USER MOD reduce.3.24.130724 H: found=0, std=0, add=694, rem=0, adj=14 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: A 143 CYS SG : rot -7:sc= -1.7! USER MOD Set 1.2: B 473 CYS SG : rot 66:sc= 0.198 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.0062) USER MOD Single : A 91 ASN : amide:sc= -0.751 K(o=-0.75,f=-5.9!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= 0.575 K(o=0.57,f=-0.011) USER MOD Single : A 98 SER OG : rot 68:sc= 0.781 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= 1.18 K(o=1.2,f=-0.027) USER MOD Single : A 109 HIS : no HD1:sc= 0.541 K(o=0.54,f=-4.7!) USER MOD Single : A 112 GLN : amide:sc= -2.9! K(o=-2.9!,f=-0.17) USER MOD Single : A 114 MET CE :methyl 180:sc= -1.01 (180deg=-1.01) USER MOD Single : A 116 ASN : amide:sc= -0.0617 K(o=-0.062,f=-1.5!) USER MOD Single : A 119 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 123 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0192) USER MOD Single : A 125 LYS NZ :NH3+ -146:sc= -0.977 (180deg=-2.75!) USER MOD Single : A 127 MET CE :methyl 169:sc= -1.83 (180deg=-2.03) USER MOD Single : A 130 TYR OH : rot -163:sc= 0.502 USER MOD Single : A 131 MET CE :methyl 145:sc= -4.55! (180deg=-5.56!) USER MOD Single : A 132 GLN : amide:sc= 0.17 K(o=0.17,f=-0.46) USER MOD Single : A 142 CYS SG : rot 80:sc= 0.00181 USER MOD Single : B 465 HIS : no HD1:sc= -0.0516 X(o=-0.052,f=-0.033) USER MOD Single : B 468 ASN : amide:sc= -0.467 K(o=-0.47,f=-2.9!) USER MOD Single : B 472 GLN : amide:sc= -4.66! K(o=-4.7!,f=-4) USER MOD Single : B 476 TYR OH : rot -71:sc= 0.213 USER MOD Single : B 479 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0926) USER MOD Single : B 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 70 N ARG A 86 -0.081 -11.219 -0.225 1.00 0.00 N ATOM 71 CA ARG A 86 0.149 -10.309 -1.330 1.00 0.00 C ATOM 72 C ARG A 86 -0.978 -10.388 -2.350 1.00 0.00 C ATOM 73 O ARG A 86 -1.676 -11.397 -2.453 1.00 0.00 O ATOM 74 CB ARG A 86 1.502 -10.589 -1.981 1.00 0.00 C ATOM 75 CG ARG A 86 1.699 -12.034 -2.404 1.00 0.00 C ATOM 76 CD ARG A 86 3.155 -12.434 -2.275 1.00 0.00 C ATOM 77 NE ARG A 86 3.636 -12.236 -0.907 1.00 0.00 N ATOM 78 CZ ARG A 86 4.862 -11.829 -0.596 1.00 0.00 C ATOM 79 NH1 ARG A 86 5.766 -11.626 -1.548 1.00 0.00 N ATOM 80 NH2 ARG A 86 5.175 -11.619 0.676 1.00 0.00 N ATOM 0 HA ARG A 86 0.165 -9.293 -0.936 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.612 -9.947 -2.855 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.293 -10.315 -1.283 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.081 -12.687 -1.787 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.370 -12.165 -3.435 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.275 -13.480 -2.558 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.760 -11.846 -2.965 1.00 0.00 H new ATOM 0 HE ARG A 86 2.988 -12.423 -0.142 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.521 -11.783 -2.526 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.705 -11.314 -1.301 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.477 -11.770 1.405 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.113 -11.306 0.925 1.00 0.00 H new ATOM 94 N VAL A 87 -1.150 -9.306 -3.090 1.00 0.00 N ATOM 95 CA VAL A 87 -2.228 -9.182 -4.054 1.00 0.00 C ATOM 96 C VAL A 87 -1.669 -9.211 -5.472 1.00 0.00 C ATOM 97 O VAL A 87 -0.568 -8.717 -5.717 1.00 0.00 O ATOM 98 CB VAL A 87 -3.002 -7.864 -3.837 1.00 0.00 C ATOM 99 CG1 VAL A 87 -4.226 -7.800 -4.731 1.00 0.00 C ATOM 100 CG2 VAL A 87 -3.397 -7.703 -2.379 1.00 0.00 C ATOM 0 H VAL A 87 -0.544 -8.487 -3.038 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.909 -10.021 -3.913 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.341 -7.040 -4.106 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.754 -6.862 -4.559 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.917 -7.856 -5.775 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -4.888 -8.636 -4.502 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.941 -6.767 -2.251 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.033 -8.536 -2.080 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.501 -7.690 -1.759 1.00 0.00 H new ATOM 110 N SER A 88 -2.422 -9.800 -6.391 1.00 0.00 N ATOM 111 CA SER A 88 -2.022 -9.879 -7.787 1.00 0.00 C ATOM 112 C SER A 88 -1.899 -8.480 -8.398 1.00 0.00 C ATOM 113 O SER A 88 -2.697 -7.585 -8.106 1.00 0.00 O ATOM 114 CB SER A 88 -3.050 -10.704 -8.558 1.00 0.00 C ATOM 115 OG SER A 88 -3.286 -11.942 -7.907 1.00 0.00 O ATOM 0 H SER A 88 -3.323 -10.234 -6.190 1.00 0.00 H new ATOM 0 HA SER A 88 -1.046 -10.360 -7.850 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.983 -10.147 -8.641 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.694 -10.882 -9.573 1.00 0.00 H new ATOM 0 HG SER A 88 -3.948 -12.457 -8.414 1.00 0.00 H new ATOM 121 N LEU A 89 -0.891 -8.321 -9.256 1.00 0.00 N ATOM 122 CA LEU A 89 -0.567 -7.042 -9.881 1.00 0.00 C ATOM 123 C LEU A 89 -1.754 -6.524 -10.687 1.00 0.00 C ATOM 124 O LEU A 89 -1.967 -5.319 -10.778 1.00 0.00 O ATOM 125 CB LEU A 89 0.656 -7.205 -10.801 1.00 0.00 C ATOM 126 CG LEU A 89 1.696 -6.069 -10.770 1.00 0.00 C ATOM 127 CD1 LEU A 89 1.071 -4.724 -11.108 1.00 0.00 C ATOM 128 CD2 LEU A 89 2.392 -6.012 -9.417 1.00 0.00 C ATOM 0 H LEU A 89 -0.273 -9.082 -9.538 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.336 -6.321 -9.097 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.159 -8.135 -10.538 1.00 0.00 H new ATOM 0 HB3 LEU A 89 0.300 -7.314 -11.825 1.00 0.00 H new ATOM 0 HG LEU A 89 2.441 -6.287 -11.535 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.836 -3.949 -11.076 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.638 -4.765 -12.107 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.290 -4.493 -10.383 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.122 -5.203 -9.417 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.654 -5.834 -8.635 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.899 -6.958 -9.229 1.00 0.00 H new ATOM 140 N GLN A 90 -2.520 -7.444 -11.268 1.00 0.00 N ATOM 141 CA GLN A 90 -3.716 -7.079 -12.023 1.00 0.00 C ATOM 142 C GLN A 90 -4.693 -6.302 -11.147 1.00 0.00 C ATOM 143 O GLN A 90 -5.278 -5.316 -11.586 1.00 0.00 O ATOM 144 CB GLN A 90 -4.393 -8.327 -12.604 1.00 0.00 C ATOM 145 CG GLN A 90 -4.742 -9.387 -11.568 1.00 0.00 C ATOM 146 CD GLN A 90 -5.451 -10.591 -12.161 1.00 0.00 C ATOM 147 OE1 GLN A 90 -5.313 -11.711 -11.666 1.00 0.00 O ATOM 148 NE2 GLN A 90 -6.223 -10.374 -13.214 1.00 0.00 N ATOM 0 H GLN A 90 -2.334 -8.446 -11.231 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.411 -6.437 -12.849 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.304 -8.025 -13.120 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -3.735 -8.769 -13.352 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -3.828 -9.718 -11.074 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.375 -8.942 -10.801 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -6.312 -9.432 -13.596 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -6.729 -11.148 -13.644 1.00 0.00 H new ATOM 157 N ASN A 91 -4.840 -6.736 -9.900 1.00 0.00 N ATOM 158 CA ASN A 91 -5.703 -6.053 -8.947 1.00 0.00 C ATOM 159 C ASN A 91 -5.146 -4.676 -8.643 1.00 0.00 C ATOM 160 O ASN A 91 -5.881 -3.692 -8.597 1.00 0.00 O ATOM 161 CB ASN A 91 -5.809 -6.831 -7.634 1.00 0.00 C ATOM 162 CG ASN A 91 -6.518 -8.162 -7.762 1.00 0.00 C ATOM 163 OD1 ASN A 91 -6.483 -8.812 -8.805 1.00 0.00 O ATOM 164 ND2 ASN A 91 -7.156 -8.586 -6.684 1.00 0.00 N ATOM 0 H ASN A 91 -4.370 -7.561 -9.526 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.693 -5.976 -9.396 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -4.806 -7.002 -7.243 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.337 -6.219 -6.903 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.643 -9.482 -6.699 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.161 -8.017 -5.838 1.00 0.00 H new ATOM 171 N LEU A 92 -3.834 -4.623 -8.460 1.00 0.00 N ATOM 172 CA LEU A 92 -3.156 -3.397 -8.071 1.00 0.00 C ATOM 173 C LEU A 92 -3.235 -2.358 -9.182 1.00 0.00 C ATOM 174 O LEU A 92 -3.349 -1.166 -8.919 1.00 0.00 O ATOM 175 CB LEU A 92 -1.697 -3.692 -7.721 1.00 0.00 C ATOM 176 CG LEU A 92 -1.497 -4.727 -6.610 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.019 -4.995 -6.396 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.148 -4.256 -5.318 1.00 0.00 C ATOM 0 H LEU A 92 -3.214 -5.424 -8.576 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.655 -2.991 -7.191 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.187 -4.041 -8.619 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.215 -2.761 -7.422 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.975 -5.658 -6.915 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.106 -5.733 -5.603 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.419 -5.376 -7.319 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.481 -4.069 -6.112 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.996 -5.004 -4.540 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.699 -3.313 -5.007 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.216 -4.113 -5.480 1.00 0.00 H new ATOM 190 N LYS A 93 -3.196 -2.824 -10.423 1.00 0.00 N ATOM 191 CA LYS A 93 -3.250 -1.937 -11.583 1.00 0.00 C ATOM 192 C LYS A 93 -4.490 -1.039 -11.577 1.00 0.00 C ATOM 193 O LYS A 93 -4.431 0.102 -12.035 1.00 0.00 O ATOM 194 CB LYS A 93 -3.203 -2.751 -12.876 1.00 0.00 C ATOM 195 CG LYS A 93 -1.820 -3.293 -13.198 1.00 0.00 C ATOM 196 CD LYS A 93 -1.809 -4.050 -14.516 1.00 0.00 C ATOM 197 CE LYS A 93 -0.409 -4.518 -14.877 1.00 0.00 C ATOM 198 NZ LYS A 93 -0.385 -5.275 -16.156 1.00 0.00 N ATOM 0 H LYS A 93 -3.127 -3.815 -10.655 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.377 -1.287 -11.526 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.902 -3.583 -12.798 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.542 -2.126 -13.702 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.108 -2.469 -13.245 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.491 -3.953 -12.396 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.475 -4.910 -14.449 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.195 -3.409 -15.308 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.252 -3.655 -14.954 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.020 -5.147 -14.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 0.589 -5.575 -16.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.996 -6.113 -16.