USER MOD reduce.3.24.130724 H: found=0, std=0, add=653, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 654 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 60 CYS SG : rot 90:sc= -0.0288 USER MOD Set 1.2: A 90 MET CE :methyl 152:sc= -0.0888 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 138:sc= -1.5! (180deg=-3.94!) USER MOD Single : A 52 CYS SG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -156:sc= 0.178 (180deg=0.0166) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -0.525 K(o=-0.53,f=-3.2!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.3) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.39) USER MOD Single : A 76 MET CE :methyl 177:sc= -3.23! (180deg=-3.37!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.939 K(o=-0.94,f=-5.4!) USER MOD Single : A 86 THR OG1 : rot 9:sc= 0.694 USER MOD Single : A 89 ASN : amide:sc= -1.65 X(o=-1.7,f=-1.2) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -143:sc= -1.25 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 71:sc= 1.1 USER MOD Single : A 110 SER OG : rot 164:sc= -0.482 USER MOD Single : A 112 MET CE :methyl -134:sc= 0 (180deg=-0.0847) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 118 LYS NZ :NH3+ 165:sc=-0.00724 (180deg=-0.158) USER MOD Single : A 121 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.592) USER MOD Single : A 125 SER OG : rot 21:sc= 1.18 USER MOD ----------------------------------------------------------------- ATOM 117 N GLU A 47 16.732 -1.704 4.823 1.00 0.00 N ATOM 118 CA GLU A 47 15.751 -2.450 5.603 1.00 0.00 C ATOM 119 C GLU A 47 14.713 -1.512 6.210 1.00 0.00 C ATOM 120 O GLU A 47 13.518 -1.812 6.218 1.00 0.00 O ATOM 121 CB GLU A 47 16.446 -3.246 6.710 1.00 0.00 C ATOM 122 CG GLU A 47 17.427 -4.284 6.190 1.00 0.00 C ATOM 123 CD GLU A 47 16.734 -5.487 5.580 1.00 0.00 C ATOM 124 OE1 GLU A 47 16.242 -6.340 6.347 1.00 0.00 O ATOM 125 OE2 GLU A 47 16.684 -5.573 4.335 1.00 0.00 O ATOM 0 HA GLU A 47 15.242 -3.143 4.933 1.00 0.00 H new ATOM 0 HB2 GLU A 47 16.975 -2.554 7.365 1.00 0.00 H new ATOM 0 HB3 GLU A 47 15.690 -3.745 7.317 1.00 0.00 H new ATOM 0 HG2 GLU A 47 18.074 -3.825 5.443 1.00 0.00 H new ATOM 0 HG3 GLU A 47 18.068 -4.614 7.007 1.00 0.00 H new ATOM 132 N ASP A 48 15.176 -0.377 6.721 1.00 0.00 N ATOM 133 CA ASP A 48 14.289 0.606 7.332 1.00 0.00 C ATOM 134 C ASP A 48 13.435 1.299 6.273 1.00 0.00 C ATOM 135 O ASP A 48 12.267 1.609 6.508 1.00 0.00 O ATOM 136 CB ASP A 48 15.100 1.644 8.109 1.00 0.00 C ATOM 137 CG ASP A 48 15.352 1.224 9.544 1.00 0.00 C ATOM 138 OD1 ASP A 48 15.304 0.008 9.824 1.00 0.00 O ATOM 139 OD2 ASP A 48 15.597 2.112 10.387 1.00 0.00 O ATOM 0 H ASP A 48 16.162 -0.114 6.724 1.00 0.00 H new ATOM 0 HA ASP A 48 13.628 0.082 8.022 1.00 0.00 H new ATOM 0 HB2 ASP A 48 16.054 1.805 7.608 1.00 0.00 H new ATOM 0 HB3 ASP A 48 14.570 2.596 8.100 1.00 0.00 H new ATOM 144 N LEU A 49 14.027 1.538 5.108 1.00 0.00 N ATOM 145 CA LEU A 49 13.321 2.196 4.013 1.00 0.00 C ATOM 146 C LEU A 49 12.201 1.310 3.478 1.00 0.00 C ATOM 147 O LEU A 49 11.086 1.775 3.241 1.00 0.00 O ATOM 148 CB LEU A 49 14.297 2.541 2.886 1.00 0.00 C ATOM 149 CG LEU A 49 15.170 3.776 3.110 1.00 0.00 C ATOM 150 CD1 LEU A 49 16.373 3.755 2.179 1.00 0.00 C ATOM 151 CD2 LEU A 49 14.359 5.048 2.906 1.00 0.00 C ATOM 0 H LEU A 49 14.993 1.287 4.897 1.00 0.00 H new ATOM 0 HA LEU A 49 12.880 3.116 4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 49 14.950 1.684 2.723 1.00 0.00 H new ATOM 0 HB3 LEU A 49 13.726 2.686 1.969 1.00 0.00 H new ATOM 0 HG LEU A 49 15.531 3.760 4.138 1.00 0.00 H new ATOM 0 HD11 LEU A 49 16.983 4.642 2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 49 16.967 2.862 2.373 1.00 0.00 H new ATOM 0 HD13 LEU A 49 16.032 3.746 1.144 1.00 0.00 H new ATOM 0 HD21 LEU A 49 14.997 5.916 3.070 1.00 0.00 H new ATOM 0 HD22 LEU A 49 13.968 5.071 1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 49 13.530 5.068 3.613 1.00 0.00 H new ATOM 163 N LYS A 50 12.504 0.030 3.290 1.00 0.00 N ATOM 164 CA LYS A 50 11.523 -0.924 2.786 1.00 0.00 C ATOM 165 C LYS A 50 10.381 -1.105 3.779 1.00 0.00 C ATOM 166 O LYS A 50 9.212 -1.142 3.395 1.00 0.00 O ATOM 167 CB LYS A 50 12.189 -2.273 2.506 1.00 0.00 C ATOM 168 CG LYS A 50 11.217 -3.440 2.498 1.00 0.00 C ATOM 169 CD LYS A 50 11.891 -4.723 2.040 1.00 0.00 C ATOM 170 CE LYS A 50 12.094 -4.739 0.532 1.00 0.00 C ATOM 171 NZ LYS A 50 13.283 -3.941 0.124 1.00 0.00 N ATOM 0 H LYS A 50 13.422 -0.371 3.479 1.00 0.00 H new ATOM 0 HA LYS A 50 11.113 -0.529 1.856 1.00 0.00 H new ATOM 0 HB2 LYS A 50 12.695 -2.226 1.542 1.00 0.00 H new ATOM 0 HB3 LYS A 50 12.955 -2.454 3.260 1.00 0.00 H new ATOM 0 HG2 LYS A 50 10.807 -3.580 3.498 1.00 0.00 H new ATOM 0 HG3 LYS A 50 10.379 -3.213 1.839 1.00 0.00 H new ATOM 0 HD2 LYS A 50 12.854 -4.827 2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 50 11.285 -5.579 2.336 1.00 0.00 H new ATOM 0 HE2 LYS A 50 12.213 -5.768 0.193 1.00 0.00 H new ATOM 0 HE3 LYS A 50 11.205 -4.343 0.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 13.809 -4.453 -0.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 12.972 -3.021 -0.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 13.899 -3.790 0.948 1.00 0.00 H new ATOM 185 N GLU A 51 10.726 -1.215 5.059 1.00 0.00 N ATOM 186 CA GLU A 51 9.727 -1.391 6.107 1.00 0.00 C ATOM 187 C GLU A 51 8.758 -0.213 6.138 1.00 0.00 C ATOM 188 O GLU A 51 7.544 -0.397 6.237 1.00 0.00 O ATOM 189 CB GLU A 51 10.407 -1.543 7.469 1.00 0.00 C ATOM 190 CG GLU A 51 10.768 -2.978 7.812 1.00 0.00 C ATOM 191 CD GLU A 51 9.593 -3.758 8.368 1.00 0.00 C ATOM 192 OE1 GLU A 51 8.667 -4.069 7.591 1.00 0.00 O ATOM 193 OE2 GLU A 51 9.598 -4.057 9.581 1.00 0.00 O ATOM 0 H GLU A 51 11.689 -1.185 5.394 1.00 0.00 H new ATOM 0 HA GLU A 51 9.162 -2.297 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.312 -0.936 7.483 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.747 -1.149 8.241 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.141 -3.478 6.918 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.579 -2.981 8.541 1.00 0.00 H new ATOM 200 N CYS A 52 9.303 0.996 6.054 1.00 0.00 N ATOM 201 CA CYS A 52 8.486 2.205 6.075 1.00 0.00 C ATOM 202 C CYS A 52 7.505 2.218 4.907 1.00 0.00 C ATOM 203 O CYS A 52 6.332 2.556 5.072 1.00 0.00 O ATOM 204 CB CYS A 52 9.377 3.447 6.022 1.00 0.00 C ATOM 205 SG CYS A 52 8.611 4.934 6.709 1.00 0.00 S ATOM 0 H CYS A 52 10.305 1.165 5.971 1.00 0.00 H new ATOM 0 HA CYS A 52 7.916 2.214 7.004 1.00 0.00 H new ATOM 0 HB2 CYS A 52 10.300 3.243 6.565 1.00 0.00 H new ATOM 0 HB3 CYS A 52 9.653 3.639 4.985 1.00 0.00 H new ATOM 0 HG CYS A 52 9.442 5.930 6.621 1.00 0.00 H new ATOM 211 N LEU A 53 7.991 1.849 3.728 1.00 0.00 N ATOM 212 CA LEU A 53 7.157 1.820 2.531 1.00 0.00 C ATOM 213 C LEU A 53 5.986 0.858 2.708 1.00 0.00 C ATOM 214 O LEU A 53 4.861 1.153 2.305 1.00 0.00 O ATOM 215 CB LEU A 53 7.990 1.410 1.315 1.00 0.00 C ATOM 216 CG LEU A 53 7.208 0.879 0.114 1.00 0.00 C ATOM 217 CD1 LEU A 53 6.163 1.890 -0.331 1.00 0.00 C ATOM 218 CD2 LEU A 53 8.151 0.544 -1.032 1.00 0.00 C ATOM 0 H LEU A 53 8.959 1.565 3.574 1.00 0.00 H new ATOM 0 HA LEU A 53 6.759 2.822 2.370 1.00 0.00 H new ATOM 0 HB2 LEU A 53 8.573 2.273 0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.700 0.645 1.628 1.00 0.00 H new ATOM 0 HG LEU A 53 6.695 -0.035 0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.616 1.495 -1.187 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.468 2.080 0.487 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.654 2.821 -0.613 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.576 0.167 -1.878 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.692 1.441 -1.332 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.861 -0.217 -0.708 1.00 0.00 H new ATOM 230 N LYS A 54 6.258 -0.292 3.314 1.00 0.00 N ATOM 231 CA LYS A 54 5.228 -1.297 3.547 1.00 0.00 C ATOM 232 C LYS A 54 4.144 -0.759 4.475 1.00 0.00 C ATOM 233 O LYS A 54 2.955 -1.006 4.268 1.00 0.00 O ATOM 234 CB LYS A 54 5.846 -2.562 4.148 1.00 0.00 C ATOM 235 CG LYS A 54 4.831 -3.650 4.451 1.00 0.00 C ATOM 236 CD LYS A 54 5.508 -4.939 4.886 1.00 0.00 C ATOM 237 CE LYS A 54 4.551 -5.840 5.651 1.00 0.00 C ATOM 238 NZ LYS A 54 4.352 -5.376 7.052 1.00 0.00 N ATOM 0 H LYS A 54 7.184 -0.552 3.653 1.00 0.00 H new ATOM 0 HA LYS A 54 4.773 -1.543 2.588 1.00 0.00 H new ATOM 0 HB2 LYS A 54 6.592 -2.955 3.457 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.370 -2.299 5.067 1.00 0.00 H new ATOM 0 HG2 LYS A 54 4.155 -3.310 5.236 1.00 0.00 H new ATOM 0 HG3 LYS A 54 4.223 -3.838 3.566 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.885 -5.467 4.010 1.00 0.00 H new ATOM 0 HD3 LYS A 54 6.369 -4.706 5.512 1.00 0.00 H new ATOM 0 HE2 LYS A 54 3.590 -5.868 5.138 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.938 -6.859 5.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 4.053 -6.177 7.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 5.244 -4.988 7.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 3.619 -4.638 7.073 1.00 0.00 H new ATOM 252 N LYS A 55 4.560 -0.020 5.498 1.00 0.00 N ATOM 253 CA LYS A 55 3.625 0.557 6.457 1.00 0.00 C ATOM 254 C LYS A 55 2.757 1.623 5.796 1.00 0.00 C ATOM 255 O LYS A 55 1.576 1.759 6.115 1.00 0.00 O ATOM 256 CB LYS A 55 4.384 1.163 7.640 1.00 0.00 C ATOM 257 CG LYS A 55 5.122 0.134 8.479 1.00 0.00 C ATOM 258 CD LYS A 55 5.644 0.739 9.771 1.00 0.00 C ATOM 259 CE LYS A 55 6.385 -0.290 10.611 1.00 0.00 C ATOM 260 NZ LYS A 55 5.448 -1.215 11.308 1.00 0.00 N ATOM 0 H LYS A 55 5.540 0.194 5.684 1.00 0.00 H new ATOM 0 HA LYS A 55 2.977 -0.241 6.820 1.00 0.00 H new ATOM 0 HB2 LYS A 55 5.099 1.895 7.266 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.680 1.701 8.275 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.454 -0.696 8.709 1.00 0.00 H new ATOM 0 HG3 LYS A 55 5.954 -0.275 7.906 1.00 0.00 H new ATOM 0 HD2 LYS A 55 6.311 1.570 9.541 1.00 0.00 H new ATOM 0 HD3 LYS A 55 4.812 1.147 10.345 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.056 -0.865 9.973 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.006 0.221 11.