USER MOD reduce.3.24.130724 H: found=0, std=0, add=694, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 695 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: B 476 TYR OH : rot 113:sc= 0.132 USER MOD Set 1.2: B 480 LYS NZ :NH3+ 154:sc= 0.126 (180deg=0) USER MOD Set 2.1: B 468 ASN : amide:sc= 1.32 K(o=0.96,f=-0.3) USER MOD Set 2.2: B 472 GLN : amide:sc= -0.36 X(o=0.96,f=0.87) USER MOD Set 3.1: A 143 CYS SG : rot 3:sc= -1.49! USER MOD Set 3.2: B 473 CYS SG : rot 63:sc= 1.13 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0137 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN : amide:sc= 0.564 K(o=0.56,f=-3.8!) USER MOD Single : A 93 LYS NZ :NH3+ -160:sc= -0.0847 (180deg=-0.407) USER MOD Single : A 94 ASN : amide:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 98 SER OG : rot 130:sc= 0.0888 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -0.023 K(o=-0.023,f=-1.1) USER MOD Single : A 109 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-8.1!) USER MOD Single : A 112 GLN : amide:sc= 0.00453 X(o=0.0045,f=-0.1) USER MOD Single : A 114 MET CE :methyl 144:sc= -0.477 (180deg=-1.18) USER MOD Single : A 116 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.3!) USER MOD Single : A 119 GLN : amide:sc= -1.61! K(o=-1.6!,f=-0.54) USER MOD Single : A 123 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0117) USER MOD Single : A 125 LYS NZ :NH3+ 175:sc= -0.111 (180deg=-0.111!) USER MOD Single : A 127 MET CE :methyl 167:sc= -1.14 (180deg=-1.71) USER MOD Single : A 130 TYR OH : rot 30:sc= -0.0112 USER MOD Single : A 131 MET CE :methyl 163:sc= -4.56! (180deg=-5.1!) USER MOD Single : A 132 GLN : amide:sc= 0.742 K(o=0.74,f=-0.54) USER MOD Single : A 142 CYS SG : rot 82:sc= 0.303 USER MOD Single : B 465 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 479 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 70 N ARG A 86 -1.124 -11.707 -0.703 1.00 0.00 N ATOM 71 CA ARG A 86 -0.519 -11.005 -1.813 1.00 0.00 C ATOM 72 C ARG A 86 -1.588 -10.691 -2.846 1.00 0.00 C ATOM 73 O ARG A 86 -2.434 -11.532 -3.157 1.00 0.00 O ATOM 74 CB ARG A 86 0.611 -11.832 -2.430 1.00 0.00 C ATOM 75 CG ARG A 86 0.169 -13.185 -2.968 1.00 0.00 C ATOM 76 CD ARG A 86 1.357 -13.998 -3.445 1.00 0.00 C ATOM 77 NE ARG A 86 2.263 -14.329 -2.345 1.00 0.00 N ATOM 78 CZ ARG A 86 3.591 -14.274 -2.425 1.00 0.00 C ATOM 79 NH1 ARG A 86 4.181 -13.948 -3.569 1.00 0.00 N ATOM 80 NH2 ARG A 86 4.329 -14.567 -1.364 1.00 0.00 N ATOM 0 HA ARG A 86 -0.083 -10.073 -1.454 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.064 -11.261 -3.241 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.385 -11.987 -1.679 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.362 -13.733 -2.190 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.531 -13.041 -3.791 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.004 -14.916 -3.915 1.00 0.00 H new ATOM 0 HD3 ARG A 86 1.899 -13.438 -4.207 1.00 0.00 H new ATOM 0 HE ARG A 86 1.850 -14.621 -1.459 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.617 -13.738 -4.392 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.199 -13.907 -3.625 1.00 0.00 H new ATOM 0 HH21 ARG A 86 3.880 -14.834 -0.488 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.346 -14.525 -1.423 1.00 0.00 H new ATOM 94 N VAL A 87 -1.556 -9.482 -3.362 1.00 0.00 N ATOM 95 CA VAL A 87 -2.585 -9.020 -4.269 1.00 0.00 C ATOM 96 C VAL A 87 -2.105 -9.122 -5.706 1.00 0.00 C ATOM 97 O VAL A 87 -0.977 -8.741 -6.018 1.00 0.00 O ATOM 98 CB VAL A 87 -2.976 -7.560 -3.968 1.00 0.00 C ATOM 99 CG1 VAL A 87 -4.162 -7.132 -4.817 1.00 0.00 C ATOM 100 CG2 VAL A 87 -3.281 -7.379 -2.489 1.00 0.00 C ATOM 0 H VAL A 87 -0.825 -8.798 -3.168 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.460 -9.655 -4.128 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.129 -6.923 -4.223 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.420 -6.098 -4.587 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.903 -7.215 -5.872 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -5.015 -7.775 -4.601 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.555 -6.341 -2.298 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.108 -8.030 -2.206 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.399 -7.635 -1.902 1.00 0.00 H new ATOM 110 N SER A 88 -2.960 -9.661 -6.564 1.00 0.00 N ATOM 111 CA SER A 88 -2.681 -9.743 -7.985 1.00 0.00 C ATOM 112 C SER A 88 -2.375 -8.353 -8.536 1.00 0.00 C ATOM 113 O SER A 88 -3.073 -7.382 -8.231 1.00 0.00 O ATOM 114 CB SER A 88 -3.894 -10.338 -8.698 1.00 0.00 C ATOM 115 OG SER A 88 -4.368 -11.485 -8.013 1.00 0.00 O ATOM 0 H SER A 88 -3.862 -10.052 -6.293 1.00 0.00 H new ATOM 0 HA SER A 88 -1.813 -10.381 -8.153 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.687 -9.593 -8.760 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.626 -10.604 -9.720 1.00 0.00 H new ATOM 0 HG SER A 88 -5.146 -11.850 -8.485 1.00 0.00 H new ATOM 121 N LEU A 89 -1.323 -8.277 -9.347 1.00 0.00 N ATOM 122 CA LEU A 89 -0.846 -7.015 -9.897 1.00 0.00 C ATOM 123 C LEU A 89 -1.937 -6.356 -10.726 1.00 0.00 C ATOM 124 O LEU A 89 -2.035 -5.133 -10.776 1.00 0.00 O ATOM 125 CB LEU A 89 0.397 -7.250 -10.762 1.00 0.00 C ATOM 126 CG LEU A 89 1.605 -6.354 -10.456 1.00 0.00 C ATOM 127 CD1 LEU A 89 1.232 -4.882 -10.540 1.00 0.00 C ATOM 128 CD2 LEU A 89 2.182 -6.688 -9.086 1.00 0.00 C ATOM 0 H LEU A 89 -0.779 -9.089 -9.640 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.582 -6.354 -9.071 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.703 -8.290 -10.650 1.00 0.00 H new ATOM 0 HB3 LEU A 89 0.121 -7.110 -11.807 1.00 0.00 H new ATOM 0 HG LEU A 89 2.369 -6.547 -11.209 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.107 -4.272 -10.318 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.875 -4.654 -11.544 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.446 -4.664 -9.817 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.038 -6.044 -8.885 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.421 -6.529 -8.322 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.501 -7.730 -9.070 1.00 0.00 H new ATOM 140 N GLN A 90 -2.756 -7.179 -11.368 1.00 0.00 N ATOM 141 CA GLN A 90 -3.891 -6.688 -12.137 1.00 0.00 C ATOM 142 C GLN A 90 -4.859 -5.916 -11.239 1.00 0.00 C ATOM 143 O GLN A 90 -5.363 -4.865 -11.621 1.00 0.00 O ATOM 144 CB GLN A 90 -4.607 -7.851 -12.827 1.00 0.00 C ATOM 145 CG GLN A 90 -5.041 -8.955 -11.878 1.00 0.00 C ATOM 146 CD GLN A 90 -5.731 -10.099 -12.588 1.00 0.00 C ATOM 147 OE1 GLN A 90 -5.087 -11.057 -13.018 1.00 0.00 O ATOM 148 NE2 GLN A 90 -7.042 -10.005 -12.720 1.00 0.00 N ATOM 0 H GLN A 90 -2.654 -8.194 -11.371 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.521 -6.006 -12.902 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.484 -7.467 -13.348 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -3.946 -8.274 -13.584 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.168 -9.336 -11.347 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.714 -8.540 -11.128 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -7.535 -9.193 -12.348 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -7.561 -10.744 -13.194 1.00 0.00 H new ATOM 157 N ASN A 91 -5.087 -6.431 -10.033 1.00 0.00 N ATOM 158 CA ASN A 91 -5.950 -5.769 -9.058 1.00 0.00 C ATOM 159 C ASN A 91 -5.348 -4.440 -8.645 1.00 0.00 C ATOM 160 O ASN A 91 -6.041 -3.426 -8.559 1.00 0.00 O ATOM 161 CB ASN A 91 -6.145 -6.642 -7.809 1.00 0.00 C ATOM 162 CG ASN A 91 -7.038 -7.845 -8.042 1.00 0.00 C ATOM 163 OD1 ASN A 91 -7.124 -8.370 -9.150 1.00 0.00 O ATOM 164 ND2 ASN A 91 -7.717 -8.287 -6.993 1.00 0.00 N ATOM 0 H ASN A 91 -4.684 -7.309 -9.707 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.920 -5.606 -9.529 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.171 -6.985 -7.460 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.572 -6.032 -7.013 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.338 -9.090 -7.089 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.618 -7.824 -6.090 1.00 0.00 H new ATOM 171 N LEU A 92 -4.042 -4.454 -8.417 1.00 0.00 N ATOM 172 CA LEU A 92 -3.322 -3.268 -7.987 1.00 0.00 C ATOM 173 C LEU A 92 -3.344 -2.208 -9.080 1.00 0.00 C ATOM 174 O LEU A 92 -3.409 -1.019 -8.801 1.00 0.00 O ATOM 175 CB LEU A 92 -1.877 -3.631 -7.626 1.00 0.00 C ATOM 176 CG LEU A 92 -1.730 -4.669 -6.516 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.278 -5.087 -6.371 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.258 -4.114 -5.203 1.00 0.00 C ATOM 0 H LEU A 92 -3.457 -5.283 -8.525 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.813 -2.862 -7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.378 -4.004 -8.520 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.355 -2.723 -7.325 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.316 -5.549 -6.781 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.190 -5.827 -5.576 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.072 -5.519 -7.309 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.329 -4.216 -6.124 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.147 -4.864 -4.420 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.694 -3.221 -4.932 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.312 -3.858 -5.314 1.00 0.00 H new ATOM 190 N LYS A 93 -3.319 -2.651 -10.327 1.00 0.00 N ATOM 191 CA LYS A 93 -3.310 -1.741 -11.466 1.00 0.00 C ATOM 192 C LYS A 93 -4.570 -0.879 -11.538 1.00 0.00 C ATOM 193 O LYS A 93 -4.540 0.218 -12.097 1.00 0.00 O ATOM 194 CB LYS A 93 -3.123 -2.522 -12.762 1.00 0.00 C ATOM 195 CG LYS A 93 -1.695 -2.994 -12.966 1.00 0.00 C ATOM 196 CD LYS A 93 -1.540 -3.775 -14.256 1.00 0.00 C ATOM 197 CE LYS A 93 -0.079 -4.037 -14.570 1.00 0.00 C ATOM 198 NZ LYS A 93 0.667 -2.776 -14.834 1.00 0.00 N ATOM 0 H LYS A 93 -3.304 -3.639 -10.579 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.469 -1.061 -11.328 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.789 -3.385 -12.760 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.417 -1.895 -13.604 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.026 -2.134 -12.979 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.395 -3.618 -12.125 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.073 -4.723 -14.176 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.997 -3.221 -15.076 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.383 -4.564 -13.735 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.006 -4.691 -15.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.537 -2.991 -15.