USER MOD reduce.3.24.130724 H: found=0, std=0, add=565, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 569 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 Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ -156:sc= 0.34 (180deg=-0.0616) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 TYR OH : rot 105:sc= 0.778 USER MOD Single : A 108 GLN :FLIP amide:sc= -0.0765 F(o=-1.4,f=-0.076) USER MOD Single : A 110 LYS NZ :NH3+ 166:sc=-0.00881 (180deg=-0.214) USER MOD Single : A 113 SER OG : rot -170:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -179:sc= -1.03 (180deg=-1.03) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 ASN : amide:sc= 0.0147 X(o=0.015,f=0.013) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= -0.0069 (180deg=-0.0069) USER MOD Single : A 153 GLN : amide:sc= -0.0121 X(o=-0.012,f=-0.021) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 169 GLN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 170 MET CE :methyl -179:sc= 0 (180deg=-0.00369) USER MOD Single : A 172 MET CE :methyl 150:sc= -0.798 (180deg=-4.02!) USER MOD Single : A 177 LYS NZ :NH3+ -173:sc= 0.0537 (180deg=0.0437) USER MOD ----------------------------------------------------------------- ATOM 35 N GLN A 92 -0.731 12.335 9.776 1.00 0.00 N ATOM 36 CA GLN A 92 0.671 12.259 9.491 1.00 0.00 C ATOM 37 C GLN A 92 0.809 11.502 8.223 1.00 0.00 C ATOM 38 O GLN A 92 -0.159 10.905 7.765 1.00 0.00 O ATOM 39 CB GLN A 92 1.414 11.459 10.565 1.00 0.00 C ATOM 40 CG GLN A 92 0.973 11.795 11.995 1.00 0.00 C ATOM 41 CD GLN A 92 1.205 13.270 12.310 1.00 0.00 C ATOM 42 OE1 GLN A 92 2.340 13.754 12.369 1.00 0.00 O ATOM 43 NE2 GLN A 92 0.060 13.989 12.527 1.00 0.00 N ATOM 0 HA GLN A 92 1.083 13.267 9.444 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.259 10.395 10.386 1.00 0.00 H new ATOM 0 HB3 GLN A 92 2.484 11.645 10.470 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -0.083 11.555 12.119 1.00 0.00 H new ATOM 0 HG3 GLN A 92 1.525 11.178 12.704 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.849 13.531 12.464 1.00 0.00 H new ATOM 0 HE22 GLN A 92 0.116 14.982 12.752 1.00 0.00 H new ATOM 52 N VAL A 93 2.019 11.483 7.634 1.00 0.00 N ATOM 53 CA VAL A 93 2.314 10.503 6.629 1.00 0.00 C ATOM 54 C VAL A 93 3.151 9.459 7.283 1.00 0.00 C ATOM 55 O VAL A 93 4.265 9.768 7.704 1.00 0.00 O ATOM 56 CB VAL A 93 3.042 11.025 5.412 1.00 0.00 C ATOM 57 CG1 VAL A 93 3.397 9.854 4.482 1.00 0.00 C ATOM 58 CG2 VAL A 93 2.067 11.874 4.602 1.00 0.00 C ATOM 0 H VAL A 93 2.779 12.130 7.846 1.00 0.00 H new ATOM 0 HA VAL A 93 1.362 10.131 6.249 1.00 0.00 H new ATOM 0 HB VAL A 93 3.926 11.572 5.740 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.922 10.232 3.605 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.038 9.149 5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.484 9.349 4.168 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.571 12.262 3.717 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.218 11.262 4.297 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.714 12.705 5.213 1.00 0.00 H new ATOM 68 N LYS A 94 2.670 8.188 7.345 1.00 0.00 N ATOM 69 CA LYS A 94 3.614 7.118 7.540 1.00 0.00 C ATOM 70 C LYS A 94 3.770 6.492 6.210 1.00 0.00 C ATOM 71 O LYS A 94 3.092 6.871 5.265 1.00 0.00 O ATOM 72 CB LYS A 94 3.149 6.035 8.503 1.00 0.00 C ATOM 73 CG LYS A 94 2.504 6.616 9.763 1.00 0.00 C ATOM 74 CD LYS A 94 3.461 7.362 10.709 1.00 0.00 C ATOM 75 CE LYS A 94 4.415 6.444 11.483 1.00 0.00 C ATOM 76 NZ LYS A 94 3.655 5.540 12.376 1.00 0.00 N ATOM 0 H LYS A 94 1.690 7.915 7.266 1.00 0.00 H new ATOM 0 HA LYS A 94 4.525 7.536 7.969 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.434 5.386 7.998 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.999 5.414 8.786 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.711 7.300 9.462 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.032 5.804 10.317 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.049 8.073 10.128 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.873 7.941 11.421 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.011 5.857 10.784 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.110 7.044 12.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.266 5.230 13.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.830 6.044 12.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.334 4.710 11.838 1.00 0.00 H new ATOM 90 N GLU A 95 4.683 5.520 6.098 1.00 0.00 N ATOM 91 CA GLU A 95 4.902 4.870 4.850 1.00 0.00 C ATOM 92 C GLU A 95 5.244 3.448 5.153 1.00 0.00 C ATOM 93 O GLU A 95 5.776 3.143 6.220 1.00 0.00 O ATOM 94 CB GLU A 95 6.096 5.506 4.153 1.00 0.00 C ATOM 95 CG GLU A 95 6.339 5.135 2.687 1.00 0.00 C ATOM 96 CD GLU A 95 7.536 5.932 2.190 1.00 0.00 C ATOM 97 OE1 GLU A 95 8.650 5.736 2.744 1.00 0.00 O ATOM 98 OE2 GLU A 95 7.352 6.746 1.246 1.00 0.00 O ATOM 0 H GLU A 95 5.266 5.185 6.865 1.00 0.00 H new ATOM 0 HA GLU A 95 4.021 4.950 4.213 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.982 6.588 4.212 1.00 0.00 H new ATOM 0 HB3 GLU A 95 6.992 5.248 4.718 1.00 0.00 H new ATOM 0 HG2 GLU A 95 6.527 4.066 2.591 1.00 0.00 H new ATOM 0 HG3 GLU A 95 5.457 5.358 2.087 1.00 0.00 H new ATOM 105 N ILE A 96 4.951 2.555 4.192 1.00 0.00 N ATOM 106 CA ILE A 96 5.330 1.174 4.254 1.00 0.00 C ATOM 107 C ILE A 96 5.875 0.888 2.891 1.00 0.00 C ATOM 108 O ILE A 96 5.619 1.665 1.972 1.00 0.00 O ATOM 109 CB ILE A 96 4.143 0.285 4.596 1.00 0.00 C ATOM 110 CG1 ILE A 96 4.548 -0.931 5.452 1.00 0.00 C ATOM 111 CG2 ILE A 96 3.352 -0.144 3.355 1.00 0.00 C ATOM 112 CD1 ILE A 96 5.008 -0.579 6.868 1.00 0.00 C ATOM 0 H ILE A 96 4.435 2.798 3.346 1.00 0.00 H new ATOM 0 HA ILE A 96 6.060 0.972 5.038 1.00 0.00 H new ATOM 0 HB ILE A 96 3.476 0.898 5.202 1.00 0.00 H new ATOM 0 HG12 ILE A 96 3.700 -1.613 5.517 1.00 0.00 H new ATOM 0 HG13 ILE A 96 5.350 -1.467 4.945 1.00 0.00 H new ATOM 0 HG21 ILE A 96 2.517 -0.776 3.656 1.00 0.00 H new ATOM 0 HG22 ILE A 96 2.972 0.740 2.843 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.004 -0.701 2.682 1.00 0.00 H new ATOM 0 HD11 ILE A 96 5.274 -1.492 7.401 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.877 0.077 6.816 1.00 0.00 H new ATOM 0 HD13 ILE A 96 4.201 -0.072 7.397 1.00 0.00 H new ATOM 124 N LYS A 97 6.617 -0.232 2.722 1.00 0.00 N ATOM 125 CA LYS A 97 6.814 -0.750 1.394 1.00 0.00 C ATOM 126 C LYS A 97 6.273 -2.126 1.265 1.00 0.00 C ATOM 127 O LYS A 97 6.208 -2.873 2.240 1.00 0.00 O ATOM 128 CB LYS A 97 8.242 -0.818 0.850 1.00 0.00 C ATOM 129 CG LYS A 97 8.927 0.547 0.742 1.00 0.00 C ATOM 130 CD LYS A 97 10.211 0.487 -0.090 1.00 0.00 C ATOM 131 CE LYS A 97 10.769 1.864 -0.458 1.00 0.00 C ATOM 132 NZ LYS A 97 11.155 2.611 0.757 1.00 0.00 N ATOM 0 H LYS A 97 7.064 -0.760 3.472 1.00 0.00 H new ATOM 0 HA LYS A 97 6.285 -0.001 0.806 1.00 0.00 H new ATOM 0 HB2 LYS A 97 8.837 -1.463 1.497 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.224 -1.284 -0.135 1.00 0.00 H new ATOM 0 HG2 LYS A 97 8.238 1.262 0.293 1.00 0.00 H new ATOM 0 HG3 LYS A 97 9.161 0.914 1.741 1.00 0.00 H new ATOM 0 HD2 LYS A 97 10.968 -0.066 0.466 1.00 0.00 H new ATOM 0 HD3 LYS A 97 10.015 -0.073 -1.005 1.00 0.00 H new ATOM 0 HE2 LYS A 97 11.634 1.749 -1.111 1.00 0.00 H new ATOM 0 HE3 LYS A 97 10.021 2.428 -1.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 11.531 3.542 0.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 10.322 2.737 1.