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.991 -1.901 11.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.825 -0.669 11.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 4.873 -1.721 10.605 1.00 0.00 H new ATOM 274 N GLN A 56 3.350 2.375 4.875 1.00 0.00 N ATOM 275 CA GLN A 56 2.630 3.429 4.170 1.00 0.00 C ATOM 276 C GLN A 56 1.504 2.845 3.322 1.00 0.00 C ATOM 277 O GLN A 56 0.363 3.303 3.386 1.00 0.00 O ATOM 278 CB GLN A 56 3.589 4.227 3.285 1.00 0.00 C ATOM 279 CG GLN A 56 4.670 4.957 4.065 1.00 0.00 C ATOM 280 CD GLN A 56 4.176 6.252 4.678 1.00 0.00 C ATOM 281 OE1 GLN A 56 2.994 6.392 4.993 1.00 0.00 O ATOM 282 NE2 GLN A 56 5.080 7.209 4.851 1.00 0.00 N ATOM 0 H GLN A 56 4.327 2.274 4.599 1.00 0.00 H new ATOM 0 HA GLN A 56 2.193 4.096 4.913 1.00 0.00 H new ATOM 0 HB2 GLN A 56 4.061 3.551 2.572 1.00 0.00 H new ATOM 0 HB3 GLN A 56 3.018 4.952 2.706 1.00 0.00 H new ATOM 0 HG2 GLN A 56 5.045 4.306 4.855 1.00 0.00 H new ATOM 0 HG3 GLN A 56 5.509 5.170 3.403 1.00 0.00 H new ATOM 0 HE21 GLN A 56 6.049 7.051 4.576 1.00 0.00 H new ATOM 0 HE22 GLN A 56 4.805 8.102 5.259 1.00 0.00 H new ATOM 291 N LEU A 57 1.833 1.832 2.527 1.00 0.00 N ATOM 292 CA LEU A 57 0.849 1.185 1.667 1.00 0.00 C ATOM 293 C LEU A 57 -0.225 0.487 2.494 1.00 0.00 C ATOM 294 O LEU A 57 -1.415 0.594 2.200 1.00 0.00 O ATOM 295 CB LEU A 57 1.535 0.175 0.745 1.00 0.00 C ATOM 296 CG LEU A 57 2.482 0.759 -0.304 1.00 0.00 C ATOM 297 CD1 LEU A 57 3.233 -0.352 -1.023 1.00 0.00 C ATOM 298 CD2 LEU A 57 1.712 1.614 -1.300 1.00 0.00 C ATOM 0 H LEU A 57 2.773 1.442 2.461 1.00 0.00 H new ATOM 0 HA LEU A 57 0.371 1.955 1.062 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.096 -0.527 1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.764 -0.399 0.230 1.00 0.00 H new ATOM 0 HG LEU A 57 3.209 1.393 0.204 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.902 0.083 -1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.815 -0.924 -0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.520 -1.011 -1.518 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.402 2.022 -2.039 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.962 1.002 -1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.220 2.432 -0.773 1.00 0.00 H new ATOM 310 N GLU A 58 0.204 -0.224 3.532 1.00 0.00 N ATOM 311 CA GLU A 58 -0.722 -0.938 4.404 1.00 0.00 C ATOM 312 C GLU A 58 -1.632 0.037 5.145 1.00 0.00 C ATOM 313 O GLU A 58 -2.844 -0.164 5.224 1.00 0.00 O ATOM 314 CB GLU A 58 0.047 -1.799 5.407 1.00 0.00 C ATOM 315 CG GLU A 58 0.548 -3.110 4.825 1.00 0.00 C ATOM 316 CD GLU A 58 1.429 -3.878 5.790 1.00 0.00 C ATOM 317 OE1 GLU A 58 1.998 -3.247 6.705 1.00 0.00 O ATOM 318 OE2 GLU A 58 1.551 -5.111 5.630 1.00 0.00 O ATOM 0 H GLU A 58 1.186 -0.321 3.790 1.00 0.00 H new ATOM 0 HA GLU A 58 -1.341 -1.585 3.782 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.897 -1.230 5.785 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.598 -2.012 6.259 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.305 -3.729 4.546 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.107 -2.907 3.911 1.00 0.00 H new ATOM 325 N PHE A 59 -1.037 1.094 5.689 1.00 0.00 N ATOM 326 CA PHE A 59 -1.792 2.101 6.427 1.00 0.00 C ATOM 327 C PHE A 59 -2.715 2.880 5.495 1.00 0.00 C ATOM 328 O PHE A 59 -3.865 3.161 5.834 1.00 0.00 O ATOM 329 CB PHE A 59 -0.839 3.062 7.142 1.00 0.00 C ATOM 330 CG PHE A 59 -1.462 3.758 8.318 1.00 0.00 C ATOM 331 CD1 PHE A 59 -1.493 3.151 9.563 1.00 0.00 C ATOM 332 CD2 PHE A 59 -2.015 5.021 8.178 1.00 0.00 C ATOM 333 CE1 PHE A 59 -2.065 3.790 10.647 1.00 0.00 C ATOM 334 CE2 PHE A 59 -2.588 5.665 9.258 1.00 0.00 C ATOM 335 CZ PHE A 59 -2.613 5.049 10.494 1.00 0.00 C ATOM 0 H PHE A 59 -0.035 1.275 5.633 1.00 0.00 H new ATOM 0 HA PHE A 59 -2.404 1.589 7.170 1.00 0.00 H new ATOM 0 HB2 PHE A 59 0.037 2.508 7.480 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -0.489 3.810 6.431 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -1.065 2.167 9.688 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.998 5.507 7.214 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -2.084 3.306 11.612 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -3.016 6.649 9.136 1.00 0.00 H new ATOM 0 HZ PHE A 59 -3.060 5.551 11.339 1.00 0.00 H new ATOM 345 N CYS A 60 -2.201 3.228 4.320 1.00 0.00 N ATOM 346 CA CYS A 60 -2.977 3.977 3.338 1.00 0.00 C ATOM 347 C CYS A 60 -4.190 3.175 2.877 1.00 0.00 C ATOM 348 O CYS A 60 -5.233 3.741 2.550 1.00 0.00 O ATOM 349 CB CYS A 60 -2.104 4.340 2.136 1.00 0.00 C ATOM 350 SG CYS A 60 -1.148 5.860 2.351 1.00 0.00 S ATOM 0 H CYS A 60 -1.251 3.004 4.025 1.00 0.00 H new ATOM 0 HA CYS A 60 -3.329 4.893 3.812 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -1.418 3.517 1.937 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -2.740 4.445 1.257 1.00 0.00 H new ATOM 0 HG CYS A 60 0.003 5.577 2.885 1.00 0.00 H new ATOM 356 N PHE A 61 -4.044 1.855 2.850 1.00 0.00 N ATOM 357 CA PHE A 61 -5.126 0.975 2.427 1.00 0.00 C ATOM 358 C PHE A 61 -5.936 0.491 3.626 1.00 0.00 C ATOM 359 O PHE A 61 -6.891 -0.271 3.478 1.00 0.00 O ATOM 360 CB PHE A 61 -4.567 -0.225 1.658 1.00 0.00 C ATOM 361 CG PHE A 61 -4.293 0.066 0.211 1.00 0.00 C ATOM 362 CD1 PHE A 61 -3.334 0.996 -0.154 1.00 0.00 C ATOM 363 CD2 PHE A 61 -4.996 -0.592 -0.787 1.00 0.00 C ATOM 364 CE1 PHE A 61 -3.079 1.266 -1.486 1.00 0.00 C ATOM 365 CE2 PHE A 61 -4.746 -0.327 -2.120 1.00 0.00 C ATOM 366 CZ PHE A 61 -3.787 0.603 -2.470 1.00 0.00 C ATOM 0 H PHE A 61 -3.186 1.371 3.116 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.785 1.543 1.771 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.644 -0.554 2.135 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.274 -1.052 1.727 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.778 1.517 0.611 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -5.748 -1.320 -0.519 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.328 1.994 -1.757 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -5.300 -0.847 -2.887 1.00 0.00 H new ATOM 0 HZ PHE A 61 -3.591 0.812 -3.511 1.00 0.00 H new ATOM 376 N SER A 62 -5.547 0.940 4.815 1.00 0.00 N ATOM 377 CA SER A 62 -6.233 0.550 6.042 1.00 0.00 C ATOM 378 C SER A 62 -7.697 0.977 6.004 1.00 0.00 C ATOM 379 O SER A 62 -8.067 1.898 5.275 1.00 0.00 O ATOM 380 CB SER A 62 -5.539 1.169 7.257 1.00 0.00 C ATOM 381 OG SER A 62 -5.743 0.380 8.417 1.00 0.00 O ATOM 0 H SER A 62 -4.760 1.574 4.955 1.00 0.00 H new ATOM 0 HA SER A 62 -6.192 -0.536 6.124 1.00 0.00 H new ATOM 0 HB2 SER A 62 -4.471 1.264 7.061 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.923 2.175 7.426 1.00 0.00 H new ATOM 0 HG SER A 62 -5.288 0.795 9.179 1.00 0.00 H new ATOM 387 N ARG A 63 -8.523 0.303 6.796 1.00 0.00 N ATOM 388 CA ARG A 63 -9.948 0.611 6.854 1.00 0.00 C ATOM 389 C ARG A 63 -10.176 2.040 7.339 1.00 0.00 C ATOM 390 O ARG A 63 -10.976 2.778 6.767 1.00 0.00 O ATOM 391 CB ARG A 63 -10.667 -0.373 7.778 1.00 0.00 C ATOM 392 CG ARG A 63 -10.969 -1.712 7.124 1.00 0.00 C ATOM 393 CD ARG A 63 -12.178 -2.381 7.761 1.00 0.00 C ATOM 394 NE ARG A 63 -13.431 -1.941 7.155 1.00 0.00 N ATOM 395 CZ ARG A 63 -14.550 -2.656 7.176 1.00 0.00 C ATOM 396 NH1 ARG A 63 -14.572 -3.840 7.771 1.00 0.00 N ATOM 397 NH2 ARG A 63 -15.650 -2.186 6.602 1.00 0.00 N ATOM 0 H ARG A 63 -8.231 -0.460 7.407 1.00 0.00 H new ATOM 0 HA ARG A 63 -10.356 0.518 5.847 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -10.054 -0.541 8.664 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -11.601 0.075 8.117 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -11.151 -1.566 6.059 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -10.101 -2.366 7.212 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -12.088 -3.463 7.661 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -12.194 -2.159 8.828 1.00 0.00 H new ATOM 0 HE ARG A 63 -13.448 -1.034 6.689 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -13.728 -4.204 8.214 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -15.433 -4.387 7.786 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -15.637 -1.275 6.144 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -16.509 -2.736 6.619 1.00 0.00 H new ATOM 411 N GLU A 64 -9.466 2.421 8.396 1.00 0.00 N ATOM 412 CA GLU A 64 -9.592 3.761 8.957 1.00 0.00 C ATOM 413 C GLU A 64 -9.028 4.808 8.001 1.00 0.00 C ATOM 414 O GLU A 64 -9.630 5.859 7.790 1.00 0.00 O ATOM 415 CB GLU A 64 -8.871 3.843 10.305 1.00 0.00 C ATOM 416 CG GLU A 64 -9.731 3.422 11.483 1.00 0.00 C ATOM 417 CD GLU A 64 -10.713 4.500 11.903 1.00 0.00 C ATOM 418 OE1 GLU A 64 -11.526 4.924 11.057 1.00 0.00 O ATOM 419 OE2 GLU A 64 -10.666 4.919 13.079 1.00 0.00 O ATOM 0 H GLU A 64 -8.798 1.821 8.881 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.652 3.966 9.107 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.983 3.212 10.271 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.530 4.866 10.463 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.280 2.517 11.222 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -9.088 3.173 12.327 1.00 0.00 H new ATOM 426 N ASN A 65 -7.868 4.510 7.425 1.00 0.00 N ATOM 427 CA ASN A 65 -7.221 5.425 6.491 1.00 0.00 C ATOM 428 C ASN A 65 -8.058 5.593 5.227 1.00 0.00 C ATOM 429 O ASN A 65 -8.163 6.692 4.680 1.00 0.00 O ATOM 430 CB ASN A 65 -5.825 4.913 6.128 1.00 0.00 C ATOM 431 CG ASN A 65 -4.892 6.031 5.702 1.00 0.00 C ATOM 432 OD1 ASN A 65 -4.065 6.496 6.484 1.00 0.00 O ATOM 433 ND2 ASN