USER MOD reduce.3.24.130724 H: found=0, std=0, add=539, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 531 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 189 TYR OH : rot -46:sc= 1.23 USER MOD Set 1.2: A 193 GLN : amide:sc= 0.779 K(o=2,f=-0.2) USER MOD Set 2.1: A 171 CYS SG : rot 142:sc= 0.891 USER MOD Set 2.2: A 177 CYS SG : rot 146:sc= 0.223 USER MOD Set 2.3: A 187 CYS SG : rot 175:sc= -0.228 USER MOD Set 2.4: A 190 CYS SG : rot 121:sc= -1.57 USER MOD Set 3.1: A 162 THR OG1 : rot 76:sc= 2.2 USER MOD Set 3.2: A 169 TYR OH : rot -177:sc= 1.22 USER MOD Set 4.1: A 147 TYR OH : rot -174:sc= 1.08 USER MOD Set 4.2: A 156 LYS NZ :NH3+ 174:sc=-0.00857 (180deg=-0.121) USER MOD Set 5.1: A 143 SER OG : rot 63:sc= 1.08 USER MOD Set 5.2: A 146 HIS : no HE2:sc= 0.627 K(o=2.5,f=-7.2!) USER MOD Set 5.3: A 151 SER OG : rot -74:sc= 0.986 USER MOD Set 5.4: A 200 MET CE :methyl 168:sc= -0.191 (180deg=-0.315) USER MOD Set 6.1: A 135 CYS SG : rot 10:sc= 0.352 USER MOD Set 6.2: A 138 CYS SG : rot -32:sc= 0.482 USER MOD Set 6.3: A 152 CYS SG : rot -63:sc= 0.673 USER MOD Set 6.4: A 155 CYS SG : rot 101:sc= 0.219 USER MOD Set 7.1: A 133 HIS : no HE2:sc= -1.03 X(o=-1,f=-1.1) USER MOD Set 7.2: A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 94:sc= 1.04 USER MOD Single : A 145 LYS NZ :NH3+ -178:sc= -0.0144 (180deg=-0.0267) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0968) USER MOD Single : A 168 THR OG1 : rot 16:sc= 0.579 USER MOD Single : A 170 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 174 ASN : amide:sc= 0.858 K(o=0.86,f=0) USER MOD Single : A 175 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0385) USER MOD Single : A 188 GLN : amide:sc= -0.367 K(o=-0.37,f=-1) USER MOD Single : A 192 TYR OH : rot 138:sc= 2.02 USER MOD Single : A 194 LYS NZ :NH3+ -176:sc= 1.49 (180deg=1.44) USER MOD Single : A 198 MET CE :methyl -166:sc= -0.725 (180deg=-1.03) USER MOD Single : A 201 LYS NZ :NH3+ -141:sc= 0.317 (180deg=0) USER MOD Single : A 206 GLN : amide:sc= 1.85 K(o=1.9,f=-0.0032) USER MOD ----------------------------------------------------------------- ATOM 57 N HIS A 133 -1.779 -3.311 14.632 1.00 0.00 N ATOM 58 CA HIS A 133 -3.171 -3.164 14.221 1.00 0.00 C ATOM 59 C HIS A 133 -3.448 -3.858 12.878 1.00 0.00 C ATOM 60 O HIS A 133 -2.569 -4.451 12.249 1.00 0.00 O ATOM 61 CB HIS A 133 -3.536 -1.671 14.086 1.00 0.00 C ATOM 62 CG HIS A 133 -3.195 -0.751 15.234 1.00 0.00 C ATOM 63 ND1 HIS A 133 -2.558 -1.071 16.412 1.00 0.00 N ATOM 64 CD2 HIS A 133 -3.433 0.597 15.256 1.00 0.00 C ATOM 65 CE1 HIS A 133 -2.422 0.059 17.124 1.00 0.00 C ATOM 66 NE2 HIS A 133 -2.934 1.107 16.458 1.00 0.00 N ATOM 0 HA HIS A 133 -3.781 -3.635 14.992 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -3.044 -1.286 13.193 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -4.610 -1.604 13.912 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -2.245 -2.000 16.693 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -3.921 1.167 14.480 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -1.963 0.117 18.100 1.00 0.00 H new ATOM 74 N ILE A 134 -4.684 -3.735 12.395 1.00 0.00 N ATOM 75 CA ILE A 134 -5.040 -4.230 11.078 1.00 0.00 C ATOM 76 C ILE A 134 -4.379 -3.356 10.011 1.00 0.00 C ATOM 77 O ILE A 134 -4.090 -2.183 10.241 1.00 0.00 O ATOM 78 CB ILE A 134 -6.561 -4.299 10.896 1.00 0.00 C ATOM 79 CG1 ILE A 134 -7.284 -3.016 11.341 1.00 0.00 C ATOM 80 CG2 ILE A 134 -7.085 -5.547 11.613 1.00 0.00 C ATOM 81 CD1 ILE A 134 -8.703 -2.938 10.768 1.00 0.00 C ATOM 0 H ILE A 134 -5.452 -3.295 12.902 1.00 0.00 H new ATOM 0 HA ILE A 134 -4.670 -5.250 10.971 1.00 0.00 H new ATOM 0 HB ILE A 134 -6.780 -4.377 9.831 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -7.329 -2.982 12.430 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -6.713 -2.146 11.018 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -8.166 -5.609 11.492 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -6.620 -6.435 11.184 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -6.842 -5.486 12.674 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -9.181 -2.018 11.105 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -8.657 -2.945 9.679 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -9.282 -3.795 11.112 1.00 0.00 H new ATOM 93 N CYS A 135 -4.116 -3.952 8.850 1.00 0.00 N ATOM 94 CA CYS A 135 -3.470 -3.294 7.735 1.00 0.00 C ATOM 95 C CYS A 135 -4.369 -2.171 7.250 1.00 0.00 C ATOM 96 O CYS A 135 -5.484 -2.440 6.811 1.00 0.00 O ATOM 97 CB CYS A 135 -3.194 -4.285 6.597 1.00 0.00 C ATOM 98 SG CYS A 135 -2.393 -3.544 5.149 1.00 0.00 S ATOM 0 H CYS A 135 -4.354 -4.926 8.662 1.00 0.00 H new ATOM 0 HA CYS A 135 -2.511 -2.891 8.060 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -2.564 -5.090 6.975 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -4.136 -4.737 6.286 1.00 0.00 H new ATOM 0 HG CYS A 135 -2.011 -2.335 5.436 1.00 0.00 H new ATOM 103 N ALA A 136 -3.882 -0.932 7.303 1.00 0.00 N ATOM 104 CA ALA A 136 -4.623 0.239 6.860 1.00 0.00 C ATOM 105 C ALA A 136 -5.294 0.017 5.499 1.00 0.00 C ATOM 106 O ALA A 136 -6.425 0.435 5.274 1.00 0.00 O ATOM 107 CB ALA A 136 -3.654 1.424 6.803 1.00 0.00 C ATOM 0 H ALA A 136 -2.951 -0.715 7.659 1.00 0.00 H new ATOM 0 HA ALA A 136 -5.427 0.440 7.568 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -4.188 2.315 6.473 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -3.234 1.599 7.794 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.849 1.203 6.102 1.00 0.00 H new ATOM 113 N ILE A 137 -4.564 -0.623 4.585 1.00 0.00 N ATOM 114 CA ILE A 137 -4.977 -0.848 3.209 1.00 0.00 C ATOM 115 C ILE A 137 -6.024 -1.961 3.036 1.00 0.00 C ATOM 116 O ILE A 137 -6.995 -1.747 2.311 1.00 0.00 O ATOM 117 CB ILE A 137 -3.722 -1.099 2.354 1.00 0.00 C ATOM 118 CG1 ILE A 137 -2.767 0.109 2.402 1.00 0.00 C ATOM 119 CG2 ILE A 137 -4.098 -1.372 0.893 1.00 0.00 C ATOM 120 CD1 ILE A 137 -1.329 -0.325 2.120 1.00 0.00 C ATOM 0 H ILE A 137 -3.643 -1.008 4.793 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.491 0.051 2.867 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.221 -1.973 2.770 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.078 0.853 1.669 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.823 0.584 3.381 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.193 -1.546 0.311 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.738 -2.253 0.841 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.630 -0.512 0.487 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -0.672 0.544 2.159 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -1.015 -1.051 2.869 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -1.273 -0.778 1.130 1.00 0.00 H new ATOM 132 N CYS A 138 -5.809 -3.157 3.610 1.00 0.00 N ATOM 133 CA CYS A 138 -6.671 -4.324 3.359 1.00 0.00 C ATOM 134 C CYS A 138 -7.260 -5.017 4.594 1.00 0.00 C ATOM 135 O CYS A 138 -8.009 -5.980 4.445 1.00 0.00 O ATOM 136 CB CYS A 138 -5.926 -5.317 2.458 1.00 0.00 C ATOM 137 SG CYS A 138 -4.344 -5.956 3.075 1.00 0.00 S ATOM 0 H CYS A 138 -5.040 -3.341 4.255 1.00 0.00 H new ATOM 0 HA CYS A 138 -7.556 -3.929 2.859 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -6.585 -6.165 2.270 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -5.746 -4.835 1.497 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.760 -5.046 3.797 1.00 0.00 H new ATOM 142 N GLY A 139 -6.972 -4.539 5.803 1.00 0.00 N ATOM 143 CA GLY A 139 -7.559 -5.067 7.028 1.00 0.00 C ATOM 144 C GLY A 139 -6.870 -6.305 7.609 1.00 0.00 C ATOM 145 O GLY A 139 -7.211 -6.725 8.711 1.00 0.00 O ATOM 0 H GLY A 139 -6.321 -3.770 5.959 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -7.551 -4.280 7.783 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.603 -5.311 6.834 1.00 0.00 H new ATOM 149 N ASP A 140 -5.911 -6.914 6.908 1.00 0.00 N ATOM 150 CA ASP A 140 -5.210 -8.100 7.395 1.00 0.00 C ATOM 151 C ASP A 140 -4.325 -7.700 8.573 1.00 0.00 C ATOM 152 O ASP A 140 -3.789 -6.600 8.560 1.00 0.00 O ATOM 153 CB ASP A 140 -4.356 -8.686 6.268 1.00 0.00 C ATOM 154 CG ASP A 140 -5.223 -9.265 5.160 1.00 0.00 C ATOM 155 OD1 ASP A 140 -5.876 -8.450 4.476 1.00 0.00 O ATOM 156 OD2 ASP A 140 -5.224 -10.507 5.021 1.00 0.00 O ATOM 0 H ASP A 140 -5.600 -6.598 5.989 1.00 0.00 H new ATOM 0 HA ASP A 140 -5.928 -8.853 7.720 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.709 -7.910 5.858 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -3.706 -9.464 6.668 1.00 0.00 H new ATOM 161 N ARG A 141 -4.154 -8.547 9.591 1.00 0.00 N ATOM 162 CA ARG A 141 -3.331 -8.175 10.742 1.00 0.00 C ATOM 163 C ARG A 141 -1.907 -7.789 10.286 1.00 0.00 C ATOM 164 O ARG A 141 -1.280 -8.531 9.531 1.00 0.00 O ATOM 165 CB ARG A 141 -3.362 -9.281 11.811 1.00 0.00 C ATOM 166 CG ARG A 141 -3.601 -8.671 13.205 1.00 0.00 C ATOM 167 CD ARG A 141 -3.017 -9.501 14.361 1.00 0.00 C ATOM 168 NE ARG A 141 -1.623 -9.918 14.134 1.00 0.00 N ATOM 169 CZ ARG A 141 -0.647 -9.146 13.638 1.00 0.00 C ATOM 170 NH1 ARG A 141 -0.742 -7.817 13.611 1.00 0.00 N ATOM 171 NH2 ARG A 141 0.446 -9.699 13.107 1.00 0.00 N ATOM 0 H ARG A 141 -4.567 -9.478 9.642 1.00 0.00 H new ATOM 0 HA ARG A 141 -3.748 -7.287 11.217 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -4.150 -9.997 11.580 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -2.420 -9.830 11.803 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -3.165 -7.672 13.233 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -4.674 -8.555 13.360 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -3.069 -8.918 15.280 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -3.634 -10.387 14.511 1.00 0.00 H new ATOM 0 HE ARG A 141 -1.379 -10.879 14.376 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -1.577 -7.358 13.975 1.00 0.00 H new ATOM 0 HH12 ARG A 141 0.020 -7.259 13.226 1.00 0.00 H new ATOM 0 HH21 ARG A 141 0.541 -10.714 13.078 1.00 0.00 H new ATOM 0 HH22 ARG A 141 1.186 -9.106 12.731 1.00 0.00 H new ATOM 185 N SER A 142 -1.425 -6.602 10.676 1.00 0.00 N ATOM 186 CA SER A 142 -0.157 -6.058 10.193 1.00 0.00 C ATOM 187 C SER A 142 1.096 -6.784 10.680 1.00 0.00 C ATOM 188 O SER A 142 1.140 -7.310 11.791 1.00 0.00 O ATOM 189 CB SER A 142 -0.055 -4.594 10.625 1.00 0.00 C ATOM 190 OG SER A 142 -1.119 -3.864 10.060 1.00 0.00 O ATOM 0 H SER A 142 -1.907 -5.993 11.337 1.00 0.00 H new ATOM 0 HA SER A 142 -0.180 -6.185 9.111 1.00 0.00 H new ATOM 0 HB2 SER A 142 -0.086 -4.521 11.712 1.00 0.00 H new ATOM 0 HB3 SER A 142 0.899 -4.175 10.305 1.00 0.00 H new ATOM 0 HG SER A 142 -1.865 -3.828 10.695 1.00 0.00 H new ATOM 196 N SER A 143 2.167 -6.714 9.888 1.00 0.00 N ATOM 197 CA SER A 143 3.477 -7.190 10.297 1.00 0.00 C ATOM 198 C SER A 143 4.145 -6.085 11.122 1.00 0.00 C ATOM 199 O SER A 143 4.905 -6.385 12.041 1.00 0.00 O ATOM 200 CB SER A 143 4.298 -7.617 9.076 1.00 0.00 C ATOM 201 OG SER A 143 3.966 -6.853 7.933 1.00 0.00 O ATOM 0 H SER A 143 2.144 -6.324 8.946 1.00 0.00 H new ATOM 0 HA SER A 143 3.396 -8.080 10.921 1.00 0.00 H new ATOM 0 HB2 SER A 143 5.360 -7.505 9.294 1.00 0.00 H new ATOM 0 HB3 SER A 143 4.124 -8.673 8.871 1.00 0.00 H new ATOM 0 HG SER A 143 4.186 -5.912 8.094 1.00 0.00 H new ATOM 207 N GLY A 144 3.853 -4.813 10.820 1.00 0.00 N ATOM 208 CA GLY A 144 4.384 -3.687 11.567 1.00 0.00 C ATOM 209 C GLY A 144 3.864 -2.364 11.007 1.00 0.00 C ATOM 210 O GLY A 144 3.189 -2.337 9.976 1.00 0.00 O ATOM 0 H GLY A 144 3.241 -4.546 10.049 1.00 0.00 H new ATOM 0 HA2 GLY A 144 4.103 -3.777 12.616 1.00 0.00 H new ATOM 0 HA3 GLY A 144 5.473 -3.700 11.526 1.00 0.00 H new ATOM 214 N LYS A 145 4.195 -1.260 11.685 1.00 0.00 N ATOM 215 CA LYS A 145 3.826 0.083 11.257 1.00 0.00 C ATOM 216 C LYS A 145 4.821 0.556 10.197 1.00 0.00 C ATOM 217 O LYS A 145 5.619 1.469 10.411 1.00 0.00 O ATOM 218 CB LYS A 145 3.619 1.028 12.451 1.00 0.00 C ATOM 219 CG LYS A 145 4.814 1.184 13.406 1.00 0.00 C ATOM 220 CD LYS A 145 4.415 1.943 14.682 1.00 0.00 C ATOM 221 CE LYS A 145 3.791 3.322 14.422 1.00 0.00 C ATOM 222 NZ LYS A 145 4.664 4.176 13.598 1.00 0.00 N ATOM 0 H LYS A 145 4.731 -1.279 12.553 1.00 0.00 H new ATOM 0 HA LYS A 145 2.847 0.080 10.777 1.00 0.00 H new ATOM 0 HB2 LYS A 145 3.356 2.014 12.067 1.00 0.00 H new ATOM 0 HB3 LYS A 145 2.764 0.672 13.026 1.00 0.00 H new ATOM 0 HG2 LYS A 145 5.201 0.200 13.672 1.00 0.00 H new ATOM 0 HG3 LYS A 145 5.619 1.717 12.900 1.00 0.00 H new ATOM 0 HD2 LYS A 145 3.707 1.336 15.246 1.00 0.00 H new ATOM 0 HD3 LYS A 145 5.298 2.068 15.309 1.00 0.00 H new ATOM 0 HE2 LYS A 145 2.830 3.197 13.923 1.00 0.00 H new ATOM 0 HE3 LYS A 145 3.594 3.816 15.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 4.221 5.109 13.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 5.584 4.289 14.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 4.804 3.734 12.667 1.00 0.00 H new ATOM 236 N HIS A 146 4.773 -0.094 9.035 1.00 0.00 N ATOM 237 CA HIS A 146 5.711 0.171 7.961 1.00 0.00 C ATOM 238 C HIS A 146 5.377 1.514 7.325 1.00 0.00 C ATOM 239 O HIS A 146 4.213 1.861 7.133 1.00 0.00 O ATOM 240 CB HIS A 146 5.670 -0.965 6.938 1.00 0.00 C ATOM 241 CG HIS A 146 5.758 -2.331 7.571 1.00 0.00 C ATOM 242 ND1 HIS A 146 6.727 -2.753 8.454 1.00 0.00 N ATOM 243 CD2 HIS A 146 4.885 -3.370 7.386 1.00 0.00 C ATOM 244 CE1 HIS A 146 6.455 -4.031 8.771 1.00 0.00 C ATOM 245 NE2 HIS A 146 5.347 -4.452 8.142 1.00 0.00 N ATOM 0 H HIS A 146 4.084 -0.814 8.819 1.00 0.00 H new ATOM 0 HA HIS A 146 6.726 0.221 8.354 1.00 0.00 H new ATOM 0 HB2 HIS A 146 4.747 -0.896 6.363 1.00 0.00 H new ATOM 0 HB3 HIS A 146 6.493 -0.843 6.234 1.00 0.00 H new ATOM 0 HD1 HIS A 146 7.508 -2.198 8.803 1.00 0.00 H new ATOM 0 HD2 HIS A 146 4.000 -3.356 6.768 1.00 0.00 H new ATOM 0 HE1 HIS A 146 7.048 -4.636 9.441 1.00 0.00 H new ATOM 253 N TYR A 147 6.418 2.310 7.073 1.00 0.00 N ATOM 254 CA TYR A 147 6.285 3.665 6.560 1.00 0.00 C ATOM 255 C TYR A 147 5.353 4.482 7.466 1.00 0.00 C ATOM 256 O TYR A 147 4.640 5.367 6.996 1.00 0.00 O ATOM 257 CB TYR A 147 5.826 3.650 5.093 1.00 0.00 C ATOM 258 CG TYR A 147 6.414 2.534 4.249 1.00 0.00 C ATOM 259 CD1 TYR A 147 7.808 2.345 4.169 1.00 0.00 C ATOM 260 CD2 TYR A 147 5.555 1.611 3.629 1.00 0.00 C ATOM 261 CE1 TYR A 147 8.334 1.256 3.453 1.00 0.00 C ATOM 262 CE2 TYR A 147 6.081 0.539 2.896 1.00 0.00 C ATOM 263 CZ TYR A 147 7.469 0.371 2.790 1.00 0.00 C ATOM 264 OH TYR A 147 7.976 -0.671 2.081 1.00 0.00 O ATOM 0 H TYR A 147 7.386 2.024 7.223 1.00 0.00 H new ATOM 0 HA TYR A 147 7.259 4.154 6.574 1.00 0.00 H new ATOM 0 HB2 TYR A 147 4.739 3.570 5.069 1.00 0.00 H new ATOM 0 HB3 TYR A 147 6.085 4.605 4.637 1.00 0.00 H new ATOM 0 HD1 TYR A 147 8.474 3.039 4.659 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.485 1.728 3.718 1.00 0.00 H new ATOM 0 HE1 TYR A 147 9.402 1.100 3.413 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.415 -0.160 2.411 1.00 0.00 H new ATOM 0 HH TYR A 147 7.250 -1.129 1.608 1.00 0.00 H new ATOM 274 N GLY A 148 5.358 4.167 8.768 1.00 0.00 N ATOM 275 CA GLY A 148 4.556 4.837 9.775 1.00 0.00 C ATOM 276 C GLY A 148 3.097 4.379 9.835 1.00 0.00 C ATOM 277 O GLY A 148 2.348 4.946 10.627 1.00 0.00 O ATOM 0 H GLY A 148 5.937 3.419 9.150 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.014 4.677 10.751 1.00 0.00 H new ATOM 0 HA3 GLY A 148 4.579 5.910 9.584 1.00 0.00 H new ATOM 281 N VAL A 149 2.672 3.388 9.037 1.00 0.00 N ATOM 282 CA VAL A 149 1.283 2.935 9.019 1.00 0.00 C ATOM 283 C VAL A 149 1.210 1.411 9.142 1.00 0.00 C ATOM 284 O VAL A 149 1.908 0.685 8.435 1.00 0.00 O ATOM 285 CB VAL A 149 0.593 3.427 7.735 1.00 0.00 C ATOM 286 CG1 VAL A 149 -0.886 3.029 7.710 1.00 0.00 C ATOM 287 CG2 VAL A 149 0.691 4.952 7.576 1.00 0.00 C ATOM 0 H VAL A 149 3.281 2.884 8.392 1.00 0.00 H new ATOM 0 HA VAL A 149 0.758 3.357 9.876 1.00 0.00 H new ATOM 0 HB VAL A 149 1.118 2.949 6.908 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -1.345 3.391 6.790 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -0.971 1.943 7.755 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -1.396 3.469 8.567 1.00 0.00 H new ATOM 0 HG21 VAL A 149 0.191 5.255 6.656 1.00 0.00 