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.073 -2.132 -15.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.913 -2.323 -13.931 1.00 0.00 H new ATOM 212 N ASN A 94 -5.665 -1.356 -10.956 1.00 0.00 N ATOM 213 CA ASN A 94 -6.916 -0.597 -10.959 1.00 0.00 C ATOM 214 C ASN A 94 -6.844 0.569 -9.979 1.00 0.00 C ATOM 215 O ASN A 94 -7.628 1.511 -10.067 1.00 0.00 O ATOM 216 CB ASN A 94 -8.110 -1.487 -10.597 1.00 0.00 C ATOM 217 CG ASN A 94 -8.457 -2.496 -11.674 1.00 0.00 C ATOM 218 OD1 ASN A 94 -9.246 -2.220 -12.576 1.00 0.00 O ATOM 219 ND2 ASN A 94 -7.885 -3.682 -11.577 1.00 0.00 N ATOM 0 H ASN A 94 -5.715 -2.256 -10.479 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.057 -0.213 -11.969 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -7.891 -2.017 -9.670 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.979 -0.857 -10.406 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -8.093 -4.406 -12.265 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.235 -3.874 -10.814 1.00 0.00 H new ATOM 226 N LEU A 95 -5.893 0.506 -9.053 1.00 0.00 N ATOM 227 CA LEU A 95 -5.723 1.557 -8.055 1.00 0.00 C ATOM 228 C LEU A 95 -5.379 2.877 -8.726 1.00 0.00 C ATOM 229 O LEU A 95 -5.909 3.928 -8.365 1.00 0.00 O ATOM 230 CB LEU A 95 -4.623 1.182 -7.061 1.00 0.00 C ATOM 231 CG LEU A 95 -4.868 -0.104 -6.276 1.00 0.00 C ATOM 232 CD1 LEU A 95 -3.678 -0.416 -5.387 1.00 0.00 C ATOM 233 CD2 LEU A 95 -6.137 0.002 -5.451 1.00 0.00 C ATOM 0 H LEU A 95 -5.227 -0.263 -8.972 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.664 1.667 -7.516 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.683 1.084 -7.604 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.499 2.002 -6.354 1.00 0.00 H new ATOM 0 HG LEU A 95 -4.993 -0.921 -6.987 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.868 -1.336 -4.834 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.787 -0.540 -6.002 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.523 0.404 -4.685 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -6.291 -0.926 -4.900 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.046 0.830 -4.748 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.986 0.178 -6.111 1.00 0.00 H new ATOM 245 N GLY A 96 -4.501 2.807 -9.718 1.00 0.00 N ATOM 246 CA GLY A 96 -4.117 3.992 -10.457 1.00 0.00 C ATOM 247 C GLY A 96 -5.234 4.506 -11.345 1.00 0.00 C ATOM 248 O GLY A 96 -5.225 5.668 -11.754 1.00 0.00 O ATOM 0 H GLY A 96 -4.047 1.947 -10.024 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.824 4.774 -9.757 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.243 3.768 -11.069 1.00 0.00 H new ATOM 252 N GLU A 97 -6.208 3.646 -11.634 1.00 0.00 N ATOM 253 CA GLU A 97 -7.320 4.016 -12.499 1.00 0.00 C ATOM 254 C GLU A 97 -8.427 4.681 -11.688 1.00 0.00 C ATOM 255 O GLU A 97 -9.213 5.467 -12.218 1.00 0.00 O ATOM 256 CB GLU A 97 -7.884 2.786 -13.212 1.00 0.00 C ATOM 257 CG GLU A 97 -6.823 1.866 -13.790 1.00 0.00 C ATOM 258 CD GLU A 97 -7.391 0.889 -14.795 1.00 0.00 C ATOM 259 OE1 GLU A 97 -7.969 -0.134 -14.381 1.00 0.00 O ATOM 260 OE2 GLU A 97 -7.263 1.144 -16.011 1.00 0.00 O ATOM 0 H GLU A 97 -6.248 2.690 -11.281 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.946 4.719 -13.244 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.497 2.221 -12.510 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.542 3.115 -14.016 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.048 2.465 -14.268 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -6.345 1.314 -12.981 1.00 0.00 H new ATOM 267 N SER A 98 -8.472 4.373 -10.399 1.00 0.00 N ATOM 268 CA SER A 98 -9.490 4.917 -9.516 1.00 0.00 C ATOM 269 C SER A 98 -9.282 6.411 -9.319 1.00 0.00 C ATOM 270 O SER A 98 -8.340 6.833 -8.644 1.00 0.00 O ATOM 271 CB SER A 98 -9.463 4.197 -8.166 1.00 0.00 C ATOM 272 OG SER A 98 -10.411 4.752 -7.265 1.00 0.00 O ATOM 0 H SER A 98 -7.811 3.746 -9.941 1.00 0.00 H new ATOM 0 HA SER A 98 -10.465 4.760 -9.977 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.674 3.138 -8.312 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.464 4.266 -7.735 1.00 0.00 H new ATOM 0 HG SER A 98 -10.953 4.034 -6.877 1.00 0.00 H new ATOM 278 N ALA A 99 -10.169 7.201 -9.915 1.00 0.00 N ATOM 279 CA ALA A 99 -10.112 8.653 -9.813 1.00 0.00 C ATOM 280 C ALA A 99 -10.258 9.106 -8.366 1.00 0.00 C ATOM 281 O ALA A 99 -9.797 10.187 -7.995 1.00 0.00 O ATOM 282 CB ALA A 99 -11.195 9.281 -10.676 1.00 0.00 C ATOM 0 H ALA A 99 -10.944 6.854 -10.480 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.137 8.983 -10.172 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.143 10.367 -10.592 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -11.046 8.990 -11.716 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.173 8.937 -10.340 1.00 0.00 H new ATOM 288 N THR A 100 -10.891 8.273 -7.556 1.00 0.00 N ATOM 289 CA THR A 100 -11.059 8.566 -6.145 1.00 0.00 C ATOM 290 C THR A 100 -9.753 8.346 -5.386 1.00 0.00 C ATOM 291 O THR A 100 -9.307 9.216 -4.638 1.00 0.00 O ATOM 292 CB THR A 100 -12.165 7.692 -5.521 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.404 7.903 -6.213 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.346 8.014 -4.046 1.00 0.00 C ATOM 0 H THR A 100 -11.297 7.386 -7.854 1.00 0.00 H new ATOM 0 HA THR A 100 -11.350 9.613 -6.064 1.00 0.00 H new ATOM 0 HB THR A 100 -11.866 6.648 -5.615 1.00 0.00 H new ATOM 0 HG1 THR A 100 -14.102 7.343 -5.813 1.00 0.00 H new ATOM 0 HG21 THR A 100 -13.132 7.384 -3.630 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.412 7.827 -3.516 1.00 0.00 H new ATOM 0 HG23 THR A 100 -12.624 9.062 -3.934 1.00 0.00 H new ATOM 302 N LEU A 101 -9.124 7.197 -5.613 1.00 0.00 N ATOM 303 CA LEU A 101 -7.933 6.829 -4.862 1.00 0.00 C ATOM 304 C LEU A 101 -6.774 7.749 -5.204 1.00 0.00 C ATOM 305 O LEU A 101 -6.129 8.299 -4.315 1.00 0.00 O ATOM 306 CB LEU A 101 -7.542 5.373 -5.130 1.00 0.00 C ATOM 307 CG LEU A 101 -6.254 4.910 -4.440 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.365 5.058 -2.931 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.940 3.473 -4.809 1.00 0.00 C ATOM 0 H LEU A 101 -9.418 6.510 -6.307 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.164 6.936 -3.802 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.360 4.728 -4.809 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.430 5.235 -6.205 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.437 5.544 -4.786 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.439 4.723 -2.463 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.541 6.104 -2.680 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.195 4.453 -2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -5.022 3.161 -4.310 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.761 2.829 -4.494 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.811 3.394 -5.888 1.00 0.00 H new ATOM 321 N ARG A 102 -6.530 7.938 -6.495 1.00 0.00 N ATOM 322 CA ARG A 102 -5.425 8.778 -6.942 1.00 0.00 C ATOM 323 C ARG A 102 -5.577 10.209 -6.435 1.00 0.00 C ATOM 324 O ARG A 102 -4.587 10.895 -6.212 1.00 0.00 O ATOM 325 CB ARG A 102 -5.313 8.778 -8.466 1.00 0.00 C ATOM 326 CG ARG A 102 -6.600 9.163 -9.169 1.00 0.00 C ATOM 327 CD ARG A 102 -6.337 9.664 -10.576 1.00 0.00 C ATOM 328 NE ARG A 102 -5.696 8.653 -11.415 1.00 0.00 N ATOM 329 CZ ARG A 102 -5.274 8.879 -12.659 1.00 0.00 C ATOM 330 NH1 ARG A 102 -5.425 10.078 -13.209 1.00 0.00 N ATOM 331 NH2 ARG A 102 -4.711 7.901 -13.357 1.00 0.00 N ATOM 0 H ARG A 102 -7.079 7.523 -7.248 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.511 8.356 -6.524 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.525 9.470 -8.764 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.009 7.786 -8.800 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.267 8.301 -9.207 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.111 9.936 -8.596 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.279 9.968 -11.033 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -5.704 10.550 -10.531 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.564 7.720 -11.026 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.865 10.830 -12.679 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.101 10.247 -14.161 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.601 6.976 -12.942 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.388 8.074 -14.309 1.00 0.00 H new ATOM 345 N SER A 103 -6.818 10.644 -6.224 1.00 0.00 N ATOM 346 CA SER A 103 -7.081 11.994 -5.749 1.00 0.00 C ATOM 347 C SER A 103 -6.561 12.159 -4.324 1.00 0.00 C ATOM 348 O SER A 103 -6.227 13.263 -3.894 1.00 0.00 O ATOM 349 CB SER A 103 -8.583 12.294 -5.807 1.00 0.00 C ATOM 350 OG SER A 103 -8.849 13.653 -5.494 1.00 0.00 O ATOM 0 H SER A 103 -7.654 10.079 -6.375 1.00 0.00 H new ATOM 0 HA SER A 103 -6.561 12.702 -6.395 1.00 0.00 H new ATOM 0 HB2 SER A 103 -8.963 12.067 -6.803 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.113 11.647 -5.108 1.00 0.00 H new ATOM 0 HG SER A 103 -9.814 13.816 -5.540 1.00 0.00 H new ATOM 356 N LEU A 104 -6.478 11.052 -3.600 1.00 0.00 N ATOM 357 CA LEU A 104 -5.947 11.071 -2.247 1.00 0.00 C ATOM 358 C LEU A 104 -4.428 11.177 -2.302 1.00 0.00 C ATOM 359 O LEU A 104 -3.804 11.812 -1.455 1.00 0.00 O ATOM 360 CB LEU A 104 -6.365 9.807 -1.488 1.00 0.00 C ATOM 361 CG LEU A 104 -7.859 9.471 -1.550 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.179 8.291 -0.647 1.00 0.00 C ATOM 363 CD2 LEU A 104 -8.704 10.680 -1.178 1.00 0.00 C ATOM 0 H LEU A 104 -6.771 10.131 -3.927 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.350 11.934 -1.717 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.802 8.962 -1.885 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.077 9.919 -0.443 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.103 9.194 -2.576 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.244 8.067 -0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.608 7.421 -0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.915 8.538 0.381 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.760 10.416 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.459 10.997 -0.165 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.500 11.495 -1.873 1.00 0.00 H new ATOM 375 N LEU A 105 -3.848 10.572 -3.334 1.00 0.00 N ATOM 376 CA LEU A 105 -2.404 10.616 -3.560 1.00 0.00 C ATOM 377 C LEU A 105 -1.950 12.035 -3.896 1.00 0.00 C ATOM 378 O LEU A 105 -0.759 12.343 -3.855 1.00 0.00 O ATOM 379 CB LEU A 105 -2.003 9.669 -4.696 1.00 0.00 C