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 11.884 2.080 1.274 1.00 0.00 H new ATOM 146 N PHE A 98 5.889 -2.481 0.017 1.00 0.00 N ATOM 147 CA PHE A 98 5.516 -3.807 -0.343 1.00 0.00 C ATOM 148 C PHE A 98 6.306 -4.207 -1.532 1.00 0.00 C ATOM 149 O PHE A 98 6.929 -3.385 -2.200 1.00 0.00 O ATOM 150 CB PHE A 98 4.037 -3.938 -0.693 1.00 0.00 C ATOM 151 CG PHE A 98 3.286 -3.844 0.561 1.00 0.00 C ATOM 152 CD1 PHE A 98 3.491 -4.732 1.583 1.00 0.00 C ATOM 153 CD2 PHE A 98 2.339 -2.884 0.682 1.00 0.00 C ATOM 154 CE1 PHE A 98 2.816 -4.576 2.777 1.00 0.00 C ATOM 155 CE2 PHE A 98 1.598 -2.762 1.833 1.00 0.00 C ATOM 156 CZ PHE A 98 1.810 -3.638 2.883 1.00 0.00 C ATOM 0 H PHE A 98 5.840 -1.820 -0.758 1.00 0.00 H new ATOM 0 HA PHE A 98 5.709 -4.445 0.520 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.734 -3.151 -1.383 1.00 0.00 H new ATOM 0 HB3 PHE A 98 3.841 -4.889 -1.188 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.180 -5.554 1.455 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.163 -2.204 -0.138 1.00 0.00 H new ATOM 0 HE1 PHE A 98 3.075 -5.188 3.628 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.853 -1.985 1.918 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.198 -3.588 3.771 1.00 0.00 H new ATOM 166 N ARG A 99 6.309 -5.531 -1.775 1.00 0.00 N ATOM 167 CA ARG A 99 7.137 -6.181 -2.726 1.00 0.00 C ATOM 168 C ARG A 99 6.232 -6.820 -3.742 1.00 0.00 C ATOM 169 O ARG A 99 5.016 -6.793 -3.568 1.00 0.00 O ATOM 170 CB ARG A 99 7.915 -7.295 -2.011 1.00 0.00 C ATOM 171 CG ARG A 99 8.686 -6.853 -0.751 1.00 0.00 C ATOM 172 CD ARG A 99 7.905 -7.075 0.555 1.00 0.00 C ATOM 173 NE ARG A 99 8.532 -6.261 1.638 1.00 0.00 N ATOM 174 CZ ARG A 99 7.833 -5.925 2.763 1.00 0.00 C ATOM 175 NH1 ARG A 99 6.555 -6.369 2.951 1.00 0.00 N ATOM 176 NH2 ARG A 99 8.414 -5.127 3.708 1.00 0.00 N ATOM 0 H ARG A 99 5.697 -6.177 -1.276 1.00 0.00 H new ATOM 0 HA ARG A 99 7.826 -5.478 -3.193 1.00 0.00 H new ATOM 0 HB2 ARG A 99 7.216 -8.083 -1.732 1.00 0.00 H new ATOM 0 HB3 ARG A 99 8.622 -7.732 -2.716 1.00 0.00 H new ATOM 0 HG2 ARG A 99 9.627 -7.400 -0.700 1.00 0.00 H new ATOM 0 HG3 ARG A 99 8.937 -5.796 -0.840 1.00 0.00 H new ATOM 0 HD2 ARG A 99 6.862 -6.788 0.424 1.00 0.00 H new ATOM 0 HD3 ARG A 99 7.913 -8.131 0.824 1.00 0.00 H new ATOM 0 HE ARG A 99 9.498 -5.950 1.536 1.00 0.00 H new ATOM 0 HH11 ARG A 99 6.111 -6.959 2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 99 6.044 -6.111 3.795 1.00 0.00 H new ATOM 0 HH21 ARG A 99 9.365 -4.785 3.572 1.00 0.00 H new ATOM 0 HH22 ARG A 99 7.896 -4.873 4.550 1.00 0.00 H new ATOM 259 N ASP A 106 5.431 -12.138 5.707 1.00 0.00 N ATOM 260 CA ASP A 106 6.300 -11.047 5.421 1.00 0.00 C ATOM 261 C ASP A 106 5.443 -9.867 5.199 1.00 0.00 C ATOM 262 O ASP A 106 5.785 -8.753 5.597 1.00 0.00 O ATOM 263 CB ASP A 106 7.111 -11.259 4.158 1.00 0.00 C ATOM 264 CG ASP A 106 8.282 -10.291 4.108 1.00 0.00 C ATOM 265 OD1 ASP A 106 9.123 -10.320 5.045 1.00 0.00 O ATOM 266 OD2 ASP A 106 8.355 -9.509 3.122 1.00 0.00 O ATOM 0 HA ASP A 106 6.997 -10.934 6.252 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.478 -12.285 4.122 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.476 -11.117 3.283 1.00 0.00 H new ATOM 271 N TYR A 107 4.329 -10.108 4.480 1.00 0.00 N ATOM 272 CA TYR A 107 3.597 -9.013 3.921 1.00 0.00 C ATOM 273 C TYR A 107 2.669 -8.493 4.951 1.00 0.00 C ATOM 274 O TYR A 107 2.806 -7.339 5.328 1.00 0.00 O ATOM 275 CB TYR A 107 2.853 -9.600 2.727 1.00 0.00 C ATOM 276 CG TYR A 107 1.996 -8.821 1.837 1.00 0.00 C ATOM 277 CD1 TYR A 107 1.627 -7.529 2.085 1.00 0.00 C ATOM 278 CD2 TYR A 107 1.345 -9.579 0.886 1.00 0.00 C ATOM 279 CE1 TYR A 107 0.468 -7.047 1.552 1.00 0.00 C ATOM 280 CE2 TYR A 107 0.284 -9.037 0.197 1.00 0.00 C ATOM 281 CZ TYR A 107 -0.173 -7.803 0.609 1.00 0.00 C ATOM 282 OH TYR A 107 -1.369 -7.307 0.139 1.00 0.00 O ATOM 0 H TYR A 107 3.944 -11.033 4.290 1.00 0.00 H new ATOM 0 HA TYR A 107 4.226 -8.180 3.605 1.00 0.00 H new ATOM 0 HB2 TYR A 107 3.610 -10.062 2.093 1.00 0.00 H new ATOM 0 HB3 TYR A 107 2.232 -10.405 3.121 1.00 0.00 H new ATOM 0 HD1 TYR A 107 2.249 -6.894 2.699 1.00 0.00 H new ATOM 0 HD2 TYR A 107 1.666 -10.590 0.684 1.00 0.00 H new ATOM 0 HE1 TYR A 107 0.067 -6.095 1.866 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -0.172 -9.557 -0.632 1.00 0.00 H new ATOM 0 HH TYR A 107 -1.239 -6.935 -0.758 1.00 0.00 H new ATOM 292 N GLN A 108 1.675 -9.296 5.375 1.00 0.00 N ATOM 293 CA GLN A 108 0.715 -8.999 6.374 1.00 0.00 C ATOM 294 C GLN A 108 1.164 -8.740 7.782 1.00 0.00 C ATOM 295 O GLN A 108 0.380 -8.274 8.609 1.00 0.00 O ATOM 296 CB GLN A 108 -0.508 -9.914 6.306 1.00 0.00 C ATOM 297 CG GLN A 108 -0.676 -10.815 5.071 1.00 0.00 C ATOM 298 CD GLN A 108 -1.493 -10.064 4.016 1.00 0.00 C ATOM 299 OE1 GLN A 108 -0.971 -8.871 3.601 1.00 0.00 O flip ATOM 300 NE2 GLN A 108 -2.552 -10.532 3.581 1.00 0.00 N flip ATOM 0 H GLN A 108 1.540 -10.227 4.981 1.00 0.00 H new ATOM 0 HA GLN A 108 0.434 -7.990 6.074 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -0.492 -10.556 7.187 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -1.397 -9.288 6.384 1.00 0.00 H new ATOM 0 HG2 GLN A 108 0.299 -11.088 4.668 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -1.178 -11.742 5.347 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -2.894 -11.428 3.928 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -3.083 -10.022 2.875 1.00 0.00 H new ATOM 309 N VAL A 109 2.453 -8.997 8.055 1.00 0.00 N ATOM 310 CA VAL A 109 3.176 -8.419 9.179 1.00 0.00 C ATOM 311 C VAL A 109 3.199 -6.913 9.055 1.00 0.00 C ATOM 312 O VAL A 109 2.972 -6.171 10.008 1.00 0.00 O ATOM 313 CB VAL A 109 4.605 -8.924 9.291 1.00 0.00 C ATOM 314 CG1 VAL A 109 5.428 -8.155 10.347 1.00 0.00 C ATOM 315 CG2 VAL A 109 4.539 -10.409 9.676 1.00 0.00 C ATOM 0 H VAL A 109 3.023 -9.623 7.487 1.00 0.00 H new ATOM 0 HA VAL A 109 2.646 -8.728 10.080 1.00 0.00 H new ATOM 0 HB VAL A 109 5.105 -8.772 8.335 1.00 0.00 H new ATOM 0 HG11 VAL A 109 6.440 -8.558 10.384 1.00 0.00 H new ATOM 0 HG12 VAL A 109 5.467 -7.099 10.079 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.958 -8.264 11.325 1.00 0.00 H new ATOM 0 HG21 VAL A 109 5.550 -10.807 9.766 1.00 0.00 H new ATOM 0 HG22 VAL A 109 4.021 -10.515 10.629 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.999 -10.961 8.907 1.00 0.00 H new ATOM 325 N LYS A 110 3.525 -6.411 7.859 1.00 0.00 N ATOM 326 CA LYS A 110 3.564 -5.002 7.580 1.00 0.00 C ATOM 327 C LYS A 110 2.308 -4.412 7.073 1.00 0.00 C ATOM 328 O LYS A 110 2.194 -3.195 6.920 1.00 0.00 O ATOM 329 CB LYS A 110 4.678 -4.709 6.612 1.00 0.00 C ATOM 330 CG LYS A 110 6.036 -4.858 7.296 1.00 0.00 C ATOM 331 CD LYS A 110 6.178 -4.366 8.743 1.00 0.00 C ATOM 332 CE LYS A 110 7.601 -4.478 9.298 1.00 0.00 C ATOM 333 NZ LYS A 110 8.527 -3.610 8.540 1.00 0.00 N ATOM 0 H LYS A 110 3.770 -6.993 7.058 1.00 0.00 H new ATOM 0 HA LYS A 110 3.731 -4.530 8.548 1.00 0.00 H new ATOM 0 HB2 LYS A 110 4.616 -5.388 5.762 1.00 0.00 H new ATOM 0 HB3 LYS A 110 4.571 -3.697 6.221 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.305 -5.914 7.276 1.00 0.00 H new ATOM 0 HG3 LYS A 110 6.773 -4.330 6.691 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.858 -3.325 8.796 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.504 -4.939 9.379 1.00 0.00 H new ATOM 0 HE2 LYS A 110 7.609 -4.196 10.351 1.00 0.00 H new ATOM 0 HE3 LYS A 110 7.938 -5.513 9.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.420 -3.513 9.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.716 -4.034 7.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.097 -2.672 8.412 1.00 0.00 H new ATOM 347 N LEU A 111 1.311 -5.272 6.873 1.00 0.00 N ATOM 348 CA LEU A 111 -0.031 -4.835 6.752 1.00 0.00 C ATOM 349 C LEU A 111 -0.476 -4.547 8.147 1.00 0.00 C ATOM 350 O LEU A 111 -1.271 -3.634 8.332 1.00 0.00 O ATOM 351 CB LEU A 111 -0.900 -5.881 6.058 1.00 0.00 C ATOM 352 CG LEU A 111 -2.200 -5.381 5.432 1.00 0.00 C ATOM 353 CD1 LEU A 111 -2.545 -6.231 4.216 1.00 0.00 C ATOM 354 CD2 LEU A 111 -3.372 -5.408 6.409 1.00 0.00 C ATOM 0 H LEU A 111 1.435 -6.281 6.794 1.00 0.00 H new ATOM 0 HA LEU A 111 -0.120 -3.948 6.125 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -0.305 -6.354 5.277 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -1.147 -6.655 6.784 1.00 0.00 H new ATOM 0 HG LEU A 111 -2.035 -4.343 5.143 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.473 -5.871 3.772 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.741 -6.161 3.483 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.668 -7.270 4.521 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.270 -5.042 5.911 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.537 -6.430 6.751 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.147 -4.771 7.265 1.00 0.00 H new ATOM 366 N ARG A 112 0.049 -5.301 9.154 1.00 0.00 N ATOM 367 CA ARG A 112 -0.127 -4.996 10.547 1.00 0.00 C ATOM 368 C ARG A 112 0.479 -3.659 10.889 1.00 0.00 C ATOM 369 O ARG A 112 -0.162 -2.896 11.627 1.00 0.00 O ATOM 370 CB ARG A 112 0.365 -6.063 