A 181 3.805 -14.634 -2.977 1.00 0.00 C ATOM 374 CD PRO A 181 2.915 -13.788 -2.109 1.00 0.00 C ATOM 0 HA PRO A 181 4.118 -11.546 -4.146 1.00 0.00 H new ATOM 0 HB2 PRO A 181 4.878 -14.146 -4.764 1.00 0.00 H new ATOM 0 HB3 PRO A 181 5.486 -13.354 -3.324 1.00 0.00 H new ATOM 0 HG2 PRO A 181 3.217 -15.316 -3.591 1.00 0.00 H new ATOM 0 HG3 PRO A 181 4.473 -15.246 -2.371 1.00 0.00 H new ATOM 0 HD2 PRO A 181 1.969 -14.286 -1.897 1.00 0.00 H new ATOM 0 HD3 PRO A 181 3.382 -13.568 -1.149 1.00 0.00 H new ATOM 382 N GLU A 182 1.600 -13.038 -5.302 1.00 0.00 N ATOM 383 CA GLU A 182 0.783 -13.240 -6.492 1.00 0.00 C ATOM 384 C GLU A 182 -0.061 -12.003 -6.789 1.00 0.00 C ATOM 385 O GLU A 182 -0.227 -11.614 -7.945 1.00 0.00 O ATOM 386 CB GLU A 182 -0.123 -14.459 -6.315 1.00 0.00 C ATOM 387 CG GLU A 182 -1.134 -14.308 -5.191 1.00 0.00 C ATOM 388 CD GLU A 182 -1.916 -15.582 -4.935 1.00 0.00 C ATOM 389 OE1 GLU A 182 -1.308 -16.671 -4.977 1.00 0.00 O ATOM 390 OE2 GLU A 182 -3.138 -15.488 -4.693 1.00 0.00 O ATOM 0 H GLU A 182 1.106 -13.185 -4.422 1.00 0.00 H new ATOM 0 HA GLU A 182 1.452 -13.413 -7.335 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -0.655 -14.644 -7.248 1.00 0.00 H new ATOM 0 HB3 GLU A 182 0.495 -15.335 -6.121 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -0.616 -14.015 -4.278 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -1.827 -13.504 -5.437 1.00 0.00 H new ATOM 397 N ASP A 183 -0.592 -11.391 -5.736 1.00 0.00 N ATOM 398 CA ASP A 183 -1.420 -10.199 -5.882 1.00 0.00 C ATOM 399 C ASP A 183 -0.715 -9.151 -6.738 1.00 0.00 C ATOM 400 O ASP A 183 0.487 -9.242 -6.987 1.00 0.00 O ATOM 401 CB ASP A 183 -1.754 -9.614 -4.510 1.00 0.00 C ATOM 402 CG ASP A 183 -2.809 -10.420 -3.778 1.00 0.00 C ATOM 403 OD1 ASP A 183 -2.709 -11.664 -3.777 1.00 0.00 O ATOM 404 OD2 ASP A 183 -3.736 -9.806 -3.207 1.00 0.00 O ATOM 0 H ASP A 183 -0.464 -11.700 -4.773 1.00 0.00 H new ATOM 0 HA ASP A 183 -2.346 -10.487 -6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -0.848 -9.573 -3.905 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -2.103 -8.589 -4.631 1.00 0.00 H new ATOM 409 N THR A 184 -1.473 -8.155 -7.188 1.00 0.00 N ATOM 410 CA THR A 184 -0.923 -7.091 -8.017 1.00 0.00 C ATOM 411 C THR A 184 -0.835 -5.780 -7.244 1.00 0.00 C ATOM 412 O THR A 184 -1.480 -5.614 -6.208 1.00 0.00 O ATOM 413 CB THR A 184 -1.772 -6.870 -9.284 1.00 0.00 C ATOM 414 OG1 THR A 184 -3.163 -6.858 -8.945 1.00 0.00 O ATOM 415 CG2 THR A 184 -1.504 -7.959 -10.311 1.00 0.00 C ATOM 0 H THR A 184 -2.470 -8.064 -6.992 1.00 0.00 H new ATOM 0 HA THR A 184 0.079 -7.405 -8.309 1.00 0.00 H new ATOM 0 HB THR A 184 -1.496 -5.909 -9.717 1.00 0.00 H new ATOM 0 HG1 THR A 184 -3.696 -6.715 -9.755 1.00 0.00 H new ATOM 0 HG21 THR A 184 -2.114 -7.782 -11.197 1.00 0.00 H new ATOM 0 HG22 THR A 184 -0.450 -7.946 -10.588 1.00 0.00 H new ATOM 0 HG23 THR A 184 -1.755 -8.930 -9.885 1.00 0.00 H new ATOM 423 N VAL A 185 -0.033 -4.850 -7.753 1.00 0.00 N ATOM 424 CA VAL A 185 0.138 -3.553 -7.111 1.00 0.00 C ATOM 425 C VAL A 185 -1.170 -2.770 -7.097 1.00 0.00 C ATOM 426 O VAL A 185 -1.510 -2.126 -6.105 1.00 0.00 O ATOM 427 CB VAL A 185 1.218 -2.714 -7.819 1.00 0.00 C ATOM 428 CG1 VAL A 185 1.319 -1.332 -7.190 1.00 0.00 C ATOM 429 CG2 VAL A 185 2.561 -3.428 -7.774 1.00 0.00 C ATOM 0 H VAL A 185 0.509 -4.971 -8.609 1.00 0.00 H new ATOM 0 HA VAL A 185 0.453 -3.747 -6.086 1.00 0.00 H new ATOM 0 HB VAL A 185 0.931 -2.591 -8.863 1.00 0.00 H new ATOM 0 HG11 VAL A 185 2.087 -0.754 -7.703 1.00 0.00 H new ATOM 0 HG12 VAL A 185 0.360 -0.821 -7.279 1.00 0.00 H new ATOM 0 HG13 VAL A 185 1.582 -1.430 -6.137 1.00 0.00 H new ATOM 0 HG21 VAL A 185 3.313 -2.821 -8.279 1.00 0.00 H new ATOM 0 HG22 VAL A 185 2.856 -3.582 -6.736 1.00 0.00 H new ATOM 0 HG23 VAL A 185 2.477 -4.393 -8.275 1.00 0.00 H new ATOM 439 N GLY A 186 -1.901 -2.829 -8.206 1.00 0.00 N ATOM 440 CA GLY A 186 -3.165 -2.122 -8.301 1.00 0.00 C ATOM 441 C GLY A 186 -4.179 -2.608 -7.285 1.00 0.00 C ATOM 442 O GLY A 186 -4.958 -1.820 -6.747 1.00 0.00 O ATOM 0 H GLY A 186 -1.640 -3.354 -9.041 1.00 0.00 H new ATOM 0 HA2 GLY A 186 -2.993 -1.055 -8.156 1.00 0.00 H new ATOM 0 HA3 GLY A 186 -3.573 -2.246 -9.304 1.00 0.00 H new ATOM 446 N THR A 187 -4.172 -3.911 -7.021 1.00 0.00 N ATOM 447 CA THR A 187 -5.100 -4.502 -6.065 1.00 0.00 C ATOM 448 C THR A 187 -4.751 -4.097 -4.637 1.00 0.00 C ATOM 449 O THR A 187 -5.634 -3.796 -3.833 1.00 0.00 O ATOM 450 CB THR A 187 -5.105 -6.039 -6.164 1.00 0.00 C ATOM 451 OG1 THR A 187 -5.855 -6.454 -7.311 1.00 0.00 O ATOM 452 CG2 THR A 187 -5.703 -6.660 -4.910 1.00 0.00 C ATOM 0 H THR A 187 -3.534 -4.577 -7.456 1.00 0.00 H new ATOM 0 HA THR A 187 -6.092 -4.126 -6.314 1.00 0.00 H new ATOM 0 HB THR A 187 -4.074 -6.378 -6.263 1.00 0.00 H new ATOM 0 HG1 THR A 187 -5.240 -6.694 -8.035 1.00 0.00 H new ATOM 0 HG21 THR A 187 -5.696 -7.746 -5.003 1.00 0.00 H new ATOM 0 HG22 THR A 187 -5.113 -6.366 -4.042 1.00 0.00 H new ATOM 0 HG23 THR A 187 -6.729 -6.313 -4.786 1.00 0.00 H new ATOM 460 N LEU A 188 -3.459 -4.090 -4.328 1.00 0.00 N ATOM 461 CA LEU A 188 -2.993 -3.721 -2.996 1.00 0.00 C ATOM 462 C LEU A 188 -3.514 -2.343 -2.600 1.00 0.00 C ATOM 463 O LEU A 188 -4.023 -2.154 -1.495 1.00 0.00 O ATOM 464 CB LEU A 188 -1.464 -3.734 -2.948 1.00 0.00 C ATOM 465 CG LEU A 188 -0.838 -3.853 -1.558 1.00 0.00 C ATOM 466 CD1 LEU A 188 -1.108 -5.227 -0.966 1.00 0.00 C ATOM 467 CD2 LEU A 188 0.658 -3.582 -1.622 1.00 0.00 C ATOM 0 H LEU A 188 -2.716 -4.336 -4.982 1.00 0.00 H new ATOM 0 HA LEU A 188 -3.379 -4.453 -2.286 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -1.108 -4.565 -3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -1.098 -2.818 -3.412 1.00 0.00 H new ATOM 0 HG LEU A 188 -1.295 -3.105 -0.910 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -0.655 -5.292 0.023 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -2.184 -5.383 -0.883 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -0.679 -5.993 -1.613 1.00 0.00 H new ATOM 0 HD21 LEU A 188 1.087 -3.671 -0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 188 1.131 -4.306 -2.286 1.00 0.00 H new ATOM 0 HD23 LEU A 188 0.829 -2.575 -2.002 1.00 0.00 H new ATOM 479 N LYS A 189 -3.385 -1.383 -3.510 1.00 0.00 N ATOM 480 CA LYS A 189 -3.845 -0.023 -3.258 1.00 0.00 C ATOM 481 C LYS A 189 -5.336 -0.004 -2.935 1.00 0.00 C ATOM 482 O LYS A 189 -5.762 0.614 -1.959 1.00 0.00 O ATOM 483 CB LYS A 189 -3.564 0.865 -4.472 1.00 0.00 C ATOM 484 CG LYS A 189 -2.085 1.089 -4.732 1.00 0.00 C ATOM 485 CD LYS A 189 -1.833 1.550 -6.158 1.00 0.00 C ATOM 486 CE LYS A 189 -0.593 2.427 -6.250 1.00 0.00 C ATOM 487 NZ LYS A 189 0.651 1.617 -6.365 1.00 0.00 N ATOM 0 H LYS A 189 -2.965 -1.522 -4.429 1.00 0.00 H new ATOM 0 HA LYS A 189 -3.300 0.365 -2.398 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -4.015 0.412 -5.355 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.049 1.830 -4.326 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -1.701 1.833 -4.035 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -1.538 0.165 -4.545 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -1.715 0.682 -6.807 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -2.699 2.103 -6.521 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -0.678 3.087 -7.113 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -0.532 3.063 -5.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 1.467 2.191 -6.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 0.579 0.781 -5.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 0.777 1.313 -7.351 1.00 0.00 H new ATOM 501 N SER A 190 -6.125 -0.686 -3.760 1.00 0.00 N ATOM 502 CA SER A 190 -7.568 -0.745 -3.563 1.00 0.00 C ATOM 503 C SER A 190 -7.916 -1.592 -2.343 1.00 0.00 C ATOM 504 O SER A 190 -8.945 -1.384 -1.700 1.00 0.00 O ATOM 505 CB SER A 190 -8.251 -1.317 -4.807 1.00 0.00 C ATOM 506 OG SER A 190 -9.661 -1.243 -4.694 1.00 0.00 O ATOM 0 H SER A 190 -5.789 -1.205 -4.571 1.00 0.00 H new ATOM 0 HA SER A 190 -7.928 0.270 -3.394 1.00 0.00 H new ATOM 0 HB2 SER A 190 -7.925 -0.768 -5.690 1.00 0.00 H new ATOM 0 HB3 SER A 190 -7.948 -2.355 -4.947 1.00 0.00 H new ATOM 0 HG SER A 190 -9.946 -0.308 -4.760 1.00 0.00 H new ATOM 512 N LYS A 191 -7.049 -2.549 -2.029 1.00 0.00 N ATOM 513 CA LYS A 191 -7.261 -3.429 -0.885 1.00 0.00 C ATOM 514 C LYS A 191 -7.189 -2.648 0.423 1.00 0.00 C ATOM 515 O LYS A 191 -8.054 -2.787 1.288 1.00 0.00 O ATOM 516 CB LYS A 191 -6.221 -4.551 -0.879 1.00 0.00 C ATOM 517 CG LYS A 191 -6.706 -5.827 -0.213 1.00 0.00 C ATOM 518 CD LYS A 191 -6.341 -5.859 1.261 1.00 0.00 C ATOM 519 CE LYS A 191 -5.002 -6.544 1.489 1.00 0.00 C ATOM 520 NZ LYS A 191 -4.873 -7.062 2.879 1.00 0.00 N ATOM 0 H LYS A 191 -6.193 -2.735 -2.551 1.00 0.00 H new ATOM 0 HA LYS A 191 -8.256 -3.865 -0.973 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -5.934 -4.774 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -5.325 -4.202 -0.366 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -7.787 -5.908 -0.323 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -6.269 -6.690 -0.716 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -6.301 -4.841 1.649 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -7.118 -6.382 1.818 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -4.890 -7.367 0.783 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -4.195 -5.840 1.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -4.123 -6.540 3.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -5.775 -6.935 3.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -4.631 -8.073 2.852 1.00 0.00 H new ATOM 534 N TYR A 192 -6.155 -1.826 0.560 1.00 0.00 N ATOM 535 CA TYR A 192 -5.970 -1.023 1.763 1.00 0.00 C ATOM 536 C TYR A 192 -6.461 0.405 1.546 1.00 0.00 C ATOM 537 O TYR A 192 -7.145 0.975 2.396 1.00 0.00 O ATOM 538 CB TYR A 192 -4.496 -1.011 2.172 1.00 0.00 C ATOM 539 CG TYR A 192 -3.947 -2.381 2.500 1.00 0.00 C ATOM 540 CD1 TYR A 192 -4.299 -3.027 3.679 1.00 0.00 C ATOM 541 CD2 TYR A 192 -3.077 -3.029 1.632 1.00 0.00 C ATOM 542 CE1 TYR A 192 -3.799 -4.279 3.984 1.00 0.00 C ATOM 543 CE2 TYR A 192 -2.574 -4.282 1.928 1.00 0.00 C ATOM 544 CZ TYR A 192 -2.938 -4.902 3.105 1.00 0.00 C ATOM 545 OH TYR A 192 -2.438 -6.149 3.404 1.00 0.00 O ATOM 0 H TYR A 192 -5.432 -1.698 -0.148 1.00 0.00 H new ATOM 0 HA TYR A 192 -6.558 -1.472 2.563 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -3.907 -0.577 1.364 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -4.374 -0.363 3.040 1.00 0.00 H new ATOM 0 HD1 TYR A 192 -4.975 -2.543 4.369 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -2.789 -2.545 0.710 1.00 0.00 H new ATOM 0 HE1 TYR A 192 -4.081 -4.767 4.905 1.00 0.00 H new ATOM 0 HE2 TYR A 192 -1.900 -4.773 1.242 1.00 0.00 H new ATOM 0 HH TYR A 192 -2.375 -6.682 2.584 1.00 0.00 H new ATOM 555 N PHE A 193 -6.107 0.977 0.400 1.00 0.00 N ATOM 556 CA PHE A 193 -6.511 2.339 0.070 1.00 0.00 C ATOM 557 C PHE A 193 -7.485 2.348 -1.104 1.00 0.00 C ATOM 558 O PHE A 193 -7.131 2.677 -2.236 1.00 0.00 O ATOM 559 CB PHE A 193 -5.284 3.190 -0.266 1.00 0.00 C ATOM 560 CG PHE A 193 -4.112 2.934 0.638 1.00 0.00 C ATOM 561 CD1 PHE A 193 -4.213 3.148 