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -0.732 -4.667 -16.926 1.00 0.00 H new ATOM 212 N ASN A 94 -5.602 -1.542 -11.047 1.00 0.00 N ATOM 213 CA ASN A 94 -6.860 -0.786 -11.050 1.00 0.00 C ATOM 214 C ASN A 94 -6.772 0.459 -10.173 1.00 0.00 C ATOM 215 O ASN A 94 -7.504 1.425 -10.376 1.00 0.00 O ATOM 216 CB ASN A 94 -8.035 -1.638 -10.559 1.00 0.00 C ATOM 217 CG ASN A 94 -8.180 -2.946 -11.300 1.00 0.00 C ATOM 218 OD1 ASN A 94 -8.801 -3.013 -12.361 1.00 0.00 O ATOM 219 ND2 ASN A 94 -7.640 -3.998 -10.718 1.00 0.00 N ATOM 0 H ASN A 94 -5.662 -2.463 -10.612 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.031 -0.492 -12.086 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -7.906 -1.844 -9.496 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.957 -1.066 -10.663 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -7.727 -4.919 -11.147 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.135 -3.891 -9.838 1.00 0.00 H new ATOM 226 N LEU A 95 -5.879 0.438 -9.196 1.00 0.00 N ATOM 227 CA LEU A 95 -5.767 1.532 -8.242 1.00 0.00 C ATOM 228 C LEU A 95 -5.326 2.814 -8.930 1.00 0.00 C ATOM 229 O LEU A 95 -5.807 3.902 -8.605 1.00 0.00 O ATOM 230 CB LEU A 95 -4.782 1.170 -7.132 1.00 0.00 C ATOM 231 CG LEU A 95 -5.274 0.134 -6.114 1.00 0.00 C ATOM 232 CD1 LEU A 95 -5.580 -1.196 -6.769 1.00 0.00 C ATOM 233 CD2 LEU A 95 -4.237 -0.049 -5.030 1.00 0.00 C ATOM 0 H LEU A 95 -5.220 -0.325 -9.042 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.751 1.699 -7.805 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.868 0.794 -7.592 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.517 2.081 -6.596 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.200 0.507 -5.677 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.926 -1.902 -6.014 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.357 -1.061 -7.522 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.679 -1.584 -7.243 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.591 -0.786 -4.309 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.304 -0.395 -5.474 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.068 0.902 -4.524 1.00 0.00 H new ATOM 245 N GLY A 96 -4.428 2.677 -9.895 1.00 0.00 N ATOM 246 CA GLY A 96 -3.931 3.830 -10.618 1.00 0.00 C ATOM 247 C GLY A 96 -5.005 4.509 -11.444 1.00 0.00 C ATOM 248 O GLY A 96 -4.928 5.711 -11.701 1.00 0.00 O ATOM 0 H GLY A 96 -4.033 1.784 -10.191 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.516 4.547 -9.910 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.116 3.520 -11.273 1.00 0.00 H new ATOM 252 N GLU A 97 -6.020 3.750 -11.844 1.00 0.00 N ATOM 253 CA GLU A 97 -7.091 4.287 -12.677 1.00 0.00 C ATOM 254 C GLU A 97 -8.325 4.603 -11.838 1.00 0.00 C ATOM 255 O GLU A 97 -9.368 4.997 -12.362 1.00 0.00 O ATOM 256 CB GLU A 97 -7.445 3.306 -13.798 1.00 0.00 C ATOM 257 CG GLU A 97 -7.875 1.935 -13.308 1.00 0.00 C ATOM 258 CD GLU A 97 -8.116 0.953 -14.437 1.00 0.00 C ATOM 259 OE1 GLU A 97 -9.266 0.843 -14.904 1.00 0.00 O ATOM 260 OE2 GLU A 97 -7.153 0.282 -14.859 1.00 0.00 O ATOM 0 H GLU A 97 -6.124 2.764 -11.606 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.737 5.214 -13.127 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.247 3.733 -14.400 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.581 3.192 -14.453 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -7.109 1.536 -12.643 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -8.787 2.035 -12.719 1.00 0.00 H new ATOM 267 N SER A 98 -8.195 4.434 -10.533 1.00 0.00 N ATOM 268 CA SER A 98 -9.272 4.743 -9.609 1.00 0.00 C ATOM 269 C SER A 98 -9.246 6.222 -9.248 1.00 0.00 C ATOM 270 O SER A 98 -8.374 6.676 -8.502 1.00 0.00 O ATOM 271 CB SER A 98 -9.144 3.889 -8.347 1.00 0.00 C ATOM 272 OG SER A 98 -9.263 2.511 -8.652 1.00 0.00 O ATOM 0 H SER A 98 -7.348 4.082 -10.088 1.00 0.00 H new ATOM 0 HA SER A 98 -10.223 4.517 -10.090 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.181 4.078 -7.872 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.915 4.174 -7.631 1.00 0.00 H new ATOM 0 HG SER A 98 -8.484 2.223 -9.172 1.00 0.00 H new ATOM 278 N ALA A 99 -10.210 6.966 -9.783 1.00 0.00 N ATOM 279 CA ALA A 99 -10.292 8.406 -9.565 1.00 0.00 C ATOM 280 C ALA A 99 -10.448 8.732 -8.086 1.00 0.00 C ATOM 281 O ALA A 99 -9.985 9.771 -7.618 1.00 0.00 O ATOM 282 CB ALA A 99 -11.449 8.994 -10.355 1.00 0.00 C ATOM 0 H ALA A 99 -10.951 6.591 -10.375 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.360 8.851 -9.913 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.498 10.069 -10.183 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -11.298 8.803 -11.418 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.382 8.532 -10.032 1.00 0.00 H new ATOM 288 N THR A 100 -11.076 7.828 -7.353 1.00 0.00 N ATOM 289 CA THR A 100 -11.325 8.045 -5.938 1.00 0.00 C ATOM 290 C THR A 100 -10.028 7.969 -5.139 1.00 0.00 C ATOM 291 O THR A 100 -9.800 8.765 -4.226 1.00 0.00 O ATOM 292 CB THR A 100 -12.324 7.016 -5.378 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.521 7.010 -6.171 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.670 7.339 -3.932 1.00 0.00 C ATOM 0 H THR A 100 -11.422 6.939 -7.713 1.00 0.00 H new ATOM 0 HA THR A 100 -11.754 9.042 -5.839 1.00 0.00 H new ATOM 0 HB THR A 100 -11.860 6.030 -5.417 1.00 0.00 H new ATOM 0 HG1 THR A 100 -14.150 6.352 -5.809 1.00 0.00 H new ATOM 0 HG21 THR A 100 -13.377 6.601 -3.554 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.763 7.316 -3.327 1.00 0.00 H new ATOM 0 HG23 THR A 100 -13.118 8.331 -3.878 1.00 0.00 H new ATOM 302 N LEU A 101 -9.166 7.029 -5.505 1.00 0.00 N ATOM 303 CA LEU A 101 -7.935 6.811 -4.765 1.00 0.00 C ATOM 304 C LEU A 101 -6.934 7.914 -5.066 1.00 0.00 C ATOM 305 O LEU A 101 -6.366 8.513 -4.157 1.00 0.00 O ATOM 306 CB LEU A 101 -7.328 5.450 -5.105 1.00 0.00 C ATOM 307 CG LEU A 101 -6.096 5.077 -4.277 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.472 4.880 -2.818 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.430 3.832 -4.834 1.00 0.00 C ATOM 0 H LEU A 101 -9.297 6.410 -6.305 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.173 6.828 -3.702 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.089 4.682 -4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.056 5.442 -6.161 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.382 5.899 -4.338 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.583 4.615 -2.246 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.896 5.804 -2.424 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.207 4.080 -2.737 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.557 3.585 -4.230 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.135 3.001 -4.810 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.120 4.015 -5.863 1.00 0.00 H new ATOM 321 N ARG A 102 -6.743 8.197 -6.350 1.00 0.00 N ATOM 322 CA ARG A 102 -5.790 9.218 -6.770 1.00 0.00 C ATOM 323 C ARG A 102 -6.175 10.590 -6.219 1.00 0.00 C ATOM 324 O ARG A 102 -5.312 11.436 -6.001 1.00 0.00 O ATOM 325 CB ARG A 102 -5.689 9.279 -8.295 1.00 0.00 C ATOM 326 CG ARG A 102 -7.030 9.460 -8.981 1.00 0.00 C ATOM 327 CD ARG A 102 -6.869 9.887 -10.428 1.00 0.00 C ATOM 328 NE ARG A 102 -6.192 8.869 -11.236 1.00 0.00 N ATOM 329 CZ ARG A 102 -6.303 8.778 -12.563 1.00 0.00 C ATOM 330 NH1 ARG A 102 -7.038 9.657 -13.235 1.00 0.00 N ATOM 331 NH2 ARG A 102 -5.681 7.806 -13.218 1.00 0.00 N ATOM 0 H ARG A 102 -7.234 7.735 -7.116 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.816 8.942 -6.366 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.032 10.102 -8.576 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.224 8.362 -8.658 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.590 8.526 -8.938 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.615 10.207 -8.444 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.850 10.093 -10.855 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.302 10.817 -10.469 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.601 8.190 -10.756 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -7.520 10.405 -12.737 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.120 9.584 -14.249 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -5.117 7.127 -12.707 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -5.767 7.738 -14.232 1.00 0.00 H new ATOM 345 N SER A 103 -7.470 10.795 -5.976 1.00 0.00 N ATOM 346 CA SER A 103 -7.958 12.048 -5.415 1.00 0.00 C ATOM 347 C SER A 103 -7.401 12.246 -4.005 1.00 0.00 C ATOM 348 O SER A 103 -7.300 13.371 -3.512 1.00 0.00 O ATOM 349 CB SER A 103 -9.493 12.053 -5.392 1.00 0.00 C ATOM 350 OG SER A 103 -10.010 13.350 -5.128 1.00 0.00 O ATOM 0 H SER A 103 -8.199 10.106 -6.161 1.00 0.00 H new ATOM 0 HA SER A 103 -7.617 12.873 -6.041 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.873 11.698 -6.350 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.848 11.358 -4.631 1.00 0.00 H new ATOM 0 HG SER A 103 -10.989 13.317 -5.122 1.00 0.00 H new ATOM 356 N LEU A 104 -7.037 11.142 -3.363 1.00 0.00 N ATOM 357 CA LEU A 104 -6.458 11.185 -2.029 1.00 0.00 C ATOM 358 C LEU A 104 -4.944 11.362 -2.117 1.00 0.00 C ATOM 359 O LEU A 104 -4.333 12.027 -1.280 1.00 0.00 O ATOM 360 CB LEU A 104 -6.796 9.906 -1.261 1.00 0.00 C ATOM 361 CG LEU A 104 -8.265 9.475 -1.320 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.505 8.279 -0.416 1.00 0.00 C ATOM 363 CD2 LEU A 104 -9.185 10.628 -0.946 1.00 0.00 C ATOM 0 H LEU A 104 -7.134 10.203 -3.749 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.881 12.035 -1.493 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.181 9.095 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.517 10.045 -0.216 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.494 9.182 -2.345 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.554 7.986 -0.470 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.879 7.447 -0.739 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.255 8.544 0.611 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -10.222 10.297 -0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.958 10.961 0.067 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -9.034 11.454 -1.641 1.00 0.00 H new ATOM 375 N LEU A 105 -4.351 10.787 -3.159 1.00 0.00 N ATOM 376 CA LEU A 105 -2.908 10.879 -3.387 1.00 0.00 C ATOM 377 C LEU A 105 -2.512 12.293 -3.783 1.00 0.00 C ATOM 378 O LEU A 105 -1.329 12.611 -3.910 1.00 0.00 O ATOM 379 CB LEU A 105 -2.458 9.900 -4.475 1.00 0.00 C ATOM 380 CG LEU A 105 -2.193 8.464 -4.015 