11.541 1.00 0.00 C ATOM 371 CG ARG A 112 -0.410 -6.066 12.865 1.00 0.00 C ATOM 372 CD ARG A 112 0.128 -7.110 13.848 1.00 0.00 C ATOM 373 NE ARG A 112 -0.668 -7.010 15.104 1.00 0.00 N ATOM 374 CZ ARG A 112 -0.375 -7.806 16.175 1.00 0.00 C ATOM 375 NH1 ARG A 112 0.646 -8.709 16.100 1.00 0.00 N ATOM 376 NH2 ARG A 112 -1.105 -7.697 17.323 1.00 0.00 N ATOM 0 H ARG A 112 0.606 -6.139 8.988 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.210 -4.972 10.671 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.282 -7.046 11.078 1.00 0.00 H new ATOM 0 HB3 ARG A 112 1.422 -5.896 11.748 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.352 -5.077 13.320 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.463 -6.265 12.667 1.00 0.00 H new ATOM 0 HD2 ARG A 112 0.047 -8.111 13.424 1.00 0.00 H new ATOM 0 HD3 ARG A 112 1.184 -6.934 14.051 1.00 0.00 H new ATOM 0 HE ARG A 112 -1.437 -6.343 15.164 1.00 0.00 H new ATOM 0 HH11 ARG A 112 1.193 -8.791 15.243 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.862 -9.302 16.901 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.868 -7.022 17.380 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.888 -8.290 18.124 1.00 0.00 H new ATOM 390 N SER A 113 1.711 -3.340 10.356 1.00 0.00 N ATOM 391 CA SER A 113 2.240 -2.032 10.597 1.00 0.00 C ATOM 392 C SER A 113 1.370 -0.917 10.085 1.00 0.00 C ATOM 393 O SER A 113 1.151 0.060 10.795 1.00 0.00 O ATOM 394 CB SER A 113 3.675 -1.811 10.152 1.00 0.00 C ATOM 395 OG SER A 113 4.523 -2.662 10.904 1.00 0.00 O ATOM 0 H SER A 113 2.294 -3.961 9.794 1.00 0.00 H new ATOM 0 HA SER A 113 2.244 -1.995 11.686 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.777 -2.022 9.087 1.00 0.00 H new ATOM 0 HB3 SER A 113 3.959 -0.769 10.299 1.00 0.00 H new ATOM 0 HG SER A 113 5.458 -2.419 10.741 1.00 0.00 H new ATOM 401 N LEU A 114 0.825 -1.050 8.860 1.00 0.00 N ATOM 402 CA LEU A 114 -0.103 -0.092 8.308 1.00 0.00 C ATOM 403 C LEU A 114 -1.404 0.051 9.018 1.00 0.00 C ATOM 404 O LEU A 114 -1.967 1.141 8.939 1.00 0.00 O ATOM 405 CB LEU A 114 -0.607 -0.533 6.946 1.00 0.00 C ATOM 406 CG LEU A 114 0.401 -0.324 5.831 1.00 0.00 C ATOM 407 CD1 LEU A 114 -0.208 -0.962 4.585 1.00 0.00 C ATOM 408 CD2 LEU A 114 0.677 1.178 5.707 1.00 0.00 C ATOM 0 H LEU A 114 1.028 -1.833 8.238 1.00 0.00 H new ATOM 0 HA LEU A 114 0.494 0.819 8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -0.874 -1.589 6.991 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -1.518 0.016 6.709 1.00 0.00 H new ATOM 0 HG LEU A 114 1.370 -0.790 6.009 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.475 -0.843 3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.379 -2.023 4.766 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -1.156 -0.476 4.354 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.400 1.350 4.910 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -0.251 1.700 5.474 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.078 1.553 6.648 1.00 0.00 H new ATOM 420 N ILE A 115 -1.945 -1.018 9.669 1.00 0.00 N ATOM 421 CA ILE A 115 -3.170 -0.875 10.400 1.00 0.00 C ATOM 422 C ILE A 115 -2.961 0.100 11.487 1.00 0.00 C ATOM 423 O ILE A 115 -3.782 0.988 11.681 1.00 0.00 O ATOM 424 CB ILE A 115 -3.726 -2.039 11.174 1.00 0.00 C ATOM 425 CG1 ILE A 115 -3.513 -3.430 10.603 1.00 0.00 C ATOM 426 CG2 ILE A 115 -5.200 -1.748 11.243 1.00 0.00 C ATOM 427 CD1 ILE A 115 -4.214 -3.631 9.276 1.00 0.00 C ATOM 0 H ILE A 115 -1.539 -1.954 9.684 1.00 0.00 H new ATOM 0 HA ILE A 115 -3.857 -0.642 9.587 1.00 0.00 H new ATOM 0 HB ILE A 115 -3.197 -2.097 12.125 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -2.445 -3.606 10.475 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -3.875 -4.170 11.316 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -5.703 -2.544 11.792 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -5.360 -0.798 11.753 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -5.607 -1.691 10.234 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -4.027 -4.642 8.915 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -5.286 -3.484 9.405 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -3.834 -2.911 8.551 1.00 0.00 H new ATOM 439 N ARG A 116 -1.848 -0.111 12.208 1.00 0.00 N ATOM 440 CA ARG A 116 -1.405 0.677 13.320 1.00 0.00 C ATOM 441 C ARG A 116 -1.320 2.117 12.931 1.00 0.00 C ATOM 442 O ARG A 116 -1.755 2.956 13.713 1.00 0.00 O ATOM 443 CB ARG A 116 -0.063 0.211 13.930 1.00 0.00 C ATOM 444 CG ARG A 116 0.366 0.935 15.220 1.00 0.00 C ATOM 445 CD ARG A 116 -0.640 0.825 16.370 1.00 0.00 C ATOM 446 NE ARG A 116 -0.094 1.599 17.520 1.00 0.00 N ATOM 447 CZ ARG A 116 -0.860 1.836 18.624 1.00 0.00 C ATOM 448 NH1 ARG A 116 -2.130 1.343 18.701 1.00 0.00 N ATOM 449 NH2 ARG A 116 -0.352 2.570 19.656 1.00 0.00 N ATOM 0 H ARG A 116 -1.214 -0.883 12.002 1.00 0.00 H new ATOM 0 HA ARG A 116 -2.154 0.540 14.100 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -0.130 -0.857 14.139 1.00 0.00 H new ATOM 0 HB3 ARG A 116 0.720 0.341 13.183 1.00 0.00 H new ATOM 0 HG2 ARG A 116 1.322 0.529 15.550 1.00 0.00 H new ATOM 0 HG3 ARG A 116 0.528 1.989 14.994 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -1.611 1.219 16.069 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -0.792 -0.218 16.648 1.00 0.00 H new ATOM 0 HE ARG A 116 0.861 1.955 17.482 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -2.512 0.794 17.931 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -2.698 1.523 19.529 1.00 0.00 H new ATOM 0 HH21 ARG A 116 0.597 2.939 19.600 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -0.921 2.749 20.483 1.00 0.00 H new ATOM 463 N PHE A 117 -0.776 2.426 11.727 1.00 0.00 N ATOM 464 CA PHE A 117 -0.651 3.766 11.228 1.00 0.00 C ATOM 465 C PHE A 117 -1.977 4.459 11.101 1.00 0.00 C ATOM 466 O PHE A 117 -2.155 5.562 11.599 1.00 0.00 O ATOM 467 CB PHE A 117 -0.003 3.731 9.847 1.00 0.00 C ATOM 468 CG PHE A 117 1.358 3.137 9.891 1.00 0.00 C ATOM 469 CD1 PHE A 117 2.098 2.765 10.997 1.00 0.00 C ATOM 470 CD2 PHE A 117 1.891 2.969 8.651 1.00 0.00 C ATOM 471 CE1 PHE A 117 3.386 2.289 10.841 1.00 0.00 C ATOM 472 CE2 PHE A 117 3.162 2.471 8.471 1.00 0.00 C ATOM 473 CZ PHE A 117 3.925 2.153 9.577 1.00 0.00 C ATOM 0 H PHE A 117 -0.414 1.720 11.086 1.00 0.00 H new ATOM 0 HA PHE A 117 -0.042 4.318 11.944 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.629 3.155 9.166 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.055 4.743 9.447 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.669 2.846 11.985 1.00 0.00 H new ATOM 0 HD2 PHE A 117 1.302 3.233 7.785 1.00 0.00 H new ATOM 0 HE1 PHE A 117 3.972 2.023 11.709 1.00 0.00 H new ATOM 0 HE2 PHE A 117 3.558 2.331 7.476 1.00 0.00 H new ATOM 0 HZ PHE A 117 4.938 1.800 9.454 1.00 0.00 H new ATOM 483 N LEU A 118 -2.939 3.811 10.424 1.00 0.00 N ATOM 484 CA LEU A 118 -4.282 4.289 10.167 1.00 0.00 C ATOM 485 C LEU A 118 -5.182 4.301 11.376 1.00 0.00 C ATOM 486 O LEU A 118 -6.206 4.982 11.382 1.00 0.00 O ATOM 487 CB LEU A 118 -4.900 3.377 9.152 1.00 0.00 C ATOM 488 CG LEU A 118 -4.264 3.783 7.835 1.00 0.00 C ATOM 489 CD1 LEU A 118 -3.855 2.618 6.989 1.00 0.00 C ATOM 490 CD2 LEU A 118 -5.207 4.656 7.061 1.00 0.00 C ATOM 0 H LEU A 118 -2.777 2.887 10.024 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.190 5.322 9.832 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -4.698 2.331 9.384 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -5.983 3.494 9.122 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.354 4.328 8.086 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.408 2.980 6.063 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.128 2.012 7.530 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.731 2.012 6.756 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -4.744 4.944 6.117 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -6.129 4.109 6.862 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -5.434 5.550 7.641 1.00 0.00 H new ATOM 502 N GLU A 119 -4.817 3.521 12.419 1.00 0.00 N ATOM 503 CA GLU A 119 -5.431 3.509 13.723 1.00 0.00 C ATOM 504 C GLU A 119 -5.057 4.741 14.478 1.00 0.00 C ATOM 505 O GLU A 119 -5.877 5.272 15.228 1.00 0.00 O ATOM 506 CB GLU A 119 -4.994 2.347 14.628 1.00 0.00 C ATOM 507 CG