ATOM 380 CG LEU A 105 -1.887 8.181 -4.335 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.194 7.628 -3.798 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.444 7.391 -5.552 1.00 0.00 C ATOM 0 H LEU A 105 -4.362 10.039 -4.036 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.915 10.296 -2.640 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.733 9.770 -5.499 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.044 10.000 -5.094 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.142 8.084 -3.545 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.070 6.573 -3.555 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.480 8.176 -2.900 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.973 7.737 -4.553 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.363 6.336 -5.291 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.176 7.512 -6.351 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.474 7.757 -5.890 1.00 0.00 H new ATOM 394 N LEU A 106 -2.911 12.884 -4.250 1.00 0.00 N ATOM 395 CA LEU A 106 -2.648 14.297 -4.500 1.00 0.00 C ATOM 396 C LEU A 106 -2.292 15.017 -3.200 1.00 0.00 C ATOM 397 O LEU A 106 -1.801 16.144 -3.217 1.00 0.00 O ATOM 398 CB LEU A 106 -3.868 14.961 -5.151 1.00 0.00 C ATOM 399 CG LEU A 106 -3.906 14.951 -6.687 1.00 0.00 C ATOM 400 CD1 LEU A 106 -2.865 15.899 -7.251 1.00 0.00 C ATOM 401 CD2 LEU A 106 -3.691 13.553 -7.243 1.00 0.00 C ATOM 0 H LEU A 106 -3.887 12.614 -4.371 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.801 14.371 -5.182 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.766 14.464 -4.783 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.915 15.996 -4.814 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.897 15.286 -6.992 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.906 15.879 -8.340 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.066 16.911 -6.899 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.874 15.590 -6.920 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.724 13.585 -8.332 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.719 13.179 -6.921 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -4.475 12.891 -6.876 1.00 0.00 H new ATOM 413 N ASN A 107 -2.552 14.360 -2.076 1.00 0.00 N ATOM 414 CA ASN A 107 -2.167 14.888 -0.776 1.00 0.00 C ATOM 415 C ASN A 107 -0.682 14.644 -0.539 1.00 0.00 C ATOM 416 O ASN A 107 -0.235 13.496 -0.464 1.00 0.00 O ATOM 417 CB ASN A 107 -2.993 14.238 0.340 1.00 0.00 C ATOM 418 CG ASN A 107 -4.420 14.752 0.387 1.00 0.00 C ATOM 419 OD1 ASN A 107 -4.688 15.908 0.055 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.345 13.898 0.799 1.00 0.00 N ATOM 0 H ASN A 107 -3.029 13.459 -2.040 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.361 15.961 -0.765 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.005 13.158 0.196 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.511 14.426 1.300 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.321 14.189 0.850 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.081 12.949 1.065 1.00 0.00 H new ATOM 427 N PRO A 108 0.107 15.729 -0.421 1.00 0.00 N ATOM 428 CA PRO A 108 1.566 15.645 -0.281 1.00 0.00 C ATOM 429 C PRO A 108 1.989 14.857 0.951 1.00 0.00 C ATOM 430 O PRO A 108 3.067 14.268 0.983 1.00 0.00 O ATOM 431 CB PRO A 108 2.011 17.108 -0.162 1.00 0.00 C ATOM 432 CG PRO A 108 0.784 17.856 0.229 1.00 0.00 C ATOM 433 CD PRO A 108 -0.361 17.125 -0.407 1.00 0.00 C ATOM 0 HA PRO A 108 2.019 15.120 -1.122 1.00 0.00 H new ATOM 0 HB2 PRO A 108 2.797 17.222 0.585 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.413 17.476 -1.106 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.674 17.887 1.313 1.00 0.00 H new ATOM 0 HG3 PRO A 108 0.829 18.889 -0.117 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -1.281 17.237 0.167 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -0.566 17.492 -1.412 1.00 0.00 H new ATOM 441 N HIS A 109 1.131 14.839 1.958 1.00 0.00 N ATOM 442 CA HIS A 109 1.408 14.095 3.174 1.00 0.00 C ATOM 443 C HIS A 109 1.234 12.595 2.943 1.00 0.00 C ATOM 444 O HIS A 109 2.088 11.799 3.326 1.00 0.00 O ATOM 445 CB HIS A 109 0.499 14.577 4.309 1.00 0.00 C ATOM 446 CG HIS A 109 0.595 13.757 5.556 1.00 0.00 C ATOM 447 ND1 HIS A 109 1.520 14.030 6.533 1.00 0.00 N ATOM 448 CD2 HIS A 109 -0.141 12.685 5.926 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.325 13.121 7.472 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.329 12.287 7.147 1.00 0.00 N ATOM 0 H HIS A 109 0.238 15.331 1.957 1.00 0.00 H new ATOM 0 HA HIS A 109 2.445 14.274 3.460 1.00 0.00 H new ATOM 0 HB2 HIS A 109 0.749 15.611 4.546 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.534 14.571 3.961 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -0.945 12.231 5.366 1.00 0.00 H new ATOM 0 HE1 HIS A 109 1.897 13.059 8.386 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -0.014 11.504 7.704 1.00 0.00 H new ATOM 458 N LEU A 110 0.137 12.219 2.293 1.00 0.00 N ATOM 459 CA LEU A 110 -0.177 10.816 2.076 1.00 0.00 C ATOM 460 C LEU A 110 0.862 10.159 1.176 1.00 0.00 C ATOM 461 O LEU A 110 1.268 9.018 1.406 1.00 0.00 O ATOM 462 CB LEU A 110 -1.571 10.673 1.465 1.00 0.00 C ATOM 463 CG LEU A 110 -1.937 9.257 1.024 1.00 0.00 C ATOM 464 CD1 LEU A 110 -1.918 8.298 2.203 1.00 0.00 C ATOM 465 CD2 LEU A 110 -3.295 9.239 0.351 1.00 0.00 C ATOM 0 H LEU A 110 -0.548 12.869 1.908 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.161 10.311 3.042 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.308 11.013 2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.644 11.337 0.603 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.189 8.927 0.303 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -2.182 7.297 1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.920 8.281 2.642 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.638 8.628 2.952 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -3.536 8.221 0.045 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -4.052 9.597 1.049 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -3.275 9.886 -0.526 1.00 0.00 H new ATOM 477 N ARG A 111 1.309 10.892 0.166 1.00 0.00 N ATOM 478 CA ARG A 111 2.296 10.365 -0.764 1.00 0.00 C ATOM 479 C ARG A 111 3.623 10.164 -0.040 1.00 0.00 C ATOM 480 O ARG A 111 4.364 9.223 -0.325 1.00 0.00 O ATOM 481 CB ARG A 111 2.471 11.291 -1.976 1.00 0.00 C ATOM 482 CG ARG A 111 3.124 12.624 -1.655 1.00 0.00 C ATOM 483 CD ARG A 111 3.254 13.504 -2.887 1.00 0.00 C ATOM 484 NE ARG A 111 4.002 14.727 -2.597 1.00 0.00 N ATOM 485 CZ ARG A 111 4.124 15.754 -3.438 1.00 0.00 C ATOM 486 NH1 ARG A 111 3.526 15.733 -4.624 1.00 0.00 N ATOM 487 NH2 ARG A 111 4.846 16.807 -3.085 1.00 0.00 N ATOM 0 H ARG A 111 1.006 11.846 -0.029 1.00 0.00 H new ATOM 0 HA ARG A 111 1.943 9.404 -1.138 1.00 0.00 H new ATOM 0 HB2 ARG A 111 3.071 10.777 -2.727 1.00 0.00 H new ATOM 0 HB3 ARG A 111 1.493 11.476 -2.421 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.536 13.143 -0.899 1.00 0.00 H new ATOM 0 HG3 ARG A 111 4.111 12.451 -1.227 1.00 0.00 H new ATOM 0 HD2 ARG A 111 3.755 12.949 -3.680 1.00 0.00 H new ATOM 0 HD3 ARG A 111 2.262 13.762 -3.257 1.00 0.00 H new ATOM 0 HE ARG A 111 4.462 14.799 -1.689 1.00 0.00 H new ATOM 0 HH11 ARG A 111 2.967 14.926 -4.899 1.00 0.00 H new ATOM 0 HH12 ARG A 111 3.626 16.524 -5.260 1.00 0.00 H new ATOM 0 HH21 ARG A 111 5.305 16.829 -2.174 1.00 0.00 H new ATOM 0 HH22 ARG A 111 4.943 17.596 -3.724 1.00 0.00 H new ATOM 501 N GLN A 112 3.895 11.035 0.925 1.00 0.00 N ATOM 502 CA GLN A 112 5.085 10.961 1.721 1.00 0.00 C ATOM 503 C GLN A 112 5.021 9.757 2.655 1.00 0.00 C ATOM 504 O GLN A 112 6.033 9.101 2.911 1.00 0.00 O ATOM 505 CB GLN A 112 5.207 12.254 2.513 1.00 0.00 C ATOM 506 CG GLN A 112 6.441 12.321 3.362 1.00 0.00 C ATOM 507 CD GLN A 112 7.714 12.275 2.541 1.00 0.00 C ATOM 508 OE1 GLN A 112 8.247 13.307 2.138 1.00 0.00 O ATOM 509 NE2 GLN A 112 8.194 11.074 2.264 1.00 0.00 N ATOM 0 H GLN A 112 3.282 11.813 1.168 1.00 0.00 H new ATOM 0 HA GLN A 112 5.960 10.837 1.083 1.00 0.00 H new ATOM 0 HB2 GLN A 112 5.205 13.096 1.821 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.330 12.364 3.151 1.00 0.00 H new ATOM 0 HG2 GLN A 112 6.424 13.239 3.949 1.00 0.00 H new ATOM 0 HG3 GLN A 112 6.438 11.491 4.068 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.722 10.242 2.618 1.00 0.00 H new ATOM 0 HE22 GLN A 112 9.036 10.980 1.697 1.00 0.00 H new ATOM 518 N LEU A 113 3.821 9.473 3.157 1.00 0.00 N ATOM 519 CA LEU A 113 3.591 8.294 3.984 1.00 0.00 C ATOM 520 C LEU A 113 3.968 7.038 3.212 1.00 0.00 C ATOM 521 O LEU A 113 4.779 6.233 3.672 1.00 0.00 O ATOM 522 CB LEU A 113 2.121 8.200 4.410 1.00 0.00 C ATOM 523 CG LEU A 113 1.590 9.352 5.265 1.00 0.00 C ATOM 524 CD1 LEU A 113 0.103 9.166 5.516 1.00 0.00 C ATOM 525 CD2 LEU A 113 2.337 9.439 6.588 1.00 0.00 C ATOM 0 H LEU A 113 2.991 10.046 3.004 1.00 0.00 H new ATOM 0 HA LEU A 113 4.211 8.382 4.876 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.508 8.129 3.512 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.984 7.271 4.963 1.00 0.00 H new ATOM 0 HG LEU A 113 1.750 10.284 4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.269 9.990 6.125 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.428 9.151 4.564 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.063 8.224 6.039 1.00 0.00 H new ATOM 0 HD21 LEU A 113 1.940 10.266 7.176 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.210 8.507 7.140 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.397 9.606 6.397 1.00 0.00 H new ATOM 537 N MET A 114 3.380 6.896 2.029 1.00 0.00 N ATOM 538 CA MET A 114 3.634 5.752 1.162 1.00 0.00 C ATOM 539 C MET A 114 5.123 5.606 0.865 1.00 0.00 C ATOM 540 O MET A 114 5.691 4.528 1.037 1.00 0.00 O ATOM 541 CB MET A 114 2.850 5.904 -0.143 1.00 0.00 C ATOM 542 CG MET A 114 1.354 5.676 0.008 1.00 0.00 C ATOM 543 SD MET A 114 0.406 6.343 -1.374 1.00 0.00 S ATOM 544 CE MET A 114 1.118 5.442 -2.746 1.00 0.00 C ATOM 0 H MET A 114 2.716 7.569 1.645 1.00 0.00 H new ATOM 0 HA MET A 114 3.303 4.851 1.679 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.017 6.905 -0.541 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.243 5.199 -0.876 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.160 4.607 0.094 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.012 6.137 0.934 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.341 5.218 -3.477 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.894 6.047 -3.215 1.00 0.00 H new ATOM 0 HE3 MET A 114 1.554 4.511 -2.383 1.00 0.00 H new ATOM 554 N VAL A 115 5.753 6.696 0.439 1.00 0.00 N ATOM 555 CA VAL A 115 7.164 6.692 0.102 1.00 0.00 C ATOM 556 C VAL A 115 8.021 6.273 1.301 1.00 0.00 C ATOM 557 O VAL A 115 8.977 5.514 1.153 1.00 0.00 O ATOM 558 CB VAL A 115 7.591 8.081 -0.419 1.00 0.00 C ATOM 559 CG1 VAL A 115 9.094 8.189 -0.508 1.00 0.00 C ATOM 560 CG2 VAL A 115 6.965 8.351 -1.780 1.00 0.00 C ATOM 0 H VAL A 115 5.298 7.601 0.319 1.00 0.00 H new ATOM 0 HA VAL A 115 7.323 5.958 -0.688 1.00 0.00 H new ATOM 0 HB VAL A 115 7.237 8.830 0.289 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.366 9.177 -0.878 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.529 8.039 0.480 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.474 7.429 -1.191 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.275 9.334 -2.135 1.00 0.00 H new ATOM 0 HG22 VAL A 115 7.292 7.590 -2.488 1.00 0.00 H new ATOM 0 HG23 VAL A 115 5.879 8.323 -1.693 1.00 0.00 H new ATOM 570 N ASN A 116 7.657 6.751 2.484 1.00 0.00 N ATOM 571 CA ASN A 116 8.340 6.361 3.719 1.00 0.00 C ATOM 572 C ASN A 116 8.239 4.861 3.950 1.00 0.00 C ATOM 573 O ASN A 116 9.228 4.196 4.269 1.00 0.00 O ATOM 574 CB ASN A 116 7.725 7.082 4.920 1.00 0.00 C ATOM 575 CG ASN A 116 8.436 8.365 5.284 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.644 8.501 5.096 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.686 9.315 5.816 1.00 0.00 N ATOM 0 H ASN A 116 6.891 7.411 2.618 1.00 0.00 H new ATOM 0 HA ASN A 116 9.389 6.640 3.614 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.680 7.304 4.704 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.737 6.413 5.780 1.00 0.00 H new ATOM 0 HD21 ASN A 116 8.106 10.204 6.088 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.687 9.159 5.954 1.00 0.00 H new ATOM 584 N LEU A 117 7.029 4.343 3.799 1.00 0.00 N ATOM 585 CA LEU A 117 6.753 2.929 4.017 1.00 0.00 C ATOM 586 C LEU A 117 7.501 2.058 3.009 1.00 0.00 C ATOM 587 O LEU A 117 7.994 0.984 3.353 1.00 0.00 O ATOM 588 CB LEU A 117 5.246 2.678 3.922 1.00 0.00 C ATOM 589 CG LEU A 117 4.795 1.244 4.206 1.00 0.00 C ATOM 590 CD1 LEU A 117 5.143 0.840 5.631 1.00 0.00 C ATOM 591 CD2 LEU A 117 3.302 1.101 3.959 1.00 0.00 C ATOM 0 H LEU A 117 6.212 4.888 3.523 1.00 0.00 H new ATOM 0 HA LEU A 117 7.102 2.659 5.013 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.740 3.344 4.621 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.912 2.953 2.921 1.00 0.00 H new ATOM 0 HG LEU A 117 5.325 0.577 3.526 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.813 -0.183 5.810 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.222 0.903 5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.644 1.510 6.331 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.996 0.075 4.165 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.758 1.781 4.615 1.00 0.00 H new ATOM 0 HD23 LEU A 117 3.080 1.344 2.920 1.00 0.00 H new ATOM 603 N ASP A 118 7.592 2.536 1.771 1.00 0.00 N ATOM 604 CA ASP A 118 8.266 1.799 0.701 1.00 0.00 C ATOM 605 C ASP A 118 9.752 1.631 1.001 1.00 0.00 C ATOM 606 O ASP A 118 10.349 0.595 0.692 1.00 0.00 O ATOM 607 CB ASP A 118 8.083 2.520 -0.636 1.00 0.00 C ATOM 608 CG ASP A 118 8.725 1.785 -1.800 1.00 0.00 C ATOM 609 OD1 ASP A 118 9.848 2.159 -2.199 1.00 0.00 O ATOM 610 OD2 ASP A 118 8.109 0.833 -2.325 1.00 0.00 O ATOM 0 H ASP A 118 7.206 3.435 1.481 1.00 0.00 H new ATOM 0 HA ASP A 118 7.815 0.809 0.639 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.018 2.642 -0.834 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.511 3.520 -0.565 1.00 0.00 H new ATOM 615 N GLN A 119 10.344 2.646 1.622 1.00 0.00 N ATOM 616 CA GLN A 119 11.755 2.601 1.994 1.00 0.00 C ATOM 617 C GLN A 119 12.006 1.479 2.987 1.00 0.00 C ATOM 618 O GLN A 119 13.095 0.909 3.054 1.00 0.00 O ATOM 619 CB GLN A 119 12.184 3.933 2.598 1.00 0.00 C ATOM 620 CG GLN A 119 11.948 5.098 1.664 1.00 0.00 C ATOM 621 CD GLN A 119 12.370 6.427 2.252 1.00 0.00 C ATOM 622 OE1 GLN A 119 13.289 6.497 3.067 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.701 7.489 1.841 1.00 0.00 N ATOM 0 H GLN A 119 9.869 3.511 1.879 1.00 0.00 H new ATOM 0 HA GLN A 119 12.343 2.413 1.095 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.637 4.100 3.526 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.242 3.887 2.855 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.494 4.928 0.736 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.890 5.141 1.407 1.00 0.00 H new ATOM 0 HE21 GLN A 119 10.946 7.385 1.163 1.00 0.00 H new ATOM 0 HE22 GLN A 119 11.940 8.413 2.201 1.00 0.00 H new ATOM 632 N GLY A 120 10.970 1.186 3.755 1.00 0.00 N ATOM 633 CA GLY A 120 10.971 0.030 4.630 1.00 0.00 C ATOM 634 C GLY A 120 11.903 0.167 5.814 1.00 0.00 C ATOM 635 O GLY A 120 12.382 -0.838 6.341 1.00 0.00 O ATOM 0 H GLY A 120 10.113 1.738 3.789 1.00 0.00 H new ATOM 0 HA2 GLY A 120 9.958 -0.141 4.994 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.256 -0.851 4.054 1.00 0.00 H new ATOM 639 N GLU A 121 12.149 1.403 6.240 1.00 0.00 N ATOM 640 CA GLU A 121 13.021 1.660 7.383 1.00 0.00 C ATOM 641 C GLU A 121 12.518 0.913 8.614 1.00 0.00 C ATOM 642 O GLU A 121 13.251 0.137 9.227 1.00 0.00 O ATOM 643 CB GLU A 121 13.087 3.158 7.675 1.00 0.00 C ATOM 644 CG GLU A 121 13.556 3.992 6.494 1.00 0.00 C ATOM 645 CD GLU A 121 13.677 5.460 6.838 1.00 0.00 C ATOM 646 OE1 GLU A 121 14.691 5.842 7.455 1.00 0.00 O ATOM 647 OE2 GLU A 121 12.760 6.238 6.502 1.00 0.00 O ATOM 0 H GLU A 121 11.757 2.242 5.812 1.00 0.00 H new ATOM 0 HA GLU A 121 14.022 1.303 7.139 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.100 3.503 7.982 1.00 0.00 H new ATOM 0 HB3 GLU A 121 13.759 3.326 8.516 1.00 0.00 H new ATOM 0 HG2 GLU A 121 14.522 3.621 6.151 1.00 0.00 H new ATOM 0 HG3 GLU A 121 12.856 3.872 5.667 1.00 0.00 H new ATOM 654 N ASP A 122 11.262 1.150 8.962 1.00 0.00 N ATOM 655 CA ASP A 122 10.610 0.416 10.035 1.00 0.00 C ATOM 656 C ASP A 122 9.117 0.351 9.777 1.00 0.00 C ATOM 657 O ASP A 122 8.330 1.090 10.365 1.00 0.00 O ATOM 658 CB ASP A 122 10.889 1.052 11.398 1.00 0.00 C ATOM 659 CG ASP A 122 10.336 0.221 12.541 1.00 0.00 C ATOM 660 OD1 ASP A 122 9.278 0.584 13.090 1.00 0.00 O ATOM 661 OD2 ASP A 122 10.959 -0.797 12.900 1.00 0.00 O ATOM 0 H ASP A 122 10.671 1.850 8.513 1.00 0.00 H new ATOM 0 HA ASP A 122 11.017 -0.595 10.054 1.00 0.00 H new ATOM 0 HB2 ASP A 122 11.964 1.174 11.527 1.00 0.00 H new ATOM 0 HB3 ASP A 122 10.449 2.049 11.429 1.00 0.00 H new ATOM 666 N LYS A 123 8.750 -0.532 8.865 1.00 0.00 N ATOM 667 CA LYS A 123 7.357 -0.761 8.501 1.00 0.00 C ATOM 668 C LYS A 123 6.497 -1.070 9.728 1.00 0.00 C ATOM 669 O LYS A 123 5.290 -0.846 9.711 1.00 0.00 O ATOM 670 CB LYS A 123 7.240 -1.913 7.483 1.00 0.00 C ATOM 671 CG LYS A 123 7.707 -3.274 7.999 1.00 0.00 C ATOM 672 CD LYS A 123 9.225 -3.411 7.983 1.00 0.00 C ATOM 673 CE LYS A 123 9.687 -4.678 8.682 1.00 0.00 C ATOM 674 NZ LYS A 123 9.210 -5.909 7.998 1.00 0.00 N ATOM 0 H LYS A 123 9.411 -1.115 8.352 1.00 0.00 H new ATOM 0 HA LYS A 123 6.988 0.159 8.047 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.200 -1.997 7.168 1.00 0.00 H new ATOM 0 HB3 LYS A 123 7.821 -1.657 6.597 1.00 0.00 H new ATOM 0 HG2 LYS A 123 7.342 -3.419 9.016 1.00 0.00 H new ATOM 0 HG3 LYS A 123 7.267 -4.062 7.388 1.00 0.00 H new ATOM 0 HD2 LYS A 123 9.578 -3.416 6.952 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.673 -2.544 8.469 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.776 -4.689 8.726 1.00 0.00 H new ATOM 0 HE3 LYS A 123 9.326 -4.674 9.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 9.593 -6.746 8.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 8.171 -5.940 8.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 9.532 -5.904 7.009 1.00 0.00 H new ATOM 688 N ALA A 124 7.127 -1.560 10.791 1.00 0.00 N ATOM 689 CA ALA A 124 6.409 -1.978 11.986 1.00 0.00 C ATOM 690 C ALA A 124 5.640 -0.821 12.617 1.00 0.00 C ATOM 691 O ALA A 124 4.441 -0.940 12.891 1.00 0.00 O ATOM 692 CB ALA A 124 7.366 -2.597 12.990 1.00 0.00 C ATOM 0 H ALA A 124 8.139 -1.677 10.847 1.00 0.00 H new ATOM 0 HA ALA A 124 5.679 -2.730 11.687 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.813 -2.904 13.878 1.00 0.00 H new ATOM 0 HB2 ALA A 124 7.849 -3.467 12.544 1.00 0.00 H new ATOM 0 HB3 ALA A 124 8.124 -1.865 13.270 1.00 0.00 H new ATOM 698 N LYS A 125 6.319 0.294 12.859 1.00 0.00 N ATOM 699 CA LYS A 125 5.650 1.472 13.378 1.00 0.00 C ATOM 700 C LYS A 125 4.763 2.099 12.318 1.00 0.00 C ATOM 701 O LYS A 125 3.591 2.362 12.565 1.00 0.00 O ATOM 702 CB LYS A 125 6.660 2.502 13.871 1.00 0.00 C ATOM 703 CG LYS A 125 7.404 2.072 15.119 1.00 0.00 C ATOM 704 CD LYS A 125 8.227 3.213 15.683 1.00 0.00 C ATOM 705 CE LYS A 125 9.407 3.563 14.793 1.00 0.00 C ATOM 706 NZ LYS A 125 10.368 2.436 14.685 1.00 0.00 N ATOM 0 H LYS A 125 7.321 0.403 12.705 1.00 0.00 H new ATOM 0 HA LYS A 125 5.032 1.155 14.218 1.00 0.00 H new ATOM 0 HB2 LYS A 125 7.381 2.700 13.078 1.00 0.00 H new ATOM 0 HB3 LYS A 125 6.142 3.440 14.072 1.00 0.00 H new ATOM 0 HG2 LYS A 125 6.693 1.727 15.869 1.00 0.00 H new ATOM 0 HG3 LYS A 125 8.056 1.230 14.886 1.00 0.00 H new ATOM 0 HD2 LYS A 125 7.593 4.091 15.805 1.00 0.00 H new ATOM 0 HD3 LYS A 125 8.590 2.942 16.675 1.00 0.00 H new ATOM 0 HE2 LYS A 125 9.047 3.830 13.800 1.00 0.00 H new ATOM 0 HE3 LYS A 125 9.917 4.439 15.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 11.115 2.681 14.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 10.794 2.253 15.