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.459 7.796 -3.517 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.579 7.658 -5.146 1.00 0.00 C ATOM 0 H LEU A 105 -4.851 10.247 -3.866 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.413 10.618 -2.452 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.221 9.877 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.548 10.288 -4.932 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.491 8.503 -3.182 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.232 6.778 -3.199 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.860 8.359 -2.674 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -4.196 7.770 -4.319 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.395 6.638 -4.808 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.264 7.641 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.637 8.115 -5.449 1.00 0.00 H new ATOM 394 N LEU A 106 -3.515 13.133 -3.986 1.00 0.00 N ATOM 395 CA LEU A 106 -3.300 14.536 -4.288 1.00 0.00 C ATOM 396 C LEU A 106 -2.714 15.259 -3.075 1.00 0.00 C ATOM 397 O LEU A 106 -2.205 16.376 -3.187 1.00 0.00 O ATOM 398 CB LEU A 106 -4.618 15.176 -4.712 1.00 0.00 C ATOM 399 CG LEU A 106 -5.275 14.549 -5.948 1.00 0.00 C ATOM 400 CD1 LEU A 106 -6.498 15.344 -6.357 1.00 0.00 C ATOM 401 CD2 LEU A 106 -4.290 14.454 -7.105 1.00 0.00 C ATOM 0 H LEU A 106 -4.497 12.861 -3.946 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.587 14.620 -5.108 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.318 15.118 -3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.444 16.234 -4.909 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.586 13.537 -5.688 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.953 14.886 -7.235 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -7.218 15.352 -5.538 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -6.205 16.367 -6.592 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.784 14.006 -7.967 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.938 15.452 -7.366 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.442 13.836 -6.811 1.00 0.00 H new ATOM 413 N ASN A 107 -2.788 14.608 -1.915 1.00 0.00 N ATOM 414 CA ASN A 107 -2.177 15.131 -0.698 1.00 0.00 C ATOM 415 C ASN A 107 -0.707 14.740 -0.646 1.00 0.00 C ATOM 416 O ASN A 107 -0.370 13.552 -0.673 1.00 0.00 O ATOM 417 CB ASN A 107 -2.876 14.593 0.555 1.00 0.00 C ATOM 418 CG ASN A 107 -4.329 15.004 0.658 1.00 0.00 C ATOM 419 OD1 ASN A 107 -4.647 16.104 1.111 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.221 14.112 0.274 1.00 0.00 N ATOM 0 H ASN A 107 -3.267 13.715 -1.794 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.279 16.216 -0.718 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.813 13.505 0.558 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.343 14.945 1.438 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.216 14.322 0.347 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.916 13.212 -0.096 1.00 0.00 H new ATOM 427 N PRO A 108 0.193 15.737 -0.570 1.00 0.00 N ATOM 428 CA PRO A 108 1.639 15.502 -0.525 1.00 0.00 C ATOM 429 C PRO A 108 2.065 14.663 0.678 1.00 0.00 C ATOM 430 O PRO A 108 3.045 13.926 0.611 1.00 0.00 O ATOM 431 CB PRO A 108 2.244 16.908 -0.442 1.00 0.00 C ATOM 432 CG PRO A 108 1.129 17.794 -0.003 1.00 0.00 C ATOM 433 CD PRO A 108 -0.129 17.175 -0.538 1.00 0.00 C ATOM 0 HA PRO A 108 1.974 14.936 -1.394 1.00 0.00 H new ATOM 0 HB2 PRO A 108 3.072 16.938 0.266 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.639 17.223 -1.408 1.00 0.00 H new ATOM 0 HG2 PRO A 108 1.095 17.868 1.084 1.00 0.00 H new ATOM 0 HG3 PRO A 108 1.260 18.805 -0.388 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -0.985 17.382 0.104 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -0.375 17.555 -1.529 1.00 0.00 H new ATOM 441 N HIS A 109 1.324 14.768 1.773 1.00 0.00 N ATOM 442 CA HIS A 109 1.625 13.987 2.967 1.00 0.00 C ATOM 443 C HIS A 109 1.310 12.508 2.742 1.00 0.00 C ATOM 444 O HIS A 109 2.103 11.636 3.093 1.00 0.00 O ATOM 445 CB HIS A 109 0.844 14.520 4.174 1.00 0.00 C ATOM 446 CG HIS A 109 1.002 13.690 5.413 1.00 0.00 C ATOM 447 ND1 HIS A 109 2.020 13.920 6.308 1.00 0.00 N ATOM 448 CD2 HIS A 109 0.254 12.648 5.848 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.869 13.016 7.263 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.815 12.225 7.028 1.00 0.00 N ATOM 0 H HIS A 109 0.514 15.382 1.860 1.00 0.00 H new ATOM 0 HA HIS A 109 2.691 14.084 3.174 1.00 0.00 H new ATOM 0 HB2 HIS A 109 1.171 15.538 4.386 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.214 14.573 3.916 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -0.615 12.231 5.361 1.00 0.00 H new ATOM 0 HE1 HIS A 109 2.515 12.928 8.124 1.00 0.00 H new ATOM 0 HE2 HIS A 109 0.491 11.455 7.613 1.00 0.00 H new ATOM 458 N LEU A 110 0.156 12.239 2.143 1.00 0.00 N ATOM 459 CA LEU A 110 -0.301 10.872 1.930 1.00 0.00 C ATOM 460 C LEU A 110 0.684 10.124 1.038 1.00 0.00 C ATOM 461 O LEU A 110 1.030 8.969 1.296 1.00 0.00 O ATOM 462 CB LEU A 110 -1.700 10.892 1.300 1.00 0.00 C ATOM 463 CG LEU A 110 -2.551 9.629 1.500 1.00 0.00 C ATOM 464 CD1 LEU A 110 -3.976 9.883 1.044 1.00 0.00 C ATOM 465 CD2 LEU A 110 -1.969 8.442 0.749 1.00 0.00 C ATOM 0 H LEU A 110 -0.483 12.954 1.795 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.355 10.353 2.887 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.247 11.742 1.707 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.591 11.066 0.230 1.00 0.00 H new ATOM 0 HG LEU A 110 -2.549 9.389 2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -4.571 8.981 1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -4.404 10.699 1.626 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.978 10.152 -0.012 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -2.596 7.565 0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -1.932 8.668 -0.317 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -0.961 8.240 1.112 1.00 0.00 H new ATOM 477 N ARG A 111 1.156 10.800 0.001 1.00 0.00 N ATOM 478 CA ARG A 111 2.080 10.182 -0.940 1.00 0.00 C ATOM 479 C ARG A 111 3.441 9.972 -0.284 1.00 0.00 C ATOM 480 O ARG A 111 4.135 8.999 -0.576 1.00 0.00 O ATOM 481 CB ARG A 111 2.210 11.014 -2.223 1.00 0.00 C ATOM 482 CG ARG A 111 2.860 12.371 -2.027 1.00 0.00 C ATOM 483 CD ARG A 111 2.881 13.163 -3.322 1.00 0.00 C ATOM 484 NE ARG A 111 3.523 14.464 -3.161 1.00 0.00 N ATOM 485 CZ ARG A 111 3.394 15.467 -4.029 1.00 0.00 C ATOM 486 NH1 ARG A 111 2.643 15.317 -5.114 1.00 0.00 N ATOM 487 NH2 ARG A 111 4.017 16.619 -3.811 1.00 0.00 N ATOM 0 H ARG A 111 0.917 11.769 -0.210 1.00 0.00 H new ATOM 0 HA ARG A 111 1.678 9.209 -1.222 1.00 0.00 H new ATOM 0 HB2 ARG A 111 2.791 10.448 -2.951 1.00 0.00 H new ATOM 0 HB3 ARG A 111 1.218 11.158 -2.650 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.317 12.930 -1.265 1.00 0.00 H new ATOM 0 HG3 ARG A 111 3.878 12.240 -1.662 1.00 0.00 H new ATOM 0 HD2 ARG A 111 3.407 12.592 -4.087 1.00 0.00 H new ATOM 0 HD3 ARG A 111 1.860 13.305 -3.676 1.00 0.00 H new ATOM 0 HE ARG A 111 4.104 14.614 -2.336 1.00 0.00 H new ATOM 0 HH11 ARG A 111 2.164 14.433 -5.284 1.00 0.00 H new ATOM 0 HH12 ARG A 111 2.546 16.086 -5.777 1.00 0.00 H new ATOM 0 HH21 ARG A 111 4.595 16.737 -2.979 1.00 0.00 H new ATOM 0 HH22 ARG A 111 3.918 17.386 -4.476 1.00 0.00 H new ATOM 501 N GLN A 112 3.808 10.876 0.620 1.00 0.00 N ATOM 502 CA GLN A 112 5.040 10.735 1.381 1.00 0.00 C ATOM 503 C GLN A 112 4.960 9.537 2.312 1.00 0.00 C ATOM 504 O GLN A 112 5.947 8.833 2.501 1.00 0.00 O ATOM 505 CB GLN A 112 5.341 12.002 2.182 1.00 0.00 C ATOM 506 CG GLN A 112 6.048 13.083 1.379 1.00 0.00 C ATOM 507 CD GLN A 112 7.548 12.854 1.243 1.00 0.00 C ATOM 508 OE1 GLN A 112 8.319 13.807 1.134 1.00 0.00 O ATOM 509 NE2 GLN A 112 7.980 11.601 1.270 1.00 0.00 N ATOM 0 H GLN A 112 3.268 11.713 0.841 1.00 0.00 H new ATOM 0 HA GLN A 112 5.852 10.576 0.672 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.406 12.405 2.572 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.958 11.739 3.042 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.605 13.135 0.385 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.877 14.049 1.855 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.314 10.834 1.361 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.978 11.404 1.199 1.00 0.00 H new ATOM 518 N LEU A 113 3.781 9.311 2.887 1.00 0.00 N ATOM 519 CA LEU A 113 3.554 8.141 3.725 1.00 0.00 C ATOM 520 C LEU A 113 3.903 6.875 2.956 1.00 0.00 C ATOM 521 O LEU A 113 4.681 6.047 3.429 1.00 0.00 O ATOM 522 CB LEU A 113 2.100 8.080 4.205 1.00 0.00 C ATOM 523 CG LEU A 113 1.699 9.145 5.230 1.00 0.00 C ATOM 524 CD1 LEU A 113 0.229 9.011 5.585 1.00 0.00 C ATOM 525 CD2 LEU A 113 2.553 9.035 6.484 1.00 0.00 C ATOM 0 H LEU A 113 2.971 9.923 2.787 1.00 0.00 H new ATOM 0 HA LEU A 113 4.198 8.219 4.601 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.445 8.170 3.338 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.920 7.097 4.639 1.00 0.00 H new ATOM 0 HG LEU A 113 1.865 10.126 4.784 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.040 9.775 6.314 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.375 9.138 4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.046 8.024 6.009 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.251 9.801 7.198 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.419 8.050 6.930 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.602 9.176 6.223 1.00 0.00 H new ATOM 537 N MET A 114 3.346 6.749 1.754 1.00 0.00 N ATOM 538 CA MET A 114 3.642 5.613 0.887 1.00 0.00 C ATOM 539 C MET A 114 5.147 5.462 0.683 1.00 0.00 C ATOM 540 O MET A 114 5.714 4.405 0.955 1.00 0.00 O ATOM 541 CB MET A 114 2.943 5.757 -0.471 1.00 0.00 C ATOM 542 CG MET A 114 1.459 5.424 -0.445 1.00 0.00 C ATOM 543 SD MET A 114 0.756 5.276 -2.101 1.00 0.00 S ATOM 544 CE MET A 114 1.204 6.853 -2.819 1.00 0.00 C ATOM 0 H MET A 114 2.687 7.420 1.359 1.00 0.00 H new ATOM 0 HA MET A 114 3.263 4.717 1.379 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.068 6.780 -0.825 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.438 5.107 -1.193 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.309 4.489 0.095 1.00 0.00 H new ATOM 0 HG3 MET A 114 0.925 6.199 0.105 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.835 6.904 -3.843 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.762 7.658 -2.233 1.00 0.00 H new ATOM 0 HE3 MET A 114 2.289 6.958 -2.819 1.00 0.00 H new ATOM 554 N VAL A 115 5.788 6.536 0.230 1.00 0.00 N