GLU A 119 -5.747 1.042 14.380 1.00 0.00 C ATOM 508 CD GLU A 119 -5.076 -0.040 15.210 1.00 0.00 C ATOM 509 OE1 GLU A 119 -5.032 0.110 16.461 1.00 0.00 O ATOM 510 OE2 GLU A 119 -4.589 -1.034 14.606 1.00 0.00 O ATOM 0 H GLU A 119 -4.046 2.858 12.348 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.497 3.423 13.512 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -3.928 2.171 14.485 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -5.132 2.640 15.669 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -6.795 1.145 14.661 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -5.725 0.782 13.322 1.00 0.00 H new ATOM 517 N GLU A 120 -3.802 5.229 14.284 1.00 0.00 N ATOM 518 CA GLU A 120 -3.391 6.527 14.761 1.00 0.00 C ATOM 519 C GLU A 120 -4.106 7.610 13.998 1.00 0.00 C ATOM 520 O GLU A 120 -4.249 8.732 14.484 1.00 0.00 O ATOM 521 CB GLU A 120 -1.888 6.863 14.605 1.00 0.00 C ATOM 522 CG GLU A 120 -0.912 5.798 15.118 1.00 0.00 C ATOM 523 CD GLU A 120 0.508 6.357 15.134 1.00 0.00 C ATOM 524 OE1 GLU A 120 0.702 7.531 14.721 1.00 0.00 O ATOM 525 OE2 GLU A 120 1.423 5.602 15.557 1.00 0.00 O ATOM 0 H GLU A 120 -3.069 4.717 13.792 1.00 0.00 H new ATOM 0 HA GLU A 120 -3.630 6.485 15.824 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -1.682 7.040 13.549 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.687 7.797 15.130 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -1.199 5.483 16.121 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -0.957 4.915 14.481 1.00 0.00 H new ATOM 532 N GLY A 121 -4.556 7.272 12.771 1.00 0.00 N ATOM 533 CA GLY A 121 -5.177 8.147 11.839 1.00 0.00 C ATOM 534 C GLY A 121 -4.065 8.807 11.148 1.00 0.00 C ATOM 535 O GLY A 121 -3.822 9.996 11.343 1.00 0.00 O ATOM 0 H GLY A 121 -4.476 6.320 12.415 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -5.807 7.598 11.140 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -5.816 8.872 12.342 1.00 0.00 H new ATOM 539 N ASP A 122 -3.343 8.015 10.334 1.00 0.00 N ATOM 540 CA ASP A 122 -2.327 8.584 9.531 1.00 0.00 C ATOM 541 C ASP A 122 -2.732 8.176 8.191 1.00 0.00 C ATOM 542 O ASP A 122 -3.568 7.297 7.995 1.00 0.00 O ATOM 543 CB ASP A 122 -0.897 8.080 9.743 1.00 0.00 C ATOM 544 CG ASP A 122 -0.511 8.181 11.214 1.00 0.00 C ATOM 545 OD1 ASP A 122 -0.863 9.203 11.857 1.00 0.00 O ATOM 546 OD2 ASP A 122 0.150 7.236 11.719 1.00 0.00 O ATOM 0 H ASP A 122 -3.464 7.007 10.238 1.00 0.00 H new ATOM 0 HA ASP A 122 -2.262 9.649 9.755 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -0.816 7.045 9.409 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -0.205 8.665 9.138 1.00 0.00 H new ATOM 551 N LYS A 123 -2.105 8.853 7.245 1.00 0.00 N ATOM 552 CA LYS A 123 -2.283 8.630 5.870 1.00 0.00 C ATOM 553 C LYS A 123 -1.057 7.851 5.608 1.00 0.00 C ATOM 554 O LYS A 123 0.055 8.365 5.658 1.00 0.00 O ATOM 555 CB LYS A 123 -2.427 9.992 5.174 1.00 0.00 C ATOM 556 CG LYS A 123 -2.457 10.020 3.652 1.00 0.00 C ATOM 557 CD LYS A 123 -1.069 10.302 3.090 1.00 0.00 C ATOM 558 CE LYS A 123 -0.491 9.130 2.326 1.00 0.00 C ATOM 559 NZ LYS A 123 0.334 9.641 1.217 1.00 0.00 N ATOM 0 H LYS A 123 -1.437 9.597 7.450 1.00 0.00 H new ATOM 0 HA LYS A 123 -3.167 8.101 5.513 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -3.346 10.455 5.534 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -1.602 10.623 5.503 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -2.821 9.065 3.273 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -3.155 10.785 3.311 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -1.119 11.169 2.431 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -0.398 10.562 3.908 1.00 0.00 H new ATOM 0 HE2 LYS A 123 0.112 8.509 2.989 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -1.292 8.500 1.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 0.722 8.842 0.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -0.252 10.231 0.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 1.115 10.211 1.600 1.00 0.00 H new ATOM 573 N ALA A 124 -1.242 6.546 5.391 1.00 0.00 N ATOM 574 CA ALA A 124 -0.119 5.694 5.243 1.00 0.00 C ATOM 575 C ALA A 124 0.098 5.488 3.804 1.00 0.00 C ATOM 576 O ALA A 124 -0.781 5.027 3.098 1.00 0.00 O ATOM 577 CB ALA A 124 -0.319 4.316 5.803 1.00 0.00 C ATOM 0 H ALA A 124 -2.151 6.088 5.319 1.00 0.00 H new ATOM 0 HA ALA A 124 0.702 6.177 5.773 1.00 0.00 H new ATOM 0 HB1 ALA A 124 0.585 3.726 5.650 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -0.532 4.384 6.870 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.156 3.835 5.296 1.00 0.00 H new ATOM 583 N LYS A 125 1.280 5.829 3.328 1.00 0.00 N ATOM 584 CA LYS A 125 1.537 5.795 1.923 1.00 0.00 C ATOM 585 C LYS A 125 2.180 4.491 1.627 1.00 0.00 C ATOM 586 O LYS A 125 3.238 4.173 2.157 1.00 0.00 O ATOM 587 CB LYS A 125 2.554 6.916 1.605 1.00 0.00 C ATOM 588 CG LYS A 125 2.955 7.095 0.138 1.00 0.00 C ATOM 589 CD LYS A 125 4.050 8.161 -0.048 1.00 0.00 C ATOM 590 CE LYS A 125 3.576 9.599 0.170 1.00 0.00 C ATOM 591 NZ LYS A 125 4.681 10.544 -0.095 1.00 0.00 N ATOM 0 H LYS A 125 2.068 6.130 3.901 1.00 0.00 H new ATOM 0 HA LYS A 125 0.623 5.926 1.343 1.00 0.00 H new ATOM 0 HB2 LYS A 125 2.140 7.860 1.961 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.459 6.727 2.183 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.309 6.143 -0.257 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.077 7.375 -0.444 1.00 0.00 H new ATOM 0 HD2 LYS A 125 4.865 7.951 0.644 1.00 0.00 H new ATOM 0 HD3 LYS A 125 4.457 8.074 -1.055 1.00 0.00 H new ATOM 0 HE2 LYS A 125 2.735 9.817 -0.489 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.220 9.722 1.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.349 11.518 0.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.471 10.344 0.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.002 10.436 -1.078 1.00 0.00 H new ATOM 605 N ILE A 126 1.566 3.702 0.735 1.00 0.00 N ATOM 606 CA ILE A 126 2.178 2.504 0.286 1.00 0.00 C ATOM 607 C ILE A 126 3.101 2.897 -0.807 1.00 0.00 C ATOM 608 O ILE A 126 2.727 3.627 -1.717 1.00 0.00 O ATOM 609 CB ILE A 126 1.197 1.538 -0.304 1.00 0.00 C ATOM 610 CG1 ILE A 126 -0.092 1.399 0.526 1.00 0.00 C ATOM 611 CG2 ILE A 126 1.926 0.209 -0.449 1.00 0.00 C ATOM 612 CD1 ILE A 126 0.116 1.258 2.027 1.00 0.00 C ATOM 0 H ILE A 126 0.651 3.895 0.328 1.00 0.00 H new ATOM 0 HA ILE A 126 2.662 2.020 1.134 1.00 0.00 H new ATOM 0 HB ILE A 126 0.855 1.905 -1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.719 2.272 0.343 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.643 0.529 0.168 1.00 0.00 H new ATOM 0 HG21 ILE A 126 1.250 -0.532 -0.877 1.00 0.00 H new ATOM 0 HG22 ILE A 126 2.787 0.336 -1.105 1.00 0.00 H new ATOM 0 HG23 ILE A 126 2.263 -0.130 0.531 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.851 1.167 2.521 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.713 0.369 2.230 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.636 2.138 2.407 1.00 0.00 H new ATOM 624 N THR A 127 4.342 2.405 -0.739 1.00 0.00 N ATOM 625 CA THR A 127 5.217 2.510 -1.857 1.00 0.00 C ATOM 626 C THR A 127 5.480 1.103 -2.248 1.00 0.00 C ATOM 627 O THR A 127 6.063 0.307 -1.516 1.00 0.00 O ATOM 628 CB THR A 127 6.510 3.183 -1.558 1.00 0.00 C ATOM 629 OG1 THR A 127 6.292 4.418 -0.895 1.00 0.00 O ATOM 630 CG2 THR A 127 7.290 3.389 -2.867 1.00 0.00 C ATOM 0 H THR A 127 4.738 1.940 0.078 1.00 0.00 H new ATOM 0 HA THR A 127 4.754 3.121 -2.632 1.00 0.00 H new ATOM 0 HB THR A 127 7.098 2.553 -0.891 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.154 4.844 -0.706 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.238 3.882 -2.652 1.00 0.00 H new ATOM 0 HG22 THR A 127 7.481 2.422 -3.333 1.00 0.00 H new ATOM 0 HG23 THR A 127 6.704 4.009 -3.546 1.00 0.00 H new ATOM 638 N LEU A 128 5.042 0.782 -3.459 1.00 0.00 N ATOM 639 CA LEU A 128 5.409 -0.454 -4.078 1.00 0.00 C ATOM 640 C LEU A 128 6.793 -0.294 -4.594 1.00 0.00 C ATOM 641 O LEU A 128 7.188 0.811 -4.944 1.00 0.00 O ATOM 642 CB LEU A 128 4.507 -0.774 -5.253 1.00 0.00 C ATOM 643 CG LEU A 128 4.608 -2.169 -5.837 1.00 0.00 C ATOM 644 CD1 LEU A 128 4.492 -3.378 -4.887 1.00 0.00 C ATOM 645 CD2 LEU A 128 3.518 -2.135 -6.878 1.00 0.00 C ATOM 0 H LEU A 128 4.430 1.373 -4.022 1.00 0.00 H