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 9.869 1.584 14.359 1.00 0.00 H new ATOM 720 N LEU A 126 5.332 2.314 11.136 1.00 0.00 N ATOM 721 CA LEU A 126 4.644 2.991 10.050 1.00 0.00 C ATOM 722 C LEU A 126 3.275 2.386 9.752 1.00 0.00 C ATOM 723 O LEU A 126 2.300 3.115 9.611 1.00 0.00 O ATOM 724 CB LEU A 126 5.519 2.979 8.798 1.00 0.00 C ATOM 725 CG LEU A 126 6.581 4.079 8.745 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.621 3.928 9.843 1.00 0.00 C ATOM 727 CD2 LEU A 126 7.246 4.107 7.380 1.00 0.00 C ATOM 0 H LEU A 126 6.282 2.023 10.907 1.00 0.00 H new ATOM 0 HA LEU A 126 4.468 4.019 10.366 1.00 0.00 H new ATOM 0 HB2 LEU A 126 6.015 2.011 8.728 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.877 3.072 7.922 1.00 0.00 H new ATOM 0 HG LEU A 126 6.073 5.029 8.913 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.353 4.732 9.764 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.132 3.977 10.816 1.00 0.00 H new ATOM 0 HD13 LEU A 126 8.124 2.967 9.738 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.999 4.895 7.358 1.00 0.00 H new ATOM 0 HD22 LEU A 126 7.721 3.145 7.187 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.496 4.301 6.614 1.00 0.00 H new ATOM 739 N MET A 127 3.196 1.064 9.680 1.00 0.00 N ATOM 740 CA MET A 127 1.932 0.388 9.390 1.00 0.00 C ATOM 741 C MET A 127 0.831 0.812 10.359 1.00 0.00 C ATOM 742 O MET A 127 -0.287 1.118 9.948 1.00 0.00 O ATOM 743 CB MET A 127 2.110 -1.130 9.453 1.00 0.00 C ATOM 744 CG MET A 127 2.787 -1.727 8.226 1.00 0.00 C ATOM 745 SD MET A 127 1.619 -2.303 6.974 1.00 0.00 S ATOM 746 CE MET A 127 0.813 -0.779 6.480 1.00 0.00 C ATOM 0 H MET A 127 3.989 0.437 9.818 1.00 0.00 H new ATOM 0 HA MET A 127 1.633 0.679 8.383 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.697 -1.380 10.337 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.132 -1.595 9.578 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.445 -0.979 7.783 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.416 -2.561 8.537 1.00 0.00 H new ATOM 0 HE1 MET A 127 0.244 -0.948 5.566 1.00 0.00 H new ATOM 0 HE2 MET A 127 0.139 -0.451 7.271 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.565 -0.011 6.302 1.00 0.00 H new ATOM 756 N ARG A 128 1.162 0.847 11.639 1.00 0.00 N ATOM 757 CA ARG A 128 0.187 1.169 12.672 1.00 0.00 C ATOM 758 C ARG A 128 0.029 2.679 12.826 1.00 0.00 C ATOM 759 O ARG A 128 -1.069 3.179 13.070 1.00 0.00 O ATOM 760 CB ARG A 128 0.627 0.546 13.992 1.00 0.00 C ATOM 761 CG ARG A 128 0.827 -0.959 13.905 1.00 0.00 C ATOM 762 CD ARG A 128 1.440 -1.516 15.177 1.00 0.00 C ATOM 763 NE ARG A 128 2.794 -1.007 15.405 1.00 0.00 N ATOM 764 CZ ARG A 128 3.164 -0.330 16.495 1.00 0.00 C ATOM 765 NH1 ARG A 128 2.267 -0.023 17.427 1.00 0.00 N ATOM 766 NH2 ARG A 128 4.428 0.049 16.647 1.00 0.00 N ATOM 0 H ARG A 128 2.100 0.656 11.990 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.781 0.761 12.380 1.00 0.00 H new ATOM 0 HB2 ARG A 128 1.558 1.012 14.314 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -0.119 0.764 14.756 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -0.132 -1.444 13.720 1.00 0.00 H new ATOM 0 HG3 ARG A 128 1.471 -1.193 13.057 1.00 0.00 H new ATOM 0 HD2 ARG A 128 0.808 -1.257 16.027 1.00 0.00 H new ATOM 0 HD3 ARG A 128 1.467 -2.604 15.119 1.00 0.00 H new ATOM 0 HE ARG A 128 3.498 -1.180 14.687 1.00 0.00 H new ATOM 0 HH11 ARG A 128 1.294 -0.305 17.310 1.00 0.00 H new ATOM 0 HH12 ARG A 128 2.552 0.494 18.259 1.00 0.00 H new ATOM 0 HH21 ARG A 128 5.118 -0.177 15.930 1.00 0.00 H new ATOM 0 HH22 ARG A 128 4.709 0.566 17.480 1.00 0.00 H new ATOM 780 N ALA A 129 1.130 3.400 12.658 1.00 0.00 N ATOM 781 CA ALA A 129 1.140 4.847 12.818 1.00 0.00 C ATOM 782 C ALA A 129 0.446 5.544 11.654 1.00 0.00 C ATOM 783 O ALA A 129 0.108 6.721 11.738 1.00 0.00 O ATOM 784 CB ALA A 129 2.568 5.355 12.961 1.00 0.00 C ATOM 0 H ALA A 129 2.035 3.001 12.409 1.00 0.00 H new ATOM 0 HA ALA A 129 0.586 5.083 13.726 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.559 6.438 13.080 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.031 4.898 13.836 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.138 5.093 12.070 1.00 0.00 H new ATOM 790 N TYR A 130 0.261 4.830 10.557 1.00 0.00 N ATOM 791 CA TYR A 130 -0.439 5.387 9.405 1.00 0.00 C ATOM 792 C TYR A 130 -1.934 5.133 9.509 1.00 0.00 C ATOM 793 O TYR A 130 -2.745 5.903 9.001 1.00 0.00 O ATOM 794 CB TYR A 130 0.107 4.800 8.104 1.00 0.00 C ATOM 795 CG TYR A 130 1.492 5.295 7.741 1.00 0.00 C ATOM 796 CD1 TYR A 130 2.164 6.203 8.549 1.00 0.00 C ATOM 797 CD2 TYR A 130 2.122 4.855 6.588 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.420 6.657 8.218 1.00 0.00 C ATOM 799 CE2 TYR A 130 3.380 5.305 6.252 1.00 0.00 C ATOM 800 CZ TYR A 130 4.023 6.207 7.069 1.00 0.00 C ATOM 801 OH TYR A 130 5.274 6.663 6.731 1.00 0.00 O ATOM 0 H TYR A 130 0.582 3.869 10.437 1.00 0.00 H new ATOM 0 HA TYR A 130 -0.270 6.464 9.397 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.131 3.714 8.189 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.579 5.041 7.292 1.00 0.00 H new ATOM 0 HD1 TYR A 130 1.692 6.559 9.453 1.00 0.00 H new ATOM 0 HD2 TYR A 130 1.620 4.149 5.943 1.00 0.00 H new ATOM 0 HE1 TYR A 130 3.929 7.363 8.858 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.860 4.951 5.351 1.00 0.00 H new ATOM 0 HH TYR A 130 5.775 6.879 7.545 1.00 0.00 H new ATOM 811 N MET A 131 -2.292 4.069 10.206 1.00 0.00 N ATOM 812 CA MET A 131 -3.689 3.676 10.344 1.00 0.00 C ATOM 813 C MET A 131 -4.408 4.522 11.389 1.00 0.00 C ATOM 814 O MET A 131 -5.560 4.261 11.720 1.00 0.00 O ATOM 815 CB MET A 131 -3.794 2.193 10.706 1.00 0.00 C ATOM 816 CG MET A 131 -3.429 1.248 9.569 1.00 0.00 C ATOM 817 SD MET A 131 -4.856 0.714 8.591 1.00 0.00 S ATOM 818 CE MET A 131 -5.415 2.255 7.866 1.00 0.00 C ATOM 0 H MET A 131 -1.634 3.457 10.688 1.00 0.00 H new ATOM 0 HA MET A 131 -4.175 3.844 9.383 1.00 0.00 H new ATOM 0 HB2 MET A 131 -3.142 1.990 11.556 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.813 1.980 11.028 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.712 1.741 8.913 1.00 0.00 H new ATOM 0 HG3 MET A 131 -2.932 0.370 9.982 1.00 0.00 H new ATOM 0 HE1 MET A 131 -6.075 2.043 7.025 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.955 2.834 8.615 1.00 0.00 H new ATOM 0 HE3 MET A 131 -4.555 2.826 7.517 1.00 0.00 H new ATOM 828 N GLN A 132 -3.732 5.536 11.905 1.00 0.00 N ATOM 829 CA GLN A 132 -4.325 6.393 12.921 1.00 0.00 C ATOM 830 C GLN A 132 -4.785 7.714 12.316 1.00 0.00 C ATOM 831 O GLN A 132 -5.659 8.386 12.860 1.00 0.00 O ATOM 832 CB GLN A 132 -3.329 6.656 14.047 1.00 0.00 C ATOM 833 CG GLN A 132 -2.123 7.463 13.611 1.00 0.00 C ATOM 834 CD GLN A 132 -1.120 7.660 14.723 1.00 0.00 C ATOM 835 OE1 GLN A 132 -1.478 7.722 15.896 1.00 0.00 O ATOM 836 NE2 GLN A 132 0.142 7.758 14.356 1.00 0.00 N ATOM 0 H GLN A 132 -2.779 5.785 11.640 1.00 0.00 H new ATOM 0 HA GLN A 132 -5.194 5.877 13.330 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.837 7.184 14.854 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.991 5.702 14.452 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.638 6.960 12.775 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.454 8.436 13.249 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.392 7.701 13.369 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.869 7.891 15.059 1.00 0.00 H new ATOM 845 N GLU A 133 -4.197 8.080 11.185 1.00 0.00 N ATOM 846 CA GLU A 133 -4.483 9.362 10.565 1.00 0.00 C ATOM 847 C GLU A 133 -5.412 9.204 9.363 1.00 0.00 C ATOM 848 O GLU A 133 -5.253 8.288 8.552 1.00 0.00 O ATOM 849 CB GLU A 133 -3.180 10.057 10.173 1.00 0.00 C ATOM 850 CG GLU A 133 -2.021 9.104 9.919 1.00 0.00 C ATOM 851 CD GLU A 133 -0.751 9.840 9.576 1.00 0.00 C ATOM 852 OE1 GLU A 133 0.055 10.100 10.496 1.00 0.00 O ATOM 853 OE2 GLU A 133 -0.559 10.183 8.400 1.00 0.00 O ATOM 0 H GLU A 133 -3.521 7.507 10.681 1.00 0.00 H new ATOM 0 HA GLU A 133 -5.003 9.987 11.291 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -3.353 10.650 9.275 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.899 10.752 10.964 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.856 8.489 10.804 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -2.279 8.427 9.104 1.00 0.00 H new ATOM 860 N PRO A 134 -6.385 10.128 9.235 1.00 0.00 N ATOM 861 CA PRO A 134 -7.476 10.039 8.249 1.00 0.00 C ATOM 862 C PRO A 134 -7.006 10.081 6.794 1.00 0.00 C ATOM 863 O PRO A 134 -7.774 9.774 5.881 1.00 0.00 O ATOM 864 CB PRO A 134 -8.350 11.258 8.560 1.00 0.00 C ATOM 865 CG PRO A 134 -7.448 12.205 9.270 1.00 0.00 C ATOM 866 CD PRO A 134 -6.496 11.349 10.055 1.00 0.00 C ATOM 0 HA PRO A 134 -7.992 9.083 8.334 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.749 11.701 7.648 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -9.203 10.984 9.181 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.913 12.840 8.564 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -8.013 12.866 9.927 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -5.530 11.836 10.184 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -6.879 11.131 11.052 1.00 0.00 H new ATOM 874 N LEU A 135 -5.760 10.461 6.569 1.00 0.00 N ATOM 875 CA LEU A 135 -5.235 10.519 5.214 1.00 0.00 C ATOM 876 C LEU A 135 -4.893 9.128 4.692 1.00 0.00 C ATOM 877 O LEU A 135 -5.155 8.815 3.530 1.00 0.00 O ATOM 878 CB LEU A 135 -4.013 11.440 5.129 1.00 0.00 C ATOM 879 CG LEU A 135 -4.335 12.927 4.942 1.00 0.00 C ATOM 880 CD1 LEU A 135 -5.060 13.490 6.154 1.00 0.00 C ATOM 881 CD2 LEU A 135 -3.072 13.723 4.662 1.00 0.00 C ATOM 0 H LEU A 135 -5.099 10.731 7.297 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.018 10.936 4.581 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -3.424 11.323 6.039 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.387 11.112 4.299 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.997 13.016 4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -5.275 14.546 5.991 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -5.994 12.949 6.303 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -4.432 13.379 7.038 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.326 14.775 4.533 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -2.382 13.616 5.499 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -2.601 13.350 3.753 1.00 0.00 H new ATOM 893 N PHE A 136 -4.341 8.283 5.553 1.00 0.00 N ATOM 894 CA PHE A 136 -3.873 6.973 5.120 1.00 0.00 C ATOM 895 C PHE A 136 -4.976 5.940 5.280 1.00 0.00 C ATOM 896 O PHE A 136 -5.086 5.004 4.491 1.00 0.00 O ATOM 897 CB PHE A 136 -2.630 6.552 5.906 1.00 0.00 C ATOM 898 CG PHE A 136 -1.920 5.359 5.320 1.00 0.00 C ATOM 899 CD1 PHE A 136 -0.913 5.529 4.382 1.00 0.00 C ATOM 900 CD2 PHE A 136 -2.254 4.072 5.711 1.00 0.00 C ATOM 901 CE1 PHE A 136 -0.253 4.438 3.845 1.00 0.00 C ATOM 902 CE2 PHE A 136 -1.598 2.978 5.177 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.596 3.163 4.244 1.00 0.00 C ATOM 0 H PHE A 136 -4.207 8.478 6.545 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.603 7.037 4.066 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -1.936 7.392 5.949 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -2.919 6.324 6.932 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -0.641 6.525 4.067 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -3.036 3.922 6.441 1.00 0.00 H new ATOM 0 HE1 PHE A 136 0.529 4.584 3.115 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -1.869 1.980 5.489 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.082 2.310 3.827 1.00 0.00 H new ATOM 