USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1077 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 100 MET CE :methyl 178:sc= -0.471 (180deg=-0.442) USER MOD Set 1.2: A 114 MET CE :methyl -127:sc= -0.645 (180deg=-3.17!) USER MOD Set 2.1: A 76 TYR OH : rot 14:sc= 0.639 USER MOD Set 2.2: A 103 HIS : no HD1:sc= -0.172 K(o=0.051,f=-3.4) USER MOD Set 2.3: A 104 CYS SG : rot 180:sc=-0.00644 USER MOD Set 2.4: A 107 ASN :FLIP amide:sc= -0.41 F(o=-1.6,f=0.051) USER MOD Set 3.1: A 89 THR OG1 : rot 180:sc= 0.207 USER MOD Set 3.2: A 92 ASN : amide:sc= 0.19 K(o=0.4,f=-0.25) USER MOD Set 4.1: A 32 SER OG : rot 180:sc=-0.000143 USER MOD Set 4.2: A 81 LYS NZ :NH3+ 178:sc= -0.117 (180deg=-0.134) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 CYS SG : rot 125:sc= 0.488 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0.0058 USER MOD Single : A 29 HIS : no HD1:sc= -4.42! C(o=-4.4!,f=-6.3!) USER MOD Single : A 30 CYS SG : rot 26:sc= 0.298 USER MOD Single : A 35 CYS SG : rot 60:sc= 1.19 USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc=-0.00754 X(o=-0.0075,f=-0.0075) USER MOD Single : A 57 ASN : amide:sc= -0.832 K(o=-0.83,f=-2.4!) USER MOD Single : A 58 GLN : amide:sc= -2.27 K(o=-2.3,f=-8.8!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 155:sc= -0.0953 (180deg=-0.524) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 133:sc= 0.00604 USER MOD Single : A 80 THR OG1 : rot -150:sc= -0.288 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= 0.235 K(o=0.23,f=-2.3!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 72:sc= 0.0844 USER MOD Single : A 101 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0114) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -164:sc= -0.0373 (180deg=-0.267) USER MOD Single : A 110 THR OG1 : rot 62:sc= 0.331 USER MOD Single : A 113 SER OG : rot 12:sc= 1.26 USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 ASN :FLIP amide:sc= -0.0102 F(o=-0.69,f=-0.01) USER MOD Single : A 130 SER OG : rot -95:sc= 1.09 USER MOD Single : A 132 MET CE :methyl 161:sc= -2.52 (180deg=-2.87!) USER MOD Single : A 140 THR OG1 : rot -23:sc= 0.714 USER MOD Single : A 143 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0383) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 49:sc= 0.448 USER MOD ----------------------------------------------------------------- ATOM 108 N ILE A 11 11.261 -4.585 4.843 1.00 0.00 N ATOM 109 CA ILE A 11 11.347 -3.357 4.063 1.00 0.00 C ATOM 110 C ILE A 11 12.764 -3.132 3.547 1.00 0.00 C ATOM 111 O ILE A 11 13.736 -3.256 4.293 1.00 0.00 O ATOM 112 CB ILE A 11 10.914 -2.133 4.891 1.00 0.00 C ATOM 113 CG1 ILE A 11 9.454 -2.276 5.326 1.00 0.00 C ATOM 114 CG2 ILE A 11 11.111 -0.855 4.090 1.00 0.00 C ATOM 115 CD1 ILE A 11 9.010 -1.216 6.311 1.00 0.00 C ATOM 0 HA ILE A 11 10.669 -3.472 3.217 1.00 0.00 H new ATOM 0 HB ILE A 11 11.536 -2.078 5.784 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.815 -2.232 4.444 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.311 -3.259 5.774 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.800 0.001 4.689 1.00 0.00 H new ATOM 0 HG22 ILE A 11 12.163 -0.750 3.825 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.511 -0.899 3.181 1.00 0.00 H new ATOM 0 HD11 ILE A 11 7.965 -1.379 6.575 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.625 -1.274 7.209 1.00 0.00 H new ATOM 0 HD13 ILE A 11 9.120 -0.230 5.859 1.00 0.00 H new ATOM 127 N THR A 12 12.875 -2.797 2.265 1.00 0.00 N ATOM 128 CA THR A 12 14.173 -2.553 1.648 1.00 0.00 C ATOM 129 C THR A 12 14.114 -1.365 0.695 1.00 0.00 C ATOM 130 O THR A 12 13.228 -1.283 -0.156 1.00 0.00 O ATOM 131 CB THR A 12 14.670 -3.791 0.878 1.00 0.00 C ATOM 132 OG1 THR A 12 14.750 -4.917 1.759 1.00 0.00 O ATOM 133 CG2 THR A 12 16.034 -3.529 0.256 1.00 0.00 C ATOM 0 H THR A 12 12.081 -2.688 1.634 1.00 0.00 H new ATOM 0 HA THR A 12 14.871 -2.332 2.456 1.00 0.00 H new ATOM 0 HB THR A 12 13.959 -4.005 0.080 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.065 -5.700 1.261 1.00 0.00 H new ATOM 0 HG21 THR A 12 16.365 -4.417 -0.283 1.00 0.00 H new ATOM 0 HG22 THR A 12 15.963 -2.690 -0.436 1.00 0.00 H new ATOM 0 HG23 THR A 12 16.752 -3.292 1.041 1.00 0.00 H new ATOM 141 N TYR A 13 15.063 -0.447 0.842 1.00 0.00 N ATOM 142 CA TYR A 13 15.117 0.738 -0.005 1.00 0.00 C ATOM 143 C TYR A 13 16.058 0.521 -1.186 1.00 0.00 C ATOM 144 O TYR A 13 17.174 0.026 -1.023 1.00 0.00 O ATOM 145 CB TYR A 13 15.573 1.951 0.808 1.00 0.00 C ATOM 146 CG TYR A 13 14.832 2.117 2.115 1.00 0.00 C ATOM 147 CD1 TYR A 13 13.594 2.747 2.159 1.00 0.00 C ATOM 148 CD2 TYR A 13 15.369 1.646 3.306 1.00 0.00 C ATOM 149 CE1 TYR A 13 12.913 2.902 3.351 1.00 0.00 C ATOM 150 CE2 TYR A 13 14.695 1.795 4.502 1.00 0.00 C ATOM 151 CZ TYR A 13 13.467 2.424 4.520 1.00 0.00 C ATOM 152 OH TYR A 13 12.793 2.575 5.710 1.00 0.00 O ATOM 0 H TYR A 13 15.805 -0.501 1.540 1.00 0.00 H new ATOM 0 HA TYR A 13 14.115 0.923 -0.391 1.00 0.00 H new ATOM 0 HB2 TYR A 13 16.640 1.860 1.014 1.00 0.00 H new ATOM 0 HB3 TYR A 13 15.440 2.851 0.208 1.00 0.00 H new ATOM 0 HD1 TYR A 13 13.157 3.122 1.245 1.00 0.00 H new ATOM 0 HD2 TYR A 13 16.331 1.155 3.297 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.952 3.395 3.367 1.00 0.00 H new ATOM 0 HE2 TYR A 13 15.127 1.421 5.419 1.00 0.00 H new ATOM 0 HH TYR A 13 13.320 2.182 6.437 1.00 0.00 H new ATOM 162 N VAL A 14 15.600 0.895 -2.376 1.00 0.00 N ATOM 163 CA VAL A 14 16.400 0.743 -3.586 1.00 0.00 C ATOM 164 C VAL A 14 16.423 2.035 -4.395 1.00 0.00 C ATOM 165 O VAL A 14 15.483 2.829 -4.346 1.00 0.00 O ATOM 166 CB VAL A 14 15.864 -0.396 -4.474 1.00 0.00 C ATOM 167 CG1 VAL A 14 16.667 -0.491 -5.762 1.00 0.00 C ATOM 168 CG2 VAL A 14 15.892 -1.716 -3.720 1.00 0.00 C ATOM 0 H VAL A 14 14.679 1.306 -2.528 1.00 0.00 H new ATOM 0 HA VAL A 14 17.413 0.499 -3.267 1.00 0.00 H new ATOM 0 HB VAL A 14 14.829 -0.175 -4.735 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.274 -1.301 -6.377 1.00 0.00 H new ATOM 0 HG12 VAL A 14 16.591 0.449 -6.308 1.00 0.00 H new ATOM 0 HG13 VAL A 14 17.712 -0.689 -5.525 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.510 -2.510 -4.362 1.00 0.00 H new ATOM 0 HG22 VAL A 14 16.917 -1.947 -3.428 1.00 0.00 H new ATOM 0 HG23 VAL A 14 15.269 -1.639 -2.829 1.00 0.00 H new ATOM 178 N LYS A 15 17.504 2.241 -5.140 1.00 0.00 N ATOM 179 CA LYS A 15 17.651 3.436 -5.962 1.00 0.00 C ATOM 180 C LYS A 15 17.518 3.097 -7.443 1.00 0.00 C ATOM 181 O LYS A 15 18.254 2.262 -7.968 1.00 0.00 O ATOM 182 CB LYS A 15 19.006 4.097 -5.700 1.00 0.00 C ATOM 183 CG LYS A 15 19.203 5.401 -6.453 1.00 0.00 C ATOM 184 CD LYS A 15 20.643 5.878 -6.375 1.00 0.00 C ATOM 185 CE LYS A 15 21.549 5.069 -7.291 1.00 0.00 C ATOM 186 NZ LYS A 15 22.977 5.465 -7.151 1.00 0.00 N ATOM 0 H LYS A 15 18.292 1.595 -5.191 1.00 0.00 H new ATOM 0 HA LYS A 15 16.856 4.131 -5.693 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.108 4.285 -4.631 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.799 3.403 -5.979 1.00 0.00 H new ATOM 0 HG2 LYS A 15 18.920 5.266 -7.497 1.00 0.00 H new ATOM 0 HG3 LYS A 15 18.543 6.164 -6.040 1.00 0.00 H new ATOM 0 HD2 LYS A 15 20.694 6.932 -6.650 1.00 0.00 H new ATOM 0 HD3 LYS A 15 20.998 5.799 -5.348 1.00 0.00 H new ATOM 0 HE2 LYS A 15 21.442 4.009 -7.063 1.00 0.00 H new ATOM 0 HE3 LYS A 15 21.234 5.205 -8.