new ATOM 0 HA LEU A 128 5.325 -1.259 -3.348 1.00 0.00 H new ATOM 0 HB2 LEU A 128 3.475 -0.610 -4.942 1.00 0.00 H new ATOM 0 HB3 LEU A 128 4.718 -0.058 -6.047 1.00 0.00 H new ATOM 0 HG LEU A 128 5.619 -2.355 -6.200 1.00 0.00 H new ATOM 0 HD11 LEU A 128 4.585 -4.301 -5.460 1.00 0.00 H new ATOM 0 HD12 LEU A 128 5.286 -3.332 -4.141 1.00 0.00 H new ATOM 0 HD13 LEU A 128 3.523 -3.357 -4.388 1.00 0.00 H new ATOM 0 HD21 LEU A 128 3.474 -3.096 -7.390 1.00 0.00 H new ATOM 0 HD22 LEU A 128 2.561 -1.937 -6.396 1.00 0.00 H new ATOM 0 HD23 LEU A 128 3.730 -1.348 -7.601 1.00 0.00 H new ATOM 657 N ARG A 129 7.545 -1.401 -4.675 1.00 0.00 N ATOM 658 CA ARG A 129 8.900 -1.450 -5.050 1.00 0.00 C ATOM 659 C ARG A 129 8.950 -2.792 -5.660 1.00 0.00 C ATOM 660 O ARG A 129 9.061 -3.824 -4.999 1.00 0.00 O ATOM 661 CB ARG A 129 9.896 -1.370 -3.899 1.00 0.00 C ATOM 662 CG ARG A 129 11.334 -1.443 -4.426 1.00 0.00 C ATOM 663 CD ARG A 129 12.376 -1.036 -3.385 1.00 0.00 C ATOM 664 NE ARG A 129 12.284 -2.002 -2.252 1.00 0.00 N ATOM 665 CZ ARG A 129 13.004 -1.812 -1.108 1.00 0.00 C ATOM 666 NH1 ARG A 129 13.833 -0.734 -0.985 1.00 0.00 N ATOM 667 NH2 ARG A 129 12.883 -2.697 -0.076 1.00 0.00 N ATOM 0 H ARG A 129 7.167 -2.324 -4.460 1.00 0.00 H new ATOM 0 HA ARG A 129 9.184 -0.604 -5.676 1.00 0.00 H new ATOM 0 HB2 ARG A 129 9.751 -0.440 -3.349 1.00 0.00 H new ATOM 0 HB3 ARG A 129 9.717 -2.186 -3.199 1.00 0.00 H new ATOM 0 HG2 ARG A 129 11.541 -2.460 -4.760 1.00 0.00 H new ATOM 0 HG3 ARG A 129 11.428 -0.796 -5.298 1.00 0.00 H new ATOM 0 HD2 ARG A 129 13.376 -1.049 -3.819 1.00 0.00 H new ATOM 0 HD3 ARG A 129 12.193 -0.019 -3.037 1.00 0.00 H new ATOM 0 HE ARG A 129 11.675 -2.816 -2.333 1.00 0.00 H new ATOM 0 HH11 ARG A 129 13.917 -0.065 -1.751 1.00 0.00 H new ATOM 0 HH12 ARG A 129 14.368 -0.598 -0.128 1.00 0.00 H new ATOM 0 HH21 ARG A 129 12.256 -3.497 -0.161 1.00 0.00 H new ATOM 0 HH22 ARG A 129 13.419 -2.558 0.780 1.00 0.00 H new ATOM 681 N PHE A 130 8.824 -2.737 -6.979 1.00 0.00 N ATOM 682 CA PHE A 130 8.812 -3.828 -7.900 1.00 0.00 C ATOM 683 C PHE A 130 10.192 -4.387 -8.038 1.00 0.00 C ATOM 684 O PHE A 130 11.185 -3.673 -7.901 1.00 0.00 O ATOM 685 CB PHE A 130 8.501 -3.248 -9.231 1.00 0.00 C ATOM 686 CG PHE A 130 7.090 -2.911 -9.276 1.00 0.00 C ATOM 687 CD1 PHE A 130 6.214 -3.889 -9.686 1.00 0.00 C ATOM 688 CD2 PHE A 130 6.686 -1.611 -9.064 1.00 0.00 C ATOM 689 CE1 PHE A 130 4.934 -3.530 -10.029 1.00 0.00 C ATOM 690 CE2 PHE A 130 5.378 -1.284 -9.322 1.00 0.00 C ATOM 691 CZ PHE A 130 4.514 -2.234 -9.842 1.00 0.00 C ATOM 0 H PHE A 130 8.719 -1.842 -7.457 1.00 0.00 H new ATOM 0 HA PHE A 130 8.108 -4.590 -7.565 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.107 -2.359 -9.406 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.744 -3.960 -10.019 1.00 0.00 H new ATOM 0 HD1 PHE A 130 6.528 -4.921 -9.737 1.00 0.00 H new ATOM 0 HD2 PHE A 130 7.381 -0.867 -8.704 1.00 0.00 H new ATOM 0 HE1 PHE A 130 4.259 -4.263 -10.445 1.00 0.00 H new ATOM 0 HE2 PHE A 130 5.022 -0.285 -9.119 1.00 0.00 H new ATOM 0 HZ PHE A 130 3.504 -1.955 -10.102 1.00 0.00 H new ATOM 849 N ILE A 140 2.372 -7.418 -10.830 1.00 0.00 N ATOM 850 CA ILE A 140 3.263 -7.418 -9.719 1.00 0.00 C ATOM 851 C ILE A 140 2.778 -6.478 -8.679 1.00 0.00 C ATOM 852 O ILE A 140 2.805 -6.795 -7.490 1.00 0.00 O ATOM 853 CB ILE A 140 4.685 -7.277 -10.175 1.00 0.00 C ATOM 854 CG1 ILE A 140 5.032 -8.612 -10.866 1.00 0.00 C ATOM 855 CG2 ILE A 140 5.554 -7.080 -8.934 1.00 0.00 C ATOM 856 CD1 ILE A 140 6.454 -8.610 -11.398 1.00 0.00 C ATOM 0 HA ILE A 140 3.269 -8.383 -9.211 1.00 0.00 H new ATOM 0 HB ILE A 140 4.841 -6.437 -10.851 1.00 0.00 H new ATOM 0 HG12 ILE A 140 4.908 -9.432 -10.159 1.00 0.00 H new ATOM 0 HG13 ILE A 140 4.336 -8.790 -11.686 1.00 0.00 H new ATOM 0 HG21 ILE A 140 6.597 -6.974 -9.233 1.00 0.00 H new ATOM 0 HG22 ILE A 140 5.235 -6.182 -8.405 1.00 0.00 H new ATOM 0 HG23 ILE A 140 5.451 -7.944 -8.277 1.00 0.00 H new ATOM 0 HD11 ILE A 140 6.664 -9.566 -11.878 1.00 0.00 H new ATOM 0 HD12 ILE A 140 6.570 -7.806 -12.124 1.00 0.00 H new ATOM 0 HD13 ILE A 140 7.151 -8.457 -10.574 1.00 0.00 H new ATOM 868 N GLY A 141 2.315 -5.306 -9.129 1.00 0.00 N ATOM 869 CA GLY A 141 1.797 -4.338 -8.247 1.00 0.00 C ATOM 870 C GLY A 141 0.487 -4.654 -7.672 1.00 0.00 C ATOM 871 O GLY A 141 0.358 -4.689 -6.454 1.00 0.00 O ATOM 0 H GLY A 141 2.303 -5.034 -10.112 1.00 0.00 H new ATOM 0 HA2 GLY A 141 2.508 -4.194 -7.433 1.00 0.00 H new ATOM 0 HA3 GLY A 141 1.723 -3.389 -8.778 1.00 0.00 H new ATOM 875 N MET A 142 -0.523 -4.822 -8.533 1.00 0.00 N ATOM 876 CA MET A 142 -1.864 -4.728 -8.099 1.00 0.00 C ATOM 877 C MET A 142 -2.407 -6.033 -7.588 1.00 0.00 C ATOM 878 O MET A 142 -3.568 -6.073 -7.202 1.00 0.00 O ATOM 879 CB MET A 142 -2.746 -4.065 -9.164 1.00 0.00 C ATOM 880 CG MET A 142 -3.442 -5.022 -10.120 1.00 0.00 C ATOM 881 SD MET A 142 -4.425 -4.185 -11.396 1.00 0.00 S ATOM 882 CE MET A 142 -4.966 -5.734 -12.172 1.00 0.00 C ATOM 0 H MET A 142 -0.407 -5.022 -9.526 1.00 0.00 H new ATOM 0 HA MET A 142 -1.881 -4.069 -7.231 1.00 0.00 H new ATOM 0 HB2 MET A 142 -3.504 -3.464 -8.662 1.00 0.00 H new ATOM 0 HB3 MET A 142 -2.130 -3.379 -9.746 1.00 0.00 H new ATOM 0 HG2 MET A 142 -2.693 -5.649 -10.603 1.00 0.00 H new ATOM 0 HG3 MET A 142 -4.092 -5.685 -9.549 1.00 0.00 H new ATOM 0 HE1 MET A 142 -5.611 -5.509 -13.021 1.00 0.00 H new ATOM 0 HE2 MET A 142 -4.095 -6.292 -12.515 1.00 0.00 H new ATOM 0 HE3 MET A 142 -5.517 -6.332 -11.446 1.00 0.00 H new ATOM 892 N GLU A 143 -1.636 -7.141 -7.555 1.00 0.00 N ATOM 893 CA GLU A 143 -1.909 -8.037 -6.465 1.00 0.00 C ATOM 894 C GLU A 143 -1.747 -7.457 -5.134 1.00 0.00 C ATOM 895 O GLU A 143 -2.693 -7.491 -4.357 1.00 0.00 O ATOM 896 CB GLU A 143 -1.145 -9.376 -6.391 1.00 0.00 C ATOM 897 CG GLU A 143 -1.957 -10.530 -5.782 1.00 0.00 C ATOM 898 CD GLU A 143 -2.763 -11.249 -6.848 1.00 0.00 C ATOM 899 OE1 GLU A 143 -3.681 -10.616 -7.436 1.00 0.00 O ATOM 900 OE2 GLU A 143 -2.473 -12.451 -7.089 1.00 0.00 O ATOM 0 H GLU A 143 -0.897 -7.402 -8.208 1.00 0.00 H new ATOM 0 HA GLU A 143 -2.948 -8.237 -6.727 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -0.830 -9.658 -7.396 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -0.239 -9.233 -5.802 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -1.284 -11.234 -5.293 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -2.627 -10.143 -5.014 1.00 0.00 H new ATOM 907 N VAL A 144 -0.518 -7.017 -4.854 1.00 0.00 N ATOM 908 CA VAL A 144 -0.045 -6.716 -3.553 1.00 0.00 C ATOM 909 C VAL A 144 -0.791 -5.596 -3.016 1.00 0.00 C ATOM 910 O VAL A 144 -1.520 -5.801 -2.065 1.00 0.00 O ATOM 911 CB VAL A 144 1.424 -6.530 -3.550 1.00 0.00 C ATOM 912 CG1 VAL A 144 1.874 -6.356 -2.098 1.00 0.00 C ATOM 913 CG2 VAL A 144 1.856 -7.881 -4.118 1.00 0.00 C ATOM 0 H VAL A 144 0.184 -6.863 -5.577 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.221 -7.558 -2.883 1.00 0.00 H new ATOM 0 HB VAL A 144 1.820 -5.675 -4.099 1.00 0.00 H new ATOM 0 HG11 VAL A 144 2.955 -6.217 -2.066 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.383 -5.484 -1.667 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.605 -7.244 -1.525 1.00 0.00 H new ATOM 0 HG21 VAL A 144 2.943 -7.916 -4.186 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.507 -8.679 -3.463 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.426 -8.012 -5.111 1.00 0.00 H new ATOM 923 N LEU A 145 -0.641 -4.435 -3.644 1.00 0.00 N ATOM 924 CA LEU A 145 -1.269 -3.180 -3.351 1.00 0.00 C ATOM 925 C LEU A 145 -2.729 -3.285 -3.081 1.00 0.00 C ATOM 926 O LEU A 145 -3.217 -2.845 -2.050 1.00 0.00 O ATOM 927 CB LEU A 145 -1.080 -2.267 -4.549 1.00 0.00 C ATOM 928 CG LEU A 145 0.354 -1.780 -4.729 1.00 0.00 C ATOM 929 CD1 LEU A 145 0.389 -0.834 -5.937 1.00 0.00 C ATOM 930 CD2 LEU A 145 0.845 -1.168 -3.415 1.00 0.00 C ATOM 0 H LEU A 145 -0.014 -4.357 -4.445 1.00 0.00 H new ATOM 0 HA LEU A 145 -0.802 -2.795 -2.444 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -1.390 -2.796 -5.450 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -1.737 -1.404 -4.444 1.00 0.00 H new ATOM 0 HG LEU A 145 1.048 -2.591 -4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 145 1.406 -0.472 -6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 145 