ATOM 555 CA VAL A 115 7.215 6.542 -0.043 1.00 0.00 C ATOM 556 C VAL A 115 8.026 6.149 1.195 1.00 0.00 C ATOM 557 O VAL A 115 9.013 5.419 1.102 1.00 0.00 O ATOM 558 CB VAL A 115 7.645 7.937 -0.538 1.00 0.00 C ATOM 559 CG1 VAL A 115 9.146 8.024 -0.673 1.00 0.00 C ATOM 560 CG2 VAL A 115 6.974 8.265 -1.863 1.00 0.00 C ATOM 0 H VAL A 115 5.328 7.427 0.043 1.00 0.00 H new ATOM 0 HA VAL A 115 7.414 5.802 -0.818 1.00 0.00 H new ATOM 0 HB VAL A 115 7.327 8.670 0.204 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.423 9.018 -1.024 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.610 7.839 0.296 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.491 7.278 -1.389 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.290 9.254 -2.196 1.00 0.00 H new ATOM 0 HG22 VAL A 115 7.259 7.523 -2.609 1.00 0.00 H new ATOM 0 HG23 VAL A 115 5.892 8.254 -1.735 1.00 0.00 H new ATOM 570 N ASN A 116 7.594 6.629 2.352 1.00 0.00 N ATOM 571 CA ASN A 116 8.255 6.320 3.614 1.00 0.00 C ATOM 572 C ASN A 116 8.148 4.839 3.951 1.00 0.00 C ATOM 573 O ASN A 116 9.110 4.227 4.414 1.00 0.00 O ATOM 574 CB ASN A 116 7.642 7.153 4.741 1.00 0.00 C ATOM 575 CG ASN A 116 8.145 8.580 4.746 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.268 8.859 4.320 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.322 9.491 5.232 1.00 0.00 N ATOM 0 H ASN A 116 6.782 7.239 2.444 1.00 0.00 H new ATOM 0 HA ASN A 116 9.311 6.567 3.508 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.557 7.154 4.639 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.871 6.687 5.699 1.00 0.00 H new ATOM 0 HD21 ASN A 116 7.607 10.470 5.265 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.401 9.216 5.574 1.00 0.00 H new ATOM 584 N LEU A 117 6.976 4.272 3.712 1.00 0.00 N ATOM 585 CA LEU A 117 6.725 2.867 4.014 1.00 0.00 C ATOM 586 C LEU A 117 7.476 1.950 3.049 1.00 0.00 C ATOM 587 O LEU A 117 7.905 0.859 3.427 1.00 0.00 O ATOM 588 CB LEU A 117 5.222 2.590 3.954 1.00 0.00 C ATOM 589 CG LEU A 117 4.790 1.162 4.293 1.00 0.00 C ATOM 590 CD1 LEU A 117 5.214 0.787 5.706 1.00 0.00 C ATOM 591 CD2 LEU A 117 3.284 1.022 4.136 1.00 0.00 C ATOM 0 H LEU A 117 6.179 4.764 3.308 1.00 0.00 H new ATOM 0 HA LEU A 117 7.091 2.658 5.019 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.719 3.273 4.639 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.869 2.827 2.950 1.00 0.00 H new ATOM 0 HG LEU A 117 5.283 0.479 3.601 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.895 -0.233 5.923 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.299 0.854 5.790 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.752 1.471 6.418 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.986 0.002 4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.782 1.717 4.809 1.00 0.00 H new ATOM 0 HD23 LEU A 117 3.003 1.246 3.107 1.00 0.00 H new ATOM 603 N ASP A 118 7.649 2.412 1.812 1.00 0.00 N ATOM 604 CA ASP A 118 8.316 1.627 0.771 1.00 0.00 C ATOM 605 C ASP A 118 9.752 1.307 1.166 1.00 0.00 C ATOM 606 O ASP A 118 10.236 0.198 0.945 1.00 0.00 O ATOM 607 CB ASP A 118 8.309 2.387 -0.558 1.00 0.00 C ATOM 608 CG ASP A 118 8.759 1.531 -1.732 1.00 0.00 C ATOM 609 OD1 ASP A 118 9.978 1.394 -1.953 1.00 0.00 O ATOM 610 OD2 ASP A 118 7.887 0.987 -2.443 1.00 0.00 O ATOM 0 H ASP A 118 7.335 3.332 1.503 1.00 0.00 H new ATOM 0 HA ASP A 118 7.767 0.692 0.655 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.304 2.761 -0.752 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.962 3.256 -0.477 1.00 0.00 H new ATOM 615 N GLN A 119 10.411 2.280 1.788 1.00 0.00 N ATOM 616 CA GLN A 119 11.814 2.144 2.172 1.00 0.00 C ATOM 617 C GLN A 119 12.010 0.982 3.134 1.00 0.00 C ATOM 618 O GLN A 119 13.068 0.358 3.182 1.00 0.00 O ATOM 619 CB GLN A 119 12.303 3.429 2.828 1.00 0.00 C ATOM 620 CG GLN A 119 12.082 4.660 1.975 1.00 0.00 C ATOM 621 CD GLN A 119 12.587 5.923 2.638 1.00 0.00 C ATOM 622 OE1 GLN A 119 13.532 5.890 3.426 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.955 7.044 2.333 1.00 0.00 N ATOM 0 H GLN A 119 9.994 3.176 2.038 1.00 0.00 H new ATOM 0 HA GLN A 119 12.391 1.949 1.268 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.791 3.560 3.781 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.366 3.334 3.048 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.586 4.530 1.017 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.018 4.765 1.763 1.00 0.00 H new ATOM 0 HE21 GLN A 119 11.176 7.027 1.675 1.00 0.00 H new ATOM 0 HE22 GLN A 119 12.247 7.925 2.756 1.00 0.00 H new ATOM 632 N GLY A 120 10.965 0.718 3.900 1.00 0.00 N ATOM 633 CA GLY A 120 10.942 -0.431 4.785 1.00 0.00 C ATOM 634 C GLY A 120 11.952 -0.345 5.911 1.00 0.00 C ATOM 635 O GLY A 120 12.310 -1.361 6.503 1.00 0.00 O ATOM 0 H GLY A 120 10.119 1.287 3.926 1.00 0.00 H new ATOM 0 HA2 GLY A 120 9.943 -0.533 5.210 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.134 -1.332 4.203 1.00 0.00 H new ATOM 639 N GLU A 121 12.394 0.865 6.222 1.00 0.00 N ATOM 640 CA GLU A 121 13.380 1.072 7.277 1.00 0.00 C ATOM 641 C GLU A 121 12.746 0.853 8.642 1.00 0.00 C ATOM 642 O GLU A 121 13.385 0.366 9.573 1.00 0.00 O ATOM 643 CB GLU A 121 13.957 2.487 7.191 1.00 0.00 C ATOM 644 CG GLU A 121 14.574 2.811 5.840 1.00 0.00 C ATOM 645 CD GLU A 121 15.871 2.071 5.587 1.00 0.00 C ATOM 646 OE1 GLU A 121 15.962 0.868 5.917 1.00 0.00 O ATOM 647 OE2 GLU A 121 16.808 2.686 5.037 1.00 0.00 O ATOM 0 H GLU A 121 12.086 1.720 5.759 1.00 0.00 H new ATOM 0 HA GLU A 121 14.187 0.352 7.144 1.00 0.00 H new ATOM 0 HB2 GLU A 121 13.166 3.207 7.402 1.00 0.00 H new ATOM 0 HB3 GLU A 121 14.714 2.610 7.966 1.00 0.00 H new ATOM 0 HG2 GLU A 121 13.862 2.563 5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 121 14.757 3.884 5.778 1.00 0.00 H new ATOM 654 N ASP A 122 11.481 1.219 8.747 1.00 0.00 N ATOM 655 CA ASP A 122 10.735 1.075 9.987 1.00 0.00 C ATOM 656 C ASP A 122 9.284 0.738 9.695 1.00 0.00 C ATOM 657 O ASP A 122 8.366 1.221 10.359 1.00 0.00 O ATOM 658 CB ASP A 122 10.835 2.347 10.838 1.00 0.00 C ATOM 659 CG ASP A 122 10.352 3.605 10.131 1.00 0.00 C ATOM 660 OD1 ASP A 122 10.510 3.710 8.894 1.00 0.00 O ATOM 661 OD2 ASP A 122 9.847 4.514 10.821 1.00 0.00 O ATOM 0 H ASP A 122 10.943 1.623 7.980 1.00 0.00 H new ATOM 0 HA ASP A 122 11.173 0.255 10.556 1.00 0.00 H new ATOM 0 HB2 ASP A 122 10.253 2.209 11.749 1.00 0.00 H new ATOM 0 HB3 ASP A 122 11.873 2.488 11.141 1.00 0.00 H new ATOM 666 N LYS A 123 9.109 -0.120 8.699 1.00 0.00 N ATOM 667 CA LYS A 123 7.796 -0.615 8.286 1.00 0.00 C ATOM 668 C LYS A 123 6.949 -1.068 9.478 1.00 0.00 C ATOM 669 O LYS A 123 5.728 -0.906 9.471 1.00 0.00 O ATOM 670 CB LYS A 123 7.956 -1.785 7.297 1.00 0.00 C ATOM 671 CG LYS A 123 8.624 -3.031 7.887 1.00 0.00 C ATOM 672 CD LYS A 123 10.113 -2.823 8.132 1.00 0.00 C ATOM 673 CE LYS A 123 10.739 -3.979 8.895 1.00 0.00 C ATOM 674 NZ LYS A 123 10.628 -5.266 8.159 1.00 0.00 N ATOM 0 H LYS A 123 9.880 -0.498 8.148 1.00 0.00 H new ATOM 0 HA LYS A 123 7.278 0.213 7.802 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.972 -2.061 6.919 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.542 -1.444 6.443 1.00 0.00 H new ATOM 0 HG2 LYS A 123 8.136 -3.293 8.826 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.483 -3.873 7.209 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.623 -2.703 7.176 1.00 0.00 H new ATOM 0 HD3 LYS A 123 10.261 -1.899 8.691 1.00 0.00 H new ATOM 0 HE2 LYS A 123 11.790 -3.760 9.084 1.00 0.00 H new ATOM 0 HE3 LYS A 123 10.254 -4.075 9.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 11.127 -6.011 8.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 9.625 -5.524 8.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.054 -5.164 7.216 1.00 0.00 H new ATOM 688 N ALA A 124 7.603 -1.616 10.501 1.00 0.00 N ATOM 689 CA ALA A 124 6.901 -2.164 11.653 1.00 0.00 C ATOM 690 C ALA A 124 6.077 -1.097 12.365 1.00 0.00 C ATOM 691 O ALA A 124 4.881 -1.280 12.592 1.00 0.00 O ATOM 692 CB ALA A 124 7.880 -2.813 12.616 1.00 0.00 C ATOM 0 H ALA A 124 8.619 -1.691 10.552 1.00 0.00 H new ATOM 0 HA ALA A 124 6.212 -2.926 11.289 1.00 0.00 H new ATOM 0 HB1 ALA A 124 7.337 -3.217 13.470 1.00 0.00 H new ATOM 0 HB2 ALA A 124 8.409 -3.620 12.108 1.00 0.00 H new ATOM 0 HB3 ALA A 124 8.598 -2.069 12.961 1.00 0.00 H new ATOM 698 N LYS A 125 6.706 0.023 12.705 1.00 0.00 N ATOM 699 CA LYS A 125 5.997 1.094 13.385 1.00 0.00 C ATOM 700 C LYS A 125 5.121 1.859 12.400 1.00 0.00 C ATOM 701 O LYS A 125 4.031 2.304 12.750 1.00 0.00 O ATOM 702 CB LYS A 125 6.968 2.055 14.084 1.00 0.00 C ATOM 703 CG LYS A 125 7.798 2.899 13.131 1.00 0.00 C ATOM 704 CD LYS A 125 8.676 3.906 13.864 1.00 0.00 C ATOM 705 CE LYS A 125 9.970 3.287 14.376 1.00 0.00 C ATOM 706 NZ LYS A 125 9.749 2.320 15.482 1.00 0.00 N ATOM 0 H LYS A 125 7.692 0.209 12.523 1.00 0.00 H new ATOM 0 HA LYS A 125 5.365 0.641 14.148 1.00 0.00 H new ATOM 0 HB2 LYS A 125 6.400 2.717 14.738 1.00 0.00 H new ATOM 0 HB3 LYS A 125 7.639 1.478 14.720 1.00 0.00 H new ATOM 0 HG2 LYS A 125 8.426 2.246 12.525 1.00 0.00 H new ATOM 0 HG3 LYS A 125 7.135 3.429 12.447 1.00 0.00 H new ATOM 0 HD2 LYS A 125 8.913 4.733 13.194 1.00 0.00 H new ATOM 0 HD3 LYS A 125 8.120 4.325 14.703 1.00 0.00 H new ATOM 0 HE2 LYS A 125 10.476 2.781 13.553 1.00 0.00 H new ATOM 0 HE3 LYS A 125 10.635 4.079 14.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 10.547 2.365 16.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 8.869 2.559 15.