2.003 1.00 0.00 C ATOM 562 CD2 PHE A 193 -2.908 2.480 0.123 1.00 0.00 C ATOM 563 CE1 PHE A 193 -3.137 2.913 2.838 1.00 0.00 C ATOM 564 CE2 PHE A 193 -1.829 2.244 0.952 1.00 0.00 C ATOM 565 CZ PHE A 193 -1.943 2.461 2.311 1.00 0.00 C ATOM 0 H PHE A 193 -5.542 0.519 -0.315 1.00 0.00 H new ATOM 0 HA PHE A 193 -7.013 2.763 0.940 1.00 0.00 H new ATOM 0 HB2 PHE A 193 -4.987 2.995 -1.297 1.00 0.00 H new ATOM 0 HB3 PHE A 193 -5.555 4.244 -0.207 1.00 0.00 H new ATOM 0 HD1 PHE A 193 -5.144 3.503 2.420 1.00 0.00 H new ATOM 0 HD2 PHE A 193 -2.813 2.309 -0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 193 -3.230 3.082 3.901 1.00 0.00 H new ATOM 0 HE2 PHE A 193 -0.897 1.890 0.538 1.00 0.00 H new ATOM 0 HZ PHE A 193 -1.100 2.278 2.961 1.00 0.00 H new ATOM 575 N PRO A 194 -8.745 1.976 -0.830 1.00 0.00 N ATOM 576 CA PRO A 194 -9.797 1.932 -1.849 1.00 0.00 C ATOM 577 C PRO A 194 -10.207 3.323 -2.320 1.00 0.00 C ATOM 578 O PRO A 194 -10.522 4.195 -1.511 1.00 0.00 O ATOM 579 CB PRO A 194 -10.961 1.247 -1.128 1.00 0.00 C ATOM 580 CG PRO A 194 -10.730 1.529 0.317 1.00 0.00 C ATOM 581 CD PRO A 194 -9.238 1.570 0.497 1.00 0.00 C ATOM 0 HA PRO A 194 -9.470 1.412 -2.750 1.00 0.00 H new ATOM 0 HB2 PRO A 194 -11.921 1.643 -1.460 1.00 0.00 H new ATOM 0 HB3 PRO A 194 -10.973 0.175 -1.325 1.00 0.00 H new ATOM 0 HG2 PRO A 194 -11.184 2.476 0.607 1.00 0.00 H new ATOM 0 HG3 PRO A 194 -11.177 0.756 0.942 1.00 0.00 H new ATOM 0 HD2 PRO A 194 -8.946 2.282 1.269 1.00 0.00 H new ATOM 0 HD3 PRO A 194 -8.842 0.598 0.793 1.00 0.00 H new ATOM 589 N GLY A 195 -10.201 3.524 -3.634 1.00 0.00 N ATOM 590 CA GLY A 195 -10.574 4.812 -4.189 1.00 0.00 C ATOM 591 C GLY A 195 -9.467 5.840 -4.065 1.00 0.00 C ATOM 592 O GLY A 195 -9.446 6.830 -4.796 1.00 0.00 O ATOM 0 H GLY A 195 -9.945 2.818 -4.324 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -10.835 4.689 -5.240 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -11.465 5.179 -3.680 1.00 0.00 H new ATOM 596 N GLN A 196 -8.546 5.606 -3.135 1.00 0.00 N ATOM 597 CA GLN A 196 -7.432 6.521 -2.916 1.00 0.00 C ATOM 598 C GLN A 196 -6.221 6.114 -3.748 1.00 0.00 C ATOM 599 O GLN A 196 -5.210 6.815 -3.775 1.00 0.00 O ATOM 600 CB GLN A 196 -7.059 6.558 -1.434 1.00 0.00 C ATOM 601 CG GLN A 196 -8.245 6.795 -0.513 1.00 0.00 C ATOM 602 CD GLN A 196 -8.977 8.085 -0.825 1.00 0.00 C ATOM 603 OE1 GLN A 196 -8.368 9.076 -1.230 1.00 0.00 O ATOM 604 NE2 GLN A 196 -10.292 8.080 -0.639 1.00 0.00 N ATOM 0 H GLN A 196 -8.549 4.791 -2.522 1.00 0.00 H new ATOM 0 HA GLN A 196 -7.746 7.517 -3.229 1.00 0.00 H new ATOM 0 HB2 GLN A 196 -6.583 5.615 -1.164 1.00 0.00 H new ATOM 0 HB3 GLN A 196 -6.322 7.345 -1.273 1.00 0.00 H new ATOM 0 HG2 GLN A 196 -8.939 5.958 -0.597 1.00 0.00 H new ATOM 0 HG3 GLN A 196 -7.899 6.819 0.520 1.00 0.00 H new ATOM 0 HE21 GLN A 196 -10.756 7.237 -0.302 1.00 0.00 H new ATOM 0 HE22 GLN A 196 -10.838 8.920 -0.833 1.00 0.00 H new ATOM 613 N GLU A 197 -6.331 4.975 -4.426 1.00 0.00 N ATOM 614 CA GLU A 197 -5.243 4.475 -5.258 1.00 0.00 C ATOM 615 C GLU A 197 -4.751 5.554 -6.218 1.00 0.00 C ATOM 616 O GLU A 197 -3.651 5.460 -6.763 1.00 0.00 O ATOM 617 CB GLU A 197 -5.698 3.245 -6.046 1.00 0.00 C ATOM 618 CG GLU A 197 -6.457 2.231 -5.207 1.00 0.00 C ATOM 619 CD GLU A 197 -7.955 2.467 -5.219 1.00 0.00 C ATOM 620 OE1 GLU A 197 -8.371 3.630 -5.404 1.00 0.00 O ATOM 621 OE2 GLU A 197 -8.711 1.488 -5.044 1.00 0.00 O ATOM 0 H GLU A 197 -7.161 4.382 -4.415 1.00 0.00 H new ATOM 0 HA GLU A 197 -4.419 4.194 -4.602 1.00 0.00 H new ATOM 0 HB2 GLU A 197 -6.332 3.567 -6.872 1.00 0.00 H new ATOM 0 HB3 GLU A 197 -4.825 2.761 -6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 197 -6.248 1.228 -5.579 1.00 0.00 H new ATOM 0 HG3 GLU A 197 -6.095 2.271 -4.180 1.00 0.00 H new ATOM 628 N SER A 198 -5.574 6.578 -6.420 1.00 0.00 N ATOM 629 CA SER A 198 -5.225 7.674 -7.317 1.00 0.00 C ATOM 630 C SER A 198 -3.991 8.416 -6.813 1.00 0.00 C ATOM 631 O SER A 198 -2.984 8.514 -7.515 1.00 0.00 O ATOM 632 CB SER A 198 -6.399 8.645 -7.450 1.00 0.00 C ATOM 633 OG SER A 198 -7.469 8.056 -8.169 1.00 0.00 O ATOM 0 H SER A 198 -6.487 6.672 -5.975 1.00 0.00 H new ATOM 0 HA SER A 198 -4.999 7.252 -8.296 1.00 0.00 H new ATOM 0 HB2 SER A 198 -6.743 8.943 -6.459 1.00 0.00 H new ATOM 0 HB3 SER A 198 -6.070 9.551 -7.959 1.00 0.00 H new ATOM 0 HG SER A 198 -8.208 8.696 -8.239 1.00 0.00 H new ATOM 639 N GLN A 199 -4.078 8.937 -5.594 1.00 0.00 N ATOM 640 CA GLN A 199 -2.969 9.672 -4.996 1.00 0.00 C ATOM 641 C GLN A 199 -2.003 8.723 -4.295 1.00 0.00 C ATOM 642 O GLN A 199 -0.790 8.931 -4.315 1.00 0.00 O ATOM 643 CB GLN A 199 -3.494 10.711 -4.004 1.00 0.00 C ATOM 644 CG GLN A 199 -4.751 11.422 -4.476 1.00 0.00 C ATOM 645 CD GLN A 199 -4.448 12.674 -5.275 1.00 0.00 C ATOM 646 OE1 GLN A 199 -3.319 12.882 -5.721 1.00 0.00 O ATOM 647 NE2 GLN A 199 -5.457 13.517 -5.462 1.00 0.00 N ATOM 0 H GLN A 199 -4.904 8.864 -5.001 1.00 0.00 H new ATOM 0 HA GLN A 199 -2.431 10.183 -5.795 1.00 0.00 H new ATOM 0 HB2 GLN A 199 -3.699 10.221 -3.052 1.00 0.00 H new ATOM 0 HB3 GLN A 199 -2.715 11.451 -3.820 1.00 0.00 H new ATOM 0 HG2 GLN A 199 -5.342 10.740 -5.087 1.00 0.00 H new ATOM 0 HG3 GLN A 199 -5.361 11.686 -3.612 1.00 0.00 H new ATOM 0 HE21 GLN A 199 -6.377 13.306 -5.075 1.00 0.00 H new ATOM 0 HE22 GLN A 199 -5.312 14.376 -5.993 1.00 0.00 H new ATOM 656 N MET A 200 -2.549 7.682 -3.675 1.00 0.00 N ATOM 657 CA MET A 200 -1.735 6.701 -2.968 1.00 0.00 C ATOM 658 C MET A 200 -0.746 6.030 -3.916 1.00 0.00 C ATOM 659 O MET A 200 -1.054 5.008 -4.529 1.00 0.00 O ATOM 660 CB MET A 200 -2.626 5.645 -2.311 1.00 0.00 C ATOM 661 CG MET A 200 -3.251 6.105 -1.004 1.00 0.00 C ATOM 662 SD MET A 200 -3.796 7.823 -1.062 1.00 0.00 S ATOM 663 CE MET A 200 -2.352 8.659 -0.411 1.00 0.00 C ATOM 0 H MET A 200 -3.552 7.496 -3.648 1.00 0.00 H new ATOM 0 HA MET A 200 -1.172 7.223 -2.194 1.00 0.00 H new ATOM 0 HB2 MET A 200 -3.419 5.367 -3.005 1.00 0.00 H new ATOM 0 HB3 MET A 200 -2.036 4.748 -2.126 1.00 0.00 H new ATOM 0 HG2 MET A 200 -4.102 5.466 -0.768 1.00 0.00 H new ATOM 0 HG3 MET A 200 -2.528 5.984 -0.198 1.00 0.00 H new ATOM 0 HE1 MET A 200 -2.661 9.394 0.332 1.00 0.00 H new ATOM 0 HE2 MET A 200 -1.688 7.930 0.054 1.00 0.00 H new ATOM 0 HE3 MET A 200 -1.827 9.163 -1.222 1.00 0.00 H new ATOM 673 N LYS A 201 0.443 6.611 -4.032 1.00 0.00 N ATOM 674 CA LYS A 201 1.478 6.070 -4.904 1.00 0.00 C ATOM 675 C LYS A 201 2.548 5.345 -4.094 1.00 0.00 C ATOM 676 O LYS A 201 3.139 5.915 -3.176 1.00 0.00 O ATOM 677 CB LYS A 201 2.119 7.191 -5.726 1.00 0.00 C ATOM 678 CG LYS A 201 1.360 7.521 -7.000 1.00 0.00 C ATOM 679 CD LYS A 201 2.108 8.536 -7.848 1.00 0.00 C ATOM 680 CE LYS A 201 1.384 8.809 -9.158 1.00 0.00 C ATOM 681 NZ LYS A 201 1.628 10.195 -9.647 1.00 0.00 N ATOM 0 H LYS A 201 0.714 7.458 -3.532 1.00 0.00 H new ATOM 0 HA LYS A 201 1.010 5.354 -5.579 1.00 0.00 H new ATOM 0 HB2 LYS A 201 2.187 8.088 -5.111 1.00 0.00 H new ATOM 0 HB3 LYS A 201 3.138 6.904 -5.984 1.00 0.00 H new ATOM 0 HG2 LYS A 201 1.202 6.610 -7.577 1.00 0.00 H new ATOM 0 HG3 LYS A 201 0.375 7.913 -6.747 1.00 0.00 H new ATOM 0 HD2 LYS A 201 2.218 9.466 -7.291 1.00 0.00 H new ATOM 0 HD3 LYS A 201 3.113 8.168 -8.056 1.00 0.00 H new ATOM 0 HE2 LYS A 201 1.715 8.094 -9.912 1.00 0.00 H new ATOM 0 HE3 LYS A 201 0.314 8.655 -9.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 1.118 10.342 -10.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 1.290 10.878 -8.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 2.647 10.334 -9.802 1.00 0.00 H new ATOM 695 N LEU A 202 2.793 4.086 -4.441 1.00 0.00 N ATOM 696 CA LEU A 202 3.794 3.282 -3.746 1.00 0.00 C ATOM 697 C LEU A 202 5.092 3.220 -4.545 1.00 0.00 C ATOM 698 O LEU A 202 5.072 3.099 -5.771 1.00 0.00 O ATOM 699 CB LEU A 202 3.262 1.869 -3.503 1.00 0.00 C ATOM 700 CG LEU A 202 2.082 1.752 -2.539 1.00 0.00 C ATOM 701 CD1 LEU A 202 0.851 2.434 -3.117 1.00 0.00 C ATOM 702 CD2 LEU A 202 1.789 0.292 -2.228 1.00 0.00 C ATOM 0 H LEU A 202 2.313 3.600 -5.198 1.00 0.00 H new ATOM 0 HA LEU A 202 4.002 3.754 -2.786 1.00 0.00 H new ATOM 0 HB2 LEU A 202 2.965 1.444 -4.462 1.00 0.00 H new ATOM 0 HB3 LEU A 202 4.079 1.256 -3.122 1.00 0.00 H new ATOM 0 HG LEU A 202 2.347 2.254 -1.608 1.00 0.00 H new ATOM 0 HD11 LEU A 202 0.021 2.341 -2.417 1.00 0.00 H new ATOM 0 HD12 LEU A 202 1.066 3.489 -3.287 1.00 0.00 H new ATOM 0 HD13 LEU A 202 0.583 1.962 -4.062 1.00 0.00 H new ATOM 0 HD21 LEU A 202 0.946 0.229 -1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 202 1.545 -0.235 -3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 202 2.666 -0.166 -1.770 1.00 0.00 H new ATOM 714 N ILE A 203 6.217 3.300 -3.843 1.00 0.00 N ATOM 715 CA ILE A 203 7.524 3.249 -4.487 1.00 0.00 C ATOM 716 C ILE A 203 8.425 2.215 -3.820 1.00 0.00 C ATOM 717 O ILE A 203 8.675 2.279 -2.616 1.00 0.00 O ATOM 718 CB ILE A 203 8.222 4.621 -4.453 1.00 0.00 C ATOM 719 CG1 ILE A 203 7.377 5.666 -5.184 1.00 0.00 C ATOM 720 CG2 ILE A 203 9.608 4.525 -5.073 1.00 0.00 C ATOM 721 CD1 ILE A 203 7.550 7.068 -4.644 1.00 0.00 C ATOM 0 H ILE A 203 6.250 3.400 -2.828 1.00 0.00 H new ATOM 0 HA ILE A 203 7.354 2.963 -5.525 1.00 0.00 H new ATOM 0 HB ILE A 203 8.330 4.931 -3.414 1.00 0.00 H new ATOM 0 HG12 ILE A 203 7.639 5.658 -6.242 1.00 0.00 H new ATOM 0 HG13 ILE A 203 6.326 5.385 -5.114 1.00 0.00 H new ATOM 0 HG21 ILE A 203 10.089 5.503 -5.042 1.00 0.00 H new ATOM 0 HG22 ILE A 203 10.208 3.807 -4.513 1.00 0.00 H new ATOM 0 HG23 ILE A 203 9.521 4.196 -6.109 1.00 0.00 H new ATOM 0 HD11 ILE A 203 6.921 7.756 -5.209 1.00 0.00 H new ATOM 0 HD12 ILE A 203 7.260 7.092 -3.594 1.00 0.00 H new ATOM 0 HD13 ILE A 203 8.593 7.368 -4.739 1.00 0.00 H new ATOM 733 N TYR A 204 8.912 1.265 -4.610 1.00 0.00 N ATOM 734 CA TYR A 204 9.786 0.217 -4.097 1.00 0.00 C ATOM 735 C TYR A 204 11.203 0.375 -4.639 1.00 0.00 C ATOM 736 O TYR A 204 11.438 0.236 -5.839 1.00 0.00 O ATOM 737 CB TYR A 204 9.236 -1.161 -4.467 1.00 0.00 C ATOM 738 CG TYR A 204 10.109 -2.306 -4.003 1.00 0.00 C ATOM 739 CD1 TYR A 204 9.975 -2.834 -2.725 1.00 0.00 C ATOM 740 CD2 TYR A 204 11.066 -2.860 -4.844 1.00 0.00 C ATOM 741 CE1 TYR A 204 10.771 -3.879 -2.297 1.00 0.00 C ATOM 742 CE2 TYR A 204 11.865 -3.906 -4.425 1.00 0.00 C ATOM 743 CZ TYR A 204 11.714 -4.412 -3.151 1.00 0.00 C ATOM 744 OH TYR A 204 12.508 -5.454 -2.729 1.00 0.00 O ATOM 0 H TYR A 204 8.716 1.199 -5.609 1.00 0.00 H new ATOM 0 HA TYR A 204 9.821 0.307 -3.011 1.00 0.00 H new ATOM 0 HB2 TYR A 204 8.242 -1.274 -4.034 1.00 0.00 H new ATOM 0 HB3 TYR A 204 9.121 -1.218 -5.549 1.00 0.00 H new ATOM 0 HD1 TYR A 204 9.236 -2.421 -2.055 1.00 0.00 H new ATOM 0 HD2 TYR A 204 11.187 -2.466 -5.842 1.00 0.00 H new ATOM 0 HE1 TYR A 204 10.656 -4.276 -1.299 1.00 0.00 H new ATOM 0 HE2 TYR A 204 12.604 -4.325 -5.092 1.00 0.00 H new ATOM 0 HH TYR A 204 12.041 -6.303 -2.879 1.00 0.00 H new ATOM 754 N GLN A 205 12.143 0.665 -3.746 1.00 0.00 N ATOM 755 CA GLN A 205 13.537 0.841 -4.135 1.00 0.00 C ATOM 756 C GLN A 205 13.690 2.016 -5.096 1.00 0.00 C ATOM 757 O GLN A 205 14.333 1.898 -6.138 1.00 0.00 O ATOM 758 CB GLN A 205 14.074 -0.436 -4.782 1.00 0.00 C ATOM 759 CG GLN A 205 14.299 -1.571 -3.796 1.00 