0.060 -1.369 -6.828 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -0.274 0.012 -5.756 1.00 0.00 H new ATOM 0 HD21 LEU A 145 1.870 -0.818 -3.537 1.00 0.00 H new ATOM 0 HD22 LEU A 145 0.205 -0.329 -3.143 1.00 0.00 H new ATOM 0 HD23 LEU A 145 0.810 -1.921 -2.628 1.00 0.00 H new ATOM 942 N ASN A 146 -3.458 -3.884 -4.012 1.00 0.00 N ATOM 943 CA ASN A 146 -4.867 -4.190 -3.884 1.00 0.00 C ATOM 944 C ASN A 146 -5.274 -5.135 -2.841 1.00 0.00 C ATOM 945 O ASN A 146 -6.383 -5.022 -2.338 1.00 0.00 O ATOM 946 CB ASN A 146 -5.201 -4.829 -5.158 1.00 0.00 C ATOM 947 CG ASN A 146 -6.394 -4.468 -6.026 1.00 0.00 C ATOM 948 OD1 ASN A 146 -7.116 -3.477 -5.894 1.00 0.00 O ATOM 949 ND2 ASN A 146 -6.535 -5.421 -7.007 1.00 0.00 N ATOM 0 H ASN A 146 -3.067 -4.179 -4.907 1.00 0.00 H new ATOM 0 HA ASN A 146 -5.367 -3.258 -3.620 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -4.322 -4.711 -5.792 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -5.298 -5.893 -4.943 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -7.282 -5.337 -7.697 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -5.893 -6.212 -7.045 1.00 0.00 H new ATOM 956 N ARG A 147 -4.417 -6.107 -2.501 1.00 0.00 N ATOM 957 CA ARG A 147 -4.696 -6.964 -1.408 1.00 0.00 C ATOM 958 C ARG A 147 -4.339 -6.299 -0.124 1.00 0.00 C ATOM 959 O ARG A 147 -4.740 -6.780 0.933 1.00 0.00 O ATOM 960 CB ARG A 147 -3.909 -8.239 -1.643 1.00 0.00 C ATOM 961 CG ARG A 147 -3.794 -9.285 -0.553 1.00 0.00 C ATOM 962 CD ARG A 147 -3.579 -10.692 -1.111 1.00 0.00 C ATOM 963 NE ARG A 147 -2.279 -10.654 -1.842 1.00 0.00 N ATOM 964 CZ ARG A 147 -1.606 -11.793 -2.179 1.00 0.00 C ATOM 965 NH1 ARG A 147 -2.188 -13.015 -2.023 1.00 0.00 N ATOM 966 NH2 ARG A 147 -0.338 -11.699 -2.679 1.00 0.00 N ATOM 0 H ARG A 147 -3.537 -6.296 -2.982 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.758 -7.198 -1.336 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -4.344 -8.729 -2.514 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.895 -7.945 -1.915 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -2.965 -9.028 0.106 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -4.699 -9.273 0.054 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -3.553 -11.429 -0.309 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -4.393 -10.975 -1.778 1.00 0.00 H new ATOM 0 HE ARG A 147 -1.881 -9.750 -2.098 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -3.135 -13.085 -1.651 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -1.676 -13.860 -2.278 1.00 0.00 H new ATOM 0 HH21 ARG A 147 0.097 -10.784 -2.797 1.00 0.00 H new ATOM 0 HH22 ARG A 147 0.174 -12.544 -2.934 1.00 0.00 H new ATOM 980 N VAL A 148 -3.556 -5.190 -0.164 1.00 0.00 N ATOM 981 CA VAL A 148 -3.298 -4.483 1.020 1.00 0.00 C ATOM 982 C VAL A 148 -4.531 -3.710 1.308 1.00 0.00 C ATOM 983 O VAL A 148 -4.929 -3.715 2.463 1.00 0.00 O ATOM 984 CB VAL A 148 -2.197 -3.491 1.027 1.00 0.00 C ATOM 985 CG1 VAL A 148 -1.750 -3.358 2.479 1.00 0.00 C ATOM 986 CG2 VAL A 148 -1.017 -3.926 0.193 1.00 0.00 C ATOM 0 H VAL A 148 -3.122 -4.809 -1.005 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.995 -5.246 1.737 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.555 -2.553 0.602 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -0.936 -2.636 2.544 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -2.587 -3.017 3.088 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.407 -4.326 2.844 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -0.241 -3.162 0.234 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -0.623 -4.865 0.582 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.334 -4.066 -0.841 1.00 0.00 H new ATOM 996 N LYS A 149 -5.138 -3.030 0.288 1.00 0.00 N ATOM 997 CA LYS A 149 -6.389 -2.356 0.392 1.00 0.00 C ATOM 998 C LYS A 149 -7.434 -3.252 0.885 1.00 0.00 C ATOM 999 O LYS A 149 -8.158 -2.834 1.762 1.00 0.00 O ATOM 1000 CB LYS A 149 -6.973 -1.937 -0.959 1.00 0.00 C ATOM 1001 CG LYS A 149 -8.385 -1.346 -0.895 1.00 0.00 C ATOM 1002 CD LYS A 149 -8.944 -0.705 -2.168 1.00 0.00 C ATOM 1003 CE LYS A 149 -8.437 0.609 -2.727 1.00 0.00 C ATOM 1004 NZ LYS A 149 -9.035 0.867 -4.052 1.00 0.00 N ATOM 0 H LYS A 149 -4.724 -2.958 -0.641 1.00 0.00 H new ATOM 0 HA LYS A 149 -6.161 -1.508 1.038 1.00 0.00 H new ATOM 0 HB2 LYS A 149 -6.308 -1.203 -1.414 1.00 0.00 H new ATOM 0 HB3 LYS A 149 -6.988 -2.806 -1.617 1.00 0.00 H new ATOM 0 HG2 LYS A 149 -9.068 -2.139 -0.591 1.00 0.00 H new ATOM 0 HG3 LYS A 149 -8.399 -0.594 -0.106 1.00 0.00 H new ATOM 0 HD2 LYS A 149 -8.828 -1.443 -2.962 1.00 0.00 H new ATOM 0 HD3 LYS A 149 -10.014 -0.578 -2.005 1.00 0.00 H new ATOM 0 HE2 LYS A 149 -8.684 1.422 -2.044 1.00 0.00 H new ATOM 0 HE3 LYS A 149 -7.350 0.582 -2.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -8.679 1.771 -4.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 -8.778 0.099 -4.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 -10.070 0.913 -3.963 1.00 0.00 H new ATOM 1018 N ASP A 150 -7.604 -4.440 0.271 1.00 0.00 N ATOM 1019 CA ASP A 150 -8.677 -5.323 0.485 1.00 0.00 C ATOM 1020 C ASP A 150 -8.548 -5.913 1.832 1.00 0.00 C ATOM 1021 O ASP A 150 -9.561 -6.053 2.518 1.00 0.00 O ATOM 1022 CB ASP A 150 -8.638 -6.445 -0.538 1.00 0.00 C ATOM 1023 CG ASP A 150 -9.222 -6.010 -1.879 1.00 0.00 C ATOM 1024 OD1 ASP A 150 -9.636 -4.829 -2.014 1.00 0.00 O ATOM 1025 OD2 ASP A 150 -9.253 -6.871 -2.799 1.00 0.00 O ATOM 0 H ASP A 150 -6.939 -4.792 -0.418 1.00 0.00 H new ATOM 0 HA ASP A 150 -9.615 -4.776 0.392 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -7.608 -6.772 -0.679 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -9.196 -7.302 -0.159 1.00 0.00 H new ATOM 1030 N ASP A 151 -7.308 -6.260 2.251 1.00 0.00 N ATOM 1031 CA ASP A 151 -7.190 -6.676 3.626 1.00 0.00 C ATOM 1032 C ASP A 151 -7.258 -5.552 4.652 1.00 0.00 C ATOM 1033 O ASP A 151 -7.601 -5.813 5.805 1.00 0.00 O ATOM 1034 CB ASP A 151 -5.954 -7.562 3.818 1.00 0.00 C ATOM 1035 CG ASP A 151 -6.019 -8.335 5.128 1.00 0.00 C ATOM 1036 OD1 ASP A 151 -7.001 -9.103 5.315 1.00 0.00 O ATOM 1037 OD2 ASP A 151 -5.082 -8.180 5.955 1.00 0.00 O ATOM 0 H ASP A 151 -6.453 -6.257 1.694 1.00 0.00 H new ATOM 0 HA ASP A 151 -8.084 -7.266 3.830 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -5.873 -8.261 2.986 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -5.056 -6.944 3.803 1.00 0.00 H new ATOM 1042 N LEU A 152 -6.948 -4.284 4.282 1.00 0.00 N ATOM 1043 CA LEU A 152 -7.005 -3.168 5.176 1.00 0.00 C ATOM 1044 C LEU A 152 -8.378 -2.643 5.313 1.00 0.00 C ATOM 1045 O LEU A 152 -8.688 -2.179 6.402 1.00 0.00 O ATOM 1046 CB LEU A 152 -6.280 -1.891 4.719 1.00 0.00 C ATOM 1047 CG LEU A 152 -5.194 -1.351 5.677 1.00 0.00 C ATOM 1048 CD1 LEU A 152 -5.608 -1.281 7.167 1.00 0.00 C ATOM 1049 CD2 LEU A 152 -3.897 -2.107 5.407 1.00 0.00 C ATOM 0 H LEU A 152 -6.652 -4.036 3.338 1.00 0.00 H new ATOM 0 HA LEU A 152 -6.555 -3.605 6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -5.819 -2.085 3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -7.024 -1.109 4.567 1.00 0.00 H new ATOM 0 HG LEU A 152 -5.036 -0.295 5.458 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -4.779 -0.890 7.757 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -6.471 -0.624 7.274 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -5.865 -2.279 7.520 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -3.117 -1.740 6.074 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -4.053 -3.171 5.582 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -3.593 -1.950 4.372 1.00 0.00 H new ATOM 1061 N GLN A 153 -9.173 -2.653 4.200 1.00 0.00 N ATOM 1062 CA GLN A 153 -10.443 -2.070 3.833 1.00 0.00 C ATOM 1063 C GLN A 153 -11.440 -1.787 4.892 1.00 0.00 C ATOM 1064 O GLN A 153 -12.226 -0.847 4.801 1.00 0.00 O ATOM 1065 CB GLN A 153 -11.118 -2.991 2.824 1.00 0.00 C ATOM 1066 CG GLN A 153 -11.786 -2.214 1.698 1.00 0.00 C ATOM 1067 CD GLN A 153 -12.205 -3.188 0.600 1.00 0.00 C ATOM 1068 OE1 GLN A 153 -11.796 -3.048 -0.560 1.00 0.00 O ATOM 1069 NE2 GLN A 153 -13.040 -4.198 0.987 1.00 0.00 N ATOM 0 H GLN A 153 -8.835 -3.189 3.401 1.00 0.00 H new ATOM 0 HA GLN A 153 -10.157 -1.085 3.463 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -10.378 -3.673 2.404 