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 9.676 1.358 15.093 1.00 0.00 H new ATOM 720 N LEU A 126 5.595 1.989 11.163 1.00 0.00 N ATOM 721 CA LEU A 126 4.868 2.724 10.134 1.00 0.00 C ATOM 722 C LEU A 126 3.479 2.137 9.905 1.00 0.00 C ATOM 723 O LEU A 126 2.504 2.871 9.825 1.00 0.00 O ATOM 724 CB LEU A 126 5.655 2.741 8.822 1.00 0.00 C ATOM 725 CG LEU A 126 6.974 3.513 8.853 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.669 3.417 7.507 1.00 0.00 C ATOM 727 CD2 LEU A 126 6.759 4.969 9.228 1.00 0.00 C ATOM 0 H LEU A 126 6.481 1.593 10.850 1.00 0.00 H new ATOM 0 HA LEU A 126 4.749 3.748 10.487 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.864 1.712 8.531 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.022 3.170 8.045 1.00 0.00 H new ATOM 0 HG LEU A 126 7.607 3.061 9.617 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.607 3.971 7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.873 2.371 7.277 1.00 0.00 H new ATOM 0 HD13 LEU A 126 7.026 3.840 6.735 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.718 5.487 9.240 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.102 5.440 8.497 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.303 5.027 10.216 1.00 0.00 H new ATOM 739 N MET A 127 3.384 0.813 9.827 1.00 0.00 N ATOM 740 CA MET A 127 2.092 0.150 9.630 1.00 0.00 C ATOM 741 C MET A 127 1.078 0.598 10.681 1.00 0.00 C ATOM 742 O MET A 127 -0.112 0.727 10.397 1.00 0.00 O ATOM 743 CB MET A 127 2.250 -1.370 9.689 1.00 0.00 C ATOM 744 CG MET A 127 2.913 -1.977 8.460 1.00 0.00 C ATOM 745 SD MET A 127 1.732 -2.728 7.313 1.00 0.00 S ATOM 746 CE MET A 127 0.745 -1.313 6.822 1.00 0.00 C ATOM 0 H MET A 127 4.179 0.178 9.896 1.00 0.00 H new ATOM 0 HA MET A 127 1.724 0.434 8.644 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.837 -1.629 10.570 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.266 -1.822 9.818 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.475 -1.202 7.938 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.632 -2.732 8.778 1.00 0.00 H new ATOM 0 HE1 MET A 127 0.112 -1.586 5.978 1.00 0.00 H new ATOM 0 HE2 MET A 127 0.120 -0.998 7.658 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.403 -0.494 6.531 1.00 0.00 H new ATOM 756 N ARG A 128 1.559 0.842 11.891 1.00 0.00 N ATOM 757 CA ARG A 128 0.708 1.299 12.979 1.00 0.00 C ATOM 758 C ARG A 128 0.528 2.815 12.923 1.00 0.00 C ATOM 759 O ARG A 128 -0.572 3.331 13.116 1.00 0.00 O ATOM 760 CB ARG A 128 1.309 0.892 14.326 1.00 0.00 C ATOM 761 CG ARG A 128 1.444 -0.612 14.507 1.00 0.00 C ATOM 762 CD ARG A 128 0.085 -1.289 14.572 1.00 0.00 C ATOM 763 NE ARG A 128 0.197 -2.740 14.715 1.00 0.00 N ATOM 764 CZ ARG A 128 -0.784 -3.521 15.172 1.00 0.00 C ATOM 765 NH1 ARG A 128 -1.944 -2.990 15.546 1.00 0.00 N ATOM 766 NH2 ARG A 128 -0.598 -4.831 15.258 1.00 0.00 N ATOM 0 H ARG A 128 2.541 0.730 12.145 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.270 0.830 12.870 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.292 1.351 14.428 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.686 1.291 15.127 1.00 0.00 H new ATOM 0 HG2 ARG A 128 2.020 -1.029 13.681 1.00 0.00 H new ATOM 0 HG3 ARG A 128 2.000 -0.821 15.421 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -0.480 -0.885 15.412 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -0.478 -1.057 13.668 1.00 0.00 H new ATOM 0 HE ARG A 128 1.077 -3.182 14.450 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -2.087 -1.982 15.484 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -2.691 -3.591 15.895 1.00 0.00 H new ATOM 0 HH21 ARG A 128 0.293 -5.239 14.975 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -1.346 -5.430 15.607 1.00 0.00 H new ATOM 780 N ALA A 129 1.614 3.518 12.632 1.00 0.00 N ATOM 781 CA ALA A 129 1.619 4.976 12.622 1.00 0.00 C ATOM 782 C ALA A 129 0.836 5.543 11.441 1.00 0.00 C ATOM 783 O ALA A 129 0.482 6.721 11.435 1.00 0.00 O ATOM 784 CB ALA A 129 3.048 5.495 12.598 1.00 0.00 C ATOM 0 H ALA A 129 2.513 3.097 12.397 1.00 0.00 H new ATOM 0 HA ALA A 129 1.126 5.311 13.534 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.039 6.585 12.591 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.578 5.142 13.483 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.553 5.130 11.703 1.00 0.00 H new ATOM 790 N TYR A 130 0.578 4.717 10.440 1.00 0.00 N ATOM 791 CA TYR A 130 -0.177 5.159 9.273 1.00 0.00 C ATOM 792 C TYR A 130 -1.672 4.987 9.498 1.00 0.00 C ATOM 793 O TYR A 130 -2.484 5.734 8.953 1.00 0.00 O ATOM 794 CB TYR A 130 0.247 4.385 8.025 1.00 0.00 C ATOM 795 CG TYR A 130 1.618 4.749 7.495 1.00 0.00 C ATOM 796 CD1 TYR A 130 2.584 5.336 8.307 1.00 0.00 C ATOM 797 CD2 TYR A 130 1.952 4.488 6.178 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.830 5.647 7.820 1.00 0.00 C ATOM 799 CE2 TYR A 130 3.194 4.800 5.686 1.00 0.00 C ATOM 800 CZ TYR A 130 4.129 5.379 6.508 1.00 0.00 C ATOM 801 OH TYR A 130 5.371 5.679 6.016 1.00 0.00 O ATOM 0 H TYR A 130 0.877 3.742 10.409 1.00 0.00 H new ATOM 0 HA TYR A 130 0.038 6.217 9.122 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.230 3.319 8.251 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.489 4.556 7.240 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.349 5.551 9.339 1.00 0.00 H new ATOM 0 HD2 TYR A 130 1.222 4.031 5.526 1.00 0.00 H new ATOM 0 HE1 TYR A 130 4.569 6.099 8.465 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.436 4.591 4.654 1.00 0.00 H new ATOM 0 HH TYR A 130 5.342 5.685 5.036 1.00 0.00 H new ATOM 811 N MET A 131 -2.033 4.016 10.326 1.00 0.00 N ATOM 812 CA MET A 131 -3.437 3.708 10.575 1.00 0.00 C ATOM 813 C MET A 131 -4.042 4.666 11.592 1.00 0.00 C ATOM 814 O MET A 131 -5.187 4.502 12.012 1.00 0.00 O ATOM 815 CB MET A 131 -3.599 2.263 11.052 1.00 0.00 C ATOM 816 CG MET A 131 -3.353 1.215 9.973 1.00 0.00 C ATOM 817 SD MET A 131 -4.807 0.870 8.947 1.00 0.00 S ATOM 818 CE MET A 131 -4.948 2.354 7.947 1.00 0.00 C ATOM 0 H MET A 131 -1.375 3.428 10.837 1.00 0.00 H new ATOM 0 HA MET A 131 -3.972 3.829 9.633 1.00 0.00 H new ATOM 0 HB2 MET A 131 -2.910 2.086 11.878 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.607 2.133 11.445 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.538 1.551 9.332 1.00 0.00 H new ATOM 0 HG3 MET A 131 -3.025 0.289 10.446 1.00 0.00 H new ATOM 0 HE1 MET A 131 -5.307 2.090 6.952 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.651 3.043 8.415 1.00 0.00 H new ATOM 0 HE3 MET A 131 -3.972 2.832 7.865 1.00 0.00 H new ATOM 828 N GLN A 132 -3.268 5.660 11.997 1.00 0.00 N ATOM 829 CA GLN A 132 -3.767 6.682 12.900 1.00 0.00 C ATOM 830 C GLN A 132 -4.045 7.966 12.130 1.00 0.00 C ATOM 831 O GLN A 132 -4.616 8.915 12.669 1.00 0.00 O ATOM 832 CB GLN A 132 -2.760 6.951 14.017 1.00 0.00 C ATOM 833 CG GLN A 132 -1.510 7.666 13.543 1.00 0.00 C ATOM 834 CD GLN A 132 -0.465 7.809 14.624 1.00 0.00 C ATOM 835 OE1 GLN A 132 -0.781 7.889 15.812 1.00 0.00 O ATOM 836 NE2 GLN A 132 0.787 7.839 14.214 1.00 0.00 N ATOM 0 H GLN A 132 -2.295 5.780 11.715 1.00 0.00 H new ATOM 0 HA GLN A 132 -4.694 6.325 13.348 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.240 7.549 14.792 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.476 6.004 14.475 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.082 7.120 12.702 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -1.782 8.655 13.175 1.00 0.00 H new ATOM 0 HE21 GLN A 132 1.000 7.769 13.219 1.00 0.00 H new ATOM 0 HE22 GLN A 132 1.544 7.932 14.892 1.00 0.00 H new ATOM 845 N GLU A 133 -3.643 7.986 10.863 1.00 0.00 N ATOM 846 CA GLU A 133 -3.782 9.177 10.041 1.00 0.00 C ATOM 847 C GLU A 133 -4.957 9.029 9.088 1.00 0.00 C ATOM 848 O GLU A 133 -5.020 8.065 8.322 1.00 0.00 O ATOM 849 CB GLU A 133 -2.512 9.434 9.232 1.00 0.00 C ATOM 850 CG GLU A 133 -1.237 9.193 10.014 1.00 0.00 C ATOM 851 CD GLU A 133 -0.186 10.247 9.753 1.00 0.00 C ATOM 852 OE1 GLU A 133 -0.064 11.177 10.577 1.00 0.00 O ATOM 853 OE2 GLU A 133 0.516 10.154 8.729 1.00 0.00 O ATOM 0 H GLU A 133 -3.219 7.190 10.386 1.00 0.00 H new ATOM 0 HA GLU A 133 -3.956 10.021 10.708 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.516 8.791 8.352 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.521 10.464 8.875 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.467 9.171 11.079 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -0.836 8.213 9.754 1.00 0.00 H new ATOM 860 N PRO A 134 -5.885 9.999 9.102 1.00 0.00 N ATOM 861 CA PRO A 134 -7.087 9.964 8.262 1.00 0.00 C ATOM 862 C PRO A 134 -6.760 10.009 6.771 1.00 0.00 C ATOM 863 O PRO A 134 -7.610 9.720 5.933 1.00 0.00 O ATOM 864 CB PRO A 134 -7.867 11.213 8.683 1.00 0.00 C ATOM 865 CG PRO A 134 -6.853 12.109 9.303 1.00 0.00 C ATOM 866 CD PRO A 134 -5.837 11.208 9.941 1.00 0.00 C ATOM 0 HA PRO A 134 -7.646 9.038 8.399 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.343 11.689 7.826 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.659 10.964 9.390 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.389 12.750 8.554 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -7.312 12.764 10.043 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -4.844 11.658 9.942 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -6.089 10.988 10.979 1.00 0.00 H new ATOM 874 N LEU A 135 -5.525 10.362 6.441 1.00 0.00 N ATOM 875 CA LEU A 135 -5.091 10.354 5.055 1.00 0.00 C ATOM 876 C LEU A 135 -4.893 8.923 4.568 1.00 0.00 C ATOM 877 O LEU A 135 -5.355 8.556 3.489 1.00 0.00 O ATOM 878 CB LEU A 135 -3.790 11.145 4.863 1.00 0.00 C ATOM 879 CG LEU A 135 -3.870 12.640 5.177 1.00 0.00 C ATOM 880 CD1 LEU A 135 -3.500 12.913 6.626 1.00 0.00 C ATOM 881 CD2 LEU A 135 -2.989 13.435 4.226 1.00 0.00 C ATOM 0 H LEU A 135 -4.813 10.655 7.110 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.873 10.835 4.468 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -3.020 10.701 5.494 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.463 11.026 3.830 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.901 12.964 5.033 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.565 13.983 6.823 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.187 12.381 7.284 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -2.482 12.571 6.812 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.060 14.496 4.466 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -1.954 13.108 4.329 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -3.321 13.272 3.201 1.00 0.00 H new ATOM 893 N PHE A 136 -4.259 8.100 5.393 1.00 0.00 N ATOM 894 CA PHE A 136 -3.829 6.782 4.955 1.00 0.00 C ATOM 895 C PHE A 136 -4.934 5.769 5.186 1.00 0.00 C ATOM 896 O PHE A 136 -5.058 4.787 4.457 1.00 0.00 O ATOM 897 CB PHE A 136 -2.557 6.361 5.692 1.00 0.00 C ATOM 898 CG PHE A 136 -1.860 5.182 5.068 1.00 0.00 C ATOM 899 CD1 PHE A 136 -2.133 3.890 5.491 1.00 0.00 C ATOM 900 CD2 PHE A 136 -0.930 5.372 4.059 1.00 0.00 C ATOM 901 CE1 PHE A 136 -1.490 2.809 4.919 1.00 0.00 C ATOM 902 CE2 PHE A 136 -0.284 4.296 3.483 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.562 3.014 3.914 1.00 0.00 C ATOM 0 H PHE A 136 -4.033 8.321 6.363 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.610 6.824 3.888 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -1.868 7.205 5.722 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -2.809 6.119 6.724 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -2.856 3.727 6.276 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -0.708 6.373 3.719 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -1.711 1.807 5.256 1.00 0.00 H new ATOM 0 HE2 PHE A 136 0.438 4.457 2.696 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.055 2.172 3.467 1.00 0.00 H