H new ATOM 0 HG22 VAL A 149 0.213 5.438 8.426 1.00 0.00 H new ATOM 0 HG23 VAL A 149 1.740 5.247 7.532 1.00 0.00 H new ATOM 297 N TYR A 150 0.345 0.925 10.039 1.00 0.00 N ATOM 298 CA TYR A 150 0.103 -0.494 10.269 1.00 0.00 C ATOM 299 C TYR A 150 -0.187 -1.187 8.937 1.00 0.00 C ATOM 300 O TYR A 150 -1.175 -0.862 8.274 1.00 0.00 O ATOM 301 CB TYR A 150 -1.042 -0.649 11.278 1.00 0.00 C ATOM 302 CG TYR A 150 -0.710 -0.064 12.640 1.00 0.00 C ATOM 303 CD1 TYR A 150 0.061 -0.807 13.554 1.00 0.00 C ATOM 304 CD2 TYR A 150 -1.112 1.244 12.971 1.00 0.00 C ATOM 305 CE1 TYR A 150 0.479 -0.226 14.761 1.00 0.00 C ATOM 306 CE2 TYR A 150 -0.672 1.833 14.168 1.00 0.00 C ATOM 307 CZ TYR A 150 0.113 1.094 15.069 1.00 0.00 C ATOM 308 OH TYR A 150 0.495 1.640 16.257 1.00 0.00 O ATOM 0 H TYR A 150 -0.218 1.528 10.638 1.00 0.00 H new ATOM 0 HA TYR A 150 0.985 -0.974 10.694 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -1.934 -0.161 10.886 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -1.280 -1.707 11.390 1.00 0.00 H new ATOM 0 HD1 TYR A 150 0.332 -1.827 13.326 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -1.759 1.795 12.304 1.00 0.00 H new ATOM 0 HE1 TYR A 150 1.082 -0.794 15.453 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -0.937 2.855 14.396 1.00 0.00 H new ATOM 0 HH TYR A 150 0.163 2.560 16.316 1.00 0.00 H new ATOM 318 N SER A 151 0.701 -2.097 8.516 1.00 0.00 N ATOM 319 CA SER A 151 0.556 -2.798 7.253 1.00 0.00 C ATOM 320 C SER A 151 1.199 -4.189 7.271 1.00 0.00 C ATOM 321 O SER A 151 1.985 -4.522 8.160 1.00 0.00 O ATOM 322 CB SER A 151 1.071 -1.902 6.123 1.00 0.00 C ATOM 323 OG SER A 151 2.293 -1.287 6.476 1.00 0.00 O ATOM 0 H SER A 151 1.533 -2.360 9.045 1.00 0.00 H new ATOM 0 HA SER A 151 -0.501 -2.996 7.075 1.00 0.00 H new ATOM 0 HB2 SER A 151 1.207 -2.495 5.218 1.00 0.00 H new ATOM 0 HB3 SER A 151 0.329 -1.137 5.894 1.00 0.00 H new ATOM 0 HG SER A 151 2.124 -0.571 7.123 1.00 0.00 H new ATOM 329 N CYS A 152 0.824 -5.007 6.282 1.00 0.00 N ATOM 330 CA CYS A 152 1.295 -6.374 6.100 1.00 0.00 C ATOM 331 C CYS A 152 2.381 -6.425 5.019 1.00 0.00 C ATOM 332 O CYS A 152 2.367 -5.624 4.084 1.00 0.00 O ATOM 333 CB CYS A 152 0.112 -7.302 5.785 1.00 0.00 C ATOM 334 SG CYS A 152 -0.890 -6.888 4.333 1.00 0.00 S ATOM 0 H CYS A 152 0.160 -4.720 5.563 1.00 0.00 H new ATOM 0 HA CYS A 152 1.749 -6.728 7.026 1.00 0.00 H new ATOM 0 HB2 CYS A 152 0.499 -8.312 5.653 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -0.544 -7.323 6.655 1.00 0.00 H new ATOM 0 HG CYS A 152 -1.462 -5.735 4.515 1.00 0.00 H new ATOM 339 N GLU A 153 3.330 -7.355 5.165 1.00 0.00 N ATOM 340 CA GLU A 153 4.489 -7.557 4.297 1.00 0.00 C ATOM 341 C GLU A 153 4.193 -7.375 2.803 1.00 0.00 C ATOM 342 O GLU A 153 4.943 -6.697 2.104 1.00 0.00 O ATOM 343 CB GLU A 153 5.103 -8.942 4.542 1.00 0.00 C ATOM 344 CG GLU A 153 5.555 -9.132 5.995 1.00 0.00 C ATOM 345 CD GLU A 153 6.350 -10.423 6.163 1.00 0.00 C ATOM 346 OE1 GLU A 153 7.550 -10.397 5.813 1.00 0.00 O ATOM 347 OE2 GLU A 153 5.740 -11.408 6.629 1.00 0.00 O ATOM 0 H GLU A 153 3.307 -8.023 5.936 1.00 0.00 H new ATOM 0 HA GLU A 153 5.199 -6.774 4.564 1.00 0.00 H new ATOM 0 HB2 GLU A 153 4.373 -9.710 4.288 1.00 0.00 H new ATOM 0 HB3 GLU A 153 5.956 -9.081 3.878 1.00 0.00 H new ATOM 0 HG2 GLU A 153 6.166 -8.283 6.302 1.00 0.00 H new ATOM 0 HG3 GLU A 153 4.684 -9.151 6.650 1.00 0.00 H new ATOM 354 N GLY A 154 3.119 -7.985 2.296 1.00 0.00 N ATOM 355 CA GLY A 154 2.773 -7.867 0.885 1.00 0.00 C ATOM 356 C GLY A 154 2.560 -6.405 0.497 1.00 0.00 C ATOM 357 O GLY A 154 3.164 -5.914 -0.456 1.00 0.00 O ATOM 0 H GLY A 154 2.479 -8.562 2.842 1.00 0.00 H new ATOM 0 HA2 GLY A 154 3.567 -8.298 0.274 1.00 0.00 H new ATOM 0 HA3 GLY A 154 1.867 -8.438 0.679 1.00 0.00 H new ATOM 361 N CYS A 155 1.731 -5.692 1.267 1.00 0.00 N ATOM 362 CA CYS A 155 1.484 -4.275 1.064 1.00 0.00 C ATOM 363 C CYS A 155 2.793 -3.499 1.210 1.00 0.00 C ATOM 364 O CYS A 155 3.080 -2.632 0.384 1.00 0.00 O ATOM 365 CB CYS A 155 0.413 -3.782 2.039 1.00 0.00 C ATOM 366 SG CYS A 155 -1.266 -4.341 1.650 1.00 0.00 S ATOM 0 H CYS A 155 1.214 -6.091 2.050 1.00 0.00 H new ATOM 0 HA CYS A 155 1.107 -4.107 0.055 1.00 0.00 H new ATOM 0 HB2 CYS A 155 0.671 -4.117 3.043 1.00 0.00 H new ATOM 0 HB3 CYS A 155 0.426 -2.692 2.054 1.00 0.00 H new ATOM 0 HG CYS A 155 -1.578 -5.344 2.416 1.00 0.00 H new ATOM 371 N LYS A 156 3.589 -3.821 2.235 1.00 0.00 N ATOM 372 CA LYS A 156 4.880 -3.185 2.461 1.00 0.00 C ATOM 373 C LYS A 156 5.733 -3.247 1.190 1.00 0.00 C ATOM 374 O LYS A 156 6.128 -2.209 0.656 1.00 0.00 O ATOM 375 CB LYS A 156 5.616 -3.827 3.643 1.00 0.00 C ATOM 376 CG LYS A 156 6.956 -3.124 3.902 1.00 0.00 C ATOM 377 CD LYS A 156 7.756 -3.878 4.963 1.00 0.00 C ATOM 378 CE LYS A 156 9.163 -3.292 5.135 1.00 0.00 C ATOM 379 NZ LYS A 156 9.138 -1.852 5.446 1.00 0.00 N ATOM 0 H LYS A 156 3.351 -4.531 2.928 1.00 0.00 H new ATOM 0 HA LYS A 156 4.704 -2.139 2.711 1.00 0.00 H new ATOM 0 HB2 LYS A 156 4.994 -3.773 4.536 1.00 0.00 H new ATOM 0 HB3 LYS A 156 5.789 -4.884 3.438 1.00 0.00 H new ATOM 0 HG2 LYS A 156 7.529 -3.068 2.977 1.00 0.00 H new ATOM 0 HG3 LYS A 156 6.779 -2.100 4.230 1.00 0.00 H new ATOM 0 HD2 LYS A 156 7.226 -3.838 5.915 1.00 0.00 H new ATOM 0 HD3 LYS A 156 7.831 -4.929 4.684 1.00 0.00 H new ATOM 0 HE2 LYS A 156 9.680 -3.824 5.933 1.00 0.00 H new ATOM 0 HE3 LYS A 156 9.735 -3.454 4.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 10.103 -1.525 5.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 8.762 -1.327 4.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 8.531 -1.686 6.274 1.00 0.00 H new ATOM 393 N GLY A 157 6.034 -4.467 0.737 1.00 0.00 N ATOM 394 CA GLY A 157 6.867 -4.733 -0.426 1.00 0.00 C ATOM 395 C GLY A 157 6.273 -4.113 -1.684 1.00 0.00 C ATOM 396 O GLY A 157 6.981 -3.492 -2.474 1.00 0.00 O ATOM 0 H GLY A 157 5.693 -5.317 1.186 1.00 0.00 H new ATOM 0 HA2 GLY A 157 7.867 -4.334 -0.259 1.00 0.00 H new ATOM 0 HA3 GLY A 157 6.972 -5.809 -0.563 1.00 0.00 H new ATOM 400 N PHE A 158 4.963 -4.284 -1.874 1.00 0.00 N ATOM 401 CA PHE A 158 4.238 -3.723 -3.005 1.00 0.00 C ATOM 402 C PHE A 158 4.478 -2.217 -3.070 1.00 0.00 C ATOM 403 O PHE A 158 4.909 -1.695 -4.098 1.00 0.00 O ATOM 404 CB PHE A 158 2.747 -4.041 -2.852 1.00 0.00 C ATOM 405 CG PHE A 158 1.841 -3.160 -3.684 1.00 0.00 C ATOM 406 CD1 PHE A 158 1.801 -3.312 -5.081 1.00 0.00 C ATOM 407 CD2 PHE A 158 1.145 -2.098 -3.073 1.00 0.00 C ATOM 408 CE1 PHE A 158 1.051 -2.416 -5.860 1.00 0.00 C ATOM 409 CE2 PHE A 158 0.395 -1.206 -3.857 1.00 0.00 C ATOM 410 CZ PHE A 158 0.351 -1.367 -5.250 1.00 0.00 C ATOM 0 H PHE A 158 4.374 -4.822 -1.238 1.00 0.00 H new ATOM 0 HA PHE A 158 4.593 -4.163 -3.937 1.00 0.00 H new ATOM 0 HB2 PHE A 158 2.578 -5.082 -3.128 1.00 0.00 H new ATOM 0 HB3 PHE A 158 2.470 -3.941 -1.802 1.00 0.00 H new ATOM 0 HD1 PHE A 158 2.346 -4.116 -5.554 1.00 0.00 H new ATOM 0 HD2 PHE A 158 1.188 -1.970 -2.002 1.00 0.00 H new ATOM 0 HE1 PHE A 158 1.014 -2.536 -6.933 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -0.147 -0.398 -3.388 1.00 0.00 H new ATOM 0 HZ PHE A 158 -0.224 -0.680 -5.854 1.00 0.00 H new ATOM 420 N PHE A 159 4.206 -1.522 -1.965 1.00 0.00 N ATOM 421 CA PHE A 159 4.396 -0.086 -1.880 1.00 0.00 C ATOM 422 C PHE A 159 5.862 0.247 -2.154 1.00 0.00 C ATOM 423 O PHE A 159 6.143 1.122 -2.965 1.00 0.00 O ATOM 424 CB PHE A 159 3.930 0.419 -0.513 1.00 0.00 C ATOM 425 CG PHE A 159 3.985 1.926 -0.348 1.00 0.00 C ATOM 426 CD1 PHE A 159 2.933 2.729 -0.826 1.00 0.00 C ATOM 427 CD2 PHE A 159 5.051 2.522 0.351 1.00 0.00 C ATOM 428 CE1 PHE A 159 2.909 4.105 -0.535 1.00 0.00 C ATOM 429 CE2 PHE A 159 4.986 3.878 0.710 1.00 0.00 C ATOM 430 CZ PHE A 159 3.919 4.674 0.259 1.00 0.00 C ATOM 0 H PHE A 159 3.848 -1.944 -1.108 1.00 0.00 H new ATOM 0 HA PHE A 159 3.794 0.422 -2.634 1.00 0.00 H new ATOM 0 HB2 PHE A 159 2.906 0.085 -0.346 1.00 0.00 H new ATOM 0 HB3 PHE A 159 4.546 -0.041 0.260 1.00 0.00 H new ATOM 0 HD1 PHE A 159 2.143 2.289 -1.417 1.00 0.00 H new ATOM 0 HD2 PHE A 159 5.920 1.936 0.612 1.00 