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 23.561 4.890 -7.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 23.084 6.471 -7.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 23.285 5.311 -6.170 1.00 0.00 H new ATOM 200 N GLY A 16 16.574 3.751 -8.113 1.00 0.00 N ATOM 201 CA GLY A 16 16.362 3.506 -9.528 1.00 0.00 C ATOM 202 C GLY A 16 14.906 3.252 -9.861 1.00 0.00 C ATOM 203 O GLY A 16 14.037 3.356 -8.995 1.00 0.00 O ATOM 0 H GLY A 16 15.952 4.446 -7.701 1.00 0.00 H new ATOM 0 HA2 GLY A 16 16.718 4.363 -10.099 1.00 0.00 H new ATOM 0 HA3 GLY A 16 16.957 2.647 -9.838 1.00 0.00 H new ATOM 207 N ASP A 17 14.637 2.920 -11.119 1.00 0.00 N ATOM 208 CA ASP A 17 13.275 2.651 -11.565 1.00 0.00 C ATOM 209 C ASP A 17 12.481 1.930 -10.481 1.00 0.00 C ATOM 210 O ASP A 17 13.047 1.214 -9.654 1.00 0.00 O ATOM 211 CB ASP A 17 13.291 1.814 -12.845 1.00 0.00 C ATOM 212 CG ASP A 17 14.412 2.214 -13.784 1.00 0.00 C ATOM 213 OD1 ASP A 17 14.731 3.419 -13.848 1.00 0.00 O ATOM 214 OD2 ASP A 17 14.969 1.321 -14.457 1.00 0.00 O ATOM 0 H ASP A 17 15.345 2.831 -11.848 1.00 0.00 H new ATOM 0 HA ASP A 17 12.791 3.606 -11.770 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.397 0.761 -12.586 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.335 1.922 -13.358 1.00 0.00 H new ATOM 219 N LEU A 18 11.167 2.125 -10.489 1.00 0.00 N ATOM 220 CA LEU A 18 10.293 1.494 -9.505 1.00 0.00 C ATOM 221 C LEU A 18 9.358 0.491 -10.172 1.00 0.00 C ATOM 222 O LEU A 18 9.064 -0.566 -9.614 1.00 0.00 O ATOM 223 CB LEU A 18 9.478 2.555 -8.764 1.00 0.00 C ATOM 224 CG LEU A 18 8.198 2.065 -8.087 1.00 0.00 C ATOM 225 CD1 LEU A 18 8.492 0.876 -7.184 1.00 0.00 C ATOM 226 CD2 LEU A 18 7.549 3.190 -7.294 1.00 0.00 C ATOM 0 H LEU A 18 10.683 2.715 -11.166 1.00 0.00 H new ATOM 0 HA LEU A 18 10.918 0.960 -8.789 1.00 0.00 H new ATOM 0 HB2 LEU A 18 10.115 3.010 -8.006 1.00 0.00 H new ATOM 0 HB3 LEU A 18 9.213 3.341 -9.471 1.00 0.00 H new ATOM 0 HG LEU A 18 7.501 1.744 -8.861 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.569 0.541 -6.711 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.911 0.063 -7.777 1.00 0.00 H new ATOM 0 HD13 LEU A 18 9.207 1.170 -6.416 1.00 0.00 H new ATOM 0 HD21 LEU A 18 6.639 2.823 -6.819 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.241 3.542 -6.529 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.301 4.012 -7.965 1.00 0.00 H new ATOM 238 N PHE A 19 8.894 0.829 -11.371 1.00 0.00 N ATOM 239 CA PHE A 19 7.992 -0.043 -12.115 1.00 0.00 C ATOM 240 C PHE A 19 8.753 -0.840 -13.170 1.00 0.00 C ATOM 241 O PHE A 19 8.422 -1.991 -13.453 1.00 0.00 O ATOM 242 CB PHE A 19 6.887 0.780 -12.780 1.00 0.00 C ATOM 243 CG PHE A 19 6.369 1.895 -11.919 1.00 0.00 C ATOM 244 CD1 PHE A 19 5.816 1.630 -10.676 1.00 0.00 C ATOM 245 CD2 PHE A 19 6.435 3.210 -12.351 1.00 0.00 C ATOM 246 CE1 PHE A 19 5.337 2.654 -9.882 1.00 0.00 C ATOM 247 CE2 PHE A 19 5.959 4.239 -11.560 1.00 0.00 C ATOM 248 CZ PHE A 19 5.410 3.961 -10.324 1.00 0.00 C ATOM 0 H PHE A 19 9.128 1.700 -11.848 1.00 0.00 H new ATOM 0 HA PHE A 19 7.541 -0.743 -11.412 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.267 1.198 -13.712 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.060 0.119 -13.041 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.759 0.611 -10.324 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.863 3.434 -13.317 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.906 2.433 -8.917 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.017 5.260 -11.909 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.038 4.763 -9.704 1.00 0.00 H new ATOM 258 N ALA A 20 9.776 -0.219 -13.748 1.00 0.00 N ATOM 259 CA ALA A 20 10.586 -0.870 -14.770 1.00 0.00 C ATOM 260 C ALA A 20 11.555 -1.870 -14.149 1.00 0.00 C ATOM 261 O ALA A 20 11.944 -2.850 -14.786 1.00 0.00 O ATOM 262 CB ALA A 20 11.346 0.169 -15.582 1.00 0.00 C ATOM 0 H ALA A 20 10.063 0.734 -13.526 1.00 0.00 H new ATOM 0 HA ALA A 20 9.917 -1.417 -15.434 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.947 -0.331 -16.342 1.00 0.00 H new ATOM 0 HB2 ALA A 20 10.638 0.843 -16.065 1.00 0.00 H new ATOM 0 HB3 ALA A 20 11.998 0.741 -14.922 1.00 0.00 H new ATOM 268 N CYS A 21 11.941 -1.617 -12.903 1.00 0.00 N ATOM 269 CA CYS A 21 12.866 -2.495 -12.196 1.00 0.00 C ATOM 270 C CYS A 21 12.287 -3.899 -12.060 1.00 0.00 C ATOM 271 O CYS A 21 12.854 -4.881 -12.540 1.00 0.00 O ATOM 272 CB CYS A 21 13.186 -1.926 -10.813 1.00 0.00 C ATOM 273 SG CYS A 21 14.678 -0.907 -10.761 1.00 0.00 S ATOM 0 H CYS A 21 11.628 -0.811 -12.362 1.00 0.00 H new ATOM 0 HA CYS A 21 13.786 -2.556 -12.777 1.00 0.00 H new ATOM 0 HB2 CYS A 21 12.340 -1.329 -10.473 1.00 0.00 H new ATOM 0 HB3 CYS A 21 13.298 -2.751 -10.110 1.00 0.00 H new ATOM 0 HG CYS A 21 14.386 0.265 -10.280 1.00 0.00 H new ATOM 279 N PRO A 22 11.130 -4.000 -11.389 1.00 0.00 N ATOM 280 CA PRO A 22 10.448 -5.280 -11.173 1.00 0.00 C ATOM 281 C PRO A 22 9.864 -5.850 -12.461 1.00 0.00 C ATOM 282 O PRO A 22 9.911 -5.211 -13.512 1.00 0.00 O ATOM 283 CB PRO A 22 9.330 -4.925 -10.190 1.00 0.00 C ATOM 284 CG PRO A 22 9.071 -3.475 -10.417 1.00 0.00 C ATOM 285 CD PRO A 22 10.397 -2.872 -10.790 1.00 0.00 C ATOM 0 HA PRO A 22 11.129 -6.048 -10.806 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.436 -5.520 -10.376 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.633 -5.117 -9.161 1.00 0.00 H new ATOM 0 HG2 PRO A 22 8.339 -3.329 -11.211 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.667 -3.005 -9.520 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.280 -2.049 -11.495 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.916 -2.473 -9.919 1.00 0.00 H new ATOM 293 N LYS A 23 9.313 -7.056 -12.372 1.00 0.00 N ATOM 294 CA LYS A 23 8.718 -7.712 -13.530 1.00 0.00 C ATOM 295 C LYS A 23 7.323 -8.235 -13.201 1.00 0.00 C ATOM 296 O LYS A 23 6.404 -8.139 -14.015 1.00 0.00 O ATOM 297 CB LYS A 23 9.607 -8.865 -14.002 1.00 0.00 C ATOM 298 CG LYS A 23 9.441 -9.197 -15.475 1.00 0.00 C ATOM 299 CD LYS A 23 8.245 -10.104 -15.710 1.00 0.00 C ATOM 300 CE LYS A 23 8.594 -11.563 -15.458 1.00 0.00 C ATOM 301 NZ LYS A 23 9.264 -12.184 -16.634 1.00 0.00 N ATOM 0 H LYS A 23 9.266 -7.599 -11.510 1.00 0.00 H new ATOM 0 HA LYS A 23 8.633 -6.976 -14.329 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.650 -8.611 -13.811 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.382 -9.752 -13.410 1.00 0.00 H new ATOM 0 HG2 LYS A 23 9.318 -8.276 -16.045 1.00 0.00 H new ATOM 0 HG3 LYS A 23 10.345 -9.682 -15.844 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.427 -9.806 -15.054 1.00 0.00 H new ATOM 0 HD3 LYS A 23 7.892 -9.985 -16.734 1.00 0.00 H new ATOM 0 HE2 LYS A 23 9.247 -11.635 -14.588 1.00 0.00 H new ATOM 0 HE3 LYS A 23 7.686 -12.118 -15.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 9.486 -13.178 -16.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 8.631 -12.138 -17.