new ATOM 913 N VAL A 137 -5.740 6.019 6.205 1.00 0.00 N ATOM 914 CA VAL A 137 -6.875 5.167 6.509 1.00 0.00 C ATOM 915 C VAL A 137 -7.845 5.115 5.330 1.00 0.00 C ATOM 916 O VAL A 137 -8.264 4.042 4.911 1.00 0.00 O ATOM 917 CB VAL A 137 -7.617 5.651 7.763 1.00 0.00 C ATOM 918 CG1 VAL A 137 -6.774 5.469 9.015 1.00 0.00 C ATOM 919 CG2 VAL A 137 -8.032 7.081 7.614 1.00 0.00 C ATOM 0 H VAL A 137 -5.627 6.810 6.838 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.487 4.166 6.699 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.512 5.038 7.872 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.331 5.822 9.883 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.535 4.413 9.142 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.851 6.041 8.919 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.556 7.403 8.514 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.149 7.703 7.466 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.694 7.180 6.754 1.00 0.00 H new ATOM 929 N GLU A 138 -8.186 6.285 4.803 1.00 0.00 N ATOM 930 CA GLU A 138 -9.043 6.384 3.626 1.00 0.00 C ATOM 931 C GLU A 138 -8.381 5.721 2.434 1.00 0.00 C ATOM 932 O GLU A 138 -9.029 5.007 1.676 1.00 0.00 O ATOM 933 CB GLU A 138 -9.346 7.839 3.277 1.00 0.00 C ATOM 934 CG GLU A 138 -10.090 8.593 4.357 1.00 0.00 C ATOM 935 CD GLU A 138 -10.610 9.926 3.864 1.00 0.00 C ATOM 936 OE1 GLU A 138 -11.750 9.968 3.351 1.00 0.00 O ATOM 937 OE2 GLU A 138 -9.883 10.934 3.973 1.00 0.00 O ATOM 0 H GLU A 138 -7.880 7.184 5.175 1.00 0.00 H new ATOM 0 HA GLU A 138 -9.978 5.876 3.862 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -8.408 8.354 3.070 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -9.934 7.866 2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -10.924 7.988 4.712 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -9.428 8.755 5.208 1.00 0.00 H new ATOM 944 N PHE A 139 -7.084 5.966 2.281 1.00 0.00 N ATOM 945 CA PHE A 139 -6.302 5.348 1.222 1.00 0.00 C ATOM 946 C PHE A 139 -6.461 3.834 1.283 1.00 0.00 C ATOM 947 O PHE A 139 -6.768 3.182 0.283 1.00 0.00 O ATOM 948 CB PHE A 139 -4.828 5.746 1.367 1.00 0.00 C ATOM 949 CG PHE A 139 -3.888 4.965 0.493 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.182 3.889 1.006 1.00 0.00 C ATOM 951 CD2 PHE A 139 -3.710 5.304 -0.836 1.00 0.00 C ATOM 952 CE1 PHE A 139 -2.317 3.166 0.210 1.00 0.00 C ATOM 953 CE2 PHE A 139 -2.846 4.584 -1.639 1.00 0.00 C ATOM 954 CZ PHE A 139 -2.149 3.513 -1.115 1.00 0.00 C ATOM 0 H PHE A 139 -6.551 6.593 2.883 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.660 5.695 0.253 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.725 6.806 1.135 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.530 5.617 2.407 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -3.310 3.612 2.042 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -4.252 6.141 -1.251 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -1.772 2.330 0.623 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -2.716 4.859 -2.675 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.474 2.948 -1.741 1.00 0.00 H new ATOM 964 N ALA A 140 -6.283 3.297 2.480 1.00 0.00 N ATOM 965 CA ALA A 140 -6.439 1.876 2.721 1.00 0.00 C ATOM 966 C ALA A 140 -7.874 1.436 2.469 1.00 0.00 C ATOM 967 O ALA A 140 -8.116 0.461 1.758 1.00 0.00 O ATOM 968 CB ALA A 140 -6.020 1.542 4.144 1.00 0.00 C ATOM 0 H ALA A 140 -6.027 3.835 3.308 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.796 1.334 2.027 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.140 0.473 4.317 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.976 1.818 4.290 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.643 2.096 4.846 1.00 0.00 H new ATOM 974 N ASP A 141 -8.822 2.191 3.017 1.00 0.00 N ATOM 975 CA ASP A 141 -10.239 1.848 2.923 1.00 0.00 C ATOM 976 C ASP A 141 -10.685 1.816 1.465 1.00 0.00 C ATOM 977 O ASP A 141 -11.554 1.036 1.075 1.00 0.00 O ATOM 978 CB ASP A 141 -11.070 2.864 3.711 1.00 0.00 C ATOM 979 CG ASP A 141 -12.547 2.528 3.745 1.00 0.00 C ATOM 980 OD1 ASP A 141 -13.302 3.058 2.903 1.00 0.00 O ATOM 981 OD2 ASP A 141 -12.964 1.755 4.634 1.00 0.00 O ATOM 0 H ASP A 141 -8.633 3.050 3.534 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.391 0.856 3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.693 2.919 4.732 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.939 3.852 3.269 1.00 0.00 H new ATOM 986 N CYS A 142 -10.052 2.653 0.663 1.00 0.00 N ATOM 987 CA CYS A 142 -10.358 2.745 -0.752 1.00 0.00 C ATOM 988 C CYS A 142 -9.733 1.595 -1.536 1.00 0.00 C ATOM 989 O CYS A 142 -10.422 0.915 -2.296 1.00 0.00 O ATOM 990 CB CYS A 142 -9.871 4.084 -1.298 1.00 0.00 C ATOM 991 SG CYS A 142 -10.836 5.502 -0.733 1.00 0.00 S ATOM 0 H CYS A 142 -9.314 3.286 0.973 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.439 2.676 -0.871 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -8.830 4.227 -1.007 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -9.896 4.051 -2.387 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.461 5.832 0.467 1.00 0.00 H new ATOM 997 N CYS A 143 -8.437 1.359 -1.333 1.00 0.00 N ATOM 998 CA CYS A 143 -7.719 0.354 -2.111 1.00 0.00 C ATOM 999 C CYS A 143 -8.236 -1.050 -1.814 1.00 0.00 C ATOM 1000 O CYS A 143 -8.225 -1.919 -2.687 1.00 0.00 O ATOM 1001 CB CYS A 143 -6.213 0.439 -1.852 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.735 0.204 -0.128 1.00 0.00 S ATOM 0 H CYS A 143 -7.868 1.847 -0.641 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.899 0.561 -3.166 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.710 -0.312 -2.461 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.854 1.413 -2.186 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.801 0.156 0.615 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.724 -1.259 -0.595 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.263 -2.558 -0.206 1.00 0.00 C ATOM 1010 C LEU A 144 -10.529 -2.872 -0.988 1.00 0.00 C ATOM 1011 O LEU A 144 -10.899 -4.033 -1.145 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.552 -2.602 1.297 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.329 -2.418 2.196 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.698 -2.625 3.656 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -7.214 -3.362 1.779 1.00 0.00 C ATOM 0 H LEU A 144 -8.757 -0.550 0.137 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.512 -3.313 -0.437 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.279 -1.825 1.535 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -10.018 -3.558 1.534 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.969 -1.395 2.082 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.813 -2.489 4.278 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.459 -1.900 3.945 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.087 -3.634 3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.352 -3.217 2.430 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.560 -4.392 1.860 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.929 -3.155 0.748 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.186 -1.828 -1.478 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.365 -2.008 -2.299 1.00 0.00 C ATOM 1029 C GLY A 145 -12.017 -2.195 -3.761 1.00 0.00 C ATOM 1030 O GLY A 145 -12.853 -2.606 -4.563 1.00 0.00 O ATOM 0 H GLY A 145 -10.921 -0.856 -1.320 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.923 -2.875 -1.946 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -13.018 -1.142 -2.190 1.00 0.00 H new ATOM 1034 N ILE A 146 -10.781 -1.873 -4.115 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.326 -2.003 -5.489 1.00 0.00 C ATOM 1036 C ILE A 146 -9.687 -3.376 -5.726 1.00 0.00 C ATOM 1037 O ILE A 146 -9.768 -3.929 -6.822 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.318 -0.886 -5.845 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -9.858 0.473 -5.393 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.049 -0.873 -7.344 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -8.865 1.606 -5.529 1.00 0.00 C ATOM 0 H ILE A 146 -10.076 -1.520 -3.468 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.198 -1.906 -6.136 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.380 -1.083 -5.326 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -10.747 0.711 -5.976 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.170 0.400 -4.351 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.338 -0.081 -7.579 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.635 -1.835 -7.648 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -9.981 -0.694 -7.879 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.323 2.534 -5.188 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -7.984 1.393 -4.923 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -8.571 1.709 -6.574 1.00 0.00 H new ATOM 1053 N VAL A 147 -9.061 -3.927 -4.689 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.361 -5.208 -4.809 1.00 0.00 C ATOM 1055 C VAL A 147 -9.116 -6.344 -4.123 1.00 0.00 C ATOM 1056 O VAL A 147 -8.617 -7.471 -4.063 1.00 0.00 O ATOM 1057 CB VAL A 147 -6.945 -5.139 -4.199 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -6.127 -4.044 -4.857 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -7.010 -4.924 -2.693 1.00 0.00 C ATOM 0 H VAL A 147 -9.023 -3.510 -3.759 1.00 0.00 H new ATOM 0 HA VAL A 147 -8.298 -5.410 -5.878 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.454 -6.094 -4.386 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -5.133 -4.014 -4.411 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.040 -4.247 -5.924 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.620 -3.083 -4.709 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -5.999 -4.879 -2.288 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.528 -3.989 -2.481 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.550 -5.750 -2.230 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.310 -6.045 -3.622 1.00 0.00 N ATOM 1070 CA GLU A 148 -11.071 -6.991 -2.808 1.00 0.00 C ATOM 1071 C GLU A 148 -11.201 -8.371 -3.452 1.00 0.00 C ATOM 1072 O GLU A 148 -11.560 -8.511 -4.618 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.458 -6.433 -2.450 1.00 0.00 C ATOM 1074 CG GLU A 148 -13.073 -5.503 -3.488 1.00 0.00 C ATOM 1075 CD GLU A 148 -13.482 -6.196 -4.769 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -12.725 -6.116 -5.760 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -14.564 -6.813 -4.798 1.00 0.00 O ATOM 0 H GLU A 148 -10.776 -5.149 -3.766 