0.00 H new ATOM 0 HE1 PHE A 159 2.114 4.725 -0.922 1.00 0.00 H new ATOM 0 HE2 PHE A 159 5.756 4.309 1.333 1.00 0.00 H new ATOM 0 HZ PHE A 159 3.876 5.721 0.522 1.00 0.00 H new ATOM 440 N LYS A 160 6.789 -0.470 -1.509 1.00 0.00 N ATOM 441 CA LYS A 160 8.225 -0.278 -1.693 1.00 0.00 C ATOM 442 C LYS A 160 8.577 -0.265 -3.186 1.00 0.00 C ATOM 443 O LYS A 160 9.136 0.704 -3.700 1.00 0.00 O ATOM 444 CB LYS A 160 9.003 -1.376 -0.938 1.00 0.00 C ATOM 445 CG LYS A 160 10.284 -0.843 -0.287 1.00 0.00 C ATOM 446 CD LYS A 160 10.934 -1.853 0.667 1.00 0.00 C ATOM 447 CE LYS A 160 11.305 -3.161 -0.039 1.00 0.00 C ATOM 448 NZ LYS A 160 12.136 -4.018 0.822 1.00 0.00 N ATOM 0 H LYS A 160 6.558 -1.205 -0.840 1.00 0.00 H new ATOM 0 HA LYS A 160 8.514 0.688 -1.279 1.00 0.00 H new ATOM 0 HB2 LYS A 160 8.362 -1.809 -0.170 1.00 0.00 H new ATOM 0 HB3 LYS A 160 9.258 -2.178 -1.630 1.00 0.00 H new ATOM 0 HG2 LYS A 160 10.998 -0.576 -1.066 1.00 0.00 H new ATOM 0 HG3 LYS A 160 10.054 0.071 0.261 1.00 0.00 H new ATOM 0 HD2 LYS A 160 11.829 -1.412 1.105 1.00 0.00 H new ATOM 0 HD3 LYS A 160 10.250 -2.067 1.488 1.00 0.00 H new ATOM 0 HE2 LYS A 160 10.397 -3.695 -0.319 1.00 0.00 H new ATOM 0 HE3 LYS A 160 11.842 -2.939 -0.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 12.370 -4.896 0.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 13.013 -3.516 1.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 11.613 -4.249 1.691 1.00 0.00 H new ATOM 462 N ARG A 161 8.229 -1.347 -3.884 1.00 0.00 N ATOM 463 CA ARG A 161 8.480 -1.503 -5.306 1.00 0.00 C ATOM 464 C ARG A 161 7.810 -0.380 -6.097 1.00 0.00 C ATOM 465 O ARG A 161 8.468 0.297 -6.889 1.00 0.00 O ATOM 466 CB ARG A 161 7.986 -2.884 -5.747 1.00 0.00 C ATOM 467 CG ARG A 161 8.900 -3.988 -5.198 1.00 0.00 C ATOM 468 CD ARG A 161 8.304 -5.378 -5.447 1.00 0.00 C ATOM 469 NE ARG A 161 7.129 -5.613 -4.595 1.00 0.00 N ATOM 470 CZ ARG A 161 6.423 -6.753 -4.588 1.00 0.00 C ATOM 471 NH1 ARG A 161 6.746 -7.747 -5.424 1.00 0.00 N ATOM 472 NH2 ARG A 161 5.399 -6.906 -3.743 1.00 0.00 N ATOM 0 H ARG A 161 7.758 -2.149 -3.465 1.00 0.00 H new ATOM 0 HA ARG A 161 9.550 -1.435 -5.505 1.00 0.00 H new ATOM 0 HB2 ARG A 161 6.966 -3.041 -5.395 1.00 0.00 H new ATOM 0 HB3 ARG A 161 7.959 -2.935 -6.835 1.00 0.00 H new ATOM 0 HG2 ARG A 161 9.880 -3.920 -5.670 1.00 0.00 H new ATOM 0 HG3 ARG A 161 9.050 -3.840 -4.129 1.00 0.00 H new ATOM 0 HD2 ARG A 161 8.021 -5.473 -6.495 1.00 0.00 H new ATOM 0 HD3 ARG A 161 9.058 -6.140 -5.250 1.00 0.00 H new ATOM 0 HE ARG A 161 6.833 -4.863 -3.971 1.00 0.00 H new ATOM 0 HH11 ARG A 161 7.530 -7.638 -6.067 1.00 0.00 H new ATOM 0 HH12 ARG A 161 6.208 -8.614 -5.418 1.00 0.00 H new ATOM 0 HH21 ARG A 161 5.152 -6.154 -3.100 1.00 0.00 H new ATOM 0 HH22 ARG A 161 4.865 -7.775 -3.741 1.00 0.00 H new ATOM 486 N THR A 162 6.507 -0.180 -5.878 1.00 0.00 N ATOM 487 CA THR A 162 5.734 0.847 -6.561 1.00 0.00 C ATOM 488 C THR A 162 6.436 2.203 -6.466 1.00 0.00 C ATOM 489 O THR A 162 6.655 2.859 -7.482 1.00 0.00 O ATOM 490 CB THR A 162 4.305 0.905 -5.997 1.00 0.00 C ATOM 491 OG1 THR A 162 3.678 -0.351 -6.155 1.00 0.00 O ATOM 492 CG2 THR A 162 3.453 1.945 -6.726 1.00 0.00 C ATOM 0 H THR A 162 5.961 -0.732 -5.217 1.00 0.00 H new ATOM 0 HA THR A 162 5.663 0.590 -7.618 1.00 0.00 H new ATOM 0 HB THR A 162 4.384 1.177 -4.944 1.00 0.00 H new ATOM 0 HG1 THR A 162 4.027 -0.977 -5.487 1.00 0.00 H new ATOM 0 HG21 THR A 162 2.450 1.957 -6.300 1.00 0.00 H new ATOM 0 HG22 THR A 162 3.907 2.930 -6.614 1.00 0.00 H new ATOM 0 HG23 THR A 162 3.394 1.690 -7.784 1.00 0.00 H new ATOM 500 N VAL A 163 6.795 2.614 -5.252 1.00 0.00 N ATOM 501 CA VAL A 163 7.475 3.870 -4.998 1.00 0.00 C ATOM 502 C VAL A 163 8.823 3.889 -5.719 1.00 0.00 C ATOM 503 O VAL A 163 9.091 4.818 -6.476 1.00 0.00 O ATOM 504 CB VAL A 163 7.606 4.075 -3.479 1.00 0.00 C ATOM 505 CG1 VAL A 163 8.573 5.214 -3.127 1.00 0.00 C ATOM 506 CG2 VAL A 163 6.227 4.363 -2.866 1.00 0.00 C ATOM 0 H VAL A 163 6.616 2.071 -4.407 1.00 0.00 H new ATOM 0 HA VAL A 163 6.897 4.705 -5.393 1.00 0.00 H new ATOM 0 HB VAL A 163 8.014 3.154 -3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 163 8.632 5.320 -2.044 1.00 0.00 H new ATOM 0 HG12 VAL A 163 9.563 4.987 -3.524 1.00 0.00 H new ATOM 0 HG13 VAL A 163 8.212 6.145 -3.563 1.00 0.00 H new ATOM 0 HG21 VAL A 163 6.330 4.507 -1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 163 5.811 5.265 -3.314 1.00 0.00 H new ATOM 0 HG23 VAL A 163 5.561 3.522 -3.058 1.00 0.00 H new ATOM 516 N ARG A 164 9.672 2.878 -5.501 1.00 0.00 N ATOM 517 CA ARG A 164 10.996 2.824 -6.122 1.00 0.00 C ATOM 518 C ARG A 164 10.947 2.980 -7.640 1.00 0.00 C ATOM 519 O ARG A 164 11.705 3.769 -8.200 1.00 0.00 O ATOM 520 CB ARG A 164 11.751 1.552 -5.714 1.00 0.00 C ATOM 521 CG ARG A 164 12.233 1.693 -4.270 1.00 0.00 C ATOM 522 CD ARG A 164 12.965 0.446 -3.774 1.00 0.00 C ATOM 523 NE ARG A 164 13.325 0.620 -2.363 1.00 0.00 N ATOM 524 CZ ARG A 164 13.718 -0.356 -1.539 1.00 0.00 C ATOM 525 NH1 ARG A 164 13.998 -1.578 -2.003 1.00 0.00 N ATOM 526 NH2 ARG A 164 13.819 -0.093 -0.238 1.00 0.00 N ATOM 0 H ARG A 164 9.462 2.084 -4.896 1.00 0.00 H new ATOM 0 HA ARG A 164 11.550 3.683 -5.743 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.100 0.683 -5.809 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.599 1.390 -6.379 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.897 2.554 -4.194 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.379 1.891 -3.623 1.00 0.00 H new ATOM 0 HD2 ARG A 164 12.331 -0.433 -3.893 1.00 0.00 H new ATOM 0 HD3 ARG A 164 13.861 0.276 -4.371 1.00 0.00 H new ATOM 0 HE ARG A 164 13.271 1.563 -1.979 1.00 0.00 H new ATOM 0 HH11 ARG A 164 13.913 -1.777 -3.000 1.00 0.00 H new ATOM 0 HH12 ARG A 164 14.297 -2.312 -1.360 1.00 0.00 H new ATOM 0 HH21 ARG A 164 13.598 0.839 0.113 1.00 0.00 H new ATOM 0 HH22 ARG A 164 14.117 -0.824 0.408 1.00 0.00 H new ATOM 540 N LYS A 165 10.064 2.240 -8.310 1.00 0.00 N ATOM 541 CA LYS A 165 9.935 2.345 -9.759 1.00 0.00 C ATOM 542 C LYS A 165 9.077 3.560 -10.155 1.00 0.00 C ATOM 543 O LYS A 165 8.945 3.854 -11.340 1.00 0.00 O ATOM 544 CB LYS A 165 9.335 1.067 -10.358 1.00 0.00 C ATOM 545 CG LYS A 165 10.292 -0.128 -10.422 1.00 0.00 C ATOM 546 CD LYS A 165 10.370 -0.841 -9.074 1.00 0.00 C ATOM 547 CE LYS A 165 11.269 -2.081 -9.114 1.00 0.00 C ATOM 548 NZ LYS A 165 10.734 -3.126 -10.005 1.00 0.00 N ATOM 0 H LYS A 165 9.433 1.567 -7.875 1.00 0.00 H new ATOM 0 HA LYS A 165 10.939 2.480 -10.162 1.00 0.00 H new ATOM 0 HB2 LYS A 165 8.462 0.783 -9.770 1.00 0.00 H new ATOM 0 HB3 LYS A 165 8.983 1.286 -11.366 1.00 0.00 H new ATOM 0 HG2 LYS A 165 9.956 -0.827 -11.188 1.00 0.00 H new ATOM 0 HG3 LYS A 165 11.285 0.212 -10.715 1.00 0.00 H new ATOM 0 HD2 LYS A 165 10.747 -0.148 -8.322 1.00 0.00 H new ATOM 0 HD3 LYS A 165 9.367 -1.134 -8.764 1.00 0.00 H new ATOM 0 HE2 LYS A 165 12.266 -1.795 -9.450 1.00 0.00 H new ATOM 0 HE3 LYS A 165 11.375 -2.484 -8.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 11.286 -3.999 -9.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 9.739 -3.310 -9.