0.00 C ATOM 760 CD GLN A 205 15.323 -2.575 -4.285 1.00 0.00 C ATOM 761 OE1 GLN A 205 16.048 -2.321 -5.247 1.00 0.00 O ATOM 762 NE2 GLN A 205 15.389 -3.724 -3.623 1.00 0.00 N ATOM 0 H GLN A 205 11.965 0.783 -2.749 1.00 0.00 H new ATOM 0 HA GLN A 205 14.114 1.054 -3.235 1.00 0.00 H new ATOM 0 HB2 GLN A 205 13.374 -0.766 -5.549 1.00 0.00 H new ATOM 0 HB3 GLN A 205 15.015 -0.211 -5.284 1.00 0.00 H new ATOM 0 HG2 GLN A 205 14.627 -1.158 -2.842 1.00 0.00 H new ATOM 0 HG3 GLN A 205 13.353 -2.082 -3.614 1.00 0.00 H new ATOM 0 HE21 GLN A 205 14.769 -3.893 -2.831 1.00 0.00 H new ATOM 0 HE22 GLN A 205 16.060 -4.438 -3.906 1.00 0.00 H new ATOM 771 N GLY A 206 13.094 3.149 -4.737 1.00 0.00 N ATOM 772 CA GLY A 206 13.175 4.328 -5.579 1.00 0.00 C ATOM 773 C GLY A 206 12.404 4.170 -6.875 1.00 0.00 C ATOM 774 O GLY A 206 12.409 5.064 -7.721 1.00 0.00 O ATOM 0 H GLY A 206 12.557 3.271 -3.879 1.00 0.00 H new ATOM 0 HA2 GLY A 206 12.788 5.188 -5.032 1.00 0.00 H new ATOM 0 HA3 GLY A 206 14.220 4.538 -5.805 1.00 0.00 H new ATOM 778 N ARG A 207 11.740 3.029 -7.031 1.00 0.00 N ATOM 779 CA ARG A 207 10.963 2.756 -8.234 1.00 0.00 C ATOM 780 C ARG A 207 9.468 2.877 -7.954 1.00 0.00 C ATOM 781 O ARG A 207 8.971 2.371 -6.947 1.00 0.00 O ATOM 782 CB ARG A 207 11.282 1.358 -8.766 1.00 0.00 C ATOM 783 CG ARG A 207 11.079 1.216 -10.266 1.00 0.00 C ATOM 784 CD ARG A 207 10.693 -0.205 -10.644 1.00 0.00 C ATOM 785 NE ARG A 207 10.775 -0.430 -12.084 1.00 0.00 N ATOM 786 CZ ARG A 207 10.638 -1.624 -12.651 1.00 0.00 C ATOM 787 NH1 ARG A 207 10.413 -2.695 -11.902 1.00 0.00 N ATOM 788 NH2 ARG A 207 10.726 -1.748 -13.969 1.00 0.00 N ATOM 0 H ARG A 207 11.725 2.279 -6.340 1.00 0.00 H new ATOM 0 HA ARG A 207 11.235 3.495 -8.988 1.00 0.00 H new ATOM 0 HB2 ARG A 207 12.316 1.113 -8.523 1.00 0.00 H new ATOM 0 HB3 ARG A 207 10.653 0.631 -8.252 1.00 0.00 H new ATOM 0 HG2 ARG A 207 10.302 1.905 -10.596 1.00 0.00 H new ATOM 0 HG3 ARG A 207 11.995 1.496 -10.786 1.00 0.00 H new ATOM 0 HD2 ARG A 207 11.349 -0.908 -10.130 1.00 0.00 H new ATOM 0 HD3 ARG A 207 9.678 -0.408 -10.303 1.00 0.00 H new ATOM 0 HE ARG A 207 10.947 0.374 -12.688 1.00 0.00 H new ATOM 0 HH11 ARG A 207 10.345 -2.603 -10.888 1.00 0.00 H new ATOM 0 HH12 ARG A 207 10.308 -3.610 -12.339 1.00 0.00 H new ATOM 0 HH21 ARG A 207 10.899 -0.926 -14.548 1.00 0.00 H new ATOM 0 HH22 ARG A 207 10.621 -2.665 -14.403 1.00 0.00 H new ATOM 802 N LEU A 208 8.756 3.550 -8.852 1.00 0.00 N ATOM 803 CA LEU A 208 7.317 3.738 -8.702 1.00 0.00 C ATOM 804 C LEU A 208 6.554 2.511 -9.191 1.00 0.00 C ATOM 805 O LEU A 208 6.735 2.065 -10.325 1.00 0.00 O ATOM 806 CB LEU A 208 6.862 4.978 -9.475 1.00 0.00 C ATOM 807 CG LEU A 208 5.389 5.360 -9.323 1.00 0.00 C ATOM 808 CD1 LEU A 208 5.035 5.547 -7.856 1.00 0.00 C ATOM 809 CD2 LEU A 208 5.082 6.623 -10.113 1.00 0.00 C ATOM 0 H LEU A 208 9.152 3.974 -9.691 1.00 0.00 H new ATOM 0 HA LEU A 208 7.102 3.878 -7.643 1.00 0.00 H new ATOM 0 HB2 LEU A 208 7.471 5.824 -9.156 1.00 0.00 H new ATOM 0 HB3 LEU A 208 7.068 4.818 -10.533 1.00 0.00 H new ATOM 0 HG LEU A 208 4.780 4.549 -9.722 1.00 0.00 H new ATOM 0 HD11 LEU A 208 3.983 5.819 -7.767 1.00 0.00 H new ATOM 0 HD12 LEU A 208 5.217 4.617 -7.317 1.00 0.00 H new ATOM 0 HD13 LEU A 208 5.651 6.339 -7.431 1.00 0.00 H new ATOM 0 HD21 LEU A 208 4.030 6.880 -9.993 1.00 0.00 H new ATOM 0 HD22 LEU A 208 5.700 7.442 -9.744 1.00 0.00 H new ATOM 0 HD23 LEU A 208 5.296 6.453 -11.168 1.00 0.00 H new ATOM 821 N LEU A 209 5.699 1.971 -8.330 1.00 0.00 N ATOM 822 CA LEU A 209 4.905 0.797 -8.674 1.00 0.00 C ATOM 823 C LEU A 209 3.742 1.174 -9.586 1.00 0.00 C ATOM 824 O LEU A 209 2.602 0.773 -9.350 1.00 0.00 O ATOM 825 CB LEU A 209 4.377 0.124 -7.406 1.00 0.00 C ATOM 826 CG LEU A 209 5.373 -0.012 -6.254 1.00 0.00 C ATOM 827 CD1 LEU A 209 4.894 -1.054 -5.255 1.00 0.00 C ATOM 828 CD2 LEU A 209 6.754 -0.371 -6.782 1.00 0.00 C ATOM 0 H LEU A 209 5.538 2.328 -7.388 1.00 0.00 H new ATOM 0 HA LEU A 209 5.549 0.098 -9.208 1.00 0.00 H new ATOM 0 HB2 LEU A 209 3.516 0.689 -7.050 1.00 0.00 H new ATOM 0 HB3 LEU A 209 4.018 -0.871 -7.669 1.00 0.00 H new ATOM 0 HG LEU A 209 5.441 0.948 -5.742 1.00 0.00 H new ATOM 0 HD11 LEU A 209 5.615 -1.137 -4.442 1.00 0.00 H new ATOM 0 HD12 LEU A 209 3.926 -0.754 -4.852 1.00 0.00 H new ATOM 0 HD13 LEU A 209 4.796 -2.018 -5.754 1.00 0.00 H new ATOM 0 HD21 LEU A 209 7.450 -0.464 -5.948 1.00 0.00 H new ATOM 0 HD22 LEU A 209 6.703 -1.318 -7.319 1.00 0.00 H new ATOM 0 HD23 LEU A 209 7.100 0.411 -7.458 1.00 0.00 H new ATOM 840 N GLN A 210 4.039 1.945 -10.627 1.00 0.00 N ATOM 841 CA GLN A 210 3.017 2.374 -11.575 1.00 0.00 C ATOM 842 C GLN A 210 2.191 1.187 -12.060 1.00 0.00 C ATOM 843 O GLN A 210 1.036 1.021 -11.668 1.00 0.00 O ATOM 844 CB GLN A 210 3.663 3.083 -12.767 1.00 0.00 C ATOM 845 CG GLN A 210 4.040 4.528 -12.484 1.00 0.00 C ATOM 846 CD GLN A 210 4.001 5.395 -13.727 1.00 0.00 C ATOM 847 OE1 GLN A 210 4.778 5.197 -14.661 1.00 0.00 O ATOM 848 NE2 GLN A 210 3.093 6.363 -13.745 1.00 0.00 N ATOM 0 H GLN A 210 4.978 2.285 -10.835 1.00 0.00 H new ATOM 0 HA GLN A 210 2.352 3.070 -11.064 1.00 0.00 H new ATOM 0 HB2 GLN A 210 4.557 2.535 -13.064 1.00 0.00 H new ATOM 0 HB3 GLN A 210 2.975 3.054 -13.612 1.00 0.00 H new ATOM 0 HG2 GLN A 210 3.359 4.938 -11.738 1.00 0.00 H new ATOM 0 HG3 GLN A 210 5.041 4.561 -12.054 1.00 0.00 H new ATOM 0 HE21 GLN A 210 2.469 6.492 -12.949 1.00 0.00 H new ATOM 0 HE22 GLN A 210 3.019 6.978 -14.555 1.00 0.00 H new ATOM 857 N ASP A 211 2.791 0.365 -12.914 1.00 0.00 N ATOM 858 CA ASP A 211 2.111 -0.807 -13.452 1.00 0.00 C ATOM 859 C ASP A 