A 65 -5.024 6.467 4.454 1.00 0.00 N ATOM 0 H ASN A 65 -7.357 3.643 7.588 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.130 6.397 6.977 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.397 4.393 6.985 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -5.907 4.184 5.322 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -4.425 7.217 4.110 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -5.724 6.051 3.840 1.00 0.00 H new ATOM 440 N LEU A 66 -8.652 4.498 4.767 1.00 0.00 N ATOM 441 CA LEU A 66 -9.481 4.523 3.567 1.00 0.00 C ATOM 442 C LEU A 66 -10.703 5.413 3.768 1.00 0.00 C ATOM 443 O LEU A 66 -11.049 6.214 2.900 1.00 0.00 O ATOM 444 CB LEU A 66 -9.923 3.106 3.198 1.00 0.00 C ATOM 445 CG LEU A 66 -8.886 2.246 2.474 1.00 0.00 C ATOM 446 CD1 LEU A 66 -9.372 0.812 2.353 1.00 0.00 C ATOM 447 CD2 LEU A 66 -8.578 2.825 1.101 1.00 0.00 C ATOM 0 H LEU A 66 -8.575 3.581 5.207 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.885 4.934 2.752 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.220 2.590 4.111 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.810 3.176 2.569 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.968 2.247 3.061 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.621 0.216 1.835 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.540 0.400 3.348 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -10.304 0.790 1.789 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -7.838 2.200 0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.491 2.855 0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.184 3.835 1.212 1.00 0.00 H new ATOM 459 N SER A 67 -11.351 5.268 4.920 1.00 0.00 N ATOM 460 CA SER A 67 -12.536 6.057 5.234 1.00 0.00 C ATOM 461 C SER A 67 -12.150 7.474 5.652 1.00 0.00 C ATOM 462 O SER A 67 -12.984 8.379 5.664 1.00 0.00 O ATOM 463 CB SER A 67 -13.340 5.386 6.350 1.00 0.00 C ATOM 464 OG SER A 67 -14.410 6.212 6.774 1.00 0.00 O ATOM 0 H SER A 67 -11.075 4.612 5.651 1.00 0.00 H new ATOM 0 HA SER A 67 -13.152 6.116 4.336 1.00 0.00 H new ATOM 0 HB2 SER A 67 -13.731 4.431 5.998 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.686 5.170 7.195 1.00 0.00 H new ATOM 0 HG SER A 67 -14.909 5.761 7.486 1.00 0.00 H new ATOM 470 N LYS A 68 -10.879 7.657 5.994 1.00 0.00 N ATOM 471 CA LYS A 68 -10.380 8.961 6.410 1.00 0.00 C ATOM 472 C LYS A 68 -9.867 9.756 5.214 1.00 0.00 C ATOM 473 O LYS A 68 -9.924 10.986 5.203 1.00 0.00 O ATOM 474 CB LYS A 68 -9.262 8.797 7.443 1.00 0.00 C ATOM 475 CG LYS A 68 -8.351 10.008 7.553 1.00 0.00 C ATOM 476 CD LYS A 68 -7.296 10.014 6.459 1.00 0.00 C ATOM 477 CE LYS A 68 -6.019 10.698 6.921 1.00 0.00 C ATOM 478 NZ LYS A 68 -5.291 11.335 5.790 1.00 0.00 N ATOM 0 H LYS A 68 -10.176 6.918 5.991 1.00 0.00 H new ATOM 0 HA LYS A 68 -11.207 9.510 6.861 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -9.706 8.598 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -8.663 7.925 7.182 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.946 10.919 7.491 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -7.865 10.011 8.529 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -7.074 8.989 6.161 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.686 10.525 5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.262 11.454 7.668 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.371 9.968 7.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -4.426 11.790 6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -5.037 10.610 5.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.900 12.050 5.344 1.00 0.00 H new ATOM 492 N ASP A 69 -9.370 9.046 4.207 1.00 0.00 N ATOM 493 CA ASP A 69 -8.850 9.685 3.004 1.00 0.00 C ATOM 494 C ASP A 69 -9.941 9.821 1.947 1.00 0.00 C ATOM 495 O ASP A 69 -10.079 8.971 1.067 1.00 0.00 O ATOM 496 CB ASP A 69 -7.676 8.884 2.442 1.00 0.00 C ATOM 497 CG ASP A 69 -6.806 9.705 1.511 1.00 0.00 C ATOM 498 OD1 ASP A 69 -7.314 10.697 0.947 1.00 0.00 O ATOM 499 OD2 ASP A 69 -5.618 9.356 1.345 1.00 0.00 O ATOM 0 H ASP A 69 -9.316 8.027 4.200 1.00 0.00 H new ATOM 0 HA ASP A 69 -8.503 10.683 3.273 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -7.068 8.509 3.266 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.057 8.015 1.906 1.00 0.00 H new ATOM 504 N LEU A 70 -10.716 10.897 2.040 1.00 0.00 N ATOM 505 CA LEU A 70 -11.797 11.145 1.092 1.00 0.00 C ATOM 506 C LEU A 70 -11.273 11.153 -0.341 1.00 0.00 C ATOM 507 O LEU A 70 -11.974 10.752 -1.271 1.00 0.00 O ATOM 508 CB LEU A 70 -12.481 12.477 1.405 1.00 0.00 C ATOM 509 CG LEU A 70 -13.242 12.546 2.730 1.00 0.00 C ATOM 510 CD1 LEU A 70 -13.794 13.945 2.956 1.00 0.00 C ATOM 511 CD2 LEU A 70 -14.362 11.517 2.755 1.00 0.00 C ATOM 0 H LEU A 70 -10.616 11.611 2.762 1.00 0.00 H new ATOM 0 HA LEU A 70 -12.524 10.339 1.189 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -11.724 13.261 1.403 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.177 12.704 0.597 1.00 0.00 H new ATOM 0 HG LEU A 70 -12.548 12.317 3.539 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -14.332 13.975 3.903 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -12.972 14.660 2.983 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -14.474 14.203 2.144 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -14.893 11.580 3.705 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -15.056 11.714 1.938 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -13.941 10.518 2.640 1.00 0.00 H new ATOM 523 N TYR A 71 -10.038 11.611 -0.511 1.00 0.00 N ATOM 524 CA TYR A 71 -9.420 11.672 -1.831 1.00 0.00 C ATOM 525 C TYR A 71 -9.158 10.270 -2.375 1.00 0.00 C ATOM 526 O TYR A 71 -9.451 9.977 -3.535 1.00 0.00 O ATOM 527 CB TYR A 71 -8.111 12.459 -1.768 1.00 0.00 C ATOM 528 CG TYR A 71 -7.255 12.311 -3.005 1.00 0.00 C ATOM 529 CD1 TYR A 71 -7.528 13.044 -4.154 1.00 0.00 C ATOM 530 CD2 TYR A 71 -6.173 11.440 -3.026 1.00 0.00 C ATOM 531 CE1 TYR A 71 -6.749 12.911 -5.287 1.00 0.00 C ATOM 532 CE2 TYR A 71 -5.389 11.302 -4.155 1.00 0.00 C ATOM 533 CZ TYR A 71 -5.682 12.039 -5.283 1.00 0.00 C ATOM 534 OH TYR A 71 -4.902 11.906 -6.410 1.00 0.00 O ATOM 0 H TYR A 71 -9.445 11.946 0.248 1.00 0.00 H new ATOM 0 HA TYR A 71 -10.110 12.181 -2.504 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -8.338 13.514 -1.618 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -7.540 12.129 -0.900 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.363 13.729 -4.161 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.941 10.861 -2.145 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -6.975 13.488 -6.172 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -4.551 10.621 -4.154 1.00 0.00 H new ATOM 0 HH TYR A 71 -4.191 11.253 -6.241 1.00 0.00 H new ATOM 544 N LEU A 72 -8.606 9.407 -1.528 1.00 0.00 N ATOM 545 CA LEU A 72 -8.305 8.035 -1.922 1.00 0.00 C ATOM 546 C LEU A 72 -9.565 7.315 -2.393 1.00 0.00 C ATOM 547 O LEU A 72 -9.551 6.625 -3.413 1.00 0.00 O ATOM 548 CB LEU A 72 -7.676 7.276 -0.753 1.00 0.00 C ATOM 549 CG LEU A 72 -6.936 5.986 -1.111 1.00 0.00 C ATOM 550 CD1 LEU A 72 -5.846 6.264 -2.136 1.00 0.00 C ATOM 551 CD2 LEU A 72 -6.346 5.346 0.137 1.00 0.00 C ATOM 0 H LEU A 72 -8.358 9.633 -0.565 1.00 0.00 H new ATOM 0 HA LEU A 72 -7.597 8.067 -2.750 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.978 7.943 -0.246 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -8.462 7.034 -0.038 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.650 5.289 -1.549 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -5.330 5.335 -2.379 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -6.293 6.678 -3.040 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.133 6.978 -1.724 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -5.823 4.429 -0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.645 6.038 0.604 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.146 5.112 0.839 1.00 0.00 H new ATOM 563 N ILE A 73 -10.650 7.483 -1.646 1.00 0.00 N ATOM 564 CA ILE A 73 -11.918 6.851 -1.990 1.00 0.00 C ATOM 565 C ILE A 73 -12.461 7.391 -3.308 1.00 0.00 C ATOM 566 O ILE A 73 -13.019 6.645 -4.113 1.00 0.00 O ATOM 567 CB ILE A 73 -12.971 7.066 -0.887 1.00 0.00 C ATOM 568 CG1 ILE A 73 -12.402 6.670 0.477 1.00 0.00 C ATOM 569 CG2 ILE A 73 -14.230 6.269 -1.193 1.00 0.00 C ATOM 570 CD1 ILE A 73 -13.287 7.064 1.639 1.00 0.00 C ATOM 0 H ILE A 73 -10.677 8.051 -0.799 1.00 0.00 H new ATOM 0 HA ILE A 73 -11.722 5.784 -2.091 1.00 0.00 H new ATOM 0 HB ILE A 73 -13.232 8.124 -0.857 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -12.248 5.591 0.498 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -11.424 7.134 0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -14.964 6.432 -0.404 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -14.644 6.595 -2.147 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -13.985 5.208 -1.247 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -12.821 6.752 2.574 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -13.421 8.146 1.644 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -14.258 6.579 1.538 1.00 0.00 H new ATOM 582 N SER A 74 -12.295 8.692 -3.522 1.00 0.00 N ATOM 583 CA SER A 74 -12.770 9.333 -4.743 1.00 0.00 C ATOM 584 C SER A 74 -11.968 8.861 -5.952 1.00 0.00 C ATOM 585 O SER A 74 -12.467 8.860 -7.077 1.00 0.00 O ATOM 586 CB SER A 74 -12.675 10.855 -4.615 1.00 0.00 C ATOM 587 OG SER A 74 -13.680 11.495 -5.383 1.00 0.00 O ATOM 0 H SER A 74 -11.835 9.323 -2.866 1.00 0.00 H new ATOM 0 HA SER A 74 -13.813 9.052 -4.890 1.00 0.00 H new ATOM 0 HB2 SER A 74 -12.775 11.142 -3.568 1.00 0.00 H new ATOM 0 HB3 SER A 74 -11.692 11.190 -4.945 1.00 0.00 H new ATOM 0 HG SER A 74 -13.599 12.467 -5.283 1.00 0.00 H new ATOM 593 N GLN A 75 -10.724 8.462 -5.710 1.00 0.00 N ATOM 594 CA GLN A 75 -9.852 