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 10.144 -11.670 -16.844 1.00 0.00 H new ATOM 315 N THR A 24 7.170 -8.787 -12.001 1.00 0.00 N ATOM 316 CA THR A 24 5.888 -9.325 -11.565 1.00 0.00 C ATOM 317 C THR A 24 5.399 -8.623 -10.303 1.00 0.00 C ATOM 318 O THR A 24 4.197 -8.558 -10.044 1.00 0.00 O ATOM 319 CB THR A 24 5.975 -10.839 -11.296 1.00 0.00 C ATOM 320 OG1 THR A 24 6.877 -11.092 -10.212 1.00 0.00 O ATOM 321 CG2 THR A 24 6.444 -11.583 -12.537 1.00 0.00 C ATOM 0 H THR A 24 7.919 -8.873 -11.314 1.00 0.00 H new ATOM 0 HA THR A 24 5.179 -9.149 -12.374 1.00 0.00 H new ATOM 0 HB THR A 24 4.980 -11.197 -11.032 1.00 0.00 H new ATOM 0 HG1 THR A 24 6.926 -12.057 -10.045 1.00 0.00 H new ATOM 0 HG21 THR A 24 6.498 -12.650 -12.323 1.00 0.00 H new ATOM 0 HG22 THR A 24 5.741 -11.411 -13.352 1.00 0.00 H new ATOM 0 HG23 THR A 24 7.430 -11.221 -12.827 1.00 0.00 H new ATOM 329 N ASP A 25 6.337 -8.099 -9.522 1.00 0.00 N ATOM 330 CA ASP A 25 6.000 -7.400 -8.287 1.00 0.00 C ATOM 331 C ASP A 25 4.855 -6.418 -8.513 1.00 0.00 C ATOM 332 O ASP A 25 4.760 -5.792 -9.569 1.00 0.00 O ATOM 333 CB ASP A 25 7.224 -6.659 -7.745 1.00 0.00 C ATOM 334 CG ASP A 25 8.096 -7.542 -6.874 1.00 0.00 C ATOM 335 OD1 ASP A 25 8.375 -8.689 -7.282 1.00 0.00 O ATOM 336 OD2 ASP A 25 8.501 -7.085 -5.785 1.00 0.00 O ATOM 0 H ASP A 25 7.336 -8.145 -9.722 1.00 0.00 H new ATOM 0 HA ASP A 25 5.680 -8.141 -7.555 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.814 -6.280 -8.579 1.00 0.00 H new ATOM 0 HB3 ASP A 25 6.896 -5.795 -7.168 1.00 0.00 H new ATOM 341 N SER A 26 3.987 -6.289 -7.514 1.00 0.00 N ATOM 342 CA SER A 26 2.845 -5.387 -7.606 1.00 0.00 C ATOM 343 C SER A 26 3.164 -4.040 -6.965 1.00 0.00 C ATOM 344 O SER A 26 4.171 -3.892 -6.272 1.00 0.00 O ATOM 345 CB SER A 26 1.621 -6.010 -6.931 1.00 0.00 C ATOM 346 OG SER A 26 1.110 -7.088 -7.695 1.00 0.00 O ATOM 0 H SER A 26 4.053 -6.798 -6.632 1.00 0.00 H new ATOM 0 HA SER A 26 2.625 -5.224 -8.661 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.891 -6.362 -5.935 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.848 -5.253 -6.803 1.00 0.00 H new ATOM 0 HG SER A 26 0.330 -7.469 -7.241 1.00 0.00 H new ATOM 352 N LEU A 27 2.298 -3.060 -7.200 1.00 0.00 N ATOM 353 CA LEU A 27 2.486 -1.724 -6.646 1.00 0.00 C ATOM 354 C LEU A 27 1.359 -1.372 -5.681 1.00 0.00 C ATOM 355 O LEU A 27 0.215 -1.783 -5.870 1.00 0.00 O ATOM 356 CB LEU A 27 2.552 -0.689 -7.770 1.00 0.00 C ATOM 357 CG LEU A 27 3.390 -1.075 -8.990 1.00 0.00 C ATOM 358 CD1 LEU A 27 3.236 -0.040 -10.093 1.00 0.00 C ATOM 359 CD2 LEU A 27 4.854 -1.230 -8.603 1.00 0.00 C ATOM 0 H LEU A 27 1.459 -3.166 -7.770 1.00 0.00 H new ATOM 0 HA LEU A 27 3.427 -1.714 -6.096 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.536 -0.479 -8.104 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.950 0.239 -7.359 1.00 0.00 H new ATOM 0 HG LEU A 27 3.030 -2.033 -9.366 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.839 -0.332 -10.953 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.189 0.023 -10.389 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.569 0.932 -9.729 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.436 -1.505 -9.483 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.226 -0.287 -8.202 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.950 -2.009 -7.847 1.00 0.00 H new ATOM 371 N ALA A 28 1.691 -0.606 -4.646 1.00 0.00 N ATOM 372 CA ALA A 28 0.706 -0.194 -3.654 1.00 0.00 C ATOM 373 C ALA A 28 0.957 1.237 -3.192 1.00 0.00 C ATOM 374 O ALA A 28 1.994 1.536 -2.599 1.00 0.00 O ATOM 375 CB ALA A 28 0.724 -1.145 -2.466 1.00 0.00 C ATOM 0 H ALA A 28 2.634 -0.259 -4.473 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.279 -0.230 -4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -0.017 -0.825 -1.733 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.488 -2.154 -2.804 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.714 -1.138 -2.009 1.00 0.00 H new ATOM 381 N HIS A 29 0.001 2.119 -3.467 1.00 0.00 N ATOM 382 CA HIS A 29 0.119 3.520 -3.080 1.00 0.00 C ATOM 383 C HIS A 29 -1.092 3.962 -2.264 1.00 0.00 C ATOM 384 O HIS A 29 -2.089 3.245 -2.177 1.00 0.00 O ATOM 385 CB HIS A 29 0.263 4.404 -4.319 1.00 0.00 C ATOM 386 CG HIS A 29 0.377 5.864 -4.005 1.00 0.00 C ATOM 387 ND1 HIS A 29 -0.665 6.752 -4.168 1.00 0.00 N ATOM 388 CD2 HIS A 29 1.417 6.589 -3.532 1.00 0.00 C ATOM 389 CE1 HIS A 29 -0.270 7.961 -3.811 1.00 0.00 C ATOM 390 NE2 HIS A 29 0.989 7.889 -3.420 1.00 0.00 N ATOM 0 H HIS A 29 -0.864 1.888 -3.956 1.00 0.00 H new ATOM 0 HA HIS A 29 1.011 3.626 -2.462 1.00 0.00 H new ATOM 0 HB2 HIS A 29 1.145 4.091 -4.877 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -0.598 4.247 -4.969 1.00 0.00 H new ATOM 0 HD2 HIS A 29 2.400 6.215 -3.288 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -0.874 8.856 -3.835 1.00 0.00 H new ATOM 0 HE2 HIS A 29 1.552 8.672 -3.088 1.00 0.00 H new ATOM 398 N CYS A 30 -0.997 5.145 -1.667 1.00 0.00 N ATOM 399 CA CYS A 30 -2.084 5.682 -0.857 1.00 0.00 C ATOM 400 C CYS A 30 -2.825 6.787 -1.603 1.00 0.00 C ATOM 401 O CYS A 30 -2.213 7.738 -2.090 1.00 0.00 O ATOM 402 CB CYS A 30 -1.543 6.220 0.469 1.00 0.00 C ATOM 403 SG CYS A 30 -0.418 7.624 0.291 1.00 0.00 S ATOM 0 H CYS A 30 -0.178 5.750 -1.729 1.00 0.00 H new ATOM 0 HA CYS A 30 -2.785 4.873 -0.654 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -2.382 6.518 1.098 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -1.024 5.416 0.990 1.00 0.00 H new ATOM 0 HG CYS A 30 -0.687 8.259 -0.811 1.00 0.00 H new ATOM 409 N ILE A 31 -4.144 6.654 -1.690 1.00 0.00 N ATOM 410 CA ILE A 31 -4.967 7.641 -2.377 1.00 0.00 C ATOM 411 C ILE A 31 -6.316 7.808 -1.687 1.00 0.00 C ATOM 412 O ILE A 31 -6.599 7.150 -0.686 1.00 0.00 O ATOM 413 CB ILE A 31 -5.201 7.252 -3.849 1.00 0.00 C ATOM 414 CG1 ILE A 31 -5.979 5.937 -3.934 1.00 0.00 C ATOM 415 CG2 ILE A 31 -3.874 7.137 -4.584 1.00 0.00 C ATOM 416 CD1 ILE A 31 -6.784 5.792 -5.207 1.00 0.00 C ATOM 0 H ILE A 31 -4.666 5.872 -1.293 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.424 8.585 -2.341 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.792 8.034 -4.327 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.279 5.105 -3.860 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -6.651 5.866 -3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.056 6.862 -5.623 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.354 8.094 -4.548 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.260 6.373 -4.108 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -7.309 4.837 -5.199 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.508 6.604 -5.274 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.115 5.831 -6.067 1.00 0.00 H new ATOM 428 N SER A 32 -7.147 8.693 -2.230 1.00 0.00 N ATOM 429 CA SER A 32 -8.467 8.948 -1.665 1.00 0.00 C ATOM 430 C SER A 32 -9.554 8.275 -2.497 1.00 0.00 C ATOM 431 O SER A 32 -9.310 7.843 -3.623 1.00 0.00 O ATOM 432 CB SER A 32 -8.728 10.454 -1.586 1.00 0.00 C ATOM 433 OG SER A 32 -7.688 11.116 -0.888 1.00 0.00 O ATOM 0 H SER A 32 -6.929 9.245 -3.060 1.00 0.00 H new ATOM 0 HA SER A 32 -8.492 8.528 -0.659 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.814 10.865 -2.592 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.679 10.636 -1.085 1.00 0.00 H new ATOM 0 HG SER A 32 -7.878 12.077 -0.853 1.00 0.00 H new ATOM 439 N GLU A 33 -10.755 8.190 -1.933 1.00 0.00 N ATOM 440 CA GLU A 33 -11.879 7.568 -2.623 1.00 0.00 C ATOM 441 C GLU A 33 -12.038 8.138 -4.029 1.00 0.00 C ATOM 442 O GLU A 33 -12.117 7.394 -5.007 1.00 0.00 O ATOM 443 CB GLU A 33 -13.171 7.775 -1.828 1.00 0.00 C ATOM 444 CG GLU A 33 -13.392 6.732 -0.745 1.00 0.00 C ATOM 445 CD GLU A 33 -14.801 6.764 -0.184 1.00 0.00 C ATOM 