211 1.302 -1.512 -12.368 1.00 0.00 C ATOM 860 O ASP A 211 1.839 -2.240 -11.533 1.00 0.00 O ATOM 861 CB ASP A 211 3.126 -1.777 -14.060 1.00 0.00 C ATOM 862 CG ASP A 211 3.878 -1.171 -15.229 1.00 0.00 C ATOM 863 OD1 ASP A 211 3.381 -1.270 -16.370 1.00 0.00 O ATOM 864 OD2 ASP A 211 4.964 -0.597 -15.002 1.00 0.00 O ATOM 0 H ASP A 211 3.747 0.489 -13.248 1.00 0.00 H new ATOM 0 HA ASP A 211 1.426 -0.473 -14.231 1.00 0.00 H new ATOM 0 HB2 ASP A 211 3.838 -2.082 -13.293 1.00 0.00 H new ATOM 0 HB3 ASP A 211 2.610 -2.678 -14.392 1.00 0.00 H new ATOM 869 N PRO A 212 -0.021 -1.291 -12.378 1.00 0.00 N ATOM 870 CA PRO A 212 -0.932 -1.895 -11.402 1.00 0.00 C ATOM 871 C PRO A 212 -1.083 -3.399 -11.603 1.00 0.00 C ATOM 872 O PRO A 212 -1.807 -4.064 -10.863 1.00 0.00 O ATOM 873 CB PRO A 212 -2.261 -1.183 -11.669 1.00 0.00 C ATOM 874 CG PRO A 212 -2.178 -0.747 -13.092 1.00 0.00 C ATOM 875 CD PRO A 212 -0.729 -0.434 -13.344 1.00 0.00 C ATOM 0 HA PRO A 212 -0.569 -1.780 -10.381 1.00 0.00 H new ATOM 0 HB2 PRO A 212 -3.107 -1.851 -11.508 1.00 0.00 H new ATOM 0 HB3 PRO A 212 -2.395 -0.332 -11.001 1.00 0.00 H new ATOM 0 HG2 PRO A 212 -2.530 -1.531 -13.762 1.00 0.00 H new ATOM 0 HG3 PRO A 212 -2.803 0.128 -13.269 1.00 0.00 H new ATOM 0 HD2 PRO A 212 -0.441 -0.663 -14.370 1.00 0.00 H new ATOM 0 HD3 PRO A 212 -0.511 0.621 -13.180 1.00 0.00 H new ATOM 883 N ALA A 213 -0.396 -3.928 -12.610 1.00 0.00 N ATOM 884 CA ALA A 213 -0.452 -5.354 -12.907 1.00 0.00 C ATOM 885 C ALA A 213 0.804 -6.067 -12.416 1.00 0.00 C ATOM 886 O ALA A 213 0.785 -7.270 -12.158 1.00 0.00 O ATOM 887 CB ALA A 213 -0.638 -5.576 -14.401 1.00 0.00 C ATOM 0 H ALA A 213 0.206 -3.390 -13.234 1.00 0.00 H new ATOM 0 HA ALA A 213 -1.307 -5.776 -12.379 1.00 0.00 H new ATOM 0 HB1 ALA A 213 -0.678 -6.645 -14.608 1.00 0.00 H new ATOM 0 HB2 ALA A 213 -1.568 -5.109 -14.725 1.00 0.00 H new ATOM 0 HB3 ALA A 213 0.198 -5.133 -14.942 1.00 0.00 H new ATOM 893 N ARG A 214 1.893 -5.317 -12.291 1.00 0.00 N ATOM 894 CA ARG A 214 3.159 -5.878 -11.834 1.00 0.00 C ATOM 895 C ARG A 214 2.971 -6.652 -10.532 1.00 0.00 C ATOM 896 O ARG A 214 2.626 -6.078 -9.499 1.00 0.00 O ATOM 897 CB ARG A 214 4.191 -4.767 -11.634 1.00 0.00 C ATOM 898 CG ARG A 214 5.000 -4.456 -12.882 1.00 0.00 C ATOM 899 CD ARG A 214 6.264 -5.299 -12.952 1.00 0.00 C ATOM 900 NE ARG A 214 7.159 -4.857 -14.018 1.00 0.00 N ATOM 901 CZ ARG A 214 7.049 -5.254 -15.281 1.00 0.00 C ATOM 902 NH1 ARG A 214 6.088 -6.097 -15.633 1.00 0.00 N ATOM 903 NH2 ARG A 214 7.902 -4.808 -16.194 1.00 0.00 N ATOM 0 H ARG A 214 1.925 -4.319 -12.500 1.00 0.00 H new ATOM 0 HA ARG A 214 3.520 -6.566 -12.598 1.00 0.00 H new ATOM 0 HB2 ARG A 214 3.679 -3.862 -11.308 1.00 0.00 H new ATOM 0 HB3 ARG A 214 4.871 -5.055 -10.832 1.00 0.00 H new ATOM 0 HG2 ARG A 214 4.390 -4.639 -13.767 1.00 0.00 H new ATOM 0 HG3 ARG A 214 5.266 -3.399 -12.891 1.00 0.00 H new ATOM 0 HD2 ARG A 214 6.786 -5.249 -11.997 1.00 0.00 H new ATOM 0 HD3 ARG A 214 5.995 -6.343 -13.114 1.00 0.00 H new ATOM 0 HE ARG A 214 7.909 -4.208 -13.780 1.00 0.00 H new ATOM 0 HH11 ARG A 214 5.431 -6.442 -14.933 1.00 0.00 H new ATOM 0 HH12 ARG A 214 6.006 -6.400 -16.603 1.00 0.00 H new ATOM 0 HH21 ARG A 214 8.643 -4.160 -15.926 1.00 0.00 H new ATOM 0 HH22 ARG A 214 7.817 -5.113 -17.164 1.00 0.00 H new ATOM 917 N THR A 215 3.200 -7.961 -10.590 1.00 0.00 N ATOM 918 CA THR A 215 3.055 -8.814 -9.418 1.00 0.00 C ATOM 919 C THR A 215 4.054 -8.432 -8.332 1.00 0.00 C ATOM 920 O THR A 215 5.142 -7.932 -8.623 1.00 0.00 O ATOM 921 CB THR A 215 3.247 -10.300 -9.777 1.00 0.00 C ATOM 922 OG1 THR A 215 4.375 -10.451 -10.646 1.00 0.00 O ATOM 923 CG2 THR A 215 2.003 -10.859 -10.450 1.00 0.00 C ATOM 0 H THR A 215 3.487 -8.452 -11.437 1.00 0.00 H new ATOM 0 HA THR A 215 2.042 -8.666 -9.044 1.00 0.00 H new ATOM 0 HB THR A 215 3.422 -10.855 -8.855 1.00 0.00 H new ATOM 0 HG1 THR A 215 4.426 -11.379 -10.958 1.00 0.00 H new ATOM 0 HG21 THR A 215 2.162 -11.909 -10.694 1.00 0.00 H new ATOM 0 HG22 THR A 215 1.152 -10.768 -9.775 1.00 0.00 H new ATOM 0 HG23 THR A 215 1.802 -10.300 -11.364 1.00 0.00 H new ATOM 931 N LEU A 216 3.680 -8.671 -7.080 1.00 0.00 N ATOM 932 CA LEU A 216 4.545 -8.352 -5.949 1.00 0.00 C ATOM 933 C LEU A 216 5.818 -9.192 -5.983 1.00 0.00 C ATOM 934 O LEU A 216 6.890 -8.728 -5.597 1.00 0.00 O ATOM 935 CB LEU A 216 3.802 -8.584 -4.632 1.00 0.00 C ATOM 936 CG LEU A 216 2.311 -8.248 -4.634 1.00 0.00 C ATOM 937 CD1 LEU A 216 1.841 -7.896 -3.232 1.00 0.00 C ATOM 938 CD2 LEU A 216 2.023 -7.105 -5.598 1.00 0.00 C ATOM 0 H LEU A 216 2.784 -9.084 -6.822 1.00 0.00 H new ATOM 0 HA LEU A 216 4.824 -7.301 -6.021 1.00 0.00 H new ATOM 0 HB2 LEU A 216 3.917 -9.631 -4.353 1.00 0.00 H new ATOM 0 HB3 LEU A 216 4.286 -7.992 -3.856 1.00 0.00 H new ATOM 0 HG LEU A 216 1.761 -9.127 -4.969 1.00 0.00 H new ATOM 0 HD11 LEU A 216 0.777 -7.660 -3.253 1.00 0.00 H new ATOM 0 HD12 LEU A 216 2.011 -8.743 -2.568 1.00 0.00 H new ATOM 0 HD13 LEU A 216 2.397 -7.032 -2.868 1.00 0.00 H new ATOM 0 HD21 LEU A 216 0.957 -6.879 -5.586 1.00 0.00 H new ATOM 0 HD22 LEU A 216 2.584 -6.222 -5.293 1.00 0.00 H new ATOM 0 HD23 LEU A 216 2.322 -7.395 -6.605 1.00 0.00 H new ATOM 950 N SER A 217 5.691 -10.430 -6.450 1.00 0.00 N ATOM 951 CA SER A 217 6.831 -11.336 -6.533 1.00 0.00 C ATOM 952 C SER A 217 7.875 -10.807 -7.512 1.00 0.00 C ATOM 953 O SER A 217 9.069 -10.785 -7.211 1.00 0.00 O ATOM 954 CB SER A 217 6.371 -12.730 -6.966 1.00 0.00 C ATOM 955 OG SER A 217 7.445 -13.654 -6.935 1.00 0.00 O ATOM 0 H SER A 217 4.811 -10.829 -6.777 1.00 0.00 H new ATOM 0 HA SER A 217 7.285 -11.401 -5.544 1.00 0.00 H new ATOM 0 HB2 SER A 217 5.573 -13.073 -6.308 1.00 0.00 H new ATOM 0 HB3 SER A 217 5.956 -12.683 -7.973 1.00 0.00 H new ATOM 0 HG SER A 217 7.125 -14.537 -7.214 1.00 0.00 H new ATOM 961 N SER A 218 7.416 -10.381 -8.684 1.00 0.00 N ATOM 962 CA SER A 218 8.310 -9.855 -9.709 1.00 0.00 C ATOM 963 C SER A 218 9.016 -8.595 -9.219 1.00 0.00 C ATOM 964 O SER A 218 10.181 -8.356 -9.543 1.00 0.00 O ATOM 965 CB SER A 218 7.529 -9.550 -10.989 1.00 0.00 C ATOM 966 OG SER A 218 7.227 -10.740 -11.698 1.00 0.00 O ATOM 0 H SER A 218 6.431 -10.390 -8.948 1.00 0.00 H new ATOM 0 HA SER A 218 9.063 -10.613 -9.923 1.00 0.00 H new ATOM 0 HB2 SER A 218 6.606 -9.027 -10.740 1.00 0.00 H new ATOM 0 HB3 SER A 218 8.112 -8.883 -11.624 1.00 0.00 H new ATOM 0 HG SER A 218 6.287 -10.978 -11.553 1.00 0.00 H new ATOM 972 N LEU A 219 8.304 -7.791 -8.437 1.00 0.00 N ATOM 973 CA LEU A 219 8.861 -6.554 -7.901 1.00 0.00 C ATOM 974 C LEU A 219 9.801 -6.841 -6.735 1.00 0.00 C ATOM 975 O LEU A 219 10.310 -5.922 -6.094 1.00 0.00 O ATOM 976 CB LEU A 219 7.738 -5.619 -7.448 1.00 0.00 C ATOM 977 CG LEU A 219 6.775 -5.150 -8.539 1.00 0.00 C ATOM 978 CD1 LEU A 219 5.491 -4.616 -7.923 1.00 0.00 C ATOM 979 CD2 LEU A 219 7.432 -4.090 -9.410 1.00 0.00 C ATOM 0 H LEU A 219 7.339 -7.974 -8.160 1.00 0.00 H new ATOM 0 HA LEU A 219 9.431 -6.068 -8.693 1.00 0.00 H new ATOM 0 HB2 LEU A 219 7.161 -6.125 -6.675 1.00 0.00 H new ATOM 0 HB3 LEU A 219 8.188 -4.740 -6.986 1.00 0.00 H new ATOM 0 HG LEU A 219 6.524 -6.004 -9.168 1.00 0.00 H new ATOM 0 HD11 LEU A 219 4.817 -4.287 -8.714 1.00 0.00 H new ATOM 0 HD12 LEU A 219 5.011 -5.404 -7.342 1.00 0.00 H new ATOM 0 HD13 LEU A 219 5.723 -3.774 -7.270 1.00 0.00 H new ATOM 0 HD21 LEU A 219 6.732 -3.768 -10.181 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.712 -3.235 -8.794 1.00 0.00 H new ATOM 0 HD23 LEU A 219 8.323 -4.506 -9.880 1.00 0.00 H new ATOM 991 N ASN A 220 10.029 -8.122 -6.467 1.00 0.00 N ATOM 992 CA ASN A 220 10.910 -8.530 -5.378 1.00 0.00 C ATOM 993 C ASN A 220 10.360 -8.069 -4.032 1.00 0.00 C ATOM 994 O ASN A 220 11.114 -7.648 -3.154 1.00 0.00 O ATOM 995 CB ASN A 220 12.314 -7.962 -5.590 1.00 0.00 C ATOM 996 CG ASN A 220 12.906 -8.366 -6.926 1.00 0.00 C ATOM 997 OD1 ASN A 220 12.951 -7.571 -7.864 1.00 0.00 O ATOM 998 ND2 ASN A 220 13.364 -9.609 -7.018 1.00 0.00 N ATOM 0 H ASN A 220 9.616 -8.896 -6.988 1.00 0.00 H new ATOM 0 HA ASN A 220 10.963 -9.619 -5.375 1.00 0.00 H new ATOM 0 HB2 ASN A 220 12.276 -6.875 -5.526 1.00 0.00 H new ATOM 0 HB3 ASN A 220 12.967 -8.306 -4.788 1.00 0.00 H new ATOM 0 HD21 ASN A 220 13.773 -9.938 -7.892 1.00 0.00 H new ATOM 0 HD22 ASN A 220 13.306 -10.235 -6.214 1.00 0.00 H new ATOM 1005 N ILE A 221 9.043 -8.153 -3.876 1.00 0.00 N ATOM 1006 CA ILE A 221 8.393 -7.746 -2.637 1.00 0.00 C ATOM 1007 C ILE A 221 8.233 -8.928 -1.686 1.00 0.00 C ATOM 1008 O ILE A 221 7.215 -9.620 -1.704 1.00 0.00 O ATOM 1009 CB ILE A 221 7.009 -7.126 -2.904 1.00 0.00 C ATOM 1010 CG1 ILE A 221 7.160 -5.705 -3.453 1.00 0.00 C ATOM 1011 CG2 ILE A 221 6.176 -7.123 -1.631 1.00 0.00 C ATOM 1012 CD1 ILE A 221 5.853 -5.089 -3.901 1.00 0.00 C ATOM 0 H ILE A 221 8.405 -8.499 -4.593 1.00 0.00 H new ATOM 0 HA ILE A 221 9.035 -6.996 -2.176 1.00 0.00 H new ATOM 0 HB ILE A 221 6.494 -7.730 -3.650 1.00 0.00 H new ATOM 0 HG12 ILE A 221 7.606 -5.073 -2.685 1.00 0.00 H new ATOM 0 HG13 ILE A 221 7.852 -5.721 -4.295 1.00 0.00 H new ATOM 0 HG21 ILE A 221 5.201 -6.682 -1.836 1.00 0.00 H new ATOM 0 HG22 ILE A 221 6.045 -8.146 -1.280 1.00 0.00 H new ATOM 0 HG23 ILE A 221 6.685 -6.539 -0.864 1.00 0.00 H new ATOM 0 HD11 ILE A 221 6.035 -4.083 -4.278 1.00 0.00 H new ATOM 0 HD12 ILE A 221 5.415 -5.699 -4.691 1.00 0.00 H new ATOM 0 HD13 ILE A 221 5.165 -5.041 -3.057 1.00 0.00 H new ATOM 1024 N THR A 222 9.246 -9.153 -0.855 1.00 0.00 N ATOM 1025 CA THR A 222 9.218 -10.250 0.104 1.00 0.00 C ATOM 1026 C THR A 222 8.726 -9.777 1.467 1.00 0.00 C ATOM 1027 O THR A 222 8.584 -8.578 1.704 1.00 0.00 O ATOM 1028 CB THR A 222 10.610 -10.889 0.267 1.00 0.00 C ATOM 1029 OG1 THR A 222 11.535 -9.925 0.783 1.00 0.00 O ATOM 1030 CG2 THR A 222 11.119 -11.425 -1.063 1.00 0.00 C ATOM 0 H THR A 222 10.096 -8.590 -0.827 1.00 0.00 H new ATOM 0 HA THR A 222 8.527 -10.996 -0.289 1.00 0.00 H new ATOM 0 HB THR A 222 10.523 -11.720 0.967 1.00 0.00 H new ATOM 0 HG1 THR A 222 12.417 -10.340 0.885 1.00 0.00 H new ATOM 0 HG21 THR A 222 12.103 -11.871 -0.923 1.00 0.00 H new ATOM 0 HG22 THR A 222 10.429 -12.180 -1.439 1.00 0.00 H new ATOM 0 HG23 THR A 222 11.190 -10.608 -1.781 1.00 0.00 H new ATOM 1038 N ASN A 223 8.469 -10.727 2.360 1.00 0.00 N ATOM 1039 CA ASN A 223 7.993 -10.406 3.701 1.00 0.00 C ATOM 1040 C ASN A 223 8.986 -9.507 4.431 1.00 0.00 C ATOM 1041 O ASN A 223 10.169 -9.469 4.093 1.00 0.00 O ATOM 1042 CB ASN A 223 7.764 -11.688 4.504 1.00 0.00 C ATOM 1043 CG ASN A 223 7.984 -11.487 5.991 1.00 0.00 C ATOM 1044 OD1 ASN A 223 7.209 -10.801 6.657 1.00 0.00 O ATOM 1045 ND2 ASN A 223 9.046 -12.085 6.518 1.00 0.00 N ATOM 0 H ASN A 223 8.582 -11.725 2.180 1.00 0.00 H new ATOM 0 HA ASN A 223 7.048 -9.871 3.605 1.00 0.00 H new ATOM 0 HB2 ASN A 223 6.747 -12.043 4.335 1.00 0.00 H new ATOM 0 HB3 ASN A 223 8.437 -12.465 4.142 1.00 0.00 H new ATOM 0 HD21 ASN A 223 9.246 -11.985 7.513 1.00 0.00 H new ATOM 0 HD22 ASN A 223 9.662 -12.644 5.928 1.00 0.00 H new ATOM 1052 N ASN A 224 8.496 -8.784 5.432 1.00 0.00 N ATOM 1053 CA ASN A 224 9.341 -7.884 6.210 1.00 0.00 C ATOM 1054 C ASN A 224 9.889 -6.760 5.336 1.00 0.00 C ATOM 1055 O ASN A 224 11.043 -6.355 5.479 1.00 0.00 O ATOM 1056 