913 N VAL A 137 -5.792 6.120 6.310 1.00 0.00 N ATOM 914 CA VAL A 137 -6.905 5.219 6.576 1.00 0.00 C ATOM 915 C VAL A 137 -7.841 5.124 5.376 1.00 0.00 C ATOM 916 O VAL A 137 -8.164 4.032 4.921 1.00 0.00 O ATOM 917 CB VAL A 137 -7.710 5.665 7.807 1.00 0.00 C ATOM 918 CG1 VAL A 137 -6.928 5.464 9.090 1.00 0.00 C ATOM 919 CG2 VAL A 137 -8.136 7.091 7.674 1.00 0.00 C ATOM 0 H VAL A 137 -5.703 6.886 6.978 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.472 4.238 6.772 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.600 5.038 7.858 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.530 5.791 9.938 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.682 4.408 9.205 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -6.009 6.048 9.051 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.704 7.385 8.557 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.255 7.727 7.581 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.760 7.203 6.787 1.00 0.00 H new ATOM 929 N GLU A 138 -8.263 6.273 4.870 1.00 0.00 N ATOM 930 CA GLU A 138 -9.149 6.330 3.717 1.00 0.00 C ATOM 931 C GLU A 138 -8.445 5.816 2.478 1.00 0.00 C ATOM 932 O GLU A 138 -9.062 5.181 1.629 1.00 0.00 O ATOM 933 CB GLU A 138 -9.639 7.756 3.496 1.00 0.00 C ATOM 934 CG GLU A 138 -10.367 8.318 4.697 1.00 0.00 C ATOM 935 CD GLU A 138 -11.539 7.454 5.119 1.00 0.00 C ATOM 936 OE1 GLU A 138 -12.552 7.414 4.387 1.00 0.00 O ATOM 937 OE2 GLU A 138 -11.455 6.811 6.182 1.00 0.00 O ATOM 0 H GLU A 138 -8.003 7.186 5.244 1.00 0.00 H new ATOM 0 HA GLU A 138 -10.011 5.692 3.912 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -8.788 8.395 3.261 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -10.303 7.777 2.632 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -9.670 8.412 5.530 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -10.724 9.322 4.465 1.00 0.00 H new ATOM 944 N PHE A 139 -7.152 6.091 2.386 1.00 0.00 N ATOM 945 CA PHE A 139 -6.331 5.546 1.314 1.00 0.00 C ATOM 946 C PHE A 139 -6.429 4.027 1.323 1.00 0.00 C ATOM 947 O PHE A 139 -6.732 3.401 0.306 1.00 0.00 O ATOM 948 CB PHE A 139 -4.876 5.995 1.493 1.00 0.00 C ATOM 949 CG PHE A 139 -3.884 5.211 0.675 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.736 5.446 -0.681 1.00 0.00 C ATOM 951 CD2 PHE A 139 -3.096 4.239 1.273 1.00 0.00 C ATOM 952 CE1 PHE A 139 -2.825 4.723 -1.428 1.00 0.00 C ATOM 953 CE2 PHE A 139 -2.184 3.514 0.532 1.00 0.00 C ATOM 954 CZ PHE A 139 -2.047 3.756 -0.820 1.00 0.00 C ATOM 0 H PHE A 139 -6.648 6.689 3.041 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.690 5.916 0.353 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.797 7.049 1.227 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.608 5.911 2.546 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.339 6.203 -1.161 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -3.197 4.047 2.331 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.721 4.914 -2.486 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.578 2.758 1.010 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.333 3.191 -1.401 1.00 0.00 H new ATOM 964 N ALA A 140 -6.203 3.455 2.497 1.00 0.00 N ATOM 965 CA ALA A 140 -6.296 2.022 2.690 1.00 0.00 C ATOM 966 C ALA A 140 -7.714 1.536 2.434 1.00 0.00 C ATOM 967 O ALA A 140 -7.925 0.579 1.691 1.00 0.00 O ATOM 968 CB ALA A 140 -5.853 1.657 4.099 1.00 0.00 C ATOM 0 H ALA A 140 -5.951 3.973 3.339 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.636 1.531 1.975 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.926 0.578 4.235 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.821 1.973 4.249 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.495 2.159 4.824 1.00 0.00 H new ATOM 974 N ASP A 141 -8.681 2.233 3.016 1.00 0.00 N ATOM 975 CA ASP A 141 -10.084 1.845 2.923 1.00 0.00 C ATOM 976 C ASP A 141 -10.538 1.817 1.469 1.00 0.00 C ATOM 977 O ASP A 141 -11.362 0.990 1.071 1.00 0.00 O ATOM 978 CB ASP A 141 -10.941 2.822 3.733 1.00 0.00 C ATOM 979 CG ASP A 141 -12.423 2.556 3.604 1.00 0.00 C ATOM 980 OD1 ASP A 141 -13.093 3.279 2.840 1.00 0.00 O ATOM 981 OD2 ASP A 141 -12.930 1.631 4.274 1.00 0.00 O ATOM 0 H ASP A 141 -8.518 3.078 3.563 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.202 0.842 3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.657 2.761 4.784 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.730 3.840 3.404 1.00 0.00 H new ATOM 986 N CYS A 142 -9.970 2.709 0.680 1.00 0.00 N ATOM 987 CA CYS A 142 -10.306 2.821 -0.726 1.00 0.00 C ATOM 988 C CYS A 142 -9.666 1.704 -1.541 1.00 0.00 C ATOM 989 O CYS A 142 -10.344 1.030 -2.317 1.00 0.00 O ATOM 990 CB CYS A 142 -9.868 4.183 -1.254 1.00 0.00 C ATOM 991 SG CYS A 142 -10.881 5.560 -0.662 1.00 0.00 S ATOM 0 H CYS A 142 -9.264 3.375 0.995 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.387 2.726 -0.828 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -8.831 4.357 -0.965 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -9.897 4.166 -2.343 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.488 5.908 0.527 1.00 0.00 H new ATOM 997 N CYS A 143 -8.368 1.480 -1.342 1.00 0.00 N ATOM 998 CA CYS A 143 -7.639 0.513 -2.151 1.00 0.00 C ATOM 999 C CYS A 143 -8.123 -0.904 -1.872 1.00 0.00 C ATOM 1000 O CYS A 143 -8.124 -1.752 -2.764 1.00 0.00 O ATOM 1001 CB CYS A 143 -6.129 0.628 -1.911 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.621 0.401 -0.193 1.00 0.00 S ATOM 0 H CYS A 143 -7.806 1.952 -0.633 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.834 0.737 -3.200 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.619 -0.112 -2.528 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.794 1.609 -2.248 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.660 0.109 0.532 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.569 -1.145 -0.640 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.075 -2.455 -0.250 1.00 0.00 C ATOM 1010 C LEU A 144 -10.251 -2.861 -1.121 1.00 0.00 C ATOM 1011 O LEU A 144 -10.287 -3.970 -1.643 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.505 -2.463 1.219 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.390 -2.203 2.229 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.919 -2.317 3.647 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -7.232 -3.159 2.007 1.00 0.00 C ATOM 0 H LEU A 144 -8.589 -0.448 0.104 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.265 -3.171 -0.386 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.280 -1.709 1.357 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.957 -3.430 1.443 1.00 0.00 H new ATOM 0 HG LEU A 144 -8.023 -1.187 2.082 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.110 -2.129 4.353 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.712 -1.585 3.799 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.315 -3.320 3.808 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.448 -2.957 2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.580 -4.185 2.123 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.835 -3.022 1.001 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.191 -1.938 -1.301 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.393 -2.238 -2.054 1.00 0.00 C ATOM 1029 C GLY A 145 -12.106 -2.476 -3.520 1.00 0.00 C ATOM 1030 O GLY A 145 -12.823 -3.214 -4.194 1.00 0.00 O ATOM 0 H GLY A 145 -11.140 -0.986 -0.938 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.873 -3.121 -1.632 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -13.098 -1.413 -1.953 1.00 0.00 H new ATOM 1034 N ILE A 146 -11.045 -1.859 -4.007 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.665 -1.979 -5.402 1.00 0.00 C ATOM 1036 C ILE A 146 -9.999 -3.325 -5.666 1.00 0.00 C ATOM 1037 O ILE A 146 -10.290 -3.988 -6.662 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.708 -0.839 -5.809 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -10.365 0.516 -5.532 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.322 -0.958 -7.280 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -9.419 1.692 -5.640 1.00 0.00 C ATOM 0 H ILE A 146 -10.428 -1.266 -3.452 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.573 -1.909 -6.001 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.798 -0.917 -5.215 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -11.188 0.659 -6.232 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.797 0.501 -4.531 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.647 -0.145 -7.546 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.824 -1.913 -7.449 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -10.219 -0.902 -7.897 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.960 2.615 -5.430 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -8.609 1.574 -4.920 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -9.006 1.735 -6.648 1.00 0.00 H new ATOM 1053 N VAL A 147 -9.130 -3.746 -4.754 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.351 -4.960 -4.961 1.00 0.00 C ATOM 1055 C VAL A 147 -9.058 -6.200 -4.419 1.00 0.00 C ATOM 1056 O VAL A 147 -8.490 -7.293 -4.450 1.00 0.00 O ATOM 1057 CB VAL A 147 -6.949 -4.864 -4.323 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -6.188 -3.671 -4.880 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -7.041 -4.788 -2.809 1.00 0.00 C ATOM 0 H VAL A 147 -8.948 -3.269 -3.871 1.00 0.00 H new ATOM 0 HA VAL A 147 -8.245 -5.059 -6.041 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.399 -5.770 -4.578 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -5.202 -3.620 -4.418 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.078 -3.781 -5.959 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.738 -2.755 -4.663 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.038 -4.721 -2.386 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.615 -3.906 -2.523 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.536 -5.682 -2.429 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.279 -6.027 -3.916 1.00 0.00 N ATOM 1070 CA GLU A 148 -11.086 -7.155 -3.445 1.00 0.00 C ATOM 1071 C GLU A 148 -11.206 -8.219 -4.536 1.00 0.00 C ATOM 1072 O GLU A 148 -11.800 -7.978 -5.587 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.484 -6.684 -3.028 1.00 0.00 C ATOM 1074 CG GLU A 148 -12.529 -5.965 -1.688 1.00 0.00 C ATOM 1075 CD GLU A 148 -12.391 -6.905 -0.507 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -13.422 -7.241 0.114 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -11.258 -7.320 -0.192 1.00 0.00 O ATOM 0 H GLU A 148 -10.732 -5.118 -3.823 