446 OE1 GLU A 33 -15.438 7.836 -0.243 1.00 0.00 O ATOM 447 OE2 GLU A 33 -15.265 5.718 0.314 1.00 0.00 O ATOM 0 H GLU A 33 -10.974 8.543 -1.002 1.00 0.00 H new ATOM 0 HA GLU A 33 -11.677 6.500 -2.704 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.152 8.764 -1.370 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.017 7.758 -2.515 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -13.190 5.742 -1.153 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -12.679 6.896 0.063 1.00 0.00 H new ATOM 454 N ASP A 34 -12.085 9.463 -4.122 1.00 0.00 N ATOM 455 CA ASP A 34 -12.234 10.134 -5.408 1.00 0.00 C ATOM 456 C ASP A 34 -11.243 9.580 -6.428 1.00 0.00 C ATOM 457 O ASP A 34 -11.470 9.663 -7.636 1.00 0.00 O ATOM 458 CB ASP A 34 -12.030 11.641 -5.247 1.00 0.00 C ATOM 459 CG ASP A 34 -12.819 12.211 -4.085 1.00 0.00 C ATOM 460 OD1 ASP A 34 -13.987 12.599 -4.296 1.00 0.00 O ATOM 461 OD2 ASP A 34 -12.269 12.271 -2.966 1.00 0.00 O ATOM 0 H ASP A 34 -12.022 10.093 -3.322 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.245 9.949 -5.772 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -10.970 11.847 -5.099 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.327 12.145 -6.166 1.00 0.00 H new ATOM 466 N CYS A 35 -10.146 9.018 -5.934 1.00 0.00 N ATOM 467 CA CYS A 35 -9.120 8.452 -6.803 1.00 0.00 C ATOM 468 C CYS A 35 -8.538 9.519 -7.724 1.00 0.00 C ATOM 469 O CYS A 35 -8.188 9.240 -8.871 1.00 0.00 O ATOM 470 CB CYS A 35 -9.700 7.305 -7.632 1.00 0.00 C ATOM 471 SG CYS A 35 -10.152 5.848 -6.663 1.00 0.00 S ATOM 0 H CYS A 35 -9.944 8.942 -4.937 1.00 0.00 H new ATOM 0 HA CYS A 35 -8.318 8.066 -6.174 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -10.583 7.664 -8.161 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -8.971 7.013 -8.388 1.00 0.00 H new ATOM 0 HG CYS A 35 -11.049 6.175 -5.781 1.00 0.00 H new ATOM 477 N ARG A 36 -8.440 10.743 -7.215 1.00 0.00 N ATOM 478 CA ARG A 36 -7.904 11.853 -7.994 1.00 0.00 C ATOM 479 C ARG A 36 -6.547 12.292 -7.451 1.00 0.00 C ATOM 480 O ARG A 36 -6.470 13.105 -6.530 1.00 0.00 O ATOM 481 CB ARG A 36 -8.878 13.033 -7.977 1.00 0.00 C ATOM 482 CG ARG A 36 -10.202 12.740 -8.664 1.00 0.00 C ATOM 483 CD ARG A 36 -10.829 14.005 -9.229 1.00 0.00 C ATOM 484 NE ARG A 36 -12.167 13.762 -9.762 1.00 0.00 N ATOM 485 CZ ARG A 36 -12.765 14.560 -10.639 1.00 0.00 C ATOM 486 NH1 ARG A 36 -12.146 15.647 -11.080 1.00 0.00 N ATOM 487 NH2 ARG A 36 -13.983 14.272 -11.077 1.00 0.00 N ATOM 0 H ARG A 36 -8.725 10.991 -6.267 1.00 0.00 H new ATOM 0 HA ARG A 36 -7.773 11.514 -9.022 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -9.070 13.319 -6.943 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -8.408 13.888 -8.462 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -10.045 12.021 -9.468 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -10.888 12.279 -7.953 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -10.882 14.763 -8.448 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -10.192 14.404 -10.018 1.00 0.00 H new ATOM 0 HE ARG A 36 -12.670 12.934 -9.443 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -11.209 15.871 -10.746 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -12.607 16.259 -11.754 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -14.462 13.437 -10.740 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -14.441 14.886 -11.751 1.00 0.00 H new ATOM 501 N MET A 37 -5.481 11.748 -8.028 1.00 0.00 N ATOM 502 CA MET A 37 -4.127 12.085 -7.603 1.00 0.00 C ATOM 503 C MET A 37 -3.631 13.341 -8.312 1.00 0.00 C ATOM 504 O MET A 37 -3.514 14.403 -7.704 1.00 0.00 O ATOM 505 CB MET A 37 -3.177 10.918 -7.882 1.00 0.00 C ATOM 506 CG MET A 37 -3.702 9.577 -7.395 1.00 0.00 C ATOM 507 SD MET A 37 -3.024 8.188 -8.323 1.00 0.00 S ATOM 508 CE MET A 37 -4.525 7.414 -8.920 1.00 0.00 C ATOM 0 H MET A 37 -5.528 11.072 -8.791 1.00 0.00 H new ATOM 0 HA MET A 37 -4.147 12.279 -6.531 1.00 0.00 H new ATOM 0 HB2 MET A 37 -2.993 10.859 -8.955 1.00 0.00 H new ATOM 0 HB3 MET A 37 -2.218 11.119 -7.404 1.00 0.00 H new ATOM 0 HG2 MET A 37 -3.458 9.457 -6.339 1.00 0.00 H new ATOM 0 HG3 MET A 37 -4.789 9.566 -7.474 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.270 6.536 -9.514 1.00 0.00 H new ATOM 0 HE2 MET A 37 -5.141 7.113 -8.073 1.00 0.00 H new ATOM 0 HE3 MET A 37 -5.079 8.122 -9.537 1.00 0.00 H new ATOM 518 N GLY A 38 -3.340 13.210 -9.603 1.00 0.00 N ATOM 519 CA GLY A 38 -2.859 14.343 -10.373 1.00 0.00 C ATOM 520 C GLY A 38 -1.866 15.189 -9.601 1.00 0.00 C ATOM 521 O GLY A 38 -1.844 16.412 -9.738 1.00 0.00 O ATOM 0 H GLY A 38 -3.429 12.341 -10.129 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.390 13.983 -11.289 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.705 14.962 -10.670 1.00 0.00 H new ATOM 525 N ALA A 39 -1.043 14.537 -8.786 1.00 0.00 N ATOM 526 CA ALA A 39 -0.043 15.238 -7.989 1.00 0.00 C ATOM 527 C ALA A 39 1.081 14.297 -7.568 1.00 0.00 C ATOM 528 O ALA A 39 0.866 13.099 -7.388 1.00 0.00 O ATOM 529 CB ALA A 39 -0.691 15.870 -6.766 1.00 0.00 C ATOM 0 H ALA A 39 -1.049 13.525 -8.660 1.00 0.00 H new ATOM 0 HA ALA A 39 0.390 16.026 -8.605 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.067 16.390 -6.180 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.454 16.580 -7.085 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -1.151 15.093 -6.156 1.00 0.00 H new ATOM 535 N GLY A 40 2.281 14.848 -7.414 1.00 0.00 N ATOM 536 CA GLY A 40 3.421 14.043 -7.016 1.00 0.00 C ATOM 537 C GLY A 40 3.498 12.733 -7.774 1.00 0.00 C ATOM 538 O GLY A 40 2.776 12.529 -8.750 1.00 0.00 O ATOM 0 H GLY A 40 2.484 15.837 -7.558 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.337 14.609 -7.181 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.362 13.838 -5.947 1.00 0.00 H new ATOM 542 N ILE A 41 4.377 11.843 -7.326 1.00 0.00 N ATOM 543 CA ILE A 41 4.546 10.546 -7.969 1.00 0.00 C ATOM 544 C ILE A 41 3.198 9.920 -8.307 1.00 0.00 C ATOM 545 O ILE A 41 3.030 9.317 -9.367 1.00 0.00 O ATOM 546 CB ILE A 41 5.342 9.574 -7.077 1.00 0.00 C ATOM 547 CG1 ILE A 41 5.680 8.298 -7.850 1.00 0.00 C ATOM 548 CG2 ILE A 41 4.553 9.245 -5.819 1.00 0.00 C ATOM 549 CD1 ILE A 41 6.826 7.514 -7.251 1.00 0.00 C ATOM 0 H ILE A 41 4.983 11.997 -6.520 1.00 0.00 H new ATOM 0 HA ILE A 41 5.104 10.721 -8.889 1.00 0.00 H new ATOM 0 HB ILE A 41 6.275 10.055 -6.782 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.796 7.661 -7.889 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.929 8.561 -8.878 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.128 8.557 -5.198 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.359 10.161 -5.261 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.606 8.780 -6.094 1.00 0.00 H new ATOM 0 HD11 ILE A 41 7.010 6.623 -7.851 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.723 8.133 -7.237 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.573 7.220 -6.232 1.00 0.00 H new ATOM 561 N ALA A 42 2.238 10.069 -7.399 1.00 0.00 N ATOM 562 CA ALA A 42 0.903 9.522 -7.603 1.00 0.00 C ATOM 563 C ALA A 42 0.473 9.649 -9.061 1.00 0.00 C ATOM 564 O ALA A 42 -0.200 8.770 -9.599 1.00 0.00 O ATOM 565 CB ALA A 42 -0.098 10.220 -6.693 1.00 0.00 C ATOM 0 H ALA A 42 2.361 10.564 -6.516 1.00 0.00 H new ATOM 0 HA ALA A 42 0.930 8.462 -7.351 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.091 