CB ASN A 224 10.496 -8.659 6.847 1.00 0.00 C ATOM 1057 CG ASN A 224 10.145 -9.193 8.222 1.00 0.00 C ATOM 1058 OD1 ASN A 224 10.216 -10.397 8.470 1.00 0.00 O ATOM 1059 ND2 ASN A 224 9.764 -8.297 9.125 1.00 0.00 N ATOM 0 H ASN A 224 7.519 -8.803 5.724 1.00 0.00 H new ATOM 0 HA ASN A 224 8.730 -7.443 6.997 1.00 0.00 H new ATOM 0 HB2 ASN A 224 10.774 -9.489 6.198 1.00 0.00 H new ATOM 0 HB3 ASN A 224 11.367 -8.009 6.924 1.00 0.00 H new ATOM 0 HD21 ASN A 224 9.516 -8.597 10.068 1.00 0.00 H new ATOM 0 HD22 ASN A 224 9.720 -7.309 8.876 1.00 0.00 H new ATOM 1066 N CYS A 225 9.053 -6.261 4.432 1.00 0.00 N ATOM 1067 CA CYS A 225 9.453 -5.184 3.533 1.00 0.00 C ATOM 1068 C CYS A 225 8.542 -3.972 3.699 1.00 0.00 C ATOM 1069 O CYS A 225 7.343 -4.111 3.939 1.00 0.00 O ATOM 1070 CB CYS A 225 9.424 -5.665 2.082 1.00 0.00 C ATOM 1071 SG CYS A 225 9.224 -4.339 0.869 1.00 0.00 S ATOM 0 H CYS A 225 8.094 -6.585 4.302 1.00 0.00 H new ATOM 0 HA CYS A 225 10.471 -4.889 3.789 1.00 0.00 H new ATOM 0 HB2 CYS A 225 10.349 -6.201 1.869 1.00 0.00 H new ATOM 0 HB3 CYS A 225 8.608 -6.378 1.963 1.00 0.00 H new ATOM 0 HG CYS A 225 9.001 -4.854 -0.304 1.00 0.00 H new ATOM 1077 N VAL A 226 9.121 -2.782 3.570 1.00 0.00 N ATOM 1078 CA VAL A 226 8.362 -1.544 3.706 1.00 0.00 C ATOM 1079 C VAL A 226 8.213 -0.841 2.361 1.00 0.00 C ATOM 1080 O VAL A 226 9.142 -0.821 1.554 1.00 0.00 O ATOM 1081 CB VAL A 226 9.031 -0.582 4.705 1.00 0.00 C ATOM 1082 CG1 VAL A 226 10.250 0.076 4.078 1.00 0.00 C ATOM 1083 CG2 VAL A 226 8.036 0.465 5.183 1.00 0.00 C ATOM 0 H VAL A 226 10.113 -2.649 3.372 1.00 0.00 H new ATOM 0 HA VAL A 226 7.376 -1.817 4.082 1.00 0.00 H new ATOM 0 HB VAL A 226 9.363 -1.156 5.570 1.00 0.00 H new ATOM 0 HG11 VAL A 226 10.710 0.752 4.799 1.00 0.00 H new ATOM 0 HG12 VAL A 226 10.969 -0.691 3.790 1.00 0.00 H new ATOM 0 HG13 VAL A 226 9.946 0.639 3.195 1.00 0.00 H new ATOM 0 HG21 VAL A 226 8.525 1.137 5.888 1.00 0.00 H new ATOM 0 HG22 VAL A 226 7.672 1.037 4.330 1.00 0.00 H new ATOM 0 HG23 VAL A 226 7.197 -0.028 5.674 1.00 0.00 H new ATOM 1093 N ILE A 227 7.039 -0.264 2.129 1.00 0.00 N ATOM 1094 CA ILE A 227 6.769 0.443 0.882 1.00 0.00 C ATOM 1095 C ILE A 227 6.444 1.910 1.142 1.00 0.00 C ATOM 1096 O ILE A 227 5.567 2.231 1.944 1.00 0.00 O ATOM 1097 CB ILE A 227 5.601 -0.201 0.112 1.00 0.00 C ATOM 1098 CG1 ILE A 227 5.944 -1.644 -0.264 1.00 0.00 C ATOM 1099 CG2 ILE A 227 5.274 0.612 -1.132 1.00 0.00 C ATOM 1100 CD1 ILE A 227 4.916 -2.295 -1.163 1.00 0.00 C ATOM 0 H ILE A 227 6.260 -0.272 2.787 1.00 0.00 H new ATOM 0 HA ILE A 227 7.674 0.375 0.278 1.00 0.00 H new ATOM 0 HB ILE A 227 4.722 -0.212 0.757 1.00 0.00 H new ATOM 0 HG12 ILE A 227 6.913 -1.660 -0.763 1.00 0.00 H new ATOM 0 HG13 ILE A 227 6.044 -2.234 0.647 1.00 0.00 H new ATOM 0 HG21 ILE A 227 4.447 0.144 -1.665 1.00 0.00 H new ATOM 0 HG22 ILE A 227 4.992 1.624 -0.842 1.00 0.00 H new ATOM 0 HG23 ILE A 227 6.149 0.651 -1.781 1.00 0.00 H new ATOM 0 HD11 ILE A 227 5.224 -3.316 -1.389 1.00 0.00 H new ATOM 0 HD12 ILE A 227 3.950 -2.311 -0.659 1.00 0.00 H new ATOM 0 HD13 ILE A 227 4.832 -1.728 -2.090 1.00 0.00 H new ATOM 1112 N HIS A 228 7.157 2.798 0.455 1.00 0.00 N ATOM 1113 CA HIS A 228 6.943 4.233 0.609 1.00 0.00 C ATOM 1114 C HIS A 228 5.695 4.680 -0.146 1.00 0.00 C ATOM 1115 O HIS A 228 5.511 4.342 -1.316 1.00 0.00 O ATOM 1116 CB HIS A 228 8.162 5.008 0.108 1.00 0.00 C ATOM 1117 CG HIS A 228 9.458 4.516 0.673 1.00 0.00 C ATOM 1118 ND1 HIS A 228 10.142 5.175 1.674 1.00 0.00 N ATOM 1119 CD2 HIS A 228 10.196 3.421 0.374 1.00 0.00 C ATOM 1120 CE1 HIS A 228 11.244 4.507 1.964 1.00 0.00 C ATOM 1121 NE2 HIS A 228 11.301 3.439 1.190 1.00 0.00 N ATOM 0 H HIS A 228 7.887 2.549 -0.213 1.00 0.00 H new ATOM 0 HA HIS A 228 6.799 4.443 1.669 1.00 0.00 H new ATOM 0 HB2 HIS A 228 8.201 4.944 -0.979 1.00 0.00 H new ATOM 0 HB3 HIS A 228 8.042 6.061 0.361 1.00 0.00 H new ATOM 0 HD2 HIS A 228 9.960 2.673 -0.368 1.00 0.00 H new ATOM 0 HE1 HIS A 228 11.975 4.787 2.708 1.00 0.00 H new ATOM 0 HE2 HIS A 228 12.045 2.741 1.197 1.00 0.00 H new ATOM 1130 N CYS A 229 4.841 5.440 0.530 1.00 0.00 N ATOM 1131 CA CYS A 229 3.609 5.932 -0.077 1.00 0.00 C ATOM 1132 C CYS A 229 3.649 7.449 -0.234 1.00 0.00 C ATOM 1133 O CYS A 229 4.111 8.164 0.656 1.00 0.00 O ATOM 1134 CB CYS A 229 2.402 5.527 0.770 1.00 0.00 C ATOM 1135 SG CYS A 229 1.938 3.787 0.608 1.00 0.00 S ATOM 0 H CYS A 229 4.979 5.729 1.498 1.00 0.00 H new ATOM 0 HA CYS A 229 3.516 5.484 -1.066 1.00 0.00 H new ATOM 0 HB2 CYS A 229 2.619 5.738 1.817 1.00 0.00 H new ATOM 0 HB3 CYS A 229 1.550 6.147 0.490 1.00 0.00 H new ATOM 0 HG CYS A 229 0.909 3.540 1.363 1.00 0.00 H new ATOM 1141 N HIS A 230 3.163 7.934 -1.372 1.00 0.00 N ATOM 1142 CA HIS A 230 3.144 9.366 -1.647 1.00 0.00 C ATOM 1143 C HIS A 230 1.714 9.896 -1.669 1.00 0.00 C ATOM 1144 O HIS A 230 0.878 9.424 -2.440 1.00 0.00 O ATOM 1145 CB HIS A 230 3.830 9.660 -2.982 1.00 0.00 C ATOM 1146 CG HIS A 230 5.302 9.905 -2.858 1.00 0.00 C ATOM 1147 ND1 HIS A 230 5.920 11.036 -3.348 1.00 0.00 N ATOM 1148 CD2 HIS A 230 6.279 9.158 -2.294 1.00 0.00 C ATOM 1149 CE1 HIS A 230 7.215 10.973 -3.092 1.00 0.00 C ATOM 1150 NE2 HIS A 230 7.459 9.843 -2.453 1.00 0.00 N ATOM 0 H HIS A 230 2.777 7.356 -2.119 1.00 0.00 H new ATOM 0 HA HIS A 230 3.688 9.871 -0.849 1.00 0.00 H new ATOM 0 HB2 HIS A 230 3.665 8.821 -3.658 1.00 0.00 H new ATOM 0 HB3 HIS A 230 3.362 10.533 -3.437 1.00 0.00 H new ATOM 0 HD2 HIS A 230 6.154 8.201 -1.809 1.00 0.00 H new ATOM 0 HE1 HIS A 230 7.949 11.719 -3.360 1.00 0.00 H new ATOM 0 HE2 HIS A 230 8.375 9.530 -2.130 1.00 0.00 H new