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.497 -7.123 -1.891 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -13.137 -7.270 -2.288 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -12.383 -5.896 -1.504 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -13.948 -5.018 -3.054 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -12.357 -4.716 -3.725 1.00 0.00 H new ATOM 1197 N ILE B 463 -8.641 -6.414 8.926 1.00 0.00 N ATOM 1198 CA ILE B 463 -7.709 -5.291 8.859 1.00 0.00 C ATOM 1199 C ILE B 463 -6.269 -5.753 9.035 1.00 0.00 C ATOM 1200 O ILE B 463 -5.365 -5.209 8.416 1.00 0.00 O ATOM 1201 CB ILE B 463 -8.033 -4.203 9.913 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -9.407 -3.580 9.642 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -6.956 -3.121 9.933 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -9.514 -2.891 8.296 1.00 0.00 C ATOM 0 HA ILE B 463 -7.825 -4.855 7.867 1.00 0.00 H new ATOM 0 HB ILE B 463 -8.054 -4.682 10.892 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -10.167 -4.359 9.702 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -9.629 -2.858 10.428 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -7.209 -2.370 10.682 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -5.994 -3.570 10.179 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -6.896 -2.649 8.952 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -10.515 -2.476 8.178 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -8.779 -2.088 8.239 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -9.325 -3.613 7.502 1.00 0.00 H new ATOM 1216 N ARG B 464 -6.062 -6.773 9.857 1.00 0.00 N ATOM 1217 CA ARG B 464 -4.717 -7.287 10.110 1.00 0.00 C ATOM 1218 C ARG B 464 -4.088 -7.786 8.812 1.00 0.00 C ATOM 1219 O ARG B 464 -2.946 -7.454 8.490 1.00 0.00 O ATOM 1220 CB ARG B 464 -4.768 -8.417 11.135 1.00 0.00 C ATOM 1221 CG ARG B 464 -5.395 -8.009 12.455 1.00 0.00 C ATOM 1222 CD ARG B 464 -5.696 -9.220 13.318 1.00 0.00 C ATOM 1223 NE ARG B 464 -6.650 -10.117 12.670 1.00 0.00 N ATOM 1224 CZ ARG B 464 -7.050 -11.278 13.177 1.00 0.00 C ATOM 1225 NH1 ARG B 464 -6.604 -11.686 14.356 1.00 0.00 N ATOM 1226 NH2 ARG B 464 -7.910 -12.024 12.501 1.00 0.00 N ATOM 0 H ARG B 464 -6.803 -7.261 10.360 1.00 0.00 H new ATOM 0 HA ARG B 464 -4.105 -6.478 10.508 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -5.331 -9.251 10.717 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -3.755 -8.776 11.319 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -4.722 -7.338 12.988 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -6.315 -7.455 12.268 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -4.772 -9.759 13.525 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -6.096 -8.893 14.278 1.00 0.00 H new ATOM 0 HE ARG B 464 -7.034 -9.833 11.769 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -5.949 -11.107 14.881 1.00 0.00 H new ATOM 0 HH12 ARG B 464 -6.916 -12.579 14.738 1.00 0.00 H new ATOM 0 HH21 ARG B 464 -8.261 -11.706 11.597 1.00 0.00 H new ATOM 0 HH22 ARG B 464 -8.222 -12.917 12.884 1.00 0.00 H new ATOM 1240 N HIS B 465 -4.853 -8.573 8.068 1.00 0.00 N ATOM 1241 CA HIS B 465 -4.422 -9.086 6.773 1.00 0.00 C ATOM 1242 C HIS B 465 -4.400 -7.980 5.721 1.00 0.00 C ATOM 1243 O HIS B 465 -3.476 -7.886 4.918 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.344 -10.233 6.321 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.398 -10.417 4.832 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -4.463 -11.130 4.116 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.268 -9.922 3.921 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -4.754 -11.060 2.831 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -5.846 -10.337 2.688 1.00 0.00 N ATOM 0 H HIS B 465 -5.788 -8.874 8.343 1.00 0.00 H new ATOM 0 HA HIS B 465 -3.407 -9.468 6.882 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -5.005 -11.162 6.780 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -6.352 -10.044 6.691 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -7.135 -9.312 4.129 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -4.192 -11.518 2.031 1.00 0.00 H new ATOM 0 HE2 HIS B 465 -6.303 -10.122 1.802 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.431 -7.158 5.713 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.570 -6.138 4.688 1.00 0.00 C ATOM 1260 C GLU B 466 -4.519 -5.041 4.860 1.00 0.00 C ATOM 1261 O GLU B 466 -4.163 -4.360 3.907 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.994 -5.580 4.693 1.00 0.00 C ATOM 1263 CG GLU B 466 -8.024 -6.631 4.294 1.00 0.00 C ATOM 1264 CD GLU B 466 -9.455 -6.137 4.335 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -10.045 -6.095 5.434 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -10.015 -5.831 3.261 1.00 0.00 O ATOM 0 H GLU B 466 -6.183 -7.175 6.402 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.394 -6.590 3.712 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -7.231 -5.200 5.687 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -7.054 -4.735 4.007 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -7.800 -6.981 3.286 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -7.928 -7.490 4.958 1.00 0.00 H new ATOM 1273 N ARG B 467 -4.006 -4.908 6.077 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.957 -3.959 6.397 1.00 0.00 C ATOM 1275 C ARG B 467 -1.671 -4.272 5.629 1.00 0.00 C ATOM 1276 O ARG B 467 -1.027 -3.372 5.094 1.00 0.00 O ATOM 1277 CB ARG B 467 -2.716 -4.010 7.898 1.00 0.00 C ATOM 1278 CG ARG B 467 -2.054 -2.780 8.457 1.00 0.00 C ATOM 1279 CD ARG B 467 -2.068 -2.797 9.976 1.00 0.00 C ATOM 1280 NE ARG B 467 -1.367 -3.962 10.515 1.00 0.00 N ATOM 1281 CZ ARG B 467 -1.755 -4.633 11.602 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -2.840 -4.264 12.273 1.00 0.00 N ATOM 1283 NH2 ARG B 467 -1.055 -5.677 12.018 1.00 0.00 N ATOM 0 H ARG B 467 -4.313 -5.464 6.875 1.00 0.00 H new ATOM 0 HA ARG B 467 -3.266 -2.957 6.100 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -3.670 -4.157 8.403 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -2.097 -4.878 8.126 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -1.026 -2.722 8.100 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -2.568 -1.890 8.095 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -1.603 -1.887 10.354 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -3.099 -2.798 10.330 1.00 0.00 H new ATOM 0 HE ARG B 467 -0.529 -4.282 10.030 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -3.385 -3.461 11.959 1.00 0.00 H new ATOM 0 HH12 ARG B 467 -3.128 -4.783 13.102 1.00 0.00 H new ATOM 0 HH21 ARG B 467 -0.221 -5.967 11.508 1.00 0.00 H new ATOM 0 HH22 ARG B 467 -1.350 -6.191 12.848 1.00 0.00 H new ATOM 1297 N ASN B 468 -1.306 -5.551 5.550 1.00 0.00 N ATOM 1298 CA ASN B 468 -0.113 -5.946 4.809 1.00 0.00 C ATOM 1299 C ASN B 468 -0.424 -6.007 3.324 1.00 0.00 C ATOM 1300 O ASN B 468 0.470 -5.997 2.482 1.00 0.00 O ATOM 1301 CB ASN B 468 0.458 -7.282 5.303 1.00 0.00 C ATOM 1302 CG ASN B 468 -0.548 -8.417 5.313 1.00 0.00 C ATOM 1303 OD1 ASN B 468 -1.211 -8.655 6.320 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -0.662 -9.136 4.206 1.00 0.00 N ATOM 0 H ASN B 468 -1.813 -6.322 5.985 1.00 0.00 H new ATOM 0 HA ASN B 468 0.654 -5.191 4.984 1.00 0.00 H new ATOM 0 HB2 ASN B 468 1.300 -7.562 4.670 1.00 0.00 H new ATOM 0 HB3 ASN B 468 0.849 -7.148 6.312 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -1.317 -9.917 4.170 1.00 0.00 H new ATOM 0 HD22 ASN B 468 -0.095 -8.908 3.389 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.707 -6.082 3.013 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.177 -5.974 1.644 1.00 0.00 C ATOM 1313 C VAL B 469 -1.940 -4.560 1.109 1.00 0.00 C ATOM 1314 O VAL B 469 -1.663 -4.367 -0.081 1.00 0.00 O ATOM 1315 CB VAL B 469 -3.675 -6.350 1.559 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.398 -5.576 0.470 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -3.827 -7.845 1.335 1.00 0.00 C ATOM 0 H VAL B 469 -2.449 -6.219 3.700 1.00 0.00 H new ATOM 0 HA VAL B 469 -1.614 -6.672 1.024 1.00 0.00 H new ATOM 0 HB VAL B 469 -4.136 -6.078 2.509 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.447 -5.873 0.448 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.328 -4.508 0.675 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -3.939 -5.791 -0.495 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -4.886 -8.098 1.277 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -3.335 -8.125 0.404 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.370 -8.385 2.164 1.00 0.00 H new ATOM 1327 N ILE B 470 -2.013 -3.578 2.006 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.793 -2.183 1.641 1.00 0.00 C ATOM 1329 C ILE B 470 -0.391 -1.993 1.071 1.00 0.00 C ATOM 1330 O ILE B 470 -0.177 -1.157 0.196 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.972 -1.234 2.848 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -3.289 -1.509 3.575 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.929 0.214 2.387 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.515 -1.312 2.711 1.00 0.00 C ATOM 0 H ILE B 470 -2.224 -3.725 2.993 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.540 -1.933 0.888 1.00 0.00 H new ATOM 0 HB ILE B 470 -1.153 -1.415 3.544 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -3.280 -2.533 3.949 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -3.358 -0.853 4.443 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -2.056 0.873 3.246 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.969 0.417 1.913 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.731 0.392 1.671 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.410 -1.525 3.295 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.549 -0.281 2.358 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.470 -1.987 1.856 1.00 0.00 H new ATOM 1346 N LEU B 471 0.555 -2.794 1.562 1.00 0.00 N ATOM 1347 CA LEU B 471 1.943 -2.728 1.106 1.00 0.00 C ATOM 1348 C LEU B 471 2.022 -2.860 -0.411 1.00 0.00 C ATOM 1349 O LEU B 471 2.736 -2.111 -1.073 1.00 0.00 O ATOM 1350 CB LEU B 471 2.775 -3.837 1.761 1.00 0.00 C ATOM 1351 CG LEU B 471 2.833 -3.801 3.290 1.00 0.00 C ATOM 1352 CD1 LEU B 471 3.572 -5.018 3.820 1.00 0.00 C ATOM 1353 CD2 LEU B 471 3.505 -2.526 3.769 1.00 0.00 C ATOM 0 H LEU B 471 0.384 -3.499 2.279 1.00 0.00 H new ATOM 0 HA LEU B 471 2.346 -1.758 1.396 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.370 -4.801 1.453 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.793 -3.780 