7.988 -6.779 1.00 0.00 C ATOM 595 C GLN A 75 -10.102 6.512 -7.072 1.00 0.00 C ATOM 596 O GLN A 75 -9.866 6.042 -8.183 1.00 0.00 O ATOM 597 CB GLN A 75 -8.386 8.205 -6.403 1.00 0.00 C ATOM 598 CG GLN A 75 -7.975 9.669 -6.371 1.00 0.00 C ATOM 599 CD GLN A 75 -8.498 10.447 -7.562 1.00 0.00 C ATOM 600 OE1 GLN A 75 -8.187 10.130 -8.710 1.00 0.00 O ATOM 601 NE2 GLN A 75 -9.297 11.472 -7.294 1.00 0.00 N ATOM 0 H GLN A 75 -10.297 8.457 -4.784 1.00 0.00 H new ATOM 0 HA GLN A 75 -10.077 8.561 -7.679 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -8.202 7.763 -5.424 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -7.755 7.675 -7.116 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -8.344 10.126 -5.453 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -6.887 9.737 -6.346 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -9.528 11.699 -6.327 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -9.680 12.033 -8.055 1.00 0.00 H new ATOM 610 N MET A 76 -10.580 5.787 -6.065 1.00 0.00 N ATOM 611 CA MET A 76 -10.862 4.364 -6.215 1.00 0.00 C ATOM 612 C MET A 76 -11.664 4.101 -7.486 1.00 0.00 C ATOM 613 O MET A 76 -12.108 5.033 -8.155 1.00 0.00 O ATOM 614 CB MET A 76 -11.628 3.843 -4.998 1.00 0.00 C ATOM 615 CG MET A 76 -10.735 3.527 -3.808 1.00 0.00 C ATOM 616 SD MET A 76 -11.674 3.154 -2.314 1.00 0.00 S ATOM 617 CE MET A 76 -10.619 1.926 -1.549 1.00 0.00 C ATOM 0 H MET A 76 -10.780 6.161 -5.137 1.00 0.00 H new ATOM 0 HA MET A 76 -9.911 3.836 -6.290 1.00 0.00 H new ATOM 0 HB2 MET A 76 -12.368 4.585 -4.700 1.00 0.00 H new ATOM 0 HB3 MET A 76 -12.175 2.943 -5.281 1.00 0.00 H new ATOM 0 HG2 MET A 76 -10.097 2.678 -4.053 1.00 0.00 H new ATOM 0 HG3 MET A 76 -10.077 4.375 -3.617 1.00 0.00 H new ATOM 0 HE1 MET A 76 -11.039 1.635 -0.586 1.00 0.00 H new ATOM 0 HE2 MET A 76 -10.552 1.051 -2.195 1.00 0.00 H new ATOM 0 HE3 MET A 76 -9.624 2.344 -1.399 1.00 0.00 H new ATOM 627 N ASP A 77 -11.844 2.826 -7.812 1.00 0.00 N ATOM 628 CA ASP A 77 -12.594 2.439 -9.002 1.00 0.00 C ATOM 629 C ASP A 77 -13.975 1.911 -8.628 1.00 0.00 C ATOM 630 O ASP A 77 -14.362 1.931 -7.459 1.00 0.00 O ATOM 631 CB ASP A 77 -11.826 1.379 -9.792 1.00 0.00 C ATOM 632 CG ASP A 77 -12.105 1.451 -11.281 1.00 0.00 C ATOM 633 OD1 ASP A 77 -12.729 2.440 -11.720 1.00 0.00 O ATOM 634 OD2 ASP A 77 -11.698 0.519 -12.006 1.00 0.00 O ATOM 0 H ASP A 77 -11.481 2.042 -7.269 1.00 0.00 H new ATOM 0 HA ASP A 77 -12.721 3.325 -9.625 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -10.757 1.505 -9.619 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -12.094 0.389 -9.422 1.00 0.00 H new ATOM 639 N SER A 78 -14.714 1.441 -9.627 1.00 0.00 N ATOM 640 CA SER A 78 -16.054 0.912 -9.403 1.00 0.00 C ATOM 641 C SER A 78 -16.000 -0.382 -8.596 1.00 0.00 C ATOM 642 O SER A 78 -16.847 -0.628 -7.738 1.00 0.00 O ATOM 643 CB SER A 78 -16.758 0.664 -10.739 1.00 0.00 C ATOM 644 OG SER A 78 -18.086 0.212 -10.539 1.00 0.00 O ATOM 0 H SER A 78 -14.408 1.416 -10.600 1.00 0.00 H new ATOM 0 HA SER A 78 -16.619 1.651 -8.835 1.00 0.00 H new ATOM 0 HB2 SER A 78 -16.768 1.583 -11.325 1.00 0.00 H new ATOM 0 HB3 SER A 78 -16.202 -0.075 -11.315 1.00 0.00 H new ATOM 0 HG SER A 78 -18.515 0.062 -11.407 1.00 0.00 H new ATOM 650 N ASP A 79 -14.997 -1.206 -8.879 1.00 0.00 N ATOM 651 CA ASP A 79 -14.830 -2.475 -8.180 1.00 0.00 C ATOM 652 C ASP A 79 -13.908 -2.315 -6.975 1.00 0.00 C ATOM 653 O ASP A 79 -13.164 -3.231 -6.626 1.00 0.00 O ATOM 654 CB ASP A 79 -14.268 -3.534 -9.130 1.00 0.00 C ATOM 655 CG ASP A 79 -15.337 -4.143 -10.017 1.00 0.00 C ATOM 656 OD1 ASP A 79 -16.181 -4.901 -9.494 1.00 0.00 O ATOM 657 OD2 ASP A 79 -15.332 -3.859 -11.233 1.00 0.00 O ATOM 0 H ASP A 79 -14.288 -1.018 -9.587 1.00 0.00 H new ATOM 0 HA ASP A 79 -15.809 -2.798 -7.825 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -13.495 -3.085 -9.754 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -13.790 -4.322 -8.549 1.00 0.00 H new ATOM 662 N GLN A 80 -13.963 -1.145 -6.347 1.00 0.00 N ATOM 663 CA GLN A 80 -13.132 -0.865 -5.181 1.00 0.00 C ATOM 664 C GLN A 80 -11.660 -1.118 -5.490 1.00 0.00 C ATOM 665 O GLN A 80 -10.965 -1.800 -4.737 1.00 0.00 O ATOM 666 CB GLN A 80 -13.572 -1.726 -3.996 1.00 0.00 C ATOM 667 CG GLN A 80 -15.012 -1.488 -3.573 1.00 0.00 C ATOM 668 CD GLN A 80 -15.202 -0.157 -2.872 1.00 0.00 C ATOM 669 OE1 GLN A 80 -14.575 0.841 -3.229 1.00 0.00 O ATOM 670 NE2 GLN A 80 -16.071 -0.135 -1.867 1.00 0.00 N ATOM 0 H GLN A 80 -14.573 -0.376 -6.625 1.00 0.00 H new ATOM 0 HA GLN A 80 -13.255 0.187 -4.922 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.447 -2.777 -4.255 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.916 -1.527 -3.149 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.656 -1.527 -4.452 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.329 -2.292 -2.909 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -16.569 -0.986 -1.605 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -16.240 0.733 -1.358 1.00 0.00 H new ATOM 679 N PHE A 81 -11.190 -0.563 -6.602 1.00 0.00 N ATOM 680 CA PHE A 81 -9.800 -0.730 -7.012 1.00 0.00 C ATOM 681 C PHE A 81 -9.105 0.623 -7.140 1.00 0.00 C ATOM 682 O PHE A 81 -9.674 1.577 -7.671 1.00 0.00 O ATOM 683 CB PHE A 81 -9.724 -1.483 -8.342 1.00 0.00 C ATOM 684 CG PHE A 81 -9.635 -2.973 -8.181 1.00 0.00 C ATOM 685 CD1 PHE A 81 -8.415 -3.588 -7.950 1.00 0.00 C ATOM 686 CD2 PHE A 81 -10.772 -3.762 -8.262 1.00 0.00 C ATOM 687 CE1 PHE A 81 -8.330 -4.960 -7.804 1.00 0.00 C ATOM 688 CE2 PHE A 81 -10.694 -5.133 -8.115 1.00 0.00 C ATOM 689 CZ PHE A 81 -9.471 -5.733 -7.885 1.00 0.00 C ATOM 0 H PHE A 81 -11.751 0.006 -7.236 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.289 -1.311 -6.245 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.604 -1.242 -8.938 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.855 -1.133 -8.900 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -7.519 -2.988 -7.883 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -11.731 -3.299 -8.442 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -7.372 -5.427 -7.627 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -11.588 -5.735 -8.180 1.00 0.00 H new ATOM 0 HZ PHE A 81 -9.408 -6.805 -7.769 1.00 0.00 H new ATOM 699 N ILE A 82 -7.873 0.697 -6.649 1.00 0.00 N ATOM 700 CA ILE A 82 -7.100 1.932 -6.709 1.00 0.00 C ATOM 701 C ILE A 82 -5.981 1.830 -7.740 1.00 0.00 C ATOM 702 O ILE A 82 -5.296 0.812 -7.852 1.00 0.00 O ATOM 703 CB ILE A 82 -6.491 2.281 -5.339 1.00 0.00 C ATOM 704 CG1 ILE A 82 -7.592 2.417 -4.286 1.00 0.00 C ATOM 705 CG2 ILE A 82 -5.679 3.564 -5.433 1.00 0.00 C ATOM 706 CD1 ILE A 82 -7.089 2.285 -2.865 1.00 0.00 C ATOM 0 H ILE A 82 -7.388 -0.083 -6.205 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.790 2.723 -7.003 1.00 0.00 H new ATOM 0 HB ILE A 82 -5.825 1.473 -5.037 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -8.077 3.386 -4.403 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -8.352 1.656 -4.466 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.254 3.798 -4.457 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.874 3.433 -6.157 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.326 4.381 -5.753 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -7.924 2.392 -2.172 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -6.630 1.306 -2.731 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -6.351 3.062 -2.667 1.00 0.00 H new ATOM 718 N PRO A 83 -5.787 2.910 -8.512 1.00 0.00 N ATOM 719 CA PRO A 83 -4.750 2.968 -9.546 1.00 0.00 C ATOM 720 C PRO A 83 -3.345 3.017 -8.956 1.00 0.00 C ATOM 721 O PRO A 83 -3.073 3.795 -8.041 1.00 0.00 O ATOM 722 CB PRO A 83 -5.063 4.268 -10.291 1.00 0.00 C ATOM 723 CG PRO A 83 -5.783 5.111 -9.294 1.00 0.00 C ATOM 724 CD PRO A 83 -6.567 4.157 -8.435 1.00 0.00 C ATOM 0 HA PRO A 83 -4.760 2.083 -10.183 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -4.152 4.755 -10.637 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -5.679 4.082 -11.171 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -5.082 5.691 -8.694 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -6.443 5.823 -9.789 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -6.651 4.516 -7.409 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -7.582 4.020 -8.809 1.00 0.00 H new ATOM 732 N ILE A 84 -2.456 2.183 -9.485 1.00 0.00 N ATOM 733 CA ILE A 84 -1.079 2.133 -9.010 1.00 0.00 C ATOM 734 C ILE A 84 -0.384 3.477 -9.200 1.00 0.00 C ATOM 735 O ILE A 84 0.488 3.853 -8.416 1.00 0.00 O ATOM 736 CB ILE A 84 -0.272 1.043 -9.739 1.00 0.00 C ATOM 737 CG1 ILE A 84 -0.962 -0.315 -9.596 1.00 0.00 C ATOM 738 CG2 ILE A 84 1.148 0.981 -9.194 1.00 0.00 C ATOM 739 CD1 ILE A 84 -0.501 -1.337 -10.611 1.00 0.00 C ATOM 0 H ILE A 84 -2.665 1.533 -10.243 1.00 0.00 H new ATOM 0 HA ILE A 84 -1.119 1.894 -7.947 1.00 0.00 H new ATOM 0 HB ILE A 84 -0.224 1.295 -10.798 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.779 -0.702 -8.594 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -2.039 -0.178 -9.694 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.706 0.206 -9.719 1.00 0.00 H new ATOM 0 HG22 ILE A 84 1.637 1.944 -9.342 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.119 0.749 -8.129 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.032 -2.275 -10.450 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -0.709 -0.971 -11.616 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.570 -1.503 -10.499 1.00 0.00 H new ATOM 751 N TRP A 85 -0.777 4.197 -10.244 1.00 0.00 N ATOM 752 CA TRP A 85 -0.192 5.502 -10.536 1.00 0.00 C ATOM 753 C TRP A 85 -0.420 6.471 -9.381 1.00 0.00 C ATOM 754 O TRP A 85 0.465 7.254 -9.030 1.00 0.00 O ATOM 755 CB TRP A 85 -0.787 6.074 -11.823 1.00 0.00 C ATOM 756 CG TRP A 85 -2.013 6.905 -11.593 1.00 0.00 C ATOM 757 CD1 TRP A 85 -3.303 6.560 -11.880 1.00 0.00 C ATOM 758 CD2 TRP A 85 -2.064 8.220 -11.028 1.00 0.00 C ATOM 759 NE1 TRP A 85 -4.153 7.581 -11.529 1.00 0.00 N ATOM 760 CE2 TRP A 85 -3.417 8.610 -11.002 1.00 0.00 C ATOM 761 CE3 TRP A 85 -1.098 9.104 -10.539 1.00 0.00 C ATOM 762 CZ2 TRP A 85 -3.825 9.847 -10.509 1.00 0.00 C ATOM 763 CZ3 TRP A 85 -1.505 10.330 -10.050 1.00 0.00 C ATOM 764 CH2 TRP A 85 -2.858 10.692 -10.038 1.00 0.00 C ATOM 0 H TRP A 85 -1.497 3.901 -10.902 1.00 0.00 H new ATOM 0 HA TRP A 85 0.882 5.370 -10.668 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -0.034 6.682 -12.324 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -1.034 5.253 -12.497 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -3.610 5.622 -12.319 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -5.167 7.574 -11.642 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -0.052 8.833 -10.543 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -4.868 10.129 -10.