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 10.799 -2.807 -10.993 1.00 0.00 H new ATOM 562 N ASP A 166 8.455 4.232 -9.179 1.00 0.00 N ATOM 563 CA ASP A 166 7.520 5.333 -9.363 1.00 0.00 C ATOM 564 C ASP A 166 6.395 4.912 -10.308 1.00 0.00 C ATOM 565 O ASP A 166 6.049 5.606 -11.262 1.00 0.00 O ATOM 566 CB ASP A 166 8.231 6.624 -9.783 1.00 0.00 C ATOM 567 CG ASP A 166 7.281 7.820 -9.786 1.00 0.00 C ATOM 568 OD1 ASP A 166 6.337 7.807 -8.963 1.00 0.00 O ATOM 569 OD2 ASP A 166 7.531 8.741 -10.594 1.00 0.00 O ATOM 0 H ASP A 166 8.601 4.007 -8.195 1.00 0.00 H new ATOM 0 HA ASP A 166 7.057 5.570 -8.405 1.00 0.00 H new ATOM 0 HB2 ASP A 166 9.060 6.820 -9.103 1.00 0.00 H new ATOM 0 HB3 ASP A 166 8.658 6.497 -10.778 1.00 0.00 H new ATOM 574 N LEU A 167 5.823 3.745 -10.015 1.00 0.00 N ATOM 575 CA LEU A 167 4.739 3.161 -10.782 1.00 0.00 C ATOM 576 C LEU A 167 3.406 3.794 -10.384 1.00 0.00 C ATOM 577 O LEU A 167 3.307 4.587 -9.442 1.00 0.00 O ATOM 578 CB LEU A 167 4.726 1.634 -10.585 1.00 0.00 C ATOM 579 CG LEU A 167 5.895 0.941 -11.301 1.00 0.00 C ATOM 580 CD1 LEU A 167 6.174 -0.434 -10.677 1.00 0.00 C ATOM 581 CD2 LEU A 167 5.604 0.762 -12.797 1.00 0.00 C ATOM 0 H LEU A 167 6.110 3.173 -9.221 1.00 0.00 H new ATOM 0 HA LEU A 167 4.893 3.363 -11.842 1.00 0.00 H new ATOM 0 HB2 LEU A 167 4.770 1.407 -9.520 1.00 0.00 H new ATOM 0 HB3 LEU A 167 3.785 1.230 -10.958 1.00 0.00 H new ATOM 0 HG LEU A 167 6.771 1.580 -11.184 1.00 0.00 H new ATOM 0 HD11 LEU A 167 7.005 -0.908 -11.198 1.00 0.00 H new ATOM 0 HD12 LEU A 167 6.429 -0.311 -9.624 1.00 0.00 H new ATOM 0 HD13 LEU A 167 5.286 -1.060 -10.765 1.00 0.00 H new ATOM 0 HD21 LEU A 167 6.450 0.269 -13.276 1.00 0.00 H new ATOM 0 HD22 LEU A 167 4.709 0.152 -12.923 1.00 0.00 H new ATOM 0 HD23 LEU A 167 5.446 1.738 -13.256 1.00 0.00 H new ATOM 593 N THR A 168 2.370 3.422 -11.129 1.00 0.00 N ATOM 594 CA THR A 168 0.977 3.806 -10.993 1.00 0.00 C ATOM 595 C THR A 168 0.220 2.716 -11.754 1.00 0.00 C ATOM 596 O THR A 168 0.814 2.040 -12.595 1.00 0.00 O ATOM 597 CB THR A 168 0.757 5.227 -11.542 1.00 0.00 C ATOM 598 OG1 THR A 168 1.374 6.162 -10.680 1.00 0.00 O ATOM 599 CG2 THR A 168 -0.723 5.617 -11.629 1.00 0.00 C ATOM 0 H THR A 168 2.501 2.785 -11.915 1.00 0.00 H new ATOM 0 HA THR A 168 0.627 3.865 -9.962 1.00 0.00 H new ATOM 0 HB THR A 168 1.183 5.235 -12.545 1.00 0.00 H new ATOM 0 HG1 THR A 168 1.999 5.696 -10.086 1.00 0.00 H new ATOM 0 HG21 THR A 168 -0.810 6.629 -12.023 1.00 0.00 H new ATOM 0 HG22 THR A 168 -1.244 4.924 -12.290 1.00 0.00 H new ATOM 0 HG23 THR A 168 -1.169 5.575 -10.635 1.00 0.00 H new ATOM 607 N TYR A 169 -1.054 2.508 -11.428 1.00 0.00 N ATOM 608 CA TYR A 169 -1.878 1.455 -12.005 1.00 0.00 C ATOM 609 C TYR A 169 -3.284 2.005 -12.216 1.00 0.00 C ATOM 610 O TYR A 169 -3.525 3.202 -12.065 1.00 0.00 O ATOM 611 CB TYR A 169 -1.861 0.241 -11.057 1.00 0.00 C ATOM 612 CG TYR A 169 -0.514 -0.104 -10.447 1.00 0.00 C ATOM 613 CD1 TYR A 169 0.408 -0.888 -11.163 1.00 0.00 C ATOM 614 CD2 TYR A 169 -0.172 0.379 -9.166 1.00 0.00 C ATOM 615 CE1 TYR A 169 1.651 -1.213 -10.590 1.00 0.00 C ATOM 616 CE2 TYR A 169 1.057 0.024 -8.585 1.00 0.00 C ATOM 617 CZ TYR A 169 1.972 -0.767 -9.298 1.00 0.00 C ATOM 618 OH TYR A 169 3.167 -1.113 -8.744 1.00 0.00 O ATOM 0 H TYR A 169 -1.549 3.079 -10.743 1.00 0.00 H new ATOM 0 HA TYR A 169 -1.496 1.128 -12.972 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -2.568 0.426 -10.248 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -2.224 -0.629 -11.605 1.00 0.00 H new ATOM 0 HD1 TYR A 169 0.162 -1.241 -12.154 1.00 0.00 H new ATOM 0 HD2 TYR A 169 -0.856 1.022 -8.632 1.00 0.00 H new ATOM 0 HE1 TYR A 169 2.361 -1.808 -11.146 1.00 0.00 H new ATOM 0 HE2 TYR A 169 1.298 0.360 -7.588 1.00 0.00 H new ATOM 0 HH TYR A 169 3.217 -0.765 -7.829 1.00 0.00 H new ATOM 628 N THR A 170 -4.228 1.129 -12.552 1.00 0.00 N ATOM 629 CA THR A 170 -5.631 1.488 -12.730 1.00 0.00 C ATOM 630 C THR A 170 -6.511 0.315 -12.282 1.00 0.00 C ATOM 631 O THR A 170 -6.048 -0.824 -12.248 1.00 0.00 O ATOM 632 CB THR A 170 -5.863 1.920 -14.187 1.00 0.00 C ATOM 633 OG1 THR A 170 -4.912 2.908 -14.533 1.00 0.00 O ATOM 634 CG2 THR A 170 -7.257 2.511 -14.425 1.00 0.00 C ATOM 0 H THR A 170 -4.037 0.139 -12.710 1.00 0.00 H new ATOM 0 HA THR A 170 -5.907 2.339 -12.108 1.00 0.00 H new ATOM 0 HB THR A 170 -5.767 1.023 -14.799 1.00 0.00 H new ATOM 0 HG1 THR A 170 -5.053 3.187 -15.462 1.00 0.00 H new ATOM 0 HG21 THR A 170 -7.357 2.796 -15.472 1.00 0.00 H new ATOM 0 HG22 THR A 170 -8.015 1.768 -14.177 1.00 0.00 H new ATOM 0 HG23 THR A 170 -7.392 3.390 -13.795 1.00 0.00 H new ATOM 642 N CYS A 171 -7.770 0.601 -11.934 1.00 0.00 N ATOM 643 CA CYS A 171 -8.798 -0.343 -11.511 1.00 0.00 C ATOM 644 C CYS A 171 -10.100 0.190 -12.100 1.00 0.00 C ATOM 645 O CYS A 171 -10.235 1.405 -12.246 1.00 0.00 O ATOM 646 CB CYS A 171 -8.886 -0.372 -9.978 1.00 0.00 C ATOM 647 SG CYS A 171 -10.224 -1.360 -9.250 1.00 0.00 S ATOM 0 H CYS A 171 -8.116 1.561 -11.942 1.00 0.00 H new ATOM 0 HA CYS A 171 -8.584 -1.358 -11.845 1.00 0.00 H new ATOM 0 HB2 CYS A 171 -7.938 -0.747 -9.591 1.00 0.00 H new ATOM 0 HB3 CYS A 171 -8.991 0.654 -9.625 1.00 0.00 H new ATOM 0 HG CYS A 171 -9.793 -1.947 -8.173 1.00 0.00 H new ATOM 652 N ARG A 172 -11.061 -0.679 -12.421 1.00 0.00 N ATOM 653 CA ARG A 172 -12.345 -0.264 -12.979 1.00 0.00 C ATOM 654 C ARG A 172 -13.271 0.241 -11.866 1.00 0.00 C ATOM 655 O ARG A 172 -14.396 -0.228 -11.719 1.00 0.00 O ATOM 656 CB ARG A 172 -12.966 -1.419 -13.780 1.00 0.00 C ATOM 657 CG ARG A 172 -12.024 -2.018 -14.837 1.00 0.00 C ATOM 658 CD ARG A 172 -11.483 -0.969 -15.816 1.00 0.00 C ATOM 659 NE ARG A 172 -10.676 -1.600 -16.867 1.00 0.00 N ATOM 660 CZ ARG A 172 -10.005 -0.929 -17.816 1.00 0.00 C ATOM 661 NH1 ARG A 172 -10.056 0.407 -17.862 1.00 0.00 N ATOM 662 NH2 ARG A 172 -9.286 -1.604 -18.717 1.00 0.00 N ATOM 0 H ARG A 172 -10.969 -1.688 -12.301 1.00 0.00 H new ATOM 0 HA ARG A 172 -12.194 0.566 -13.669 1.00 0.00 H new ATOM 0 HB2 ARG A 172 -13.269 -2.206 -13.089 1.00 0.00 H new ATOM 0 HB3 ARG A 172 -13.870 -1.062 -14.273 1.00 0.00 H new ATOM 0 HG2 ARG A 172 -11.188 -2.506 -14.336 1.00 0.00 H new ATOM 0 HG3 ARG A 172 -12.555 -2.789 -15.395 1.00 0.00 H new ATOM 0 HD2 ARG A 172 -12.313 -0.424 -16.267 1.00 0.00 H new ATOM 0 HD3 ARG A 172 -10.879 -0.240 -15.276 1.00 0.00 H new ATOM 0 HE ARG A 172 -10.621 -2.618 -16.877 1.00 0.00 H new ATOM 0 HH11 ARG A 172 -10.607 0.920 -17.174 1.00 0.00 H new ATOM 0 HH12 ARG A 172 -9.544 0.912 -18.585 1.00 0.00 H new ATOM 0 HH21 ARG A 172 -9.250 -2.623 -18.681 1.00 0.00 H new ATOM 0 HH22 ARG A 172 -8.773 -1.101 -19.441 1.00 0.00 H new ATOM 676 N ASP A 173 -12.785 1.217 -11.096 1.00 0.00 N ATOM 677 CA ASP A 173 -13.459 1.885 -9.993 1.00 0.00 C ATOM 678 C ASP A 173 -12.771 3.250 -9.864 1.00 0.00 C ATOM 679 O ASP A 173 -12.416 3.854 -10.873 1.00 0.00 O ATOM 680 CB ASP A 173 -13.368 1.052 -8.698 1.00 0.00 C ATOM 681 CG ASP A 173 -14.096 -0.287 -8.771 1.00 0.00 C ATOM 682 OD1 ASP A 173 -15.332 -0.268 -8.588 1.00 0.00 O ATOM 683 OD2 ASP A 173 -13.400 -1.307 -8.970 1.00 0.00 O ATOM 0 H ASP A 173 -11.844 1.583 -11.241 1.00 0.00 H new ATOM 0 HA ASP A 173 -14.527 2.005 -10.175 1.00 0.00 H new ATOM 0 HB2 ASP A 173 -12.318 0.871 -8.467 1.00 0.00 H new ATOM 0 HB3 ASP A 173 -13.780 1.634 -7.874 1.00 0.00 H new ATOM 688 N ASN A 174 -12.518 3.721 -8.644 1.00 0.00 N ATOM 689 CA ASN A 174 -11.791 4.938 -8.298 1.00 0.00 C ATOM 690 C ASN A 174 -10.987 4.575 -7.050 1.00 0.00 C ATOM 691 O ASN A 174 -11.158 3.479 -6.518 1.00 0.00 O ATOM 692 CB ASN A 174 -12.757 6.102 -7.999 1.00 0.00 C ATOM 693 CG ASN A 174 -13.099 7.015 -9.178 1.00 0.00 C ATOM 694 OD1 ASN A 174 -13.382 8.190 -8.972 1.00 0.00 O ATOM 695 ND2 ASN A 174 -13.064 6.538 -10.417 1.00 0.00 N ATOM 0 H ASN A 174 -12.840 3.225 -7.813 1.00 0.00 H new ATOM 0 HA ASN A 174 -11.156 5.274 -9.118 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -13.685 5.685 -7.608 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -12.323 6.713 -7.207 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -13.273 7.150 -11.205 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -12.828 5.559 -10.580 1.00 0.00 H new ATOM 702 N LYS A 175 -10.120 5.476 -6.579 1.00 0.00 N ATOM 703 CA LYS A 175 -9.295 5.265 -5.393 1.00 0.00 C ATOM 704 C LYS A 175 -10.077 4.669 -4.215 1.00 0.00 C ATOM 705 O LYS A 175 -9.600 3.762 -3.534 1.00 0.00 O ATOM 706 CB LYS A 175 -8.587 6.575 -5.014 1.00 0.00 C ATOM 707 CG LYS A 175 -9.528 7.768 -4.781 1.00 0.00 C ATOM 708 CD LYS A 175 -8.695 9.028 -4.511 1.00 0.00 C ATOM 709 CE LYS A 175 -9.580 10.243 -4.203 1.00 0.00 C ATOM 710 NZ LYS A 175 -10.431 10.616 -5.347 1.00 0.00 N ATOM 0 H LYS A 175 -9.972 6.384 -7.019 1.00 0.00 H new ATOM 0 HA LYS A 175 -8.541 4.518 -5.641 1.00 0.00 H new ATOM 0 HB2 LYS A 175 -8.003 6.408 -4.109 1.00 0.00 H new ATOM 0 HB3 LYS A 175 -7.883 6.834 -5.805 1.00 0.00 H new ATOM 0 HG2 LYS A 175 -10.164 7.919 -5.653 1.00 0.00 H new ATOM 0 HG3 LYS A 175 -10.187 7.566 -3.936 1.00 0.00 H new ATOM 0 HD2 LYS A 175 -8.023 8.846 -3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 175 -8.071 9.244 -5.378 1.00 0.00 H new ATOM 0 HE2 LYS A 175 -10.209 10.023 -3.341 1.00 0.00 H new ATOM 0 HE3 LYS A 175 -8.950 11.089 -3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 -10.935 11.499 -5.