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.587 -7.588 -2.578 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -12.875 -6.018 -3.798 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -13.148 -7.547 -2.986 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -11.729 -5.225 -1.652 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -13.470 -5.422 -1.605 1.00 0.00 H new ATOM 1197 N ILE B 463 -7.273 -6.948 9.952 1.00 0.00 N ATOM 1198 CA ILE B 463 -6.390 -5.802 9.758 1.00 0.00 C ATOM 1199 C ILE B 463 -4.965 -6.271 9.478 1.00 0.00 C ATOM 1200 O ILE B 463 -4.245 -5.662 8.687 1.00 0.00 O ATOM 1201 CB ILE B 463 -6.402 -4.863 10.989 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -7.802 -4.285 11.203 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -5.388 -3.738 10.822 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -7.924 -3.419 12.439 1.00 0.00 C ATOM 0 HA ILE B 463 -6.760 -5.242 8.900 1.00 0.00 H new ATOM 0 HB ILE B 463 -6.124 -5.448 11.866 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -8.079 -3.695 10.329 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -8.516 -5.105 11.274 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -5.414 -3.091 11.699 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -4.389 -4.161 10.713 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -5.634 -3.156 9.934 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -8.945 -3.046 12.523 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -7.680 -4.009 13.322 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -7.235 -2.578 12.363 1.00 0.00 H new ATOM 1216 N ARG B 464 -4.577 -7.372 10.117 1.00 0.00 N ATOM 1217 CA ARG B 464 -3.282 -7.998 9.862 1.00 0.00 C ATOM 1218 C ARG B 464 -3.123 -8.303 8.373 1.00 0.00 C ATOM 1219 O ARG B 464 -2.062 -8.093 7.792 1.00 0.00 O ATOM 1220 CB ARG B 464 -3.137 -9.279 10.691 1.00 0.00 C ATOM 1221 CG ARG B 464 -4.280 -10.263 10.501 1.00 0.00 C ATOM 1222 CD ARG B 464 -4.156 -11.454 11.433 1.00 0.00 C ATOM 1223 NE ARG B 464 -5.352 -12.301 11.397 1.00 0.00 N ATOM 1224 CZ ARG B 464 -5.349 -13.616 11.605 1.00 0.00 C ATOM 1225 NH1 ARG B 464 -4.214 -14.260 11.850 1.00 0.00 N ATOM 1226 NH2 ARG B 464 -6.486 -14.293 11.560 1.00 0.00 N ATOM 0 H ARG B 464 -5.143 -7.851 10.818 1.00 0.00 H new ATOM 0 HA ARG B 464 -2.495 -7.304 10.158 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -2.200 -9.769 10.426 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -3.070 -9.013 11.746 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -5.229 -9.758 10.681 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -4.294 -10.609 9.468 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -3.284 -12.045 11.153 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -3.990 -11.103 12.451 1.00 0.00 H new ATOM 0 HE ARG B 464 -6.247 -11.853 11.199 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -3.333 -13.747 11.880 1.00 0.00 H new ATOM 0 HH12 ARG B 464 -4.223 -15.268 12.008 1.00 0.00 H new ATOM 0 HH21 ARG B 464 -7.362 -13.807 11.366 1.00 0.00 H new ATOM 0 HH22 ARG B 464 -6.486 -15.301 11.719 1.00 0.00 H new ATOM 1240 N HIS B 465 -4.202 -8.764 7.759 1.00 0.00 N ATOM 1241 CA HIS B 465 -4.211 -9.054 6.336 1.00 0.00 C ATOM 1242 C HIS B 465 -4.264 -7.762 5.526 1.00 0.00 C ATOM 1243 O HIS B 465 -3.500 -7.584 4.580 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.403 -9.956 5.988 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.711 -10.016 4.523 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -5.007 -10.792 3.633 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.638 -9.357 3.795 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -5.492 -10.604 2.418 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -6.481 -9.739 2.490 1.00 0.00 N ATOM 0 H HIS B 465 -5.088 -8.946 8.230 1.00 0.00 H new ATOM 0 HA HIS B 465 -3.290 -9.579 6.082 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -5.200 -10.965 6.348 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -6.284 -9.598 6.520 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -7.369 -8.657 4.173 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -5.136 -11.081 1.517 1.00 0.00 H new ATOM 0 HE2 HIS B 465 -7.039 -9.408 1.703 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.166 -6.868 5.915 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.390 -5.625 5.186 1.00 0.00 C ATOM 1260 C GLU B 466 -4.112 -4.800 5.067 1.00 0.00 C ATOM 1261 O GLU B 466 -3.785 -4.318 3.989 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.472 -4.795 5.871 1.00 0.00 C ATOM 1263 CG GLU B 466 -7.833 -5.472 5.904 1.00 0.00 C ATOM 1264 CD GLU B 466 -8.812 -4.773 6.826 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -9.280 -5.411 7.792 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -9.107 -3.584 6.597 1.00 0.00 O ATOM 0 H GLU B 466 -5.758 -6.983 6.738 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.716 -5.893 4.181 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -6.159 -4.578 6.892 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -6.564 -3.839 5.356 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -8.246 -5.498 4.895 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -7.712 -6.506 6.226 1.00 0.00 H new ATOM 1273 N ARG B 467 -3.383 -4.658 6.170 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.174 -3.836 6.183 1.00 0.00 C ATOM 1275 C ARG B 467 -1.100 -4.402 5.260 1.00 0.00 C ATOM 1276 O ARG B 467 -0.307 -3.654 4.692 1.00 0.00 O ATOM 1277 CB ARG B 467 -1.627 -3.687 7.603 1.00 0.00 C ATOM 1278 CG ARG B 467 -2.528 -2.869 8.514 1.00 0.00 C ATOM 1279 CD ARG B 467 -1.870 -2.590 9.856 1.00 0.00 C ATOM 1280 NE ARG B 467 -1.466 -3.816 10.540 1.00 0.00 N ATOM 1281 CZ ARG B 467 -1.638 -4.039 11.842 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -2.245 -3.137 12.605 1.00 0.00 N ATOM 1283 NH2 ARG B 467 -1.207 -5.170 12.378 1.00 0.00 N ATOM 0 H ARG B 467 -3.605 -5.098 7.063 1.00 0.00 H new ATOM 0 HA ARG B 467 -2.451 -2.849 5.812 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -1.487 -4.677 8.036 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -0.645 -3.217 7.559 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -2.776 -1.926 8.028 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -3.465 -3.402 8.673 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -0.996 -1.956 9.705 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -2.562 -2.034 10.489 1.00 0.00 H new ATOM 0 HE ARG B 467 -1.024 -4.548 9.985 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -2.583 -2.266 12.195 1.00 0.00 H new ATOM 0 HH12 ARG B 467 -2.373 -3.315 13.601 1.00 0.00 H new ATOM 0 HH21 ARG B 467 -0.745 -5.867 11.794 1.00 0.00 H new ATOM 0 HH22 ARG B 467 -1.337 -5.344 13.375 1.00 0.00 H new ATOM 1297 N ASN B 468 -1.093 -5.716 5.081 1.00 0.00 N ATOM 1298 CA ASN B 468 -0.125 -6.346 4.197 1.00 0.00 C ATOM 1299 C ASN B 468 -0.554 -6.105 2.759 1.00 0.00 C ATOM 1300 O ASN B 468 0.270 -5.952 1.861 1.00 0.00 O ATOM 1301 CB ASN B 468 -0.013 -7.847 4.499 1.00 0.00 C ATOM 1302 CG ASN B 468 -0.355 -8.720 3.309 1.00 0.00 C ATOM 1303 OD1 ASN B 468 0.516 -9.113 2.531 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -1.633 -9.019 3.152 1.00 0.00 N ATOM 0 H ASN B 468 -1.741 -6.361 5.533 1.00 0.00 H new ATOM 0 HA ASN B 468 0.861 -5.911 4.357 1.00 0.00 H new ATOM 0 HB2 ASN B 468 1.002 -8.071 4.826 1.00 0.00 H new ATOM 0 HB3 ASN B 468 -0.677 -8.095 5.327 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -1.929 -9.595 2.364 1.00 0.00 H new ATOM 0 HD22 ASN B 468 -2.323 -8.674 3.819 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.863 -6.048 2.570 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.456 -5.752 1.281 1.00 0.00 C ATOM 1313 C VAL B 469 -2.131 -4.319 0.862 1.00 0.00 C ATOM 1314 O VAL B 469 -1.898 -4.039 -0.319 1.00 0.00 O ATOM 1315 CB VAL B 469 -3.986 -5.981 1.338 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.727 -5.098 0.349 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -4.306 -7.443 1.085 1.00 0.00 C ATOM 0 H VAL B 469 -2.545 -6.207 3.312 1.00 0.00 H new ATOM 0 HA VAL B 469 -2.035 -6.424 0.533 1.00 0.00 H new ATOM 0 HB VAL B 469 -4.325 -5.707 2.337 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.798 -5.290 0.421 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.530 -4.051 0.578 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -4.386 -5.319 -0.662 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -5.385 -7.592 1.128 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -3.939 -7.731 0.100 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.825 -8.058 1.846 1.00 0.00 H new ATOM 1327 N ILE B 470 -2.086 -3.423 1.843 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.734 -2.033 1.592 1.00 0.00 C ATOM 1329 C ILE B 470 -0.306 -1.937 1.066 1.00 0.00 C ATOM 1330 O ILE B 470 0.005 -1.084 0.235 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.861 -1.164 2.863 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -3.214 -1.385 3.542 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.688 0.305 2.513 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.398 -1.135 2.637 1.00 0.00 C ATOM 0 H ILE B 470 -2.289 -3.637 2.819 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.435 -1.656 0.848 1.00 0.00 H new ATOM 0 HB ILE B 470 -1.075 -1.460 3.558 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -3.261 -2.409 3.912 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -3.286 -0.729 4.409 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -1.780 0.908 3.417 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.704 0.460 2.071 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.457 0.602 1.799 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.321 -1.312 3.189 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.377 -0.103 2.287 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.351 -1.809 1.782 1.00 0.00 H new ATOM 1346 N LEU B 471 0.551 -2.834 1.545 1.00 0.00 N ATOM 1347 CA LEU B 471 1.934 -2.887 1.092 1.00 0.00 C ATOM 1348 C LEU B 471 1.990 -3.082 -0.418 1.00 0.00 C ATOM 1349 O LEU B 471 2.686 -2.352 -1.114 1.00 0.00 O ATOM 1350 CB LEU B 471 2.690 -4.018 1.795 1.00 0.00 C ATOM 1351 CG LEU B 471 2.764 -3.907 3.321 1.00 0.00 C ATOM 1352 CD1 LEU B 471 3.441 -5.134 3.913 1.00 0.00 C ATOM 1353 CD2 LEU B 471 3.508 -2.646 3.729 1.00 0.00 C ATOM 0 H LEU B 471 0.310 -3.534 2.247 1.00 0.00 H new ATOM 0 HA LEU B 471 2.412 -1.940 1.344 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.214 -4.965 1.539 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.705 -4.054 1.400 1.00 