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -0.767 11.021 -9.670 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -3.144 11.658 -9.649 1.00 0.00 H new ATOM 775 N THR A 86 -1.611 6.415 -8.792 1.00 0.00 N ATOM 776 CA THR A 86 -1.954 7.288 -7.677 1.00 0.00 C ATOM 777 C THR A 86 -1.041 7.039 -6.482 1.00 0.00 C ATOM 778 O THR A 86 -0.556 7.980 -5.854 1.00 0.00 O ATOM 779 CB THR A 86 -3.418 7.092 -7.241 1.00 0.00 C ATOM 780 OG1 THR A 86 -4.298 7.738 -8.168 1.00 0.00 O ATOM 781 CG2 THR A 86 -3.646 7.652 -5.844 1.00 0.00 C ATOM 0 H THR A 86 -2.354 5.774 -9.069 1.00 0.00 H new ATOM 0 HA THR A 86 -1.820 8.312 -8.024 1.00 0.00 H new ATOM 0 HB THR A 86 -3.629 6.023 -7.227 1.00 0.00 H new ATOM 0 HG1 THR A 86 -3.787 8.041 -8.947 1.00 0.00 H new ATOM 0 HG21 THR A 86 -4.687 7.502 -5.557 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.997 7.138 -5.135 1.00 0.00 H new ATOM 0 HG23 THR A 86 -3.418 8.718 -5.837 1.00 0.00 H new ATOM 789 N VAL A 87 -0.811 5.767 -6.174 1.00 0.00 N ATOM 790 CA VAL A 87 0.046 5.395 -5.055 1.00 0.00 C ATOM 791 C VAL A 87 1.511 5.673 -5.368 1.00 0.00 C ATOM 792 O VAL A 87 2.262 6.141 -4.512 1.00 0.00 O ATOM 793 CB VAL A 87 -0.117 3.906 -4.694 1.00 0.00 C ATOM 794 CG1 VAL A 87 0.816 3.528 -3.555 1.00 0.00 C ATOM 795 CG2 VAL A 87 -1.563 3.600 -4.334 1.00 0.00 C ATOM 0 H VAL A 87 -1.206 4.977 -6.684 1.00 0.00 H new ATOM 0 HA VAL A 87 -0.262 6.003 -4.205 1.00 0.00 H new ATOM 0 HB VAL A 87 0.151 3.308 -5.565 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.687 2.473 -3.314 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.848 3.708 -3.855 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.583 4.132 -2.678 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.660 2.544 -4.082 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.861 4.206 -3.478 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.206 3.830 -5.183 1.00 0.00 H new ATOM 805 N ALA A 88 1.913 5.382 -6.601 1.00 0.00 N ATOM 806 CA ALA A 88 3.288 5.604 -7.029 1.00 0.00 C ATOM 807 C ALA A 88 3.595 7.094 -7.143 1.00 0.00 C ATOM 808 O ALA A 88 4.757 7.497 -7.168 1.00 0.00 O ATOM 809 CB ALA A 88 3.547 4.906 -8.356 1.00 0.00 C ATOM 0 H ALA A 88 1.305 4.992 -7.321 1.00 0.00 H new ATOM 0 HA ALA A 88 3.950 5.181 -6.273 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.578 5.080 -8.664 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.378 3.835 -8.243 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.870 5.302 -9.113 1.00 0.00 H new ATOM 815 N ASN A 89 2.544 7.905 -7.216 1.00 0.00 N ATOM 816 CA ASN A 89 2.702 9.350 -7.329 1.00 0.00 C ATOM 817 C ASN A 89 2.724 10.005 -5.951 1.00 0.00 C ATOM 818 O ASN A 89 3.112 11.164 -5.810 1.00 0.00 O ATOM 819 CB ASN A 89 1.570 9.943 -8.170 1.00 0.00 C ATOM 820 CG ASN A 89 1.900 9.966 -9.651 1.00 0.00 C ATOM 821 OD1 ASN A 89 1.842 11.015 -10.293 1.00 0.00 O ATOM 822 ND2 ASN A 89 2.250 8.808 -10.196 1.00 0.00 N ATOM 0 H ASN A 89 1.575 7.586 -7.199 1.00 0.00 H new ATOM 0 HA ASN A 89 3.654 9.549 -7.821 1.00 0.00 H new ATOM 0 HB2 ASN A 89 0.661 9.362 -8.012 1.00 0.00 H new ATOM 0 HB3 ASN A 89 1.363 10.958 -7.831 1.00 0.00 H new ATOM 0 HD21 ASN A 89 2.485 8.761 -11.187 1.00 0.00 H new ATOM 0 HD22 ASN A 89 2.284 7.964 -9.624 1.00 0.00 H new ATOM 829 N MET A 90 2.304 9.254 -4.938 1.00 0.00 N ATOM 830 CA MET A 90 2.277 9.761 -3.571 1.00 0.00 C ATOM 831 C MET A 90 3.639 10.318 -3.170 1.00 0.00 C ATOM 832 O MET A 90 4.673 9.714 -3.455 1.00 0.00 O ATOM 833 CB MET A 90 1.861 8.653 -2.602 1.00 0.00 C ATOM 834 CG MET A 90 0.361 8.404 -2.572 1.00 0.00 C ATOM 835 SD MET A 90 -0.125 7.250 -1.275 1.00 0.00 S ATOM 836 CE MET A 90 -1.306 8.241 -0.363 1.00 0.00 C ATOM 0 H MET A 90 1.978 8.293 -5.038 1.00 0.00 H new ATOM 0 HA MET A 90 1.546 10.568 -3.524 1.00 0.00 H new ATOM 0 HB2 MET A 90 2.369 7.729 -2.879 1.00 0.00 H new ATOM 0 HB3 MET A 90 2.198 8.913 -1.599 1.00 0.00 H new ATOM 0 HG2 MET A 90 -0.158 9.351 -2.423 1.00 0.00 H new ATOM 0 HG3 MET A 90 0.042 8.014 -3.538 1.00 0.00 H new ATOM 0 HE1 MET A 90 -2.035 7.588 0.117 1.00 0.00 H new ATOM 0 HE2 MET A 90 -0.783 8.822 0.397 1.00 0.00 H new ATOM 0 HE3 MET A 90 -1.819 8.917 -1.047 1.00 0.00 H new ATOM 846 N GLU A 91 3.631 11.472 -2.511 1.00 0.00 N ATOM 847 CA GLU A 91 4.867 12.109 -2.074 1.00 0.00 C ATOM 848 C GLU A 91 5.666 11.181 -1.164 1.00 0.00 C ATOM 849 O GLU A 91 6.855 10.951 -1.385 1.00 0.00 O ATOM 850 CB GLU A 91 4.562 13.418 -1.342 1.00 0.00 C ATOM 851 CG GLU A 91 4.077 14.529 -2.259 1.00 0.00 C ATOM 852 CD GLU A 91 4.328 15.910 -1.686 1.00 0.00 C ATOM 853 OE1 GLU A 91 5.372 16.098 -1.026 1.00 0.00 O ATOM 854 OE2 GLU A 91 3.481 16.803 -1.897 1.00 0.00 O ATOM 0 H GLU A 91 2.783 11.984 -2.268 1.00 0.00 H new ATOM 0 HA GLU A 91 5.465 12.326 -2.959 1.00 0.00 H new ATOM 0 HB2 GLU A 91 3.805 13.231 -0.580 1.00 0.00 H new ATOM 0 HB3 GLU A 91 5.460 13.752 -0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 91 4.578 14.443 -3.223 1.00 0.00 H new ATOM 0 HG3 GLU A 91 3.010 14.404 -2.442 1.00 0.00 H new ATOM 861 N GLU A 92 5.004 10.651 -0.142 1.00 0.00 N ATOM 862 CA GLU A 92 5.653 9.748 0.802 1.00 0.00 C ATOM 863 C GLU A 92 6.206 8.519 0.087 1.00 0.00 C ATOM 864 O GLU A 92 7.317 8.070 0.373 1.00 0.00 O ATOM 865 CB GLU A 92 4.666 9.316 1.891 1.00 0.00 C ATOM 866 CG GLU A 92 4.413 10.385 2.940 1.00 0.00 C ATOM 867 CD GLU A 92 3.259 10.037 3.861 1.00 0.00 C ATOM 868 OE1 GLU A 92 2.102 10.045 3.389 1.00 0.00 O ATOM 869 OE2 GLU A 92 3.512 9.756 5.051 1.00 0.00 O ATOM 0 H GLU A 92 4.019 10.830 0.054 1.00 0.00 H new ATOM 0 HA GLU A 92 6.483 10.283 1.264 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.719 9.045 1.425 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.048 8.420 2.381 1.00 0.00 H new ATOM 0 HG2 GLU A 92 5.316 10.528 3.533 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.204 11.333 2.444 1.00 0.00 H new ATOM 876 N ILE A 93 5.426 7.981 -0.842 1.00 0.00 N ATOM 877 CA ILE A 93 5.837 6.805 -1.599 1.00 0.00 C ATOM 878 C ILE A 93 6.965 7.143 -2.569 1.00 0.00 C ATOM 879 O ILE A 93 7.818 6.305 -2.862 1.00 0.00 O ATOM 880 CB ILE A 93 4.660 6.203 -2.388 1.00 0.00 C ATOM 881 CG1 ILE A 93 3.467 5.959 -1.461 1.00 0.00 C ATOM 882 CG2 ILE A 93 5.084 4.908 -3.066 1.00 0.00 C ATOM 883 CD1 ILE A 93 3.813 5.149 -0.231 1.00 0.00 C ATOM 0 H ILE A 93 4.504 8.341 -1.090 1.00 0.00 H new ATOM 0 HA ILE A 93 6.191 6.071 -0.875 1.00 0.00 H new ATOM 0 HB ILE A 93 4.358 6.912 -3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.057 6.920 -1.150 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.684 5.443 -2.017 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.241 4.494 -3.620 1.00 0.00 H new ATOM 0 HG22 ILE A 93 5.906 5.109 -3.753 1.00 0.00 H new ATOM 0 HG23 ILE A 93 5.409 4.192 -2.311 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.920 5.015 0.380 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.195 4.174 -0.533 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.573 5.673 0.348 1.00 0.00 H new ATOM 895 N LYS A 94 6.965 8.377 -3.061 1.00 0.00 N ATOM 896 CA LYS A 94 7.990 8.828 -3.995 1.00 0.00 C ATOM 897 C LYS A 94 9.319 9.046 -3.280 1.00 0.00 C ATOM 898 O LYS A 94 10.381 8.712 -3.807 1.00 0.00 O ATOM 899 CB LYS A 94 7.548 10.123 -4.680 1.00 0.00 C ATOM 900 CG LYS A 94 6.775 9.897 -5.968 1.00 0.00 C ATOM 901 CD LYS A 94 6.134 11.182 -6.466 1.00 0.00 C ATOM 902 CE LYS A 94 7.180 12.176 -6.948 1.00 0.00 C ATOM 903 NZ LYS A 94 7.603 11.898 -8.349 1.00 0.00 N ATOM 0 H LYS A 94 6.266 9.083 -2.829 1.00 0.00 H new ATOM 0 HA LYS A 94 8.127 8.053 -4.749 1.00 0.00 H new ATOM 0 HB2 LYS A 94 6.928 10.696 -3.990 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.428 10.729 -4.896 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.446 9.504 -6.732 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.004 9.145 -5.803 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.445 10.955 -7.279 1.00 0.00 H new ATOM 0 HD3 LYS A 94 5.546 11.631 -5.665 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.778 13.187 -6.884 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.049 12.136 -6.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.316 12.596 -8.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.010 10.943 -8.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.778 11.961 -8.980 1.00 0.00 H new ATOM 917 N LYS A 95 9.255 9.607 -2.078 1.00 0.00 N ATOM 918 CA LYS A 95 10.453 9.867 -1.288 1.00 0.00 C ATOM 919 C LYS A 95 11.026 8.570 -0.725 1.00 0.00 C ATOM 920 O LYS A 95 12.234 8.451 -0.520 1.00 0.00 O ATOM 921 CB LYS A 95 10.136 10.836 -0.147 1.00 0.00 C ATOM 922 CG LYS A 95 9.435 10.181 1.030 1.00 0.00 C ATOM 923 CD LYS A 95 9.402 11.098 2.241 1.00 0.00 C ATOM 924 CE LYS A 95 8.622 10.478 3.389 1.00 0.00 C ATOM 925 NZ LYS A 95 9.073 10.995 4.711 1.00 0.00 N ATOM 0 H LYS A 95 8.385 9.891 -1.628 1.00 0.00 H new ATOM 0 HA LYS A 95 11.199 10.318 -1.942 1.00 0.00 H new ATOM 0 HB2 LYS A 95 11.064 11.291 0.201 1.00 0.00 H new ATOM 0 HB3 LYS A 95 9.510 11.642 -0.529 1.00 0.00 H new ATOM 0 HG2 LYS A 95 8.417 9.915 0.746 1.00 0.00 H new ATOM 0 HG3 LYS A 95 9.946 9.254 1.289 1.00 0.00 H new ATOM 0 HD2 LYS A 95 10.421 11.311 2.565 1.00 0.00 H new ATOM 0 HD3 LYS A 95 8.950 12.051 1.965 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.560 10.687 3.261 1.00 0.00 H new ATOM 0 HE3 LYS A 95 8.739 9.395 3.