9.802 -6.856 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.192 10.073 -5.653 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.112 11.286 -6.918 1.00 0.00 H new ATOM 571 N VAL A 43 0.866 10.749 -9.695 1.00 0.00 N ATOM 572 CA VAL A 43 0.522 10.991 -11.091 1.00 0.00 C ATOM 573 C VAL A 43 0.834 9.773 -11.952 1.00 0.00 C ATOM 574 O VAL A 43 0.011 9.345 -12.763 1.00 0.00 O ATOM 575 CB VAL A 43 1.278 12.210 -11.652 1.00 0.00 C ATOM 576 CG1 VAL A 43 1.183 12.246 -13.169 1.00 0.00 C ATOM 577 CG2 VAL A 43 0.738 13.497 -11.045 1.00 0.00 C ATOM 0 H VAL A 43 1.423 11.487 -9.264 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.549 11.191 -11.123 1.00 0.00 H new ATOM 0 HB VAL A 43 2.330 12.120 -11.380 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.723 13.114 -13.547 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.621 11.338 -13.583 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.136 12.312 -13.467 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.283 14.348 -11.452 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.321 13.596 -11.285 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.864 13.470 -9.963 1.00 0.00 H new ATOM 587 N LEU A 44 2.027 9.218 -11.773 1.00 0.00 N ATOM 588 CA LEU A 44 2.449 8.047 -12.534 1.00 0.00 C ATOM 589 C LEU A 44 1.380 6.959 -12.495 1.00 0.00 C ATOM 590 O LEU A 44 1.047 6.364 -13.520 1.00 0.00 O ATOM 591 CB LEU A 44 3.767 7.503 -11.981 1.00 0.00 C ATOM 592 CG LEU A 44 5.021 8.310 -12.320 1.00 0.00 C ATOM 593 CD1 LEU A 44 6.209 7.816 -11.510 1.00 0.00 C ATOM 594 CD2 LEU A 44 5.319 8.232 -13.810 1.00 0.00 C ATOM 0 H LEU A 44 2.720 9.560 -11.107 1.00 0.00 H new ATOM 0 HA LEU A 44 2.595 8.351 -13.571 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.683 7.438 -10.896 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.902 6.487 -12.352 1.00 0.00 H new ATOM 0 HG LEU A 44 4.840 9.353 -12.061 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.092 8.402 -11.765 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.995 7.925 -10.447 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.393 6.766 -11.737 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.215 8.812 -14.033 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.480 7.192 -14.095 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.476 8.636 -14.371 1.00 0.00 H new ATOM 606 N PHE A 45 0.845 6.704 -11.305 1.00 0.00 N ATOM 607 CA PHE A 45 -0.187 5.688 -11.133 1.00 0.00 C ATOM 608 C PHE A 45 -1.510 6.150 -11.736 1.00 0.00 C ATOM 609 O PHE A 45 -2.422 5.350 -11.946 1.00 0.00 O ATOM 610 CB PHE A 45 -0.374 5.368 -9.648 1.00 0.00 C ATOM 611 CG PHE A 45 0.850 4.784 -9.002 1.00 0.00 C ATOM 612 CD1 PHE A 45 1.059 3.414 -8.994 1.00 0.00 C ATOM 613 CD2 PHE A 45 1.792 5.605 -8.403 1.00 0.00 C ATOM 614 CE1 PHE A 45 2.184 2.874 -8.400 1.00 0.00 C ATOM 615 CE2 PHE A 45 2.919 5.070 -7.809 1.00 0.00 C ATOM 616 CZ PHE A 45 3.115 3.703 -7.806 1.00 0.00 C ATOM 0 H PHE A 45 1.109 7.187 -10.446 1.00 0.00 H new ATOM 0 HA PHE A 45 0.134 4.786 -11.654 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.654 6.280 -9.120 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.203 4.669 -9.537 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.334 2.761 -9.457 1.00 0.00 H new ATOM 0 HD2 PHE A 45 1.644 6.675 -8.400 1.00 0.00 H new ATOM 0 HE1 PHE A 45 2.335 1.805 -8.400 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.647 5.721 -7.347 1.00 0.00 H new ATOM 0 HZ PHE A 45 3.994 3.283 -7.340 1.00 0.00 H new ATOM 626 N LYS A 46 -1.608 7.446 -12.011 1.00 0.00 N ATOM 627 CA LYS A 46 -2.819 8.017 -12.590 1.00 0.00 C ATOM 628 C LYS A 46 -2.677 8.175 -14.100 1.00 0.00 C ATOM 629 O LYS A 46 -3.669 8.304 -14.817 1.00 0.00 O ATOM 630 CB LYS A 46 -3.124 9.373 -11.951 1.00 0.00 C ATOM 631 CG LYS A 46 -4.301 10.093 -12.585 1.00 0.00 C ATOM 632 CD LYS A 46 -3.855 11.000 -13.720 1.00 0.00 C ATOM 633 CE LYS A 46 -3.070 12.195 -13.202 1.00 0.00 C ATOM 634 NZ LYS A 46 -3.226 13.385 -14.085 1.00 0.00 N ATOM 0 H LYS A 46 -0.863 8.122 -11.842 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.645 7.334 -12.390 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.326 9.228 -10.890 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.240 10.006 -12.023 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -5.016 9.362 -12.962 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -4.818 10.683 -11.828 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -3.239 10.434 -14.419 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.727 11.348 -14.273 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.407 12.443 -12.195 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -2.015 11.933 -13.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.676 14.179 -13.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.881 13.157 -15.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -4.230 13.651 -14.135 1.00 0.00 H new ATOM 648 N LYS A 47 -1.437 8.163 -14.578 1.00 0.00 N ATOM 649 CA LYS A 47 -1.164 8.302 -16.003 1.00 0.00 C ATOM 650 C LYS A 47 -0.919 6.941 -16.646 1.00 0.00 C ATOM 651 O LYS A 47 -1.317 6.699 -17.786 1.00 0.00 O ATOM 652 CB LYS A 47 0.048 9.209 -16.226 1.00 0.00 C ATOM 653 CG LYS A 47 1.367 8.457 -16.283 1.00 0.00 C ATOM 654 CD LYS A 47 2.545 9.376 -16.006 1.00 0.00 C ATOM 655 CE LYS A 47 2.551 10.573 -16.944 1.00 0.00 C ATOM 656 NZ LYS A 47 3.153 10.239 -18.265 1.00 0.00 N ATOM 0 H LYS A 47 -0.604 8.058 -13.998 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.038 8.753 -16.472 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -0.087 9.760 -17.157 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.093 9.945 -15.423 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.357 7.647 -15.554 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.484 8.000 -17.266 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.503 9.722 -14.973 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.476 8.820 -16.118 1.00 0.00 H new ATOM 0 HE2 LYS A 47 1.530 10.926 -17.089 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.109 11.390 -16.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 3.139 11.081 -18.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 4.136 9.926 -18.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 2.606 9.477 -18.713 1.00 0.00 H new ATOM 670 N LYS A 48 -0.262 6.052 -15.907 1.00 0.00 N ATOM 671 CA LYS A 48 0.034 4.714 -16.403 1.00 0.00 C ATOM 672 C LYS A 48 -1.092 3.744 -16.059 1.00 0.00 C ATOM 673 O LYS A 48 -1.599 3.033 -16.927 1.00 0.00 O ATOM 674 CB LYS A 48 1.353 4.209 -15.813 1.00 0.00 C ATOM 675 CG LYS A 48 2.552 4.443 -16.716 1.00 0.00 C ATOM 676 CD LYS A 48 3.770 4.884 -15.922 1.00 0.00 C ATOM 677 CE LYS A 48 5.059 4.374 -16.549 1.00 0.00 C ATOM 678 NZ LYS A 48 5.613 5.338 -17.540 1.00 0.00 N ATOM 0 H LYS A 48 0.075 6.235 -14.962 1.00 0.00 H new ATOM 0 HA LYS A 48 0.125 4.768 -17.488 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.527 4.703 -14.857 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.265 3.142 -15.609 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.783 3.527 -17.260 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.307 5.202 -17.459 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.796 5.972 -15.868 1.00 0.00 H new ATOM 0 HD3 LYS A 48 3.691 4.516 -14.899 1.00 0.00 H new ATOM 0 HE2 LYS A 48 5.796 4.193 -15.767 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.872 3.418 -17.