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 -9.838 10.753 -6.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 -11.121 9.859 -5.528 1.00 0.00 H new ATOM 724 N ASP A 176 -11.301 5.151 -3.996 1.00 0.00 N ATOM 725 CA ASP A 176 -12.202 4.703 -2.938 1.00 0.00 C ATOM 726 C ASP A 176 -12.887 3.381 -3.312 1.00 0.00 C ATOM 727 O ASP A 176 -14.105 3.254 -3.233 1.00 0.00 O ATOM 728 CB ASP A 176 -13.219 5.816 -2.625 1.00 0.00 C ATOM 729 CG ASP A 176 -14.097 6.184 -3.822 1.00 0.00 C ATOM 730 OD1 ASP A 176 -13.506 6.507 -4.878 1.00 0.00 O ATOM 731 OD2 ASP A 176 -15.336 6.164 -3.656 1.00 0.00 O ATOM 0 H ASP A 176 -11.705 5.890 -4.572 1.00 0.00 H new ATOM 0 HA ASP A 176 -11.624 4.504 -2.035 1.00 0.00 H new ATOM 0 HB2 ASP A 176 -13.856 5.496 -1.800 1.00 0.00 H new ATOM 0 HB3 ASP A 176 -12.684 6.704 -2.288 1.00 0.00 H new ATOM 736 N CYS A 177 -12.092 2.385 -3.701 1.00 0.00 N ATOM 737 CA CYS A 177 -12.565 1.052 -4.051 1.00 0.00 C ATOM 738 C CYS A 177 -12.780 0.259 -2.758 1.00 0.00 C ATOM 739 O CYS A 177 -12.127 0.520 -1.747 1.00 0.00 O ATOM 740 CB CYS A 177 -11.522 0.421 -4.978 1.00 0.00 C ATOM 741 SG CYS A 177 -11.836 -1.193 -5.742 1.00 0.00 S ATOM 0 H CYS A 177 -11.080 2.487 -3.782 1.00 0.00 H new ATOM 0 HA CYS A 177 -13.519 1.068 -4.579 1.00 0.00 H new ATOM 0 HB2 CYS A 177 -11.337 1.130 -5.785 1.00 0.00 H new ATOM 0 HB3 CYS A 177 -10.595 0.335 -4.410 1.00 0.00 H new ATOM 0 HG CYS A 177 -11.307 -1.222 -6.929 1.00 0.00 H new ATOM 746 N LEU A 178 -13.703 -0.705 -2.773 1.00 0.00 N ATOM 747 CA LEU A 178 -14.014 -1.513 -1.601 1.00 0.00 C ATOM 748 C LEU A 178 -12.916 -2.562 -1.390 1.00 0.00 C ATOM 749 O LEU A 178 -13.093 -3.726 -1.748 1.00 0.00 O ATOM 750 CB LEU A 178 -15.408 -2.137 -1.777 1.00 0.00 C ATOM 751 CG LEU A 178 -15.927 -2.864 -0.523 1.00 0.00 C ATOM 752 CD1 LEU A 178 -16.288 -1.885 0.602 1.00 0.00 C ATOM 753 CD2 LEU A 178 -17.166 -3.686 -0.891 1.00 0.00 C ATOM 0 H LEU A 178 -14.253 -0.944 -3.598 1.00 0.00 H new ATOM 0 HA LEU A 178 -14.040 -0.897 -0.702 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -16.115 -1.353 -2.050 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -15.378 -2.842 -2.608 1.00 0.00 H new ATOM 0 HG LEU A 178 -15.129 -3.512 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -16.649 -2.442 1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -15.404 -1.312 0.883 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -17.067 -1.205 0.257 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -17.536 -4.202 -0.005 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -17.941 -3.023 -1.275 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.903 -4.418 -1.654 1.00 0.00 H new ATOM 765 N ILE A 179 -11.772 -2.149 -0.842 1.00 0.00 N ATOM 766 CA ILE A 179 -10.639 -3.034 -0.588 1.00 0.00 C ATOM 767 C ILE A 179 -10.861 -3.821 0.705 1.00 0.00 C ATOM 768 O ILE A 179 -11.221 -3.243 1.726 1.00 0.00 O ATOM 769 CB ILE A 179 -9.322 -2.233 -0.507 1.00 0.00 C ATOM 770 CG1 ILE A 179 -9.112 -1.301 -1.710 1.00 0.00 C ATOM 771 CG2 ILE A 179 -8.114 -3.174 -0.373 1.00 0.00 C ATOM 772 CD1 ILE A 179 -8.934 -2.049 -3.029 1.00 0.00 C ATOM 0 H ILE A 179 -11.607 -1.183 -0.560 1.00 0.00 H new ATOM 0 HA ILE A 179 -10.561 -3.735 -1.419 1.00 0.00 H new ATOM 0 HB ILE A 179 -9.405 -1.609 0.383 1.00 0.00 H new ATOM 0 HG12 ILE A 179 -9.966 -0.629 -1.794 1.00 0.00 H new ATOM 0 HG13 ILE A 179 -8.234 -0.680 -1.531 1.00 0.00 H new ATOM 0 HG21 ILE A 179 -7.198 -2.585 -0.318 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -8.217 -3.771 0.533 1.00 0.00 H new ATOM 0 HG23 ILE A 179 -8.069 -3.834 -1.239 1.00 0.00 H new ATOM 0 HD11 ILE A 179 -8.790 -1.332 -3.837 1.00 0.00 H new ATOM 0 HD12 ILE A 179 -8.063 -2.701 -2.963 1.00 0.00 H new ATOM 0 HD13 ILE A 179 -9.822 -2.649 -3.230 1.00 0.00 H new ATOM 784 N ASP A 180 -10.615 -5.133 0.663 1.00 0.00 N ATOM 785 CA ASP A 180 -10.688 -6.044 1.796 1.00 0.00 C ATOM 786 C ASP A 180 -9.734 -7.201 1.499 1.00 0.00 C ATOM 787 O ASP A 180 -9.080 -7.211 0.452 1.00 0.00 O ATOM 788 CB ASP A 180 -12.124 -6.574 1.970 1.00 0.00 C ATOM 789 CG ASP A 180 -13.093 -5.526 2.505 1.00 0.00 C ATOM 790 OD1 ASP A 180 -12.929 -5.155 3.687 1.00 0.00 O ATOM 791 OD2 ASP A 180 -14.005 -5.150 1.736 1.00 0.00 O ATOM 0 H ASP A 180 -10.348 -5.604 -0.201 1.00 0.00 H new ATOM 0 HA ASP A 180 -10.411 -5.534 2.719 1.00 0.00 H new ATOM 0 HB2 ASP A 180 -12.488 -6.939 1.010 1.00 0.00 H new ATOM 0 HB3 ASP A 180 -12.110 -7.426 2.650 1.00 0.00 H new ATOM 921 N CYS A 187 -5.595 -5.617 -5.997 1.00 0.00 N ATOM 922 CA CYS A 187 -6.085 -4.319 -6.456 1.00 0.00 C ATOM 923 C CYS A 187 -5.002 -3.227 -6.367 1.00 0.00 C ATOM 924 O CYS A 187 -5.134 -2.269 -5.605 1.00 0.00 O ATOM 925 CB CYS A 187 -7.363 -4.003 -5.675 1.00 0.00 C ATOM 926 SG CYS A 187 -8.391 -2.686 -6.357 1.00 0.00 S ATOM 0 HA CYS A 187 -6.330 -4.352 -7.518 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -7.962 -4.911 -5.612 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -7.087 -3.732 -4.656 1.00 0.00 H new ATOM 0 HG CYS A 187 -9.485 -2.586 -5.662 1.00 0.00 H new ATOM 931 N GLN A 188 -3.926 -3.393 -7.150 1.00 0.00 N ATOM 932 CA GLN A 188 -2.736 -2.537 -7.189 1.00 0.00 C ATOM 933 C GLN A 188 -3.046 -1.038 -7.027 1.00 0.00 C ATOM 934 O GLN A 188 -2.640 -0.424 -6.042 1.00 0.00 O ATOM 935 CB GLN A 188 -1.929 -2.776 -8.481 1.00 0.00 C ATOM 936 CG GLN A 188 -1.680 -4.240 -8.875 1.00 0.00 C ATOM 937 CD GLN A 188 -1.117 -5.112 -7.755 1.00 0.00 C ATOM 938 OE1 GLN A 188 -0.070 -4.824 -7.189 1.00 0.00 O ATOM 939 NE2 GLN A 188 -1.810 -6.194 -7.434 1.00 0.00 N ATOM 0 H GLN A 188 -3.861 -4.170 -7.807 1.00 0.00 H new ATOM 0 HA GLN A 188 -2.137 -2.825 -6.325 1.00 0.00 H new ATOM 0 HB2 GLN A 188 -2.450 -2.286 -9.304 1.00 0.00 H new ATOM 0 HB3 GLN A 188 -0.963 -2.282 -8.376 1.00 0.00 H new ATOM 0 HG2 GLN A 188 -2.618 -4.675 -9.219 1.00 0.00 H new ATOM 0 HG3 GLN A 188 -0.989 -4.263 -9.718 1.00 0.00 H new ATOM 0 HE21 GLN A 188 -2.679 -6.407 -7.924 1.00 0.00 H new ATOM 0 HE22 GLN A 188 -1.475 -6.814 -6.697 1.00 0.00 H new ATOM 948 N TYR A 189 -3.740 -0.445 -8.005 1.00 0.00 N ATOM 949 CA TYR A 189 -4.048 0.982 -8.030 1.00 0.00 C ATOM 950 C TYR A 189 -4.609 1.471 -6.707 1.00 0.00 C ATOM 951 O TYR A 189 -4.016 2.302 -6.025 1.00 0.00 O ATOM 952 CB TYR A 189 -5.063 1.287 -9.140 1.00 0.00 C ATOM 953 CG TYR A 189 -5.544 2.730 -9.189 1.00 0.00 C ATOM 954 CD1 TYR A 189 -4.624 3.796 -9.191 1.00 0.00 C ATOM 955 CD2 TYR A 189 -6.922 3.010 -9.152 1.00 0.00 C ATOM 956 CE1 TYR A 189 -5.082 5.125 -9.132 1.00 0.00 C ATOM 957 CE2 TYR A 189 -7.379 4.336 -9.093 1.00 0.00 C ATOM 958 CZ TYR A 189 -6.459 5.395 -9.058 1.00 0.00 C ATOM 959 OH TYR A 189 -6.908 6.654 -8.796 1.00 0.00 O ATOM 0 H TYR A 189 -4.107 -0.953 -8.810 1.00 0.00 H new ATOM 0 HA TYR A 189 -3.110 1.504 -8.219 1.00 0.00 H new ATOM 0 HB2 TYR A 189 -4.615 1.036 -10.101 1.00 0.00 H new ATOM 0 HB3 TYR A 189 -5.927 0.635 -9.011 1.00 0.00 H new ATOM 0 HD1 TYR A 189 -3.564 3.593 -9.238 1.00 0.00 H new ATOM 0 HD2 TYR A 189 -7.634 2.198 -9.169 1.00 0.00 H new ATOM 0 HE1 TYR A 189 -4.373 5.940 -9.144 1.00 0.00 H new ATOM 0 HE2 TYR A 189 -8.439 4.541 -9.075 1.00 0.00 H new ATOM 0 HH TYR A 189 -6.404 7.032 -8.045 1.00 0.00 H new ATOM 969 N CYS A 190 -5.787 0.967 -6.371 1.00 0.00 N ATOM 970 CA CYS A 190 -6.498 1.381 -5.189 1.00 0.00 C ATOM 971 C CYS A 190 -5.648 1.139 -3.949 1.00 0.00 C ATOM 972 O CYS A 190 -5.576 2.017 -3.103 1.00 0.00 O ATOM 973 CB CYS A 190 -7.826 0.652 -5.158 1.00 0.00 C ATOM 974 SG CYS A 190 -8.832 0.950 -6.640 1.00 0.00 S ATOM 0 H CYS A 190 -6.272 0.256 -6.919 1.00 0.00 H new ATOM 0 HA CYS A 190 -6.701 2.452 -5.205 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -7.645 -0.418 -5.057 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -8.386 