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -11.863 -3.603 3.333 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -12.656 -1.677 2.076 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -11.100 -1.468 1.297 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -13.345 -4.264 1.958 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -13.358 -4.886 0.305 1.00 0.00 H new ATOM 1078 N GLU A 154 -11.388 -2.655 5.899 1.00 0.00 N ATOM 1079 CA GLU A 154 -12.083 -2.622 7.155 1.00 0.00 C ATOM 1080 C GLU A 154 -11.952 -1.326 7.893 1.00 0.00 C ATOM 1081 O GLU A 154 -12.901 -0.785 8.458 1.00 0.00 O ATOM 1082 CB GLU A 154 -11.486 -3.667 8.115 1.00 0.00 C ATOM 1083 CG GLU A 154 -10.961 -4.906 7.386 1.00 0.00 C ATOM 1084 CD GLU A 154 -10.504 -5.922 8.420 1.00 0.00 C ATOM 1085 OE1 GLU A 154 -9.574 -5.591 9.204 1.00 0.00 O ATOM 1086 OE2 GLU A 154 -11.074 -7.045 8.439 1.00 0.00 O ATOM 0 H GLU A 154 -10.792 -3.480 5.834 1.00 0.00 H new ATOM 0 HA GLU A 154 -13.126 -2.800 6.892 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -10.673 -3.212 8.681 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -12.246 -3.969 8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -11.741 -5.333 6.756 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.134 -4.636 6.730 1.00 0.00 H new ATOM 1093 N LEU A 155 -10.695 -0.892 7.945 1.00 0.00 N ATOM 1094 CA LEU A 155 -10.130 0.068 8.824 1.00 0.00 C ATOM 1095 C LEU A 155 -9.663 1.222 7.983 1.00 0.00 C ATOM 1096 O LEU A 155 -9.964 2.381 8.261 1.00 0.00 O ATOM 1097 CB LEU A 155 -8.981 -0.710 9.496 1.00 0.00 C ATOM 1098 CG LEU A 155 -8.065 -0.109 10.579 1.00 0.00 C ATOM 1099 CD1 LEU A 155 -7.060 0.948 10.096 1.00 0.00 C ATOM 1100 CD2 LEU A 155 -8.679 0.244 11.936 1.00 0.00 C ATOM 0 H LEU A 155 -9.996 -1.255 7.297 1.00 0.00 H new ATOM 0 HA LEU A 155 -10.797 0.487 9.578 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -9.430 -1.602 9.934 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -8.326 -1.045 8.692 1.00 0.00 H new ATOM 0 HG LEU A 155 -7.486 -1.005 10.801 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -6.469 1.301 10.941 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -6.399 0.507 9.350 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -7.598 1.787 9.654 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -7.909 0.656 12.588 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -9.469 0.982 11.797 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -9.097 -0.654 12.391 1.00 0.00 H new ATOM 1112 N ALA A 156 -8.872 0.899 6.942 1.00 0.00 N ATOM 1113 CA ALA A 156 -8.248 1.898 6.083 1.00 0.00 C ATOM 1114 C ALA A 156 -8.796 1.801 4.731 1.00 0.00 C ATOM 1115 O ALA A 156 -8.995 0.679 4.273 1.00 0.00 O ATOM 1116 CB ALA A 156 -6.799 1.710 5.752 1.00 0.00 C ATOM 0 H ALA A 156 -8.654 -0.063 6.681 1.00 0.00 H new ATOM 0 HA ALA A 156 -8.418 2.807 6.660 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -6.465 2.523 5.107 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -6.213 1.711 6.671 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -6.664 0.759 5.236 1.00 0.00 H new ATOM 1122 N VAL A 157 -8.985 2.931 4.009 1.00 0.00 N ATOM 1123 CA VAL A 157 -8.827 2.808 2.596 1.00 0.00 C ATOM 1124 C VAL A 157 -7.966 3.739 1.853 1.00 0.00 C ATOM 1125 O VAL A 157 -7.629 4.844 2.244 1.00 0.00 O ATOM 1126 CB VAL A 157 -10.098 2.897 1.772 1.00 0.00 C ATOM 1127 CG1 VAL A 157 -11.135 1.942 2.334 1.00 0.00 C ATOM 1128 CG2 VAL A 157 -10.573 4.373 1.688 1.00 0.00 C ATOM 0 H VAL A 157 -9.227 3.854 4.370 1.00 0.00 H new ATOM 0 HA VAL A 157 -8.368 1.822 2.670 1.00 0.00 H new ATOM 0 HB VAL A 157 -9.917 2.583 0.744 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -12.048 2.006 1.742 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -10.749 0.923 2.297 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -11.354 2.210 3.368 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -11.486 4.428 1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -10.769 4.750 2.692 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -9.798 4.978 1.218 1.00 0.00 H new ATOM 1138 N VAL A 158 -7.692 3.267 0.644 1.00 0.00 N ATOM 1139 CA VAL A 158 -6.848 3.836 -0.317 1.00 0.00 C ATOM 1140 C VAL A 158 -7.592 4.907 -1.008 1.00 0.00 C ATOM 1141 O VAL A 158 -8.806 4.847 -1.201 1.00 0.00 O ATOM 1142 CB VAL A 158 -6.559 2.773 -1.305 1.00 0.00 C ATOM 1143 CG1 VAL A 158 -5.319 2.981 -2.135 1.00 0.00 C ATOM 1144 CG2 VAL A 158 -6.450 1.429 -0.566 1.00 0.00 C ATOM 0 H VAL A 158 -8.108 2.397 0.313 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.938 4.234 0.132 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.387 2.794 -2.013 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -5.199 2.146 -2.826 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -5.410 3.909 -2.699 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -4.449 3.038 -1.481 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -6.237 0.636 -1.283 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.645 1.481 0.167 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -7.390 1.216 -0.058 1.00 0.00 H new ATOM 1154 N GLU A 159 -6.819 5.920 -1.403 1.00 0.00 N ATOM 1155 CA GLU A 159 -7.323 7.127 -1.951 1.00 0.00 C ATOM 1156 C GLU A 159 -7.577 6.862 -3.381 1.00 0.00 C ATOM 1157 O GLU A 159 -8.554 7.331 -3.962 1.00 0.00 O ATOM 1158 CB GLU A 159 -6.251 8.205 -1.895 1.00 0.00 C ATOM 1159 CG GLU A 159 -6.723 9.599 -2.328 1.00 0.00 C ATOM 1160 CD GLU A 159 -5.612 10.615 -2.089 1.00 0.00 C ATOM 1161 OE1 GLU A 159 -4.509 10.207 -1.643 1.00 0.00 O ATOM 1162 OE2 GLU A 159 -5.858 11.822 -2.353 1.00 0.00 O ATOM 0 H GLU A 159 -5.801 5.898 -1.338 1.00 0.00 H new ATOM 0 HA GLU A 159 -8.210 7.449 -1.406 1.00 0.00 H new ATOM 0 HB2 GLU A 159 -5.868 8.266 -0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 159 -5.418 7.904 -2.531 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -6.999 9.589 -3.382 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -7.614 9.882 -1.768 1.00 0.00 H new ATOM 1169 N SER A 160 -6.647 6.100 -3.973 1.00 0.00 N ATOM 1170 CA SER A 160 -6.712 5.832 -5.358 1.00 0.00 C ATOM 1171 C SER A 160 -6.062 4.530 -5.518 1.00 0.00 C ATOM 1172 O SER A 160 -5.043 4.259 -4.889 1.00 0.00 O ATOM 1173 CB SER A 160 -5.891 6.761 -6.208 1.00 0.00 C ATOM 1174 OG SER A 160 -6.464 6.910 -7.499 1.00 0.00 O ATOM 0 H SER A 160 -5.856 5.674 -3.490 1.00 0.00 H new ATOM 0 HA SER A 160 -7.754 5.914 -5.666 1.00 0.00 H new ATOM 0 HB2 SER A 160 -5.819 7.735 -5.724 1.00 0.00 H new ATOM 0 HB3 SER A 160 -4.876 6.375 -6.299 1.00 0.00 H new ATOM 0 HG SER A 160 -5.913 7.520 -8.033 1.00 0.00 H new ATOM 1180 N PHE A 161 -6.612 3.727 -6.422 1.00 0.00 N ATOM 1181 CA PHE A 161 -5.906 2.601 -6.921 1.00 0.00 C ATOM 1182 C PHE A 161 -5.534 3.085 -8.276 1.00 0.00 C ATOM 1183 O PHE A 161 -6.404 3.035 -9.147 1.00 0.00 O ATOM 1184 CB PHE A 161 -6.765 1.340 -6.998 1.00 0.00 C ATOM 1185 CG PHE A 161 -5.864 0.217 -6.775 1.00 0.00 C ATOM 1186 CD1 PHE A 161 -5.059 -0.217 -7.793 1.00 0.00 C ATOM 1187 CD2 PHE A 161 -5.747 -0.334 -5.530 1.00 0.00 C ATOM 1188 CE1 PHE A 161 -4.049 -1.105 -7.534 1.00 0.00 C ATOM 1189 CE2 PHE A 161 -4.770 -1.227 -5.254 1.00 0.00 C ATOM 1190 CZ PHE A 161 -3.922 -1.629 -6.267 1.00 0.00 C ATOM 0 H PHE A 161 -7.546 3.853 -6.811 1.00 0.00 H new ATOM 0 HA PHE A 161 -5.070 2.298 -6.290 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -7.554 1.361 -6.246 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -7.252 1.260 -7.970 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -5.220 0.140 -8.799 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -6.445 -0.052 -4.755 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -3.360 -1.391 -8.315 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -4.654 -1.621 -4.255 1.00 0.00 H new ATOM 0 HZ PHE A 161 -3.153 -2.360 -6.064 1.00 0.00 H new ATOM 1315 N GLN A 169 8.745 1.384 -9.101 1.00 0.00 N ATOM 1316 CA GLN A 169 8.086 1.582 -7.836 1.00 0.00 C ATOM 1317 C GLN A 169 6.812 2.348 -8.038 1.00 0.00 C ATOM 1318 O GLN A 169 6.805 3.346 -8.753 1.00 0.00 O ATOM 1319 CB GLN A 169 8.878 2.533 -6.956 1.00 0.00 C ATOM 1320 CG GLN A 169 10.017 1.971 -6.099 1.00 0.00 C ATOM 1321 CD GLN A 169 10.770 3.142 -5.468 1.00 0.00 C ATOM 1322 OE1 GLN A 169 