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 8.516 10.548 5.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 10.080 10.773 4.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 8.938 12.026 4.745 1.00 0.00 H new ATOM 939 N LEU A 96 10.151 7.601 -0.478 1.00 0.00 N ATOM 940 CA LEU A 96 10.570 6.312 0.060 1.00 0.00 C ATOM 941 C LEU A 96 11.053 5.388 -1.053 1.00 0.00 C ATOM 942 O LEU A 96 11.978 4.598 -0.861 1.00 0.00 O ATOM 943 CB LEU A 96 9.417 5.655 0.819 1.00 0.00 C ATOM 944 CG LEU A 96 9.007 6.327 2.131 1.00 0.00 C ATOM 945 CD1 LEU A 96 7.685 5.762 2.629 1.00 0.00 C ATOM 946 CD2 LEU A 96 10.093 6.153 3.181 1.00 0.00 C ATOM 0 H LEU A 96 9.148 7.684 -0.642 1.00 0.00 H new ATOM 0 HA LEU A 96 11.398 6.485 0.748 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.547 5.624 0.163 1.00 0.00 H new ATOM 0 HB3 LEU A 96 9.691 4.622 1.033 1.00 0.00 H new ATOM 0 HG LEU A 96 8.876 7.393 1.946 1.00 0.00 H new ATOM 0 HD11 LEU A 96 7.409 6.251 3.563 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.910 5.939 1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.788 4.690 2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 96 9.784 6.637 4.107 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.256 5.091 3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 96 11.019 6.606 2.826 1.00 0.00 H new ATOM 958 N THR A 97 10.423 5.494 -2.218 1.00 0.00 N ATOM 959 CA THR A 97 10.788 4.669 -3.363 1.00 0.00 C ATOM 960 C THR A 97 10.392 5.340 -4.673 1.00 0.00 C ATOM 961 O THR A 97 9.311 5.919 -4.785 1.00 0.00 O ATOM 962 CB THR A 97 10.126 3.281 -3.290 1.00 0.00 C ATOM 963 OG1 THR A 97 10.407 2.669 -2.026 1.00 0.00 O ATOM 964 CG2 THR A 97 10.621 2.385 -4.414 1.00 0.00 C ATOM 0 H THR A 97 9.657 6.144 -2.394 1.00 0.00 H new ATOM 0 HA THR A 97 11.871 4.549 -3.332 1.00 0.00 H new ATOM 0 HB THR A 97 9.049 3.411 -3.398 1.00 0.00 H new ATOM 0 HG1 THR A 97 10.538 1.706 -2.151 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.139 1.410 -4.341 1.00 0.00 H new ATOM 0 HG22 THR A 97 10.378 2.839 -5.375 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.701 2.263 -4.333 1.00 0.00 H new ATOM 972 N THR A 98 11.274 5.258 -5.665 1.00 0.00 N ATOM 973 CA THR A 98 11.017 5.858 -6.968 1.00 0.00 C ATOM 974 C THR A 98 10.980 4.798 -8.063 1.00 0.00 C ATOM 975 O THR A 98 11.078 5.115 -9.249 1.00 0.00 O ATOM 976 CB THR A 98 12.083 6.911 -7.322 1.00 0.00 C ATOM 977 OG1 THR A 98 13.392 6.382 -7.086 1.00 0.00 O ATOM 978 CG2 THR A 98 11.887 8.177 -6.502 1.00 0.00 C ATOM 0 H THR A 98 12.173 4.782 -5.590 1.00 0.00 H new ATOM 0 HA THR A 98 10.044 6.345 -6.906 1.00 0.00 H new ATOM 0 HB THR A 98 11.978 7.161 -8.378 1.00 0.00 H new ATOM 0 HG1 THR A 98 14.064 7.057 -7.315 1.00 0.00 H new ATOM 0 HG21 THR A 98 12.652 8.906 -6.770 1.00 0.00 H new ATOM 0 HG22 THR A 98 10.901 8.594 -6.707 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.968 7.940 -5.441 1.00 0.00 H new ATOM 986 N ASP A 99 10.840 3.541 -7.660 1.00 0.00 N ATOM 987 CA ASP A 99 10.790 2.434 -8.608 1.00 0.00 C ATOM 988 C ASP A 99 9.427 1.749 -8.572 1.00 0.00 C ATOM 989 O ASP A 99 8.906 1.404 -7.511 1.00 0.00 O ATOM 990 CB ASP A 99 11.892 1.420 -8.300 1.00 0.00 C ATOM 991 CG ASP A 99 12.347 0.666 -9.534 1.00 0.00 C ATOM 992 OD1 ASP A 99 11.510 -0.031 -10.146 1.00 0.00 O ATOM 993 OD2 ASP A 99 13.539 0.775 -9.889 1.00 0.00 O ATOM 0 H ASP A 99 10.759 3.262 -6.682 1.00 0.00 H new ATOM 0 HA ASP A 99 10.948 2.838 -9.608 1.00 0.00 H new ATOM 0 HB2 ASP A 99 12.744 1.937 -7.859 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.530 0.710 -7.557 1.00 0.00 H new ATOM 998 N PRO A 100 8.834 1.548 -9.758 1.00 0.00 N ATOM 999 CA PRO A 100 7.524 0.903 -9.889 1.00 0.00 C ATOM 1000 C PRO A 100 7.573 -0.583 -9.550 1.00 0.00 C ATOM 1001 O PRO A 100 6.668 -1.112 -8.904 1.00 0.00 O ATOM 1002 CB PRO A 100 7.176 1.103 -11.366 1.00 0.00 C ATOM 1003 CG PRO A 100 8.492 1.248 -12.050 1.00 0.00 C ATOM 1004 CD PRO A 100 9.397 1.933 -11.063 1.00 0.00 C ATOM 0 HA PRO A 100 6.791 1.327 -9.203 1.00 0.00 H new ATOM 0 HB2 PRO A 100 6.617 0.254 -11.759 1.00 0.00 H new ATOM 0 HB3 PRO A 100 6.556 1.987 -11.510 1.00 0.00 H new ATOM 0 HG2 PRO A 100 8.892 0.276 -12.337 1.00 0.00 H new ATOM 0 HG3 PRO A 100 8.395 1.835 -12.963 1.00 0.00 H new ATOM 0 HD2 PRO A 100 10.430 1.602 -11.168 1.00 0.00 H new ATOM 0 HD3 PRO A 100 9.394 3.015 -11.199 1.00 0.00 H new ATOM 1012 N ASP A 101 8.634 -1.251 -9.990 1.00 0.00 N ATOM 1013 CA ASP A 101 8.801 -2.677 -9.732 1.00 0.00 C ATOM 1014 C ASP A 101 8.892 -2.951 -8.235 1.00 0.00 C ATOM 1015 O ASP A 101 8.286 -3.894 -7.727 1.00 0.00 O ATOM 1016 CB ASP A 101 10.054 -3.200 -10.436 1.00 0.00 C ATOM 1017 CG ASP A 101 9.913 -3.199 -11.945 1.00 0.00 C ATOM 1018 OD1 ASP A 101 9.752 -2.104 -12.525 1.00 0.00 O ATOM 1019 OD2 ASP A 101 9.965 -4.291 -12.548 1.00 0.00 O ATOM 0 H ASP A 101 9.391 -0.828 -10.527 1.00 0.00 H new ATOM 0 HA ASP A 101 7.928 -3.198 -10.126 1.00 0.00 H new ATOM 0 HB2 ASP A 101 10.909 -2.586 -10.153 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.263 -4.214 -10.094 1.00 0.00 H new ATOM 1024 N LEU A 102 9.655 -2.120 -7.531 1.00 0.00 N ATOM 1025 CA LEU A 102 9.827 -2.273 -6.091 1.00 0.00 C ATOM 1026 C LEU A 102 8.508 -2.050 -5.358 1.00 0.00 C ATOM 1027 O LEU A 102 8.134 -2.831 -4.483 1.00 0.00 O ATOM 1028 CB LEU A 102 10.882 -1.291 -5.577 1.00 0.00 C ATOM 1029 CG LEU A 102 11.390 -1.537 -4.156 1.00 0.00 C ATOM 1030 CD1 LEU A 102 12.002 -2.925 -4.040 1.00 0.00 C ATOM 1031 CD2 LEU A 102 12.402 -0.472 -3.760 1.00 0.00 C ATOM 0 H LEU A 102 10.164 -1.334 -7.935 1.00 0.00 H new ATOM 0 HA LEU A 102 10.162 -3.292 -5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 102 11.734 -1.316 -6.256 1.00 0.00 H new ATOM 0 HB3 LEU A 102 10.466 -0.284 -5.624 1.00 0.00 H new ATOM 0 HG LEU A 102 10.543 -1.478 -3.473 1.00 0.00 H new ATOM 0 HD11 LEU A 102 12.358 -3.082 -3.022 1.00 0.00 H new ATOM 0 HD12 LEU A 102 11.249 -3.676 -4.281 1.00 0.00 H new ATOM 0 HD13 LEU A 102 12.838 -3.013 -4.734 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.753 -0.663 -2.746 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.247 -0.500 -4.448 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.932 0.510 -3.802 1.00 0.00 H new ATOM 1043 N ILE A 103 7.808 -0.982 -5.724 1.00 0.00 N ATOM 1044 CA ILE A 103 6.529 -0.659 -5.103 1.00 0.00 C ATOM 1045 C ILE A 103 5.497 -1.749 -5.371 1.00 0.00 C ATOM 1046 O ILE A 103 4.791 -2.188 -4.462 1.00 0.00 O ATOM 1047 CB ILE A 103 5.980 0.688 -5.613 1.00 0.00 C ATOM 1048 CG1 ILE A 103 6.972 1.813 -5.313 1.00 0.00 C ATOM 1049 CG2 ILE A 103 4.629 0.982 -4.979 1.00 0.00 C ATOM 1050 CD1 ILE A 103 6.746 3.056 -6.147 1.00 0.00 C ATOM 0 H ILE A 103 8.104 -0.326 -6.447 1.00 0.00 H new ATOM 0 HA ILE A 103 6.708 -0.587 -4.030 1.00 0.00 H new ATOM 0 HB ILE A 103 5.847 0.625 -6.693 1.00 0.00 H new ATOM 0 HG12 ILE A 103 6.903 2.076 -4.257 1.00 0.00 H new ATOM 0 HG13 ILE A 103 7.985 1.449 -5.485 1.00 0.00 H new ATOM 0 HG21 ILE A 103 4.254 1.936 -5.348 1.00 0.00 H new ATOM 0 HG22 ILE A 103 3.926 0.191 -5.238 1.00 0.00 H new ATOM 0 HG23 ILE A 103 4.738 1.030 -3.896 1.00 0.00 H new ATOM 0 HD11 ILE A 103 7.485 3.812 -5.881 1.00 0.00 H new ATOM 0 HD12 ILE A 103 6.844 2.808 -7.204 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.745 3.445 -5.957 1.00 0.00 H new ATOM 1062 N LEU A 104 5.415 -2.184 -6.623 1.00 0.00 N ATOM 1063 CA LEU A 104 4.471 -3.226 -7.012 1.00 0.00 C ATOM 1064 C LEU A 104 4.710 -4.503 -6.212 1.00 0.00 C ATOM 1065 O LEU A 104 3.764 -5.167 -5.789 1.00 0.00 O ATOM 1066 CB LEU A 104 4.589 -3.517 -8.508 1.00 0.00 C ATOM 1067 CG LEU A 104 3.930 -2.503 -9.444 1.00 0.00 C ATOM 1068 CD1 LEU A 104 4.472 -2.650 -10.858 1.00 0.00 C ATOM 1069 CD2 LEU A 104 2.418 -2.668 -9.431 1.00 0.00 C ATOM 0 H LEU A 104 5.991 -1.831 -7.387 1.00 0.00 H new ATOM 0 HA LEU A 104 3.464 -2.868 -6.797 1.00 0.00 H new ATOM 0 HB2 LEU A 104 5.647 -3.582 -8.763 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.153 -4.497 -8.702 1.00 0.00 H new ATOM 0 HG LEU A 104 4.169 -1.501 -9.088 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.991 -1.920 -11.510 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.549 -2.480 -10.855 1.00 0.00 H new ATOM 0 HD13 LEU A 104 4.265 -3.655 -11.224 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.967 -1.938 -10.103 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.159 -3.674 -9.761 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.043 -2.510 -8.420 1.00 0.00 H new ATOM 1081 N GLU A 105 5.980 -4.838 -6.010 1.00 0.00 N ATOM 1082 CA GLU A 105 6.342 -6.036 -5.260 1.00 0.00 C ATOM 1083 C GLU A 105 5.875 -5.933 -3.811 1.00 0.00 C ATOM 1084 O GLU A 105 5.376 -6.902 -3.238 1.00 0.00 O ATOM 1085 CB GLU A 105 7.856 -6.253 -5.305 1.00 0.00 C ATOM 1086 CG GLU A 105 8.310 -7.524 -4.605 1.00 0.00 C ATOM 1087 CD GLU A 105 9.639 -8.034 -5.126 1.00 0.00 C ATOM 1088 OE1 GLU A 105 10.630 -7.276 -5.063 1.00 0.00 O ATOM 1089 OE2 GLU A 105 9.689 -9.190 -5.596 1.00 0.00 O ATOM 0 H GLU A 105 6.774 -4.299 -6.354 1.00 0.00 H new ATOM 0 HA GLU A 105 5.845 -6.888 -5.724 1.00 0.00 H new ATOM 0 HB2 GLU A 105 8.179 -6.286 -6.345 1.00 0.00 H new ATOM 0 HB3 GLU A 105 8.351 -5.398 -4.845 1.00 0.00 H new ATOM 0 HG2 GLU A 105 8.392 -7.335 -3.535 1.00 0.00 H new ATOM 0 HG3 GLU A 105 7.552 -8.297 -4.735 1.00 0.00 H new ATOM 1096 N