0.00 H new ATOM 0 HG LEU B 471 1.747 -3.850 3.710 1.00 0.00 H new ATOM 0 HD11 LEU B 471 3.485 -5.038 4.998 1.00 0.00 H new ATOM 0 HD12 LEU B 471 2.872 -6.026 3.651 1.00 0.00 H new ATOM 0 HD13 LEU B 471 4.452 -5.219 3.515 1.00 0.00 H new ATOM 0 HD21 LEU B 471 3.550 -2.584 4.816 1.00 0.00 H new ATOM 0 HD22 LEU B 471 4.521 -2.675 3.327 1.00 0.00 H new ATOM 0 HD23 LEU B 471 2.987 -1.773 3.336 1.00 0.00 H new ATOM 1365 N GLN B 472 1.228 -4.053 -0.918 1.00 0.00 N ATOM 1366 CA GLN B 472 1.163 -4.322 -2.355 1.00 0.00 C ATOM 1367 C GLN B 472 0.686 -3.094 -3.122 1.00 0.00 C ATOM 1368 O GLN B 472 1.163 -2.818 -4.224 1.00 0.00 O ATOM 1369 CB GLN B 472 0.245 -5.510 -2.653 1.00 0.00 C ATOM 1370 CG GLN B 472 0.902 -6.868 -2.448 1.00 0.00 C ATOM 1371 CD GLN B 472 1.245 -7.156 -1.000 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.343 -6.855 -0.533 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.304 -7.743 -0.282 1.00 0.00 N ATOM 0 H GLN B 472 0.646 -4.668 -0.349 1.00 0.00 H new ATOM 0 HA GLN B 472 2.172 -4.570 -2.685 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -0.636 -5.444 -2.014 1.00 0.00 H new ATOM 0 HB3 GLN B 472 -0.102 -5.438 -3.684 1.00 0.00 H new ATOM 0 HG2 GLN B 472 0.234 -7.646 -2.818 1.00 0.00 H new ATOM 0 HG3 GLN B 472 1.812 -6.918 -3.046 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.593 -7.975 -0.709 1.00 0.00 H new ATOM 0 HE22 GLN B 472 0.474 -7.964 0.699 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.241 -2.357 -2.527 1.00 0.00 N ATOM 1383 CA CYS B 473 -0.758 -1.140 -3.133 1.00 0.00 C ATOM 1384 C CYS B 473 0.357 -0.105 -3.258 1.00 0.00 C ATOM 1385 O CYS B 473 0.682 0.343 -4.357 1.00 0.00 O ATOM 1386 CB CYS B 473 -1.913 -0.593 -2.289 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.231 -1.796 -1.991 1.00 0.00 S ATOM 0 H CYS B 473 -0.652 -2.583 -1.621 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.132 -1.364 -4.132 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.521 -0.252 -1.331 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.335 0.279 -2.789 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.759 -2.797 -1.309 1.00 0.00 H new ATOM 1393 N VAL B 474 0.943 0.249 -2.117 1.00 0.00 N ATOM 1394 CA VAL B 474 2.093 1.145 -2.060 1.00 0.00 C ATOM 1395 C VAL B 474 3.204 0.707 -3.020 1.00 0.00 C ATOM 1396 O VAL B 474 3.759 1.530 -3.750 1.00 0.00 O ATOM 1397 CB VAL B 474 2.651 1.205 -0.620 1.00 0.00 C ATOM 1398 CG1 VAL B 474 3.897 2.070 -0.542 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.586 1.715 0.339 1.00 0.00 C ATOM 0 H VAL B 474 0.632 -0.079 -1.203 1.00 0.00 H new ATOM 0 HA VAL B 474 1.751 2.134 -2.366 1.00 0.00 H new ATOM 0 HB VAL B 474 2.932 0.193 -0.328 1.00 0.00 H new ATOM 0 HG11 VAL B 474 4.262 2.090 0.485 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.667 1.658 -1.194 1.00 0.00 H new ATOM 0 HG13 VAL B 474 3.656 3.084 -0.861 1.00 0.00 H new ATOM 0 HG21 VAL B 474 1.994 1.752 1.349 1.00 0.00 H new ATOM 0 HG22 VAL B 474 1.273 2.715 0.037 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.727 1.044 0.319 1.00 0.00 H new ATOM 1409 N ARG B 475 3.496 -0.594 -3.036 1.00 0.00 N ATOM 1410 CA ARG B 475 4.571 -1.134 -3.865 1.00 0.00 C ATOM 1411 C ARG B 475 4.285 -0.913 -5.339 1.00 0.00 C ATOM 1412 O ARG B 475 5.167 -0.523 -6.099 1.00 0.00 O ATOM 1413 CB ARG B 475 4.760 -2.634 -3.617 1.00 0.00 C ATOM 1414 CG ARG B 475 5.374 -2.983 -2.274 1.00 0.00 C ATOM 1415 CD ARG B 475 6.779 -2.425 -2.133 1.00 0.00 C ATOM 1416 NE ARG B 475 7.463 -2.973 -0.964 1.00 0.00 N ATOM 1417 CZ ARG B 475 8.469 -2.368 -0.339 1.00 0.00 C ATOM 1418 NH1 ARG B 475 8.889 -1.178 -0.745 1.00 0.00 N ATOM 1419 NH2 ARG B 475 9.047 -2.951 0.704 1.00 0.00 N ATOM 0 H ARG B 475 3.001 -1.294 -2.483 1.00 0.00 H new ATOM 0 HA ARG B 475 5.484 -0.605 -3.589 1.00 0.00 H new ATOM 0 HB2 ARG B 475 3.791 -3.126 -3.697 1.00 0.00 H new ATOM 0 HB3 ARG B 475 5.391 -3.042 -4.407 1.00 0.00 H new ATOM 0 HG2 ARG B 475 4.746 -2.591 -1.474 1.00 0.00 H new ATOM 0 HG3 ARG B 475 5.400 -4.066 -2.157 1.00 0.00 H new ATOM 0 HD2 ARG B 475 7.353 -2.653 -3.031 1.00 0.00 H new ATOM 0 HD3 ARG B 475 6.733 -1.339 -2.052 1.00 0.00 H new ATOM 0 HE ARG B 475 7.150 -3.875 -0.605 1.00 0.00 H new ATOM 0 HH11 ARG B 475 8.440 -0.723 -1.540 1.00 0.00 H new ATOM 0 HH12 ARG B 475 9.661 -0.718 -0.263 1.00 0.00 H new ATOM 0 HH21 ARG B 475 8.720 -3.862 1.025 1.00 0.00 H new ATOM 0 HH22 ARG B 475 9.819 -2.488 1.184 1.00 0.00 H new ATOM 1433 N TYR B 476 3.047 -1.169 -5.741 1.00 0.00 N ATOM 1434 CA TYR B 476 2.655 -1.010 -7.125 1.00 0.00 C ATOM 1435 C TYR B 476 2.678 0.460 -7.525 1.00 0.00 C ATOM 1436 O TYR B 476 3.266 0.829 -8.542 1.00 0.00 O ATOM 1437 CB TYR B 476 1.258 -1.600 -7.350 1.00 0.00 C ATOM 1438 CG TYR B 476 0.472 -0.855 -8.402 1.00 0.00 C ATOM 1439 CD1 TYR B 476 0.681 -1.082 -9.755 1.00 0.00 C ATOM 1440 CD2 TYR B 476 -0.447 0.113 -8.031 1.00 0.00 C ATOM 1441 CE1 TYR B 476 -0.005 -0.358 -10.712 1.00 0.00 C ATOM 1442 CE2 TYR B 476 -1.142 0.837 -8.979 1.00 0.00 C ATOM 1443 CZ TYR B 476 -0.916 0.601 -10.317 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.592 1.334 -11.265 1.00 0.00 O ATOM 0 H TYR B 476 2.300 -1.488 -5.124 1.00 0.00 H new ATOM 0 HA TYR B 476 3.369 -1.547 -7.750 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.353 -2.645 -7.646 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.706 -1.583 -6.410 1.00 0.00 H new ATOM 0 HD1 TYR B 476 1.390 -1.835 -10.065 1.00 0.00 H new ATOM 0 HD2 TYR B 476 -0.623 0.304 -6.983 1.00 0.00 H new ATOM 0 HE1 TYR B 476 0.171 -0.541 -11.762 1.00 0.00 H new ATOM 0 HE2 TYR B 476 -1.859 1.584 -8.673 1.00 0.00 H new ATOM 0 HH TYR B 476 -2.544 1.103 -11.240 1.00 0.00 H new ATOM 1454 N ILE B 477 2.035 1.294 -6.716 1.00 0.00 N ATOM 1455 CA ILE B 477 1.875 2.698 -7.047 1.00 0.00 C ATOM 1456 C ILE B 477 3.224 3.375 -7.181 1.00 0.00 C ATOM 1457 O ILE B 477 3.568 3.864 -8.247 1.00 0.00 O ATOM 1458 CB ILE B 477 1.027 3.440 -5.996 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.361 2.804 -5.903 1.00 0.00 C ATOM 1460 CG2 ILE B 477 0.918 4.914 -6.355 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -1.211 3.362 -4.788 1.00 0.00 C ATOM 0 H ILE B 477 1.617 1.019 -5.827 1.00 0.00 H new ATOM 0 HA ILE B 477 1.352 2.743 -8.002 1.00 0.00 H new ATOM 0 HB ILE B 477 1.513 3.359 -5.024 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.881 2.947 -6.850 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.250 1.729 -5.760 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.316 5.428 -5.605 1.00 0.00 H new ATOM 0 HG22 ILE B 477 1.914 5.356 -6.386 1.00 0.00 H new ATOM 0 HG23 ILE B 477 0.445 5.017 -7.332 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -2.180 2.863 -4.785 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.713 3.195 -3.833 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -1.354 4.432 -4.940 1.00 0.00 H new ATOM 1473 N ILE B 478 4.006 3.347 -6.117 1.00 0.00 N ATOM 1474 CA ILE B 478 5.302 4.008 -6.102 1.00 0.00 C ATOM 1475 C ILE B 478 6.212 3.468 -7.200 1.00 0.00 C ATOM 1476 O ILE B 478 7.108 4.170 -7.674 1.00 0.00 O ATOM 1477 CB ILE B 478 5.975 3.856 -4.723 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.129 4.558 -3.665 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.393 4.417 -4.725 1.00 0.00 C ATOM 1480 CD1 ILE B 478 5.700 4.452 -2.278 1.00 0.00 C ATOM 0 H ILE B 478 3.766 2.872 -5.247 1.00 0.00 H new ATOM 0 HA ILE B 478 5.136 5.068 -6.294 1.00 0.00 H new ATOM 0 HB ILE B 478 6.045 2.793 -4.491 1.00 0.00 H new ATOM 0 HG12 ILE B 478 5.029 5.611 -3.930 1.00 0.00 H new ATOM 0 HG13 ILE B 478 4.126 4.132 -3.671 1.00 0.00 H new ATOM 0 HG21 ILE B 478 7.835 4.292 -3.737 1.00 0.00 H new ATOM 0 HG22 ILE B 478 7.994 3.884 -5.461 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.365 5.477 -4.979 1.00 0.00 H new ATOM 0 HD11 ILE B 478 5.049 4.973 -1.576 1.00 0.00 H new ATOM 0 HD12 ILE B 478 5.774 3.402 -1.994 1.00 0.00 H new ATOM 0 HD13 ILE B 478 6.692 4.904 -2.257 1.00 0.00 H new ATOM 1492 N LYS B 479 5.942 2.245 -7.635 1.00 0.00 N ATOM 1493 CA LYS B 479 6.764 1.596 -8.640 1.00 0.00 C ATOM 1494 C LYS B 479 6.701 2.326 -9.974 1.00 0.00 C ATOM 1495 O LYS B 479 7.719 2.501 -10.642 1.00 0.00 O ATOM 1496 CB LYS B 479 6.343 0.135 -8.819 1.00 0.00 C ATOM 1497 CG LYS B 479 7.477 -0.858 -8.617 1.00 0.00 C ATOM 1498 CD LYS B 479 8.603 -0.626 -9.606 1.00 0.00 C ATOM 1499 CE LYS B 479 9.789 -1.533 -9.334 1.00 0.00 C ATOM 1500 NZ LYS B 479 10.948 -1.180 -10.192 1.00 0.00 N ATOM 0 H LYS B 479 5.157 1.683 -7.305 1.00 0.00 H new ATOM 0 HA LYS B 479 7.795 1.628 -8.288 1.00 0.00 H new ATOM 0 HB2 LYS B 479 5.543 -0.092 -8.114 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.932 0.005 -9.820 1.00 0.00 H new ATOM 0 HG2 LYS B 479 7.861 -0.771 -7.600 1.00 0.00 H new ATOM 0 HG3 LYS B 479 7.097 -1.873 -8.729 1.00 0.00 H new ATOM 0 HD2 LYS B 479 8.238 -0.799 -10.619 1.00 0.00 H new ATOM 0 HD3 LYS B 479 8.922 0.415 -9.555 1.00 0.00 H new ATOM 0 HE2 LYS B 479 10.074 -1.457 -8.285 1.00 0.00 H new ATOM 0 HE3 LYS B 479 9.505 -2.570 -9.512 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 11.742 -1.818 -9.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 10.681 -1.277 -11.193 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 11.233 -0.198 -10.003 1.00 0.00 H new ATOM 1514 N LYS B 480 5.512 2.751 -10.362 1.00 0.00 N ATOM 1515 CA LYS B 480 5.339 3.427 -11.639 1.00 0.00 C ATOM 1516 C LYS B 480 4.910 4.884 -11.466 1.00 0.00 C ATOM 1517 O LYS B 480 4.989 5.677 -12.404 1.00 0.00 O ATOM 1518 CB LYS B 480 4.355 2.646 -12.526 1.00 0.00 C ATOM 1519 CG LYS B 480 3.300 1.863 -11.752 1.00 0.00 C ATOM 1520 CD LYS B 480 2.212 2.762 -11.193 1.00 0.00 C ATOM 1521 CE LYS B 480 1.279 3.247 -12.289 1.00 0.00 C ATOM 1522 NZ LYS B 480 0.110 3.987 -11.745 1.00 0.00 N ATOM 0 H LYS B 480 4.657 2.642 -9.817 1.00 0.00 H new ATOM 0 HA LYS B 480 6.307 3.450 -12.139 1.00 0.00 H new ATOM 0 HB2 LYS B 480 3.854 3.345 -13.195 1.00 0.00 H new ATOM 0 HB3 LYS B 480 4.918 1.954 -13.152 1.00 0.00 H new ATOM 0 HG2 LYS B 480 2.851 1.117 -12.407 1.00 0.00 H new ATOM 0 HG3 LYS B 480 3.778 1.323 -10.935 1.00 0.00 H new ATOM 0 HD2 LYS B 480 1.641 2.220 -10.440 1.00 0.00 H new ATOM 0 HD3 LYS B 480 2.666 3.618 -10.694 1.00 0.00 H new ATOM 0 HE2 LYS B 480 1.830 3.893 -12.973 1.00 0.00 H new ATOM 0 HE3 LYS B 480 0.928 2.394 -12.869 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 -0.244 4.652 -12.462 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 -0.642 3.313 -11.497 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 0.397 4.514 -10.896 1.00 0.00 H new