10.017 3.974 -4.685 1.00 0.00 O flip ATOM 1323 NE2 GLN A 169 11.979 3.303 -5.672 1.00 0.00 N flip ATOM 0 HA GLN A 169 7.957 0.589 -7.405 1.00 0.00 H new ATOM 0 HB2 GLN A 169 9.300 3.305 -7.600 1.00 0.00 H new ATOM 0 HB3 GLN A 169 8.174 3.027 -6.286 1.00 0.00 H new ATOM 0 HG2 GLN A 169 9.620 1.314 -5.325 1.00 0.00 H new ATOM 0 HG3 GLN A 169 10.692 1.372 -6.711 1.00 0.00 H new ATOM 0 HE21 GLN A 169 12.488 2.648 -6.266 1.00 0.00 H new ATOM 0 HE22 GLN A 169 12.468 4.091 -5.246 1.00 0.00 H new ATOM 1332 N MET A 170 5.706 1.898 -7.402 1.00 0.00 N ATOM 1333 CA MET A 170 4.401 2.503 -7.583 1.00 0.00 C ATOM 1334 C MET A 170 3.862 2.941 -6.272 1.00 0.00 C ATOM 1335 O MET A 170 3.618 2.130 -5.391 1.00 0.00 O ATOM 1336 CB MET A 170 3.298 1.548 -8.109 1.00 0.00 C ATOM 1337 CG MET A 170 1.972 2.222 -8.497 1.00 0.00 C ATOM 1338 SD MET A 170 0.507 1.167 -8.768 1.00 0.00 S ATOM 1339 CE MET A 170 1.167 -0.215 -9.732 1.00 0.00 C ATOM 0 H MET A 170 5.711 1.109 -6.756 1.00 0.00 H new ATOM 0 HA MET A 170 4.589 3.298 -8.304 1.00 0.00 H new ATOM 0 HB2 MET A 170 3.685 1.018 -8.979 1.00 0.00 H new ATOM 0 HB3 MET A 170 3.095 0.799 -7.344 1.00 0.00 H new ATOM 0 HG2 MET A 170 1.724 2.940 -7.715 1.00 0.00 H new ATOM 0 HG3 MET A 170 2.144 2.792 -9.410 1.00 0.00 H new ATOM 0 HE1 MET A 170 0.362 -0.910 -9.970 1.00 0.00 H new ATOM 0 HE2 MET A 170 1.605 0.162 -10.656 1.00 0.00 H new ATOM 0 HE3 MET A 170 1.932 -0.731 -9.152 1.00 0.00 H new ATOM 1349 N ILE A 171 3.540 4.229 -6.144 1.00 0.00 N ATOM 1350 CA ILE A 171 2.851 4.682 -4.986 1.00 0.00 C ATOM 1351 C ILE A 171 1.390 4.421 -5.177 1.00 0.00 C ATOM 1352 O ILE A 171 0.761 4.882 -6.129 1.00 0.00 O ATOM 1353 CB ILE A 171 2.994 6.169 -4.786 1.00 0.00 C ATOM 1354 CG1 ILE A 171 4.469 6.481 -4.507 1.00 0.00 C ATOM 1355 CG2 ILE A 171 2.106 6.575 -3.597 1.00 0.00 C ATOM 1356 CD1 ILE A 171 4.864 6.044 -3.112 1.00 0.00 C ATOM 0 H ILE A 171 3.752 4.952 -6.832 1.00 0.00 H new ATOM 0 HA ILE A 171 3.272 4.159 -4.127 1.00 0.00 H new ATOM 0 HB ILE A 171 2.682 6.727 -5.669 1.00 0.00 H new ATOM 0 HG12 ILE A 171 5.096 5.975 -5.241 1.00 0.00 H new ATOM 0 HG13 ILE A 171 4.645 7.551 -4.620 1.00 0.00 H new ATOM 0 HG21 ILE A 171 2.191 7.649 -3.430 1.00 0.00 H new ATOM 0 HG22 ILE A 171 1.068 6.322 -3.815 1.00 0.00 H new ATOM 0 HG23 ILE A 171 2.429 6.042 -2.703 1.00 0.00 H new ATOM 0 HD11 ILE A 171 5.915 6.277 -2.942 1.00 0.00 H new ATOM 0 HD12 ILE A 171 4.252 6.570 -2.379 1.00 0.00 H new ATOM 0 HD13 ILE A 171 4.710 4.970 -3.010 1.00 0.00 H new ATOM 1368 N MET A 172 0.838 3.694 -4.199 1.00 0.00 N ATOM 1369 CA MET A 172 -0.564 3.631 -3.930 1.00 0.00 C ATOM 1370 C MET A 172 -0.700 4.394 -2.662 1.00 0.00 C ATOM 1371 O MET A 172 0.030 4.162 -1.710 1.00 0.00 O ATOM 1372 CB MET A 172 -1.013 2.188 -3.709 1.00 0.00 C ATOM 1373 CG MET A 172 -2.305 2.094 -2.917 1.00 0.00 C ATOM 1374 SD MET A 172 -3.119 0.519 -3.101 1.00 0.00 S ATOM 1375 CE MET A 172 -2.963 0.015 -1.377 1.00 0.00 C ATOM 0 H MET A 172 1.393 3.121 -3.563 1.00 0.00 H new ATOM 0 HA MET A 172 -1.167 4.023 -4.749 1.00 0.00 H new ATOM 0 HB2 MET A 172 -1.147 1.701 -4.675 1.00 0.00 H new ATOM 0 HB3 MET A 172 -0.228 1.644 -3.183 1.00 0.00 H new ATOM 0 HG2 MET A 172 -2.092 2.266 -1.862 1.00 0.00 H new ATOM 0 HG3 MET A 172 -2.981 2.886 -3.239 1.00 0.00 H new ATOM 0 HE1 MET A 172 -3.800 -0.629 -1.109 1.00 0.00 H new ATOM 0 HE2 MET A 172 -2.028 -0.529 -1.240 1.00 0.00 H new ATOM 0 HE3 MET A 172 -2.966 0.898 -0.738 1.00 0.00 H new ATOM 1385 N VAL A 173 -1.639 5.341 -2.618 1.00 0.00 N ATOM 1386 CA VAL A 173 -1.737 6.174 -1.438 1.00 0.00 C ATOM 1387 C VAL A 173 -2.809 5.595 -0.529 1.00 0.00 C ATOM 1388 O VAL A 173 -3.860 5.240 -1.039 1.00 0.00 O ATOM 1389 CB VAL A 173 -2.238 7.537 -1.824 1.00 0.00 C ATOM 1390 CG1 VAL A 173 -2.154 8.355 -0.543 1.00 0.00 C ATOM 1391 CG2 VAL A 173 -1.380 8.123 -2.959 1.00 0.00 C ATOM 0 H VAL A 173 -2.313 5.539 -3.357 1.00 0.00 H new ATOM 0 HA VAL A 173 -0.758 6.224 -0.960 1.00 0.00 H new ATOM 0 HB VAL A 173 -3.256 7.525 -2.212 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -2.503 9.370 -0.736 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -2.778 7.896 0.223 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -1.120 8.386 -0.198 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -1.756 9.110 -3.227 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -0.345 8.207 -2.627 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -1.430 7.468 -3.829 1.00 0.00 H new ATOM 1401 N LEU A 174 -2.631 5.509 0.819 1.00 0.00 N ATOM 1402 CA LEU A 174 -3.633 4.845 1.645 1.00 0.00 C ATOM 1403 C LEU A 174 -3.943 5.841 2.755 1.00 0.00 C ATOM 1404 O LEU A 174 -3.071 6.581 3.193 1.00 0.00 O ATOM 1405 CB LEU A 174 -3.150 3.444 2.038 1.00 0.00 C ATOM 1406 CG LEU A 174 -3.650 2.946 3.381 1.00 0.00 C ATOM 1407 CD1 LEU A 174 -5.059 2.444 3.113 1.00 0.00 C ATOM 1408 CD2 LEU A 174 -2.850 1.786 3.918 1.00 0.00 C ATOM 0 H LEU A 174 -1.828 5.882 1.325 1.00 0.00 H new ATOM 0 HA LEU A 174 -4.576 4.614 1.150 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -3.462 2.739 1.267 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -2.060 3.442 2.050 1.00 0.00 H new ATOM 0 HG LEU A 174 -3.580 3.749 4.115 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -5.493 2.065 4.039 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -5.671 3.263 2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -5.026 1.644 2.374 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -3.258 1.477 4.880 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -2.902 0.953 3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -1.811 2.089 4.045 1.00 0.00 H new ATOM 1420 N ALA A 175 -5.217 5.910 3.210 1.00 0.00 N ATOM 1421 CA ALA A 175 -5.711 6.933 4.089 1.00 0.00 C ATOM 1422 C ALA A 175 -6.784 6.383 4.969 1.00 0.00 C ATOM 1423 O ALA A 175 -7.116 5.215 4.795 1.00 0.00 O ATOM 1424 CB ALA A 175 -6.473 7.887 3.165 1.00 0.00 C ATOM 0 H ALA A 175 -5.928 5.225 2.954 1.00 0.00 H new ATOM 0 HA ALA A 175 -4.896 7.360 4.673 1.00 0.00 H new ATOM 0 HB1 ALA A 175 -6.889 8.706 3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 175 -5.792 8.287 2.414 1.00 0.00 H new ATOM 0 HB3 ALA A 175 -7.281 7.347 2.671 1.00 0.00 H new ATOM 1430 N PRO A 176 -7.332 7.110 5.937 1.00 0.00 N ATOM 1431 CA PRO A 176 -8.321 6.537 6.811 1.00 0.00 C ATOM 1432 C PRO A 176 -9.595 6.398 6.040 1.00 0.00 C ATOM 1433 O PRO A 176 -9.893 7.268 5.220 1.00 0.00 O ATOM 1434 CB PRO A 176 -8.486 7.560 7.935 1.00 0.00 C ATOM 1435 CG PRO A 176 -7.123 8.246 8.014 1.00 0.00 C ATOM 1436 CD PRO A 176 -6.663 8.251 6.556 1.00 0.00 C ATOM 0 HA PRO A 176 -8.047 5.557 7.201 1.00 0.00 H new ATOM 0 HB2 PRO A 176 -9.279 8.273 7.712 1.00 0.00 H new ATOM 0 HB3 PRO A 176 -8.746 7.079 8.878 1.00 0.00 H new ATOM 0 HG2 PRO A 176 -7.201 9.256 8.417 1.00 0.00 H new ATOM 0 HG3 PRO A 176 -6.431 7.699 8.655 1.00 0.00 H new ATOM 0 HD2 PRO A 176 -6.936 9.183 6.061 1.00 0.00 H new ATOM 0 HD3 PRO A 176 -5.579 8.158 6.485 1.00 0.00 H new ATOM 1444 N LYS A 177 -10.364 5.322 6.321 1.00 0.00 N ATOM 1445 CA LYS A 177 -11.637 5.150 5.690 1.00 0.00 C ATOM 1446 C LYS A 177 -12.584 6.026 6.429 1.00 0.00 C ATOM 1447 O LYS A 177 -12.609 6.046 7.659 1.00 0.00 O ATOM 1448 CB LYS A 177 -12.189 3.717 5.792 1.00 0.00 C ATOM 1449 CG LYS A 177 -13.512 3.521 5.028 1.00 0.00 C ATOM 1450 CD LYS A 177 -13.992 2.067 4.940 1.00 0.00 C ATOM 1451 CE LYS A 177 -14.183 1.415 6.308 1.00 0.00 C ATOM 1452 NZ LYS A 177 -14.906 0.134 6.162 1.00 0.00 N ATOM 0 H LYS A 177 -10.106 4.583 6.976 1.00 0.00 H new ATOM 0 HA LYS A 177 -11.525 5.384 4.631 1.00 0.00 H new ATOM 0 HB2 LYS A 177 -11.446 3.020 5.404 1.00 0.00 H new ATOM 0 HB3 LYS A 177 -12.343 3.468 6.842 1.00 0.00 H new ATOM 0 HG2 LYS A 177 -14.287 4.116 5.511 1.00 0.00 H new ATOM 0 HG3 LYS A 177 -13.394 3.912 4.017 1.00 0.00 H new ATOM 0 HD2 LYS A 177 -14.935 2.034 4.394 1.00 0.00 H new ATOM 0 HD3 LYS A 177 -13.270 1.487 4.365 1.00 0.00 H new ATOM 0 HE2 LYS A 177 -13.214 1.244 6.777 1.00 0.00 H new ATOM 0 HE3 LYS A 177 -14.740 2.084 6.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 -15.136 -0.244 7.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 -15.784 0.290 5.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 -14.307 -0.547 5.652 1.00 0.00 H new