0.965 -4.276 1.00 0.00 H new ATOM 0 HG CYS A 190 -9.071 -0.180 -7.237 1.00 0.00 H new ATOM 979 N ARG A 191 -4.969 -0.004 -3.838 1.00 0.00 N ATOM 980 CA ARG A 191 -4.091 -0.258 -2.700 1.00 0.00 C ATOM 981 C ARG A 191 -3.033 0.852 -2.570 1.00 0.00 C ATOM 982 O ARG A 191 -2.820 1.392 -1.483 1.00 0.00 O ATOM 983 CB ARG A 191 -3.465 -1.651 -2.830 1.00 0.00 C ATOM 984 CG ARG A 191 -4.523 -2.726 -2.535 1.00 0.00 C ATOM 985 CD ARG A 191 -4.068 -4.144 -2.888 1.00 0.00 C ATOM 986 NE ARG A 191 -2.826 -4.521 -2.203 1.00 0.00 N ATOM 987 CZ ARG A 191 -1.589 -4.415 -2.709 1.00 0.00 C ATOM 988 NH1 ARG A 191 -1.393 -3.912 -3.932 1.00 0.00 N ATOM 989 NH2 ARG A 191 -0.547 -4.836 -1.990 1.00 0.00 N ATOM 0 H ARG A 191 -5.011 -0.763 -4.519 1.00 0.00 H new ATOM 0 HA ARG A 191 -4.674 -0.242 -1.779 1.00 0.00 H new ATOM 0 HB2 ARG A 191 -3.065 -1.788 -3.835 1.00 0.00 H new ATOM 0 HB3 ARG A 191 -2.629 -1.750 -2.137 1.00 0.00 H new ATOM 0 HG2 ARG A 191 -4.782 -2.689 -1.477 1.00 0.00 H new ATOM 0 HG3 ARG A 191 -5.430 -2.495 -3.093 1.00 0.00 H new ATOM 0 HD2 ARG A 191 -4.854 -4.851 -2.624 1.00 0.00 H new ATOM 0 HD3 ARG A 191 -3.922 -4.218 -3.966 1.00 0.00 H new ATOM 0 HE ARG A 191 -2.911 -4.897 -1.259 1.00 0.00 H new ATOM 0 HH11 ARG A 191 -2.189 -3.604 -4.490 1.00 0.00 H new ATOM 0 HH12 ARG A 191 -0.447 -3.836 -4.307 1.00 0.00 H new ATOM 0 HH21 ARG A 191 -0.695 -5.235 -1.063 1.00 0.00 H new ATOM 0 HH22 ARG A 191 0.397 -4.759 -2.367 1.00 0.00 H new ATOM 1003 N TYR A 192 -2.392 1.226 -3.681 1.00 0.00 N ATOM 1004 CA TYR A 192 -1.412 2.308 -3.706 1.00 0.00 C ATOM 1005 C TYR A 192 -2.068 3.629 -3.282 1.00 0.00 C ATOM 1006 O TYR A 192 -1.551 4.336 -2.416 1.00 0.00 O ATOM 1007 CB TYR A 192 -0.786 2.371 -5.107 1.00 0.00 C ATOM 1008 CG TYR A 192 0.138 3.531 -5.422 1.00 0.00 C ATOM 1009 CD1 TYR A 192 1.209 3.849 -4.565 1.00 0.00 C ATOM 1010 CD2 TYR A 192 0.091 4.091 -6.713 1.00 0.00 C ATOM 1011 CE1 TYR A 192 2.266 4.656 -5.027 1.00 0.00 C ATOM 1012 CE2 TYR A 192 1.135 4.915 -7.162 1.00 0.00 C ATOM 1013 CZ TYR A 192 2.253 5.144 -6.347 1.00 0.00 C ATOM 1014 OH TYR A 192 3.379 5.698 -6.882 1.00 0.00 O ATOM 0 H TYR A 192 -2.540 0.784 -4.588 1.00 0.00 H new ATOM 0 HA TYR A 192 -0.612 2.122 -2.990 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -0.229 1.448 -5.266 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -1.597 2.383 -5.835 1.00 0.00 H new ATOM 0 HD1 TYR A 192 1.220 3.474 -3.552 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -0.750 3.886 -7.359 1.00 0.00 H new ATOM 0 HE1 TYR A 192 3.087 4.901 -4.369 1.00 0.00 H new ATOM 0 HE2 TYR A 192 1.077 5.374 -8.138 1.00 0.00 H new ATOM 0 HH TYR A 192 3.486 5.392 -7.807 1.00 0.00 H new ATOM 1024 N GLN A 193 -3.222 3.963 -3.865 1.00 0.00 N ATOM 1025 CA GLN A 193 -3.950 5.171 -3.512 1.00 0.00 C ATOM 1026 C GLN A 193 -4.291 5.189 -2.018 1.00 0.00 C ATOM 1027 O GLN A 193 -4.091 6.207 -1.366 1.00 0.00 O ATOM 1028 CB GLN A 193 -5.218 5.283 -4.360 1.00 0.00 C ATOM 1029 CG GLN A 193 -4.972 5.406 -5.869 1.00 0.00 C ATOM 1030 CD GLN A 193 -4.469 6.778 -6.302 1.00 0.00 C ATOM 1031 OE1 GLN A 193 -5.225 7.573 -6.854 1.00 0.00 O ATOM 1032 NE2 GLN A 193 -3.184 7.055 -6.109 1.00 0.00 N ATOM 0 H GLN A 193 -3.671 3.403 -4.590 1.00 0.00 H new ATOM 0 HA GLN A 193 -3.314 6.032 -3.717 1.00 0.00 H new ATOM 0 HB2 GLN A 193 -5.839 4.406 -4.177 1.00 0.00 H new ATOM 0 HB3 GLN A 193 -5.786 6.151 -4.026 1.00 0.00 H new ATOM 0 HG2 GLN A 193 -4.246 4.651 -6.172 1.00 0.00 H new ATOM 0 HG3 GLN A 193 -5.900 5.186 -6.398 1.00 0.00 H new ATOM 0 HE21 GLN A 193 -2.580 6.375 -5.647 1.00 0.00 H new ATOM 0 HE22 GLN A 193 -2.802 7.947 -6.422 1.00 0.00 H new ATOM 1041 N LYS A 194 -4.782 4.076 -1.470 1.00 0.00 N ATOM 1042 CA LYS A 194 -5.113 3.934 -0.060 1.00 0.00 C ATOM 1043 C LYS A 194 -3.862 4.224 0.772 1.00 0.00 C ATOM 1044 O LYS A 194 -3.905 5.043 1.688 1.00 0.00 O ATOM 1045 CB LYS A 194 -5.640 2.515 0.218 1.00 0.00 C ATOM 1046 CG LYS A 194 -7.061 2.231 -0.291 1.00 0.00 C ATOM 1047 CD LYS A 194 -8.152 3.031 0.433 1.00 0.00 C ATOM 1048 CE LYS A 194 -9.533 2.398 0.214 1.00 0.00 C ATOM 1049 NZ LYS A 194 -9.823 2.155 -1.211 1.00 0.00 N ATOM 0 H LYS A 194 -4.963 3.231 -2.012 1.00 0.00 H new ATOM 0 HA LYS A 194 -5.896 4.642 0.213 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -4.958 1.796 -0.237 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -5.615 2.340 1.294 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -7.106 2.455 -1.357 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -7.270 1.167 -0.180 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -7.931 3.072 1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -8.157 4.059 0.069 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -9.587 1.455 0.758 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -10.299 3.052 0.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -10.792 1.790 -1.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -9.732 3.045 -1.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -9.150 1.458 -1.588 1.00 0.00 H new ATOM 1063 N ALA A 195 -2.747 3.563 0.441 1.00 0.00 N ATOM 1064 CA ALA A 195 -1.476 3.753 1.126 1.00 0.00 C ATOM 1065 C ALA A 195 -1.100 5.237 1.189 1.00 0.00 C ATOM 1066 O ALA A 195 -0.789 5.769 2.256 1.00 0.00 O ATOM 1067 CB ALA A 195 -0.386 2.956 0.407 1.00 0.00 C ATOM 0 H ALA A 195 -2.707 2.879 -0.315 1.00 0.00 H new ATOM 0 HA ALA A 195 -1.573 3.392 2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 195 0.566 3.098 0.919 1.00 0.00 H new ATOM 0 HB2 ALA A 195 -0.646 1.898 0.411 1.00 0.00 H new ATOM 0 HB3 ALA A 195 -0.300 3.304 -0.622 1.00 0.00 H new ATOM 1073 N LEU A 196 -1.129 5.909 0.035 1.00 0.00 N ATOM 1074 CA LEU A 196 -0.804 7.322 -0.038 1.00 0.00 C ATOM 1075 C LEU A 196 -1.791 8.145 0.793 1.00 0.00 C ATOM 1076 O LEU A 196 -1.385 8.923 1.653 1.00 0.00 O ATOM 1077 CB LEU A 196 -0.789 7.769 -1.506 1.00 0.00 C ATOM 1078 CG LEU A 196 0.339 7.138 -2.343 1.00 0.00 C ATOM 1079 CD1 LEU A 196 0.096 7.461 -3.821 1.00 0.00 C ATOM 1080 CD2 LEU A 196 1.726 7.655 -1.936 1.00 0.00 C ATOM 0 H LEU A 196 -1.376 5.488 -0.861 1.00 0.00 H new ATOM 0 HA LEU A 196 0.188 7.489 0.382 1.00 0.00 H new ATOM 0 HB2 LEU A 196 -1.748 7.519 -1.961 1.00 0.00 H new ATOM 0 HB3 LEU A 196 -0.691 8.854 -1.543 1.00 0.00 H new ATOM 0 HG LEU A 196 0.325 6.062 -2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 196 0.889 7.019 -4.425 1.00 0.00 H new ATOM 0 HD12 LEU A 196 -0.866 7.052 -4.129 1.00 0.00 H new ATOM 0 HD13 LEU A 196 0.092 8.542 -3.961 1.00 0.00 H new ATOM 0 HD21 LEU A 196 2.487 7.180 -2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 196 1.767 8.735 -2.075 1.00 0.00 H new ATOM 0 HD23 LEU A 196 1.910 7.417 -0.888 1.00 0.00 H new ATOM 1092 N ALA A 197 -3.087 7.964 0.542 1.00 0.00 N ATOM 1093 CA ALA A 197 -4.173 8.670 1.212 1.00 0.00 C ATOM 1094 C ALA A 197 -4.064 8.584 2.734 1.00 0.00 C ATOM 1095 O ALA A 197 -4.223 9.592 3.418 1.00 0.00 O ATOM 1096 CB ALA A 197 -5.520 8.127 0.731 1.00 0.00 C ATOM 0 H ALA A 197 -3.419 7.299 -0.157 1.00 0.00 H new ATOM 0 HA ALA A 197 -4.097 9.725 0.950 1.00 0.00 H new ATOM 0 HB1 ALA A 197 -6.327 8.658 1.235 1.00 0.00 H new ATOM 0 HB2 ALA A 197 -5.607 8.272 -0.346 1.00 0.00 H new ATOM 0 HB3 ALA A 197 -5.587 7.064 0.961 1.00 0.00 H new ATOM 1102 N MET A 198 -3.789 7.391 3.270 1.00 0.00 N ATOM 1103 CA MET A 198 -3.655 7.196 4.711 1.00 0.00 C ATOM 1104 C MET A 198 -2.310 7.698 5.250 1.00 0.00 C ATOM 1105 O MET A 198 -2.085 7.665 6.458 1.00 0.00 O ATOM 1106 CB MET A 198 -3.995 5.749 5.090 1.00 0.00 C ATOM 1107 CG MET A 198 -5.526 5.616 5.106 1.00 0.00 C ATOM 1108 SD MET A 198 -6.218 3.959 5.305 1.00 0.00 S ATOM 1109 CE MET A 198 -5.741 3.254 3.720 1.00 0.00 C ATOM 0 H MET A 198 -3.655 6.542 2.720 1.00 0.00 H new ATOM 0 HA MET A 198 -4.389 7.824 5.216 1.00 0.00 H new ATOM 0 HB2 MET A 198 -3.558 5.054 4.373 1.00 0.00 H new ATOM 0 HB3 MET A 198 -3.580 5.502 6.067 1.00 0.00 H new ATOM 0 HG2 MET A 198 -5.909 6.240 5.914 1.00 0.00 H new ATOM 0 HG3 MET A 198 -5.909 6.031 4.174 1.00 0.00 H new ATOM 0 HE1 MET A 198 -6.289 2.326 