VAL A 106 6.040 -4.752 -3.225 1.00 0.00 N ATOM 1097 CA VAL A 106 5.634 -4.520 -1.844 1.00 0.00 C ATOM 1098 C VAL A 106 4.129 -4.696 -1.676 1.00 0.00 C ATOM 1099 O VAL A 106 3.668 -5.320 -0.719 1.00 0.00 O ATOM 1100 CB VAL A 106 6.031 -3.110 -1.370 1.00 0.00 C ATOM 1101 CG1 VAL A 106 5.581 -2.881 0.064 1.00 0.00 C ATOM 1102 CG2 VAL A 106 7.533 -2.906 -1.505 1.00 0.00 C ATOM 0 H VAL A 106 6.452 -3.940 -3.685 1.00 0.00 H new ATOM 0 HA VAL A 106 6.154 -5.259 -1.234 1.00 0.00 H new ATOM 0 HB VAL A 106 5.529 -2.379 -2.003 1.00 0.00 H new ATOM 0 HG11 VAL A 106 5.871 -1.879 0.381 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.497 -2.982 0.126 1.00 0.00 H new ATOM 0 HG13 VAL A 106 6.052 -3.618 0.715 1.00 0.00 H new ATOM 0 HG21 VAL A 106 7.796 -1.904 -1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 106 8.057 -3.644 -0.897 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.824 -3.023 -2.549 1.00 0.00 H new ATOM 1112 N LEU A 107 3.367 -4.142 -2.613 1.00 0.00 N ATOM 1113 CA LEU A 107 1.912 -4.237 -2.569 1.00 0.00 C ATOM 1114 C LEU A 107 1.455 -5.681 -2.755 1.00 0.00 C ATOM 1115 O LEU A 107 0.636 -6.186 -1.987 1.00 0.00 O ATOM 1116 CB LEU A 107 1.291 -3.351 -3.650 1.00 0.00 C ATOM 1117 CG LEU A 107 1.197 -1.860 -3.324 1.00 0.00 C ATOM 1118 CD1 LEU A 107 0.941 -1.052 -4.586 1.00 0.00 C ATOM 1119 CD2 LEU A 107 0.105 -1.606 -2.295 1.00 0.00 C ATOM 0 H LEU A 107 3.732 -3.623 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 107 1.579 -3.893 -1.590 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.873 -3.466 -4.565 1.00 0.00 H new ATOM 0 HB3 LEU A 107 0.287 -3.720 -3.862 1.00 0.00 H new ATOM 0 HG LEU A 107 2.149 -1.541 -2.900 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.877 0.006 -4.334 1.00 0.00 H new ATOM 0 HD12 LEU A 107 1.758 -1.209 -5.290 1.00 0.00 H new ATOM 0 HD13 LEU A 107 0.004 -1.374 -5.040 1.00 0.00 H new ATOM 0 HD21 LEU A 107 0.053 -0.540 -2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.853 -1.942 -2.691 1.00 0.00 H new ATOM 0 HD23 LEU A 107 0.332 -2.154 -1.381 1.00 0.00 H new ATOM 1131 N ARG A 108 1.992 -6.339 -3.777 1.00 0.00 N ATOM 1132 CA ARG A 108 1.640 -7.725 -4.063 1.00 0.00 C ATOM 1133 C ARG A 108 2.233 -8.663 -3.016 1.00 0.00 C ATOM 1134 O ARG A 108 1.725 -9.762 -2.794 1.00 0.00 O ATOM 1135 CB ARG A 108 2.131 -8.121 -5.456 1.00 0.00 C ATOM 1136 CG ARG A 108 1.468 -9.375 -6.001 1.00 0.00 C ATOM 1137 CD ARG A 108 2.155 -9.863 -7.268 1.00 0.00 C ATOM 1138 NE ARG A 108 1.843 -9.020 -8.419 1.00 0.00 N ATOM 1139 CZ ARG A 108 2.543 -9.030 -9.547 1.00 0.00 C ATOM 1140 NH1 ARG A 108 3.591 -9.833 -9.676 1.00 0.00 N ATOM 1141 NH2 ARG A 108 2.198 -8.233 -10.551 1.00 0.00 N ATOM 0 H ARG A 108 2.672 -5.935 -4.421 1.00 0.00 H new ATOM 0 HA ARG A 108 0.554 -7.813 -4.030 1.00 0.00 H new ATOM 0 HB2 ARG A 108 1.949 -7.296 -6.144 1.00 0.00 H new ATOM 0 HB3 ARG A 108 3.209 -8.276 -5.422 1.00 0.00 H new ATOM 0 HG2 ARG A 108 1.496 -10.160 -5.245 1.00 0.00 H new ATOM 0 HG3 ARG A 108 0.418 -9.171 -6.211 1.00 0.00 H new ATOM 0 HD2 ARG A 108 3.234 -9.879 -7.112 1.00 0.00 H new ATOM 0 HD3 ARG A 108 1.848 -10.888 -7.475 1.00 0.00 H new ATOM 0 HE ARG A 108 1.044 -8.389 -8.353 1.00 0.00 H new ATOM 0 HH11 ARG A 108 3.862 -10.446 -8.907 1.00 0.00 H new ATOM 0 HH12 ARG A 108 4.126 -9.838 -10.544 1.00 0.00 H new ATOM 0 HH21 ARG A 108 1.394 -7.612 -10.456 1.00 0.00 H new ATOM 0 HH22 ARG A 108 2.737 -8.242 -11.417 1.00 0.00 H new ATOM 1155 N SER A 109 3.312 -8.222 -2.377 1.00 0.00 N ATOM 1156 CA SER A 109 3.977 -9.024 -1.357 1.00 0.00 C ATOM 1157 C SER A 109 3.193 -9.000 -0.049 1.00 0.00 C ATOM 1158 O SER A 109 3.257 -9.939 0.743 1.00 0.00 O ATOM 1159 CB SER A 109 5.399 -8.510 -1.122 1.00 0.00 C ATOM 1160 OG SER A 109 6.267 -8.914 -2.166 1.00 0.00 O ATOM 0 H SER A 109 3.744 -7.314 -2.548 1.00 0.00 H new ATOM 0 HA SER A 109 4.024 -10.053 -1.713 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.389 -7.422 -1.054 1.00 0.00 H new ATOM 0 HB3 SER A 109 5.772 -8.886 -0.169 1.00 0.00 H new ATOM 0 HG SER A 109 6.047 -8.421 -2.984 1.00 0.00 H new ATOM 1166 N SER A 110 2.451 -7.919 0.169 1.00 0.00 N ATOM 1167 CA SER A 110 1.657 -7.769 1.382 1.00 0.00 C ATOM 1168 C SER A 110 0.217 -8.213 1.146 1.00 0.00 C ATOM 1169 O SER A 110 -0.369 -7.975 0.090 1.00 0.00 O ATOM 1170 CB SER A 110 1.681 -6.315 1.858 1.00 0.00 C ATOM 1171 OG SER A 110 1.415 -6.227 3.247 1.00 0.00 O ATOM 0 H SER A 110 2.383 -7.134 -0.479 1.00 0.00 H new ATOM 0 HA SER A 110 2.095 -8.403 2.153 1.00 0.00 H new ATOM 0 HB2 SER A 110 2.655 -5.875 1.643 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.941 -5.736 1.306 1.00 0.00 H new ATOM 0 HG SER A 110 1.690 -5.346 3.578 1.00 0.00 H new ATOM 1177 N PRO A 111 -0.370 -8.877 2.154 1.00 0.00 N ATOM 1178 CA PRO A 111 -1.749 -9.369 2.082 1.00 0.00 C ATOM 1179 C PRO A 111 -2.770 -8.237 2.102 1.00 0.00 C ATOM 1180 O PRO A 111 -3.663 -8.179 1.256 1.00 0.00 O ATOM 1181 CB PRO A 111 -1.883 -10.233 3.339 1.00 0.00 C ATOM 1182 CG PRO A 111 -0.878 -9.680 4.288 1.00 0.00 C ATOM 1183 CD PRO A 111 0.268 -9.195 3.442 1.00 0.00 C ATOM 0 HA PRO A 111 -1.942 -9.909 1.155 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -2.890 -10.177 3.752 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -1.686 -11.283 3.121 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -1.302 -8.865 4.875 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -0.547 -10.442 4.994 1.00 0.00 H new ATOM 0 HD2 PRO A 111 0.748 -8.320 3.880 1.00 0.00 H new ATOM 0 HD3 PRO A 111 1.038 -9.959 3.332 1.00 0.00 H new ATOM 1191 N MET A 112 -2.633 -7.339 3.073 1.00 0.00 N ATOM 1192 CA MET A 112 -3.544 -6.208 3.200 1.00 0.00 C ATOM 1193 C MET A 112 -3.962 -5.689 1.829 1.00 0.00 C ATOM 1194 O MET A 112 -5.084 -5.214 1.649 1.00 0.00 O ATOM 1195 CB MET A 112 -2.887 -5.086 4.007 1.00 0.00 C ATOM 1196 CG MET A 112 -2.383 -5.531 5.370 1.00 0.00 C ATOM 1197 SD MET A 112 -2.085 -4.147 6.485 1.00 0.00 S ATOM 1198 CE MET A 112 -3.758 -3.741 6.978 1.00 0.00 C ATOM 0 H MET A 112 -1.901 -7.373 3.782 1.00 0.00 H new ATOM 0 HA MET A 112 -4.436 -6.549 3.725 1.00 0.00 H new ATOM 0 HB2 MET A 112 -2.053 -4.679 3.435 1.00 0.00 H new ATOM 0 HB3 MET A 112 -3.606 -4.277 4.141 1.00 0.00 H new ATOM 0 HG2 MET A 112 -3.112 -6.205 5.820 1.00 0.00 H new ATOM 0 HG3 MET A 112 -1.460 -6.097 5.245 1.00 0.00 H new ATOM 0 HE1 MET A 112 -3.902 -2.662 6.921 1.00 0.00 H new ATOM 0 HE2 MET A 112 -4.464 -4.237 6.312 1.00 0.00 H new ATOM 0 HE3 MET A 112 -3.927 -4.077 8.001 1.00 0.00 H new ATOM 1208 N VAL A 113 -3.053 -5.780 0.864 1.00 0.00 N ATOM 1209 CA VAL A 113 -3.327 -5.320 -0.491 1.00 0.00 C ATOM 1210 C VAL A 113 -3.012 -6.405 -1.515 1.00 0.00 C ATOM 1211 O VAL A 113 -2.281 -7.351 -1.225 1.00 0.00 O ATOM 1212 CB VAL A 113 -2.513 -4.058 -0.831 1.00 0.00 C ATOM 1213 CG1 VAL A 113 -2.863 -2.924 0.121 1.00 0.00 C ATOM 1214 CG2 VAL A 113 -1.022 -4.358 -0.791 1.00 0.00 C ATOM 0 H VAL A 113 -2.119 -6.169 0.996 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.390 -5.081 -0.534 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.769 -3.743 -1.843 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.278 -2.041 -0.135 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.925 -2.693 0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.637 -3.225 1.144 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -0.462 -3.455 -1.034 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.746 -4.699 0.207 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.788 -5.136 -1.517 1.00 0.00 H new ATOM 1224 N GLN A 114 -3.569 -6.261 -2.713 1.00 0.00 N ATOM 1225 CA GLN A 114 -3.347 -7.230 -3.780 1.00 0.00 C ATOM 1226 C GLN A 114 -3.273 -6.538 -5.138 1.00 0.00 C ATOM 1227 O GLN A 114 -4.182 -5.802 -5.521 1.00 0.00 O ATOM 1228 CB GLN A 114 -4.463 -8.276 -3.788 1.00 0.00 C ATOM 1229 CG GLN A 114 -4.052 -9.600 -4.412 1.00 0.00 C ATOM 1230 CD GLN A 114 -4.947 -10.747 -3.987 1.00 0.00 C ATOM 1231 OE1 GLN A 114 -6.165 -10.598 -3.895 1.00 0.00 O ATOM 1232 NE2 GLN A 114 -4.345 -11.903 -3.727 1.00 0.00 N ATOM 0 H GLN A 114 -4.177 -5.483 -2.969 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.395 -7.726 -3.593 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.791 -8.453 -2.764 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -5.319 -7.878 -4.332 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -4.076 -9.509 -5.498 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -3.022 -9.825 -4.133 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -3.332 -11.982 -3.816 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -4.896 -12.711 -3.438 1.00 0.00 H new ATOM 1241 N VAL A 115 -2.183 -6.778 -5.859 1.00 0.00 N ATOM 1242 CA VAL A 115 -1.990 -6.178 -7.175 1.00 0.00 C ATOM 1243 C VAL A 115 -2.333 -7.166 -8.284 1.00 0.00 C ATOM 1244 O VAL A 115 -1.829 -8.290 -8.308 1.00 0.00 O ATOM 1245 CB VAL A 115 -0.541 -5.694 -7.363 1.00 0.00 C ATOM 1246 CG1 VAL A 115 -0.390 -4.962 -8.688 1.00 0.00 C ATOM 1247 CG2 VAL A 115 -0.122 -4.804 -6.203 1.00 0.00 C ATOM 0 H VAL A 115 -1.420 -7.383 -5.555 1.00 0.00 H new ATOM 0 HA VAL A 115 -2.662 -5.322 -7.235 1.00 0.00 H new ATOM 0 HB VAL A 115 0.115 -6.564 -7.379 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.641 -4.627 -8.803 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.647 -5.634 -9.507 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.056 -4.099 -8.705 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.905 -4.471 -6.352 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.781 -3.937 -6.153 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.189 -5.365 -5.271 1.00 0.00 H new ATOM 1257 N ASP A 116 -3.191 -6.740 -9.204 1.00 0.00 N ATOM 1258 CA ASP A 116 -3.600 -7.586 -10.319 1.00 0.00 C ATOM 1259 C ASP A 116 -2.397 -8.287 -10.940 1.00 0.00 C ATOM 1260 O ASP A 116 -1.358 -7.668 -11.171 1.00 0.00 O ATOM 1261 CB ASP A 116 -4.325 -6.755 -11.379 1.00 0.00 C ATOM 1262 CG ASP A 116 -5.235 -7.596 -12.253 1.00 0.00 C ATOM 1263 OD1 ASP A 116 -6.334 -7.960 -11.788 1.00 0.00 O ATOM 1264 OD2 ASP A 116 -4.845 -7.891 -13.403 1.00 0.00 O ATOM 0 H ASP A 116 -3.617 -5.813 -9.200 1.00 0.00 H new ATOM 0 HA ASP A 116 -4.281 -8.345 -9.935 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -4.913 -5.979 -10.889 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -3.590 -6.250 -12.006 1.00 0.00 H new ATOM 1269 N GLU A 117 -2.544 -9.581 -11.206 1.00 0.00 N ATOM 1270 CA GLU A 117 -1.467 -10.366 -11.798 1.00 0.00 C ATOM 1271 C GLU A 117 -0.670 -9.530 -12.796 1.00 0.00 C ATOM 1272 O GLU A 117 0.561 -9.555 -12.802 1.00 0.00 O ATOM 1273 CB GLU A 117 -2.031 -11.607 -12.492 1.00 0.00 C ATOM 1274 CG GLU A 117 -2.740 -12.563 -11.547 1.00 0.00 C ATOM 1275 CD GLU A 117 -3.544 -13.618 -12.280 1.00 0.00 C ATOM 1276 OE1 GLU A 117 -4.666 -13.305 -12.730 1.00 0.00 O ATOM 1277 OE2 GLU A 117 -3.051 -14.760 -12.404 1.00 0.00 O ATOM 0 H GLU A 117 -3.398 -10.108 -11.021 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.798 -10.680 -10.996 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.728 -11.293 -13.269 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -1.218 -12.136 -12.989 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.003 -13.051 -10.909 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -3.402 -11.996 -10.892 1.00 0.00 H new ATOM 1284 N LYS A 118 -1.381 -8.789 -13.640 1.00 0.00 N ATOM 1285 CA LYS A 118 -0.743 -7.945 -14.642 1.00 0.00 C ATOM 1286 C LYS A 118 -0.018 -6.775 -13.986 1.00 0.00 C ATOM 1287 O LYS A 118 1.131 -6.480 -14.314 1.00 0.00 O ATOM 1288 CB LYS A 118 -1.783 -7.422 -15.635 1.00 0.00 C ATOM 1289 CG LYS A 118 -2.234 -8.462 -16.646 1.00 0.00 C ATOM 1290 CD LYS A 118 -2.811 -7.814 -17.893 1.00 0.00 C ATOM 1291 CE LYS A 118 -3.580 -8.817 -18.740 1.00 0.00 C ATOM 1292 NZ LYS A 118 -4.868 -9.206 -18.104 1.00 0.00 N ATOM 0 H LYS A 118 -2.400 -8.757 -13.649 1.00 0.00 H new ATOM 0 HA LYS A 118 -0.011 -8.550 -15.177 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -2.652 -7.063 -15.083 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -1.367 -6.566 -16.167 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -1.389 -9.094 -16.921 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -2.983 -9.111 -16.192 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -3.472 -6.996 -17.606 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -2.005 -7.380 -18.484 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -3.775 -8.388 -19.723 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -2.968 -9.706 -18.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -5.473 -9.679 -18.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -4.682 -9.855 -17.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -5.350 -8.356 -17.749 1.00 0.00 H new ATOM 1306 N GLY A 119 -0.698 -6.110 -13.055 1.00 0.00 N ATOM 1307 CA GLY A 119 -0.101 -4.979 -12.367 1.00 0.00 C ATOM 1308 C GLY A 119 -0.608 -3.650 -12.889 1.00 0.00 C ATOM 1309 O GLY A 119 0.166 -2.842 -13.402 1.00 0.00 O ATOM 0 H GLY A 119 -1.650 -6.334 -12.766 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -0.315 -5.052 -11.301 1.00 0.00 H new ATOM 0 HA3 GLY A 119 0.982 -5.020 -12.479 1.00 0.00 H new ATOM 1313 N GLU A 120 -1.911 -3.423 -12.760 1.00 0.00 N ATOM 1314 CA GLU A 120 -2.520 -2.182 -13.226 1.00 0.00 C ATOM 1315 C GLU A 120 -3.395 -1.564 -12.140 1.00 0.00 C ATOM 1316 O GLU A 120 -3.517 -0.343 -12.045 1.00 0.00 O ATOM 1317 CB GLU A 120 -3.354 -2.438 -14.484 1.00 0.00 C ATOM 1318 CG GLU A 120 -2.524 -2.546 -15.752 1.00 0.00 C ATOM 1319 CD GLU A 120 -3.250 -3.280 -16.862 1.00 0.00 C ATOM 1320 OE1 GLU A 120 -3.872 -4.325 -16.574 1.00 0.00 O ATOM 1321 OE2 GLU A 120 -3.196 -2.812 -18.019 1.00 0.00 O ATOM 0 H GLU A 120 -2.565 -4.081 -12.337 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.719 -1.482 -13.465 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.922 -3.359 -14.352 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.077 -1.631 -14.601 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.259 -1.546 -16.095 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.591 -3.064 -15.528 1.00 0.00 H new ATOM 1328 N LYS A 121 -4.003 -2.416 -11.321 1.00 0.00 N ATOM 1329 CA LYS A 121 -4.867 -1.956 -10.240 1.00 0.00 C ATOM 1330 C LYS A 121 -4.652 -2.789 -8.981 1.00 0.00 C ATOM 1331 O LYS A 121 -4.371 -3.986 -9.056 1.00 0.00 O ATOM 1332 CB LYS A 121 -6.335 -2.027 -10.667 1.00 0.00 C ATOM 1333 CG LYS A 121 -6.757 -0.891 -11.581 1.00 0.00 C ATOM 1334 CD LYS A 121 -7.283 0.296 -10.791 1.00 0.00 C ATOM 1335 CE LYS A 121 -7.286 1.566 -11.626 1.00 0.00 C ATOM 1336 NZ LYS A 121 -8.300 2.545 -11.145 1.00 0.00 N ATOM 0 H LYS A 121 -3.913 -3.430 -11.386 1.00 0.00 H new ATOM 0 HA LYS A 121 -4.610 -0.920 -10.018 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.512 -2.975 -11.174 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -6.964 -2.019 -9.777 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.908 -0.577 -12.188 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -7.527 -1.242 -12.267 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -8.295 0.084 -10.446 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -6.668 0.445 -9.904 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -6.297 2.023 -11.595 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -7.489 1.315 -12.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -8.013 3.506 -11.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -9.224 2.324 -11.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -8.372 2.489 -10.109 1.00 0.00 H new ATOM 1350 N VAL A 122 -4.788 -2.150 -7.823 1.00 0.00 N ATOM 1351 CA VAL A 122 -4.612 -2.833 -6.547 1.00 0.00 C ATOM 1352 C VAL A 122 -5.781 -2.554 -5.609 1.00 0.00 C ATOM 1353 O VAL A 122 -6.281 -1.431 -5.539 1.00 0.00 O ATOM 1354 CB VAL A 122 -3.302 -2.405 -5.857 1.00 0.00 C ATOM 1355 CG1 VAL A 122 -3.248 -0.892 -5.706 1.00 0.00 C ATOM 1356 CG2 VAL A 122 -3.163 -3.090 -4.507 1.00 0.00 C ATOM 0 H VAL A 122 -5.020 -1.160 -7.743 1.00 0.00 H new ATOM 0 HA VAL A 122 -4.569 -3.901 -6.763 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.464 -2.713 -6.482 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.316 -0.608 -5.217 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -3.298 -0.426 -6.690 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -4.091 -0.556 -5.103 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.232 -2.776 -4.034 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.004 -2.815 -3.871 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -3.152 -4.171 -4.647 1.00 0.00 H new ATOM 1366 N ARG A 123 -6.212 -3.585 -4.889 1.00 0.00 N ATOM 1367 CA ARG A 123 -7.323 -3.452 -3.954 1.00 0.00 C ATOM 1368 C ARG A 123 -6.967 -4.052 -2.597 1.00 0.00 C ATOM 1369 O ARG A 123 -6.260 -5.054 -2.500 1.00 0.00 O ATOM 1370 CB ARG A 123 -8.573 -4.136 -4.514 1.00 0.00 C ATOM 1371 CG ARG A 123 -8.501 -5.654 -4.483 1.00 0.00 C ATOM 1372 CD ARG A 123 -9.888 -6.275 -4.409 1.00 0.00 C ATOM 1373 NE ARG A 123 -9.867 -7.585 -3.764 1.00 0.00 N ATOM 1374 CZ ARG A 123 -10.865 -8.458 -3.842 1.00 0.00 C ATOM 1375 NH1 ARG A 123 -11.956 -8.162 -4.534 1.00 0.00 N ATOM 1376 NH2 ARG A 123 -10.772 -9.631 -3.227 1.00 0.00 N ATOM 0 H ARG A 123 -5.809 -4.521 -4.935 1.00 0.00 H new ATOM 0 HA ARG A 123 -7.527 -2.390 -3.820 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -9.442 -3.810 -3.943 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -8.726 -3.809 -5.542 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -7.987 -6.013 -5.374 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -7.911 -5.974 -3.624 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -10.554 -5.610 -3.858 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -10.296 -6.373 -5.415 1.00 0.00 H new ATOM 0 HE ARG A 123 -9.041 -7.844 -3.224 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -12.031 -7.262 -5.008 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -12.721 -8.834 -4.592 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -9.934 -9.862 -2.694 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -11.539 -10.301 -3.287 1.00 0.00 H new ATOM 1390 N PRO A 124 -7.468 -3.424 -1.523 1.00 0.00 N ATOM 1391 CA PRO A 124 -7.216 -3.878 -0.152 1.00 0.00 C ATOM 1392 C PRO A 124 -7.925 -5.190 0.163 1.00 0.00 C ATOM 1393 O PRO A 124 -9.154 -5.256 0.179 1.00 0.00 O ATOM 1394 CB PRO A 124 -7.783 -2.744 0.706 1.00 0.00 C ATOM 1395 CG PRO A 124 -8.818 -2.101 -0.150 1.00 0.00 C ATOM 1396 CD PRO A 124 -8.319 -2.222 -1.564 1.00 0.00 C ATOM 0 HA PRO A 124 -6.159 -4.077 0.024 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -8.216 -3.126 1.631 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -7.005 -2.034 0.987 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -9.783 -2.594 -0.033 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -8.959 -1.056 0.126 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -9.140 -2.335 -2.272 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -7.755 -1.340 -1.868 1.00 0.00 H new ATOM 1404 N SER A 125 -7.141 -6.234 0.415 1.00 0.00 N ATOM 1405 CA SER A 125 -7.694 -7.547 0.727 1.00 0.00 C ATOM 1406 C SER A 125 -8.836 -7.431 1.732 1.00 0.00 C ATOM 1407 O SER A 125 -8.611 -7.360 2.940 1.00 0.00 O ATOM 1408 CB SER A 125 -6.603 -8.465 1.282 1.00 0.00 C ATOM 1409 OG SER A 125 -6.187 -8.042 2.569 1.00 0.00 O ATOM 0 H SER A 125 -6.122 -6.196 0.409 1.00 0.00 H new ATOM 0 HA SER A 125 -8.086 -7.977 -0.195 1.00 0.00 H new ATOM 0 HB2 SER A 125 -6.976 -9.488 1.335 1.00 0.00 H new ATOM 0 HB3 SER A 125 -5.749 -8.472 0.604 1.00 0.00 H new ATOM 0 HG SER A 125 -6.884 -7.481 2.970 1.00 0.00 H new