1.375 1.00 0.00 H new ATOM 0 HG LEU B 471 1.813 -3.818 3.673 1.00 0.00 H new ATOM 0 HD11 LEU B 471 3.605 -4.978 4.909 1.00 0.00 H new ATOM 0 HD12 LEU B 471 3.054 -5.924 3.506 1.00 0.00 H new ATOM 0 HD13 LEU B 471 4.588 -5.026 3.426 1.00 0.00 H new ATOM 0 HD21 LEU B 471 3.537 -2.519 4.859 1.00 0.00 H new ATOM 0 HD22 LEU B 471 4.521 -2.480 3.376 1.00 0.00 H new ATOM 0 HD23 LEU B 471 2.940 -1.663 3.417 1.00 0.00 H new ATOM 1365 N GLN B 472 1.265 -3.803 -0.954 1.00 0.00 N ATOM 1366 CA GLN B 472 1.250 -4.043 -2.391 1.00 0.00 C ATOM 1367 C GLN B 472 0.686 -2.836 -3.126 1.00 0.00 C ATOM 1368 O GLN B 472 1.202 -2.433 -4.164 1.00 0.00 O ATOM 1369 CB GLN B 472 0.425 -5.287 -2.726 1.00 0.00 C ATOM 1370 CG GLN B 472 1.091 -6.604 -2.357 1.00 0.00 C ATOM 1371 CD GLN B 472 1.309 -6.766 -0.867 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.370 -6.441 -0.343 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.295 -7.243 -0.170 1.00 0.00 N ATOM 0 H GLN B 472 0.651 -4.417 -0.419 1.00 0.00 H new ATOM 0 HA GLN B 472 2.277 -4.208 -2.716 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -0.533 -5.222 -2.210 1.00 0.00 H new ATOM 0 HB3 GLN B 472 0.212 -5.289 -3.795 1.00 0.00 H new ATOM 0 HG2 GLN B 472 0.477 -7.428 -2.719 1.00 0.00 H new ATOM 0 HG3 GLN B 472 2.051 -6.674 -2.868 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.571 -7.502 -0.642 1.00 0.00 H new ATOM 0 HE22 GLN B 472 0.378 -7.352 0.841 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.368 -2.263 -2.566 1.00 0.00 N ATOM 1383 CA CYS B 473 -1.008 -1.089 -3.140 1.00 0.00 C ATOM 1384 C CYS B 473 -0.024 0.080 -3.186 1.00 0.00 C ATOM 1385 O CYS B 473 0.204 0.679 -4.239 1.00 0.00 O ATOM 1386 CB CYS B 473 -2.236 -0.727 -2.303 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.372 -2.113 -2.037 1.00 0.00 S ATOM 0 H CYS B 473 -0.802 -2.596 -1.705 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.322 -1.307 -4.161 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.906 -0.348 -1.335 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.774 0.083 -2.795 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.792 -3.015 -1.302 1.00 0.00 H new ATOM 1393 N VAL B 474 0.561 0.370 -2.032 1.00 0.00 N ATOM 1394 CA VAL B 474 1.575 1.402 -1.886 1.00 0.00 C ATOM 1395 C VAL B 474 2.707 1.236 -2.900 1.00 0.00 C ATOM 1396 O VAL B 474 2.968 2.130 -3.710 1.00 0.00 O ATOM 1397 CB VAL B 474 2.167 1.355 -0.458 1.00 0.00 C ATOM 1398 CG1 VAL B 474 3.354 2.286 -0.312 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.099 1.690 0.571 1.00 0.00 C ATOM 0 H VAL B 474 0.341 -0.112 -1.160 1.00 0.00 H new ATOM 0 HA VAL B 474 1.093 2.363 -2.067 1.00 0.00 H new ATOM 0 HB VAL B 474 2.522 0.339 -0.282 1.00 0.00 H new ATOM 0 HG11 VAL B 474 3.742 2.224 0.705 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.134 1.995 -1.016 1.00 0.00 H new ATOM 0 HG13 VAL B 474 3.041 3.309 -0.520 1.00 0.00 H new ATOM 0 HG21 VAL B 474 1.532 1.652 1.570 1.00 0.00 H new ATOM 0 HG22 VAL B 474 0.712 2.691 0.381 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.286 0.967 0.500 1.00 0.00 H new ATOM 1409 N ARG B 475 3.353 0.078 -2.876 1.00 0.00 N ATOM 1410 CA ARG B 475 4.581 -0.121 -3.632 1.00 0.00 C ATOM 1411 C ARG B 475 4.316 -0.258 -5.130 1.00 0.00 C ATOM 1412 O ARG B 475 5.222 -0.067 -5.938 1.00 0.00 O ATOM 1413 CB ARG B 475 5.355 -1.330 -3.103 1.00 0.00 C ATOM 1414 CG ARG B 475 5.595 -1.277 -1.601 1.00 0.00 C ATOM 1415 CD ARG B 475 6.762 -2.150 -1.178 1.00 0.00 C ATOM 1416 NE ARG B 475 8.044 -1.535 -1.518 1.00 0.00 N ATOM 1417 CZ ARG B 475 9.229 -2.032 -1.175 1.00 0.00 C ATOM 1418 NH1 ARG B 475 9.307 -3.163 -0.484 1.00 0.00 N ATOM 1419 NH2 ARG B 475 10.339 -1.382 -1.494 1.00 0.00 N ATOM 0 H ARG B 475 3.048 -0.736 -2.342 1.00 0.00 H new ATOM 0 HA ARG B 475 5.194 0.770 -3.493 1.00 0.00 H new ATOM 0 HB2 ARG B 475 4.805 -2.240 -3.345 1.00 0.00 H new ATOM 0 HB3 ARG B 475 6.315 -1.392 -3.616 1.00 0.00 H new ATOM 0 HG2 ARG B 475 5.786 -0.247 -1.301 1.00 0.00 H new ATOM 0 HG3 ARG B 475 4.694 -1.599 -1.079 1.00 0.00 H new ATOM 0 HD2 ARG B 475 6.715 -2.325 -0.103 1.00 0.00 H new ATOM 0 HD3 ARG B 475 6.684 -3.123 -1.663 1.00 0.00 H new ATOM 0 HE ARG B 475 8.029 -0.667 -2.054 1.00 0.00 H new ATOM 0 HH11 ARG B 475 8.456 -3.655 -0.214 1.00 0.00 H new ATOM 0 HH12 ARG B 475 10.218 -3.540 -0.224 1.00 0.00 H new ATOM 0 HH21 ARG B 475 10.285 -0.500 -2.003 1.00 0.00 H new ATOM 0 HH22 ARG B 475 11.247 -1.764 -1.230 1.00 0.00 H new ATOM 1433 N TYR B 476 3.086 -0.594 -5.509 1.00 0.00 N ATOM 1434 CA TYR B 476 2.723 -0.627 -6.919 1.00 0.00 C ATOM 1435 C TYR B 476 2.713 0.787 -7.487 1.00 0.00 C ATOM 1436 O TYR B 476 3.255 1.043 -8.564 1.00 0.00 O ATOM 1437 CB TYR B 476 1.352 -1.291 -7.120 1.00 0.00 C ATOM 1438 CG TYR B 476 0.537 -0.667 -8.235 1.00 0.00 C ATOM 1439 CD1 TYR B 476 -0.472 0.238 -7.939 1.00 0.00 C ATOM 1440 CD2 TYR B 476 0.795 -0.951 -9.571 1.00 0.00 C ATOM 1441 CE1 TYR B 476 -1.204 0.844 -8.944 1.00 0.00 C ATOM 1442 CE2 TYR B 476 0.065 -0.354 -10.581 1.00 0.00 C ATOM 1443 CZ TYR B 476 -0.933 0.544 -10.263 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.654 1.150 -11.268 1.00 0.00 O ATOM 0 H TYR B 476 2.334 -0.844 -4.867 1.00 0.00 H new ATOM 0 HA TYR B 476 3.467 -1.220 -7.451 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.498 -2.350 -7.335 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.787 -1.230 -6.190 1.00 0.00 H new ATOM 0 HD1 TYR B 476 -0.689 0.473 -6.908 1.00 0.00 H new ATOM 0 HD2 TYR B 476 1.579 -1.650 -9.824 1.00 0.00 H new ATOM 0 HE1 TYR B 476 -1.984 1.549 -8.697 1.00 0.00 H new ATOM 0 HE2 TYR B 476 0.275 -0.589 -11.614 1.00 0.00 H new ATOM 0 HH TYR B 476 -2.568 0.796 -11.274 1.00 0.00 H new ATOM 1454 N ILE B 477 2.095 1.701 -6.749 1.00 0.00 N ATOM 1455 CA ILE B 477 1.978 3.081 -7.183 1.00 0.00 C ATOM 1456 C ILE B 477 3.351 3.724 -7.247 1.00 0.00 C ATOM 1457 O ILE B 477 3.763 4.225 -8.290 1.00 0.00 O ATOM 1458 CB ILE B 477 1.071 3.885 -6.235 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.310 3.233 -6.169 1.00 0.00 C ATOM 1460 CG2 ILE B 477 0.966 5.334 -6.693 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -1.235 3.867 -5.162 1.00 0.00 C ATOM 0 H ILE B 477 1.667 1.507 -5.844 1.00 0.00 H new ATOM 0 HA ILE B 477 1.528 3.086 -8.176 1.00 0.00 H new ATOM 0 HB ILE B 477 1.509 3.882 -5.237 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.772 3.283 -7.155 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.192 2.177 -5.925 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.320 5.886 -6.010 1.00 0.00 H new ATOM 0 HG22 ILE B 477 1.958 5.786 -6.700 1.00 0.00 H new ATOM 0 HG23 ILE B 477 0.545 5.368 -7.698 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -2.195 3.350 -5.174 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.795 3.794 -4.167 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -1.385 4.916 -5.416 1.00 0.00 H new ATOM 1473 N ILE B 478 4.069 3.658 -6.134 1.00 0.00 N ATOM 1474 CA ILE B 478 5.416 4.207 -6.049 1.00 0.00 C ATOM 1475 C ILE B 478 6.299 3.659 -7.162 1.00 0.00 C ATOM 1476 O ILE B 478 7.187 4.354 -7.656 1.00 0.00 O ATOM 1477 CB ILE B 478 6.071 3.867 -4.698 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.171 4.288 -3.542 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.431 4.539 -4.570 1.00 0.00 C ATOM 1480 CD1 ILE B 478 5.736 3.907 -2.201 1.00 0.00 C ATOM 0 H ILE B 478 3.738 3.226 -5.271 1.00 0.00 H new ATOM 0 HA ILE B 478 5.325 5.289 -6.149 1.00 0.00 H new ATOM 0 HB ILE B 478 6.212 2.787 -4.658 1.00 0.00 H new ATOM 0 HG12 ILE B 478 5.023 5.367 -3.576 1.00 0.00 H new ATOM 0 HG13 ILE B 478 4.191 3.827 -3.663 1.00 0.00 H new ATOM 0 HG21 ILE B 478 7.874 4.284 -3.607 1.00 0.00 H new ATOM 0 HG22 ILE B 478 8.084 4.195 -5.372 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.311 5.620 -4.639 1.00 0.00 H new ATOM 0 HD11 ILE B 478 5.055 4.231 -1.414 1.00 0.00 H new ATOM 0 HD12 ILE B 478 5.859 2.825 -2.152 1.00 0.00 H new ATOM 0 HD13 ILE B 478 6.704 4.389 -2.064 1.00 0.00 H new ATOM 1492 N LYS B 479 6.021 2.423 -7.563 1.00 0.00 N ATOM 1493 CA LYS B 479 6.839 1.719 -8.534 1.00 0.00 C ATOM 1494 C LYS B 479 6.971 2.485 -9.839 1.00 0.00 C ATOM 1495 O LYS B 479 8.075 2.669 -10.349 1.00 0.00 O ATOM 1496 CB LYS B 479 6.256 0.330 -8.798 1.00 0.00 C ATOM 1497 CG LYS B 479 7.113 -0.530 -9.703 1.00 0.00 C ATOM 1498 CD LYS B 479 8.474 -0.799 -9.088 1.00 0.00 C ATOM 1499 CE LYS B 479 9.379 -1.532 -10.053 1.00 0.00 C ATOM 1500 NZ LYS B 479 8.829 -2.860 -10.443 1.00 0.00 N ATOM 0 H LYS B 479 5.224 1.885 -7.223 1.00 0.00 H new ATOM 0 HA LYS B 479 7.839 1.625 -8.111 1.00 0.00 H new ATOM 0 HB2 LYS B 479 6.120 -0.184 -7.846 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.268 0.440 -9.245 1.00 0.00 H new ATOM 0 HG2 LYS B 479 6.606 -1.476 -9.895 1.00 0.00 H new ATOM 0 HG3 LYS B 479 7.239 -0.034 -10.666 1.00 0.00 H new ATOM 0 HD2 LYS B 479 8.937 0.144 -8.797 1.00 0.00 H new ATOM 0 HD3 LYS B 479 8.354 -1.389 -8.179 1.00 0.00 H new ATOM 0 HE2 LYS B 479 9.523 -0.924 -10.946 1.00 0.00 H new ATOM 0 HE3 LYS B 479 10.360 -1.667 -9.597 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 9.546 -3.389 -10.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 8.573 -3.394 -9.588 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 7.984 -2.726 -11.034 1.00 0.00 H new ATOM 1514 N LYS B 480 5.859 2.949 -10.369 1.00 0.00 N ATOM 1515 CA LYS B 480 5.874 3.608 -11.661 1.00 0.00 C ATOM 1516 C LYS B 480 5.552 5.092 -11.542 1.00 0.00 C ATOM 1517 O LYS B 480 5.720 5.852 -12.496 1.00 0.00 O ATOM 1518 CB LYS B 480 4.927 2.890 -12.636 1.00 0.00 C ATOM 1519 CG LYS B 480 3.744 2.199 -11.966 1.00 0.00 C ATOM 1520 CD LYS B 480 2.685 3.189 -11.527 1.00 0.00 C ATOM 1521 CE LYS B 480 1.881 3.693 -12.713 1.00 0.00 C ATOM 1522 NZ LYS B 480 0.859 4.692 -12.310 1.00 0.00 N ATOM 0 H LYS B 480 4.940 2.884 -9.931 1.00 0.00 H new ATOM 0 HA LYS B 480 6.885 3.544 -12.065 1.00 0.00 H new ATOM 0 HB2 LYS B 480 4.549 3.615 -13.357 1.00 0.00 H new ATOM 0 HB3 LYS B 480 5.496 2.149 -13.197 1.00 0.00 H new ATOM 0 HG2 LYS B 480 3.304 1.480 -12.658 1.00 0.00 H new ATOM 0 HG3 LYS B 480 4.095 1.636 -11.101 1.00 0.00 H new ATOM 0 HD2 LYS B 480 2.018 2.716 -10.806 1.00 0.00 H new ATOM 0 HD3 LYS B 480 3.157 4.030 -11.020 1.00 0.00 H new ATOM 0 HE2 LYS B 480 2.555 4.139 -13.444 1.00 0.00 H new ATOM 0 HE3 LYS B 480 1.391 2.851 -13.203 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 0.334 5.009 -13.150 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 0.200 4.260 -11.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 1.327 5.508 -11.866 1.00 0.00 H new