3.555 1.00 0.00 H new ATOM 0 HE2 MET A 198 -5.974 3.960 2.923 1.00 0.00 H new ATOM 0 HE3 MET A 198 -4.671 3.048 3.721 1.00 0.00 H new ATOM 1119 N GLY A 199 -1.439 8.221 4.383 1.00 0.00 N ATOM 1120 CA GLY A 199 -0.215 8.872 4.794 1.00 0.00 C ATOM 1121 C GLY A 199 0.953 7.925 5.002 1.00 0.00 C ATOM 1122 O GLY A 199 1.726 8.130 5.935 1.00 0.00 O ATOM 0 H GLY A 199 -1.574 8.199 3.372 1.00 0.00 H new ATOM 0 HA2 GLY A 199 0.061 9.611 4.042 1.00 0.00 H new ATOM 0 HA3 GLY A 199 -0.399 9.414 5.722 1.00 0.00 H new ATOM 1126 N MET A 200 1.136 6.929 4.128 1.00 0.00 N ATOM 1127 CA MET A 200 2.350 6.124 4.213 1.00 0.00 C ATOM 1128 C MET A 200 3.531 7.035 3.861 1.00 0.00 C ATOM 1129 O MET A 200 3.511 7.702 2.824 1.00 0.00 O ATOM 1130 CB MET A 200 2.298 4.899 3.291 1.00 0.00 C ATOM 1131 CG MET A 200 1.496 3.767 3.936 1.00 0.00 C ATOM 1132 SD MET A 200 1.722 2.135 3.193 1.00 0.00 S ATOM 1133 CE MET A 200 0.895 1.116 4.430 1.00 0.00 C ATOM 0 H MET A 200 0.487 6.671 3.385 1.00 0.00 H new ATOM 0 HA MET A 200 2.458 5.729 5.223 1.00 0.00 H new ATOM 0 HB2 MET A 200 1.846 5.174 2.338 1.00 0.00 H new ATOM 0 HB3 MET A 200 3.310 4.557 3.076 1.00 0.00 H new ATOM 0 HG2 MET A 200 1.766 3.708 4.990 1.00 0.00 H new ATOM 0 HG3 MET A 200 0.438 4.024 3.892 1.00 0.00 H new ATOM 0 HE1 MET A 200 0.751 0.110 4.036 1.00 0.00 H new ATOM 0 HE2 MET A 200 1.507 1.068 5.331 1.00 0.00 H new ATOM 0 HE3 MET A 200 -0.074 1.553 4.673 1.00 0.00 H new ATOM 1143 N LYS A 201 4.547 7.094 4.727 1.00 0.00 N ATOM 1144 CA LYS A 201 5.715 7.943 4.544 1.00 0.00 C ATOM 1145 C LYS A 201 6.551 7.424 3.373 1.00 0.00 C ATOM 1146 O LYS A 201 7.558 6.753 3.579 1.00 0.00 O ATOM 1147 CB LYS A 201 6.530 8.010 5.849 1.00 0.00 C ATOM 1148 CG LYS A 201 5.991 9.009 6.886 1.00 0.00 C ATOM 1149 CD LYS A 201 4.507 8.810 7.204 1.00 0.00 C ATOM 1150 CE LYS A 201 4.019 9.717 8.335 1.00 0.00 C ATOM 1151 NZ LYS A 201 2.591 9.471 8.607 1.00 0.00 N ATOM 0 H LYS A 201 4.576 6.543 5.585 1.00 0.00 H new ATOM 0 HA LYS A 201 5.399 8.958 4.304 1.00 0.00 H new ATOM 0 HB2 LYS A 201 6.555 7.017 6.298 1.00 0.00 H new ATOM 0 HB3 LYS A 201 7.559 8.276 5.607 1.00 0.00 H new ATOM 0 HG2 LYS A 201 6.568 8.914 7.806 1.00 0.00 H new ATOM 0 HG3 LYS A 201 6.144 10.023 6.517 1.00 0.00 H new ATOM 0 HD2 LYS A 201 3.918 9.005 6.308 1.00 0.00 H new ATOM 0 HD3 LYS A 201 4.335 7.769 7.478 1.00 0.00 H new ATOM 0 HE2 LYS A 201 4.605 9.534 9.236 1.00 0.00 H new ATOM 0 HE3 LYS A 201 4.170 10.762 8.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 2.115 10.374 8.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 2.151 9.024 7.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 2.498 8.841 9.429 1.00 0.00 H new ATOM 1165 N ARG A 202 6.126 7.744 2.147 1.00 0.00 N ATOM 1166 CA ARG A 202 6.756 7.360 0.889 1.00 0.00 C ATOM 1167 C ARG A 202 8.283 7.393 0.989 1.00 0.00 C ATOM 1168 O ARG A 202 8.946 6.404 0.692 1.00 0.00 O ATOM 1169 CB ARG A 202 6.223 8.277 -0.225 1.00 0.00 C ATOM 1170 CG ARG A 202 6.756 7.867 -1.601 1.00 0.00 C ATOM 1171 CD ARG A 202 6.038 8.613 -2.730 1.00 0.00 C ATOM 1172 NE ARG A 202 6.627 8.268 -4.035 1.00 0.00 N ATOM 1173 CZ ARG A 202 6.026 7.687 -5.088 1.00 0.00 C ATOM 1174 NH1 ARG A 202 4.749 7.288 -5.044 1.00 0.00 N ATOM 1175 NH2 ARG A 202 6.735 7.509 -6.206 1.00 0.00 N ATOM 0 H ARG A 202 5.288 8.308 2.002 1.00 0.00 H new ATOM 0 HA ARG A 202 6.499 6.328 0.650 1.00 0.00 H new ATOM 0 HB2 ARG A 202 5.134 8.245 -0.233 1.00 0.00 H new ATOM 0 HB3 ARG A 202 6.510 9.308 -0.016 1.00 0.00 H new ATOM 0 HG2 ARG A 202 7.826 8.070 -1.653 1.00 0.00 H new ATOM 0 HG3 ARG A 202 6.629 6.793 -1.736 1.00 0.00 H new ATOM 0 HD2 ARG A 202 4.978 8.359 -2.725 1.00 0.00 H new ATOM 0 HD3 ARG A 202 6.109 9.688 -2.566 1.00 0.00 H new ATOM 0 HE ARG A 202 7.613 8.498 -4.155 1.00 0.00 H new ATOM 0 HH11 ARG A 202 4.202 7.422 -4.194 1.00 0.00 H new ATOM 0 HH12 ARG A 202 4.323 6.850 -5.861 1.00 0.00 H new ATOM 0 HH21 ARG A 202 7.708 7.811 -6.246 1.00 0.00 H new ATOM 0 HH22 ARG A 202 6.303 7.071 -7.019 1.00 0.00 H new ATOM 1189 N GLU A 203 8.843 8.519 1.439 1.00 0.00 N ATOM 1190 CA GLU A 203 10.282 8.695 1.588 1.00 0.00 C ATOM 1191 C GLU A 203 10.967 7.547 2.344 1.00 0.00 C ATOM 1192 O GLU A 203 12.091 7.180 1.998 1.00 0.00 O ATOM 1193 CB GLU A 203 10.576 10.036 2.277 1.00 0.00 C ATOM 1194 CG GLU A 203 10.143 11.247 1.437 1.00 0.00 C ATOM 1195 CD GLU A 203 10.886 11.318 0.105 1.00 0.00 C ATOM 1196 OE1 GLU A 203 12.132 11.417 0.156 1.00 0.00 O ATOM 1197 OE2 GLU A 203 10.195 11.247 -0.934 1.00 0.00 O ATOM 0 H GLU A 203 8.301 9.339 1.712 1.00 0.00 H new ATOM 0 HA GLU A 203 10.702 8.689 0.582 1.00 0.00 H new ATOM 0 HB2 GLU A 203 10.063 10.065 3.238 1.00 0.00 H new ATOM 0 HB3 GLU A 203 11.644 10.106 2.483 1.00 0.00 H new ATOM 0 HG2 GLU A 203 9.070 11.193 1.251 1.00 0.00 H new ATOM 0 HG3 GLU A 203 10.323 12.162 2.001 1.00 0.00 H new ATOM 1204 N ALA A 204 10.310 6.971 3.355 1.00 0.00 N ATOM 1205 CA ALA A 204 10.862 5.881 4.151 1.00 0.00 C ATOM 1206 C ALA A 204 11.233 4.665 3.296 1.00 0.00 C ATOM 1207 O ALA A 204 12.122 3.904 3.672 1.00 0.00 O ATOM 1208 CB ALA A 204 9.900 5.511 5.281 1.00 0.00 C ATOM 0 H ALA A 204 9.373 7.253 3.643 1.00 0.00 H new ATOM 0 HA ALA A 204 11.794 6.232 4.595 1.00 0.00 H new ATOM 0 HB1 ALA A 204 10.324 4.696 5.868 1.00 0.00 H new ATOM 0 HB2 ALA A 204 9.743 6.377 5.924 1.00 0.00 H new ATOM 0 HB3 ALA A 204 8.946 5.196 4.858 1.00 0.00 H new ATOM 1214 N VAL A 205 10.613 4.498 2.122 1.00 0.00 N ATOM 1215 CA VAL A 205 10.958 3.429 1.188 1.00 0.00 C ATOM 1216 C VAL A 205 12.450 3.468 0.832 1.00 0.00 C ATOM 1217 O VAL A 205 13.026 2.454 0.443 1.00 0.00 O ATOM 1218 CB VAL A 205 10.072 3.550 -0.062 1.00 0.00 C ATOM 1219 CG1 VAL A 205 10.602 2.731 -1.241 1.00 0.00 C ATOM 1220 CG2 VAL A 205 8.637 3.133 0.285 1.00 0.00 C ATOM 0 H VAL A 205 9.858 5.102 1.796 1.00 0.00 H new ATOM 0 HA VAL A 205 10.773 2.463 1.657 1.00 0.00 H new ATOM 0 HB VAL A 205 10.087 4.593 -0.379 1.00 0.00 H new ATOM 0 HG11 VAL A 205 9.938 2.853 -2.097 1.00 0.00 H new ATOM 0 HG12 VAL A 205 11.601 3.078 -1.505 1.00 0.00 H new ATOM 0 HG13 VAL A 205 10.645 1.678 -0.963 1.00 0.00 H new ATOM 0 HG21 VAL A 205 8.009 3.219 -0.602 1.00 0.00 H new ATOM 0 HG22 VAL A 205 8.633 2.101 0.634 1.00 0.00 H new ATOM 0 HG23 VAL A 205 8.249 3.783 1.069 1.00 0.00 H new ATOM 1230 N GLN A 206 13.094 4.629 0.969 1.00 0.00 N ATOM 1231 CA GLN A 206 14.506 4.786 0.678 1.00 0.00 C ATOM 1232 C GLN A 206 15.391 4.269 1.824 1.00 0.00 C ATOM 1233 O GLN A 206 16.605 4.448 1.746 1.00 0.00 O ATOM 1234 CB GLN A 206 14.781 6.267 0.386 1.00 0.00 C ATOM 1235 CG GLN A 206 13.964 6.768 -0.817 1.00 0.00 C ATOM 1236 CD GLN A 206 13.926 8.289 -0.886 1.00 0.00 C ATOM 1237 OE1 GLN A 206 14.402 8.892 -1.842 1.00 0.00 O ATOM 1238 NE2 GLN A 206 13.352 8.914 0.134 1.00 0.00 N ATOM 0 H GLN A 206 12.641 5.486 1.287 1.00 0.00 H new ATOM 0 HA GLN A 206 14.759 4.184 -0.195 1.00 0.00 H new ATOM 0 HB2 GLN A 206 14.538 6.863 1.265 1.00 0.00 H new ATOM 0 HB3 GLN A 206 15.844 6.408 0.189 1.00 0.00 H new ATOM 0 HG2 GLN A 206 14.395 6.374 -1.737 1.00 0.00 H new ATOM 0 HG3 GLN A 206 12.947 6.382 -0.750 1.00 0.00 H new ATOM 0 HE21 GLN A 206 12.968 8.376 0.911 1.00 0.00 H new ATOM 0 HE22 GLN A 206 13.295 9.932 0.141 1.00 0.00 H new ATOM 1247 N GLU A 207 14.838 3.646 2.880 1.00 0.00 N ATOM 1248 CA GLU A 207 15.629 3.166 4.017 1.00 0.00 C ATOM 1249 C GLU A 207 16.883 2.401 3.568 1.00 0.00 C ATOM 1250 O GLU A 207 17.992 2.656 4.043 1.00 0.00 O ATOM 1251 CB GLU A 207 14.771 2.416 5.055 1.00 0.00 C ATOM 1252 CG GLU A 207 14.337 0.977 4.731 1.00 0.00 C ATOM 1253 CD GLU A 207 13.450 0.864 3.498 1.00 0.00 C ATOM 1254 OE1 GLU A 207 14.041 0.744 2.405 1.00 0.00 O ATOM 1255 OE2 GLU A 207 12.211 0.867 3.666 1.00 0.00 O ATOM 0 H GLU A 207 13.838 3.464 2.965 1.00 0.00 H new ATOM 0 HA GLU A 207 16.003 4.044 4.544 1.00 0.00 H new ATOM 0 HB2 GLU A 207 15.326 2.394 5.993 1.00 0.00 H new ATOM 0 HB3 GLU A 207 13.870 3.004 5.231 1.00 0.00 H new ATOM 0 HG2 GLU A 207 15.226 0.364 4.585 1.00 0.00 H new ATOM 0 HG3 GLU A 207 13.804 0.566 5.589 1.00 0.00 H new