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 6.491 4.954 -17.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 4.920 5.492 -18.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 5.816 6.242 -17.068 1.00 0.00 H new ATOM 692 N PHE A 49 -1.480 3.722 -14.789 1.00 0.00 N ATOM 693 CA PHE A 49 -2.548 2.840 -14.331 1.00 0.00 C ATOM 694 C PHE A 49 -3.709 3.646 -13.755 1.00 0.00 C ATOM 695 O PHE A 49 -4.175 3.379 -12.648 1.00 0.00 O ATOM 696 CB PHE A 49 -2.016 1.866 -13.278 1.00 0.00 C ATOM 697 CG PHE A 49 -0.631 1.364 -13.570 1.00 0.00 C ATOM 698 CD1 PHE A 49 0.473 2.171 -13.350 1.00 0.00 C ATOM 699 CD2 PHE A 49 -0.433 0.085 -14.065 1.00 0.00 C ATOM 700 CE1 PHE A 49 1.749 1.712 -13.619 1.00 0.00 C ATOM 701 CE2 PHE A 49 0.840 -0.380 -14.336 1.00 0.00 C ATOM 702 CZ PHE A 49 1.932 0.434 -14.111 1.00 0.00 C ATOM 0 H PHE A 49 -1.071 4.304 -14.058 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.912 2.274 -15.189 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.018 2.358 -12.306 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.694 1.016 -13.206 1.00 0.00 H new ATOM 0 HD1 PHE A 49 0.335 3.170 -12.964 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -1.284 -0.556 -14.241 1.00 0.00 H new ATOM 0 HE1 PHE A 49 2.602 2.352 -13.445 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.980 -1.378 -14.723 1.00 0.00 H new ATOM 0 HZ PHE A 49 2.928 0.072 -14.319 1.00 0.00 H new ATOM 712 N GLY A 50 -4.171 4.634 -14.515 1.00 0.00 N ATOM 713 CA GLY A 50 -5.273 5.464 -14.064 1.00 0.00 C ATOM 714 C GLY A 50 -6.472 4.647 -13.625 1.00 0.00 C ATOM 715 O GLY A 50 -6.816 4.622 -12.444 1.00 0.00 O ATOM 0 H GLY A 50 -3.802 4.875 -15.435 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.939 6.087 -13.235 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.570 6.137 -14.869 1.00 0.00 H new ATOM 719 N GLY A 51 -7.111 3.977 -14.579 1.00 0.00 N ATOM 720 CA GLY A 51 -8.273 3.166 -14.265 1.00 0.00 C ATOM 721 C GLY A 51 -9.156 3.802 -13.209 1.00 0.00 C ATOM 722 O GLY A 51 -9.728 3.109 -12.368 1.00 0.00 O ATOM 0 H GLY A 51 -6.845 3.981 -15.564 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.855 3.005 -15.172 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.945 2.186 -13.918 1.00 0.00 H new ATOM 726 N VAL A 52 -9.266 5.126 -13.252 1.00 0.00 N ATOM 727 CA VAL A 52 -10.085 5.856 -12.291 1.00 0.00 C ATOM 728 C VAL A 52 -11.513 5.325 -12.271 1.00 0.00 C ATOM 729 O VAL A 52 -12.133 5.224 -11.212 1.00 0.00 O ATOM 730 CB VAL A 52 -10.113 7.363 -12.609 1.00 0.00 C ATOM 731 CG1 VAL A 52 -8.761 7.996 -12.320 1.00 0.00 C ATOM 732 CG2 VAL A 52 -10.522 7.594 -14.056 1.00 0.00 C ATOM 0 H VAL A 52 -8.799 5.715 -13.941 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.632 5.707 -11.311 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.853 7.839 -11.966 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -8.801 9.061 -12.551 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.514 7.862 -11.267 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.997 7.520 -12.935 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.537 8.664 -14.264 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.807 7.106 -14.718 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.515 7.178 -14.224 1.00 0.00 H new ATOM 742 N GLN A 53 -12.030 4.987 -13.448 1.00 0.00 N ATOM 743 CA GLN A 53 -13.387 4.465 -13.564 1.00 0.00 C ATOM 744 C GLN A 53 -13.447 3.004 -13.133 1.00 0.00 C ATOM 745 O GLN A 53 -14.462 2.543 -12.612 1.00 0.00 O ATOM 746 CB GLN A 53 -13.887 4.606 -15.003 1.00 0.00 C ATOM 747 CG GLN A 53 -15.341 4.200 -15.183 1.00 0.00 C ATOM 748 CD GLN A 53 -16.307 5.210 -14.596 1.00 0.00 C ATOM 749 OE1 GLN A 53 -16.631 6.216 -15.228 1.00 0.00 O ATOM 750 NE2 GLN A 53 -16.772 4.948 -13.381 1.00 0.00 N ATOM 0 H GLN A 53 -11.530 5.065 -14.334 1.00 0.00 H new ATOM 0 HA GLN A 53 -14.031 5.045 -12.904 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.765 5.641 -15.322 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -13.264 3.996 -15.657 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.551 4.077 -16.246 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.504 3.231 -14.712 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -16.477 4.102 -12.893 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -17.425 5.592 -12.935 1.00 0.00 H new ATOM 759 N GLU A 54 -12.354 2.281 -13.354 1.00 0.00 N ATOM 760 CA GLU A 54 -12.284 0.871 -12.989 1.00 0.00 C ATOM 761 C GLU A 54 -12.146 0.706 -11.478 1.00 0.00 C ATOM 762 O GLU A 54 -12.666 -0.246 -10.895 1.00 0.00 O ATOM 763 CB GLU A 54 -11.108 0.195 -13.696 1.00 0.00 C ATOM 764 CG GLU A 54 -11.454 -0.339 -15.076 1.00 0.00 C ATOM 765 CD GLU A 54 -12.673 -1.241 -15.065 1.00 0.00 C ATOM 766 OE1 GLU A 54 -12.568 -2.374 -14.549 1.00 0.00 O ATOM 767 OE2 GLU A 54 -13.731 -0.814 -15.571 1.00 0.00 O ATOM 0 H GLU A 54 -11.505 2.648 -13.784 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.211 0.394 -13.306 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.290 0.910 -13.787 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.747 -0.627 -13.078 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.632 0.498 -15.751 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.602 -0.891 -15.472 1.00 0.00 H new ATOM 774 N LEU A 55 -11.440 1.640 -10.850 1.00 0.00 N ATOM 775 CA LEU A 55 -11.232 1.600 -9.406 1.00 0.00 C ATOM 776 C LEU A 55 -12.496 2.016 -8.662 1.00 0.00 C ATOM 777 O LEU A 55 -12.910 1.360 -7.705 1.00 0.00 O ATOM 778 CB LEU A 55 -10.070 2.515 -9.014 1.00 0.00 C ATOM 779 CG LEU A 55 -8.702 2.148 -9.590 1.00 0.00 C ATOM 780 CD1 LEU A 55 -7.696 3.257 -9.325 1.00 0.00 C ATOM 781 CD2 LEU A 55 -8.213 0.831 -9.005 1.00 0.00 C ATOM 0 H LEU A 55 -11.002 2.434 -11.317 1.00 0.00 H new ATOM 0 HA LEU A 55 -10.990 0.575 -9.126 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.313 3.531 -9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.993 2.525 -7.927 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.804 2.028 -10.669 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.728 2.978 -9.742 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.040 4.180 -9.792 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.597 3.410 -8.250 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.238 0.585 -9.426 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.128 0.923 -7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.922 0.040 -9.247 1.00 0.00 H new ATOM 793 N LEU A 56 -13.106 3.109 -9.107 1.00 0.00 N ATOM 794 CA LEU A 56 -14.326 3.612 -8.484 1.00 0.00 C ATOM 795 C LEU A 56 -15.435 2.567 -8.537 1.00 0.00 C ATOM 796 O LEU A 56 -16.263 2.480 -7.631 1.00 0.00 O ATOM 797 CB LEU A 56 -14.785 4.895 -9.179 1.00 0.00 C ATOM 798 CG LEU A 56 -13.878 6.114 -9.007 1.00 0.00 C ATOM 799 CD1 LEU A 56 -14.192 7.166 -10.059 1.00 0.00 C ATOM 800 CD2 LEU A 56 -14.024 6.694 -7.608 1.00 0.00 C ATOM 0 H LEU A 56 -12.776 3.664 -9.897 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.108 3.830 -7.439 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.887 4.690 -10.245 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.777 5.150 -8.807 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.844 5.796 -9.140 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.537 8.026 -9.921 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.034 6.746 -11.052 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.231 7.482 -9.959 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.371 7.561 -7.504 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.058 6.997 -7.446 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.747 5.940 -6.871 1.00 0.00 H new ATOM 812 N ASN A 57 -15.444 1.773 -9.603 1.00 0.00 N ATOM 813 CA ASN A 57 -16.450 0.732 -9.772 1.00 0.00 C ATOM 814 C ASN A 57 -16.503 -0.178 -8.549 1.00 0.00 C ATOM 815 O ASN A 57 -17.530 -0.794 -8.266 1.00 0.00 O ATOM 816 CB ASN A 57 -16.152 -0.096 -11.025 1.00 0.00 C ATOM 817 CG ASN A 57 -16.546 0.624 -12.300 1.00 0.00 C ATOM 818 OD1 ASN A 57 -17.401 1.510 -12.288 1.00 0.00 O ATOM 819 ND2 ASN A 57 -15.922 0.245 -13.410 1.00 0.00 N ATOM 0 H ASN A 57 -14.766 1.831 -10.362 1.00 0.00 H new ATOM 0 HA ASN A 57 -17.421 1.215 -9.885 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.088 -0.331 -11.057 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -16.686 -1.044 -10.966 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -16.145 0.693 -14.299 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -15.220 -0.494 -13.373 1.00 0.00 H new ATOM 826 N GLN A 58 -15.390 -0.256 -7.828 1.00 0.00 N ATOM 827 CA GLN A 58 -15.310 -1.091 -6.635 1.00 0.00 C ATOM 828 C GLN A 58 -16.123 -0.489 -5.494 1.00 0.00 C ATOM 829 O GLN A 58 -16.621 -1.208 -4.628 1.00 0.00 O ATOM 830 CB GLN A 58 -13.852 -1.262 -6.203 1.00 0.00 C ATOM 831 CG GLN A 58 -13.027 -2.103 -7.165 1.00 0.00 C ATOM 832 CD GLN A 58 -11.608 -2.322 -6.679 1.00 0.00 C ATOM 833 OE1 GLN A 58 -11.386 -2.907 -5.618 1.00 0.00 O ATOM 834 NE2 GLN A 58 -10.638 -1.852 -7.454 1.00 0.00 N ATOM 0 H GLN A 58 -14.531 0.248 -8.049 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.727 -2.068 -6.878 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -13.392 -0.278 -6.107 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -13.826 -1.723 -5.216 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.512 -3.069 -7.305 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -13.002 -1.615 -8.139 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -10.868 -1.374 -8.325 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.663 -1.969 -7.178 1.00 0.00 H new ATOM 843 N GLN A 59 -16.252 0.834 -5.499 1.00 0.00 N ATOM 844 CA GLN A 59 -17.004 1.532 -4.463 1.00 0.00 C ATOM 845 C GLN A 59 -16.501 1.151 -3.075 1.00 0.00 C ATOM 846 O GLN A 59 -17.288 0.840 -2.181 1.00 0.00 O ATOM 847 CB GLN A 59 -18.495 1.212 -4.583 1.00 0.00 C ATOM 848 CG GLN A 59 -19.082 1.551 -5.944 1.00 0.00 C ATOM 849 CD GLN A 59 -20.597 1.498 -5.956 1.00 0.00 C ATOM 850 OE1 GLN A 59 -21.192 0.428 -6.091 1.00 0.00 O ATOM 851 NE2 GLN A 59 -21.231 2.656 -5.813 1.00 0.00 N ATOM 0 H GLN A 59 -15.846 1.444 -6.209 1.00 0.00 H new ATOM 0 HA GLN A 59 -16.857 2.603 -4.602 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -18.648 0.151 -4.385 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -19.039 1.761 -3.815 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -18.755 2.548 -6.238 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -18.692 0.855 -6.687 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -20.698 3.519 -5.704 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -22.251 2.682 -5.812 1.00 0.00 H new ATOM 860 N LYS A 60 -15.184 1.177 -2.901 1.00 0.00 N ATOM 861 CA LYS A 60 -14.574 0.835 -1.621 1.00 0.00 C ATOM 862 C LYS A 60 -14.793 1.947 -0.600 1.00 0.00 C ATOM 863 O LYS A 60 -15.489 2.925 -0.872 1.00 0.00 O ATOM 864 CB LYS A 60 -13.075 0.581 -1.799 1.00 0.00 C ATOM 865 CG LYS A 60 -12.762 -0.643 -2.644 1.00 0.00 C ATOM 866 CD LYS A 60 -13.095 -1.929 -1.907 1.00 0.00 C ATOM 867 CE LYS A 60 -13.496 -3.035 -2.871 1.00 0.00 C ATOM 868 NZ LYS A 60 -13.514 -4.369 -2.208 1.00 0.00 N ATOM 0 H LYS A 60 -14.518 1.431 -3.631 1.00 0.00 H new ATOM 0 HA LYS A 60 -15.050 -0.073 -1.251 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.619 1.457 -2.260 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.616 0.462 -0.818 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -13.328 -0.599 -3.574 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.706 -0.640 -2.913 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -12.232 -2.249 -1.323 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.907 -1.746 -1.203 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -14.483 -2.820 -3.281 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.800 -3.056 -3.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -13.792 -5.096 -2.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.566 -4.586 -1.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -14.197 -4.358 -1.423 1.00 0.00 H new ATOM 882 N LYS A 61 -14.195 1.790 0.576 1.00 0.00 N ATOM 883 CA LYS A 61 -14.322 2.781 1.638 1.00 0.00 C ATOM 884 C LYS A 61 -13.173 2.662 2.634 1.00 0.00 C ATOM 885 O LYS A 61 -12.546 1.609 2.749 1.00 0.00 O ATOM 886 CB LYS A 61 -15.659 2.613 2.362 1.00 0.00 C ATOM 887 CG LYS A 61 -16.867 2.874 1.479 1.00 0.00 C ATOM 888 CD LYS A 61 -18.102 3.196 2.303 1.00 0.00 C ATOM 889 CE LYS A 61 -19.374 3.045 1.484 1.00 0.00 C ATOM 890 NZ LYS A 61 -20.594 3.286 2.303 1.00 0.00 N ATOM 0 H LYS A 61 -13.617 0.985 0.818 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.284 3.771 1.184 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.722 1.600 2.760 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.689 3.292 3.214 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.653 3.703 0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.061 1.999 0.858 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -18.145 2.535 3.169 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -18.032 4.215 2.683 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -19.353 3.745 0.649 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -19.415 2.042 1.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -21.439 3.173 1.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -20.628 2.602 3.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -20.568 4.252 2.689 1.00 0.00 H new ATOM 904 N SER A 62 -12.904 3.747 3.352 1.00 0.00 N ATOM 905 CA SER A 62 -11.829 3.764 4.338 1.00 0.00 C ATOM 906 C SER A 62 -11.719 2.417 5.045 1.00 0.00 C ATOM 907 O SER A 62 -12.717 1.856 5.494 1.00 0.00 O ATOM 908 CB SER A 62 -12.066 4.874 5.364 1.00 0.00 C ATOM 909 OG SER A 62 -12.245 6.127 4.727 1.00 0.00 O ATOM 0 H SER A 62 -13.415 4.626 3.270 1.00 0.00 H new ATOM 0 HA SER A 62 -10.893 3.957 3.815 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.945 4.638 5.963 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.219 4.928 6.048 1.00 0.00 H new ATOM 0 HG SER A 62 -12.396 6.819 5.404 1.00 0.00 H new ATOM 915 N GLY A 63 -10.496 1.904 5.140 1.00 0.00 N ATOM 916 CA GLY A 63 -10.276 0.626 5.793 1.00 0.00 C ATOM 917 C GLY A 63 -10.222 -0.526 4.810 1.00 0.00 C ATOM 918 O GLY A 63 -9.814 -1.632 5.163 1.00 0.00 O ATOM 0 H GLY A 63 -9.654 2.350 4.777 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.343 0.664 6.354 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.074 0.448 6.514 1.00 0.00 H new ATOM 922 N GLU A 64 -10.637 -0.267 3.574 1.00 0.00 N ATOM 923 CA GLU A 64 -10.637 -1.294 2.538 1.00 0.00 C ATOM 924 C GLU A 64 -9.565 -1.009 1.490 1.00 0.00 C ATOM 925 O GLU A 64 -9.016 0.092 1.431 1.00 0.00 O ATOM 926 CB GLU A 64 -12.010 -1.375 1.869 1.00 0.00 C ATOM 927 CG GLU A 64 -13.080 -2.001 2.749 1.00 0.00 C ATOM 928 CD GLU A 64 -14.177 -2.672 1.946 1.00 0.00 C ATOM 929 OE1 GLU A 64 -13.872 -3.643 1.222 1.00 0.00 O ATOM 930 OE2 GLU A 64 -15.340 -2.226 2.040 1.00 0.00 O ATOM 0 H GLU A 64 -10.977 0.644 3.266 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.414 -2.251 3.011 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -12.326 -0.371 1.585 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -11.923 -1.954 0.949 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.618 -2.735 3.410 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -13.519 -1.231 3.384 1.00 0.00 H new ATOM 937 N VAL A 65 -9.270 -2.009 0.666 1.00 0.00 N ATOM 938 CA VAL A 65 -8.265 -1.867 -0.381 1.00 0.00 C ATOM 939 C VAL A 65 -8.846 -2.198 -1.750 1.00 0.00 C ATOM 940 O VAL A 65 -9.639 -3.128 -1.891 1.00 0.00 O ATOM 941 CB VAL A 65 -7.049 -2.775 -0.118 1.00 0.00 C ATOM 942 CG1 VAL A 65 -7.494 -4.215 0.092 1.00 0.00 C ATOM 943 CG2 VAL A 65 -6.054 -2.678 -1.264 1.00 0.00 C ATOM 0 H VAL A 65 -9.713 -2.927 0.703 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.941 -0.826 -0.370 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.554 -2.436 0.792 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.622 -4.842 0.276 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.166 -4.267 0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.013 -4.569 -0.799 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.201 -3.326 -1.061 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.535 -2.990 -2.191 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.712 -1.648 -1.362 1.00 0.00 H new ATOM 953 N ALA A 66 -8.446 -1.430 -2.758 1.00 0.00 N ATOM 954 CA ALA A 66 -8.925 -1.643 -4.118 1.00 0.00 C ATOM 955 C ALA A 66 -7.872 -2.347 -4.967 1.00 0.00 C ATOM 956 O ALA A 66 -6.706 -1.952 -4.983 1.00 0.00 O ATOM 957 CB ALA A 66 -9.317 -0.317 -4.753 1.00 0.00 C ATOM 0 H ALA A 66 -7.791 -0.654 -2.658 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.805 -2.285 -4.071 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.673 -0.491 -5.768 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -10.109 0.148 -4.166 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.450 0.344 -4.780 1.00 0.00 H new ATOM 963 N VAL A 67 -8.290 -3.393 -5.673 1.00 0.00 N ATOM 964 CA VAL A 67 -7.383 -4.153 -6.525 1.00 0.00 C ATOM 965 C VAL A 67 -7.740 -3.983 -7.997 1.00 0.00 C ATOM 966 O VAL A 67 -8.916 -3.920 -8.359 1.00 0.00 O ATOM 967 CB VAL A 67 -7.406 -5.652 -6.172 1.00 0.00 C ATOM 968 CG1 VAL A 67 -6.532 -6.440 -7.136 1.00 0.00 C ATOM 969 CG2 VAL A 67 -6.957 -5.868 -4.735 1.00 0.00 C ATOM 0 H VAL A 67 -9.251 -3.733 -5.672 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.381 -3.761 -6.350 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.430 -6.014 -6.267 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.560 -7.497 -6.872 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -6.903 -6.310 -8.153 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.506 -6.078 -7.075 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -6.979 -6.933 -4.503 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.942 -5.491 -4.610 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.627 -5.335 -4.060 1.00 0.00 H new ATOM 979 N LEU A 68 -6.719 -3.908 -8.843 1.00 0.00 N ATOM 980 CA LEU A 68 -6.924 -3.746 -10.278 1.00 0.00 C ATOM 981 C LEU A 68 -5.821 -4.442 -11.068 1.00 0.00 C ATOM 982 O LEU A 68 -4.635 -4.274 -10.782 1.00 0.00 O ATOM 983 CB LEU A 68 -6.968 -2.261 -10.642 1.00 0.00 C ATOM 984 CG LEU A 68 -7.821 -1.892 -11.856 1.00 0.00 C ATOM 985 CD1 LEU A 68 -9.293 -2.146 -11.571 1.00 0.00 C ATOM 986 CD2 LEU A 68 -7.594 -0.439 -12.246 1.00 0.00 C ATOM 0 H LEU A 68 -5.740 -3.957 -8.560 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.877 -4.206 -10.538 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.340 -1.707 -9.780 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.948 -1.922 -10.823 1.00 0.00 H new ATOM 0 HG LEU A 68 -7.520 -2.523 -12.693 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -9.885 -1.878 -12.446 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.442 -3.201 -11.342 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.609 -1.542 -10.721 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -8.209 -0.194 -13.112 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.867 0.208 -11.412 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.543 -0.289 -12.493 1.00 0.00 H new ATOM 998 N LYS A 69 -6.218 -5.225 -12.066 1.00 0.00 N ATOM 999 CA LYS A 69 -5.265 -5.945 -12.901 1.00 0.00 C ATOM 1000 C LYS A 69 -4.980 -5.177 -14.188 1.00 0.00 C ATOM 1001 O LYS A 69 -5.803 -5.153 -15.103 1.00 0.00 O ATOM 1002 CB LYS A 69 -5.799 -7.340 -13.235 1.00 0.00 C ATOM 1003 CG LYS A 69 -5.107 -7.988 -14.421 1.00 0.00 C ATOM 1004 CD LYS A 69 -3.705 -8.452 -14.063 1.00 0.00 C ATOM 1005 CE LYS A 69 -3.696 -9.903 -13.608 1.00 0.00 C ATOM 1006 NZ LYS A 69 -4.075 -10.831 -14.709 1.00 0.00 N ATOM 0 H LYS A 69 -7.195 -5.377 -12.316 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.334 -6.043 -12.343 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.684 -7.983 -12.362 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -6.867 -7.271 -13.441 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.695 -8.838 -14.767 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.057 -7.278 -15.247 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.051 -8.337 -14.927 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.302 -7.819 -13.272 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.703 -10.162 -13.240 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.387 -10.027 -12.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.669 -11.771 -14.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.111 -10.905 -14.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.710 -10.466 -15.612 1.00 0.00 H new ATOM 1020 N ARG A 70 -3.809 -4.552 -14.251 1.00 0.00 N ATOM 1021 CA ARG A 70 -3.415 -3.783 -15.426 1.00 0.00 C ATOM 1022 C ARG A 70 -2.375 -4.539 -16.247 1.00 0.00 C ATOM 1023 O ARG A 70 -2.652 -4.983 -17.361 1.00 0.00 O ATOM 1024 CB ARG A 70 -2.859 -2.421 -15.008 1.00 0.00 C ATOM 1025 CG ARG A 70 -3.116 -1.320 -16.024 1.00 0.00 C ATOM 1026 CD ARG A 70 -4.460 -0.648 -15.790 1.00 0.00 C ATOM 1027 NE ARG A 70 -4.730 0.395 -16.776 1.00 0.00 N ATOM 1028 CZ ARG A 70 -5.029 0.146 -18.046 1.00 0.00 C ATOM 1029 NH1 ARG A 70 -5.097 -1.105 -18.481 1.00 0.00 N ATOM 1030 NH2 ARG A 70 -5.262 1.148 -18.883 1.00 0.00 N ATOM 0 H ARG A 70 -3.116 -4.563 -13.502 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.300 -3.632 -16.044 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.302 -2.134 -14.054 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.785 -2.511 -14.846 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -2.321 -0.576 -15.965 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -3.087 -1.738 -17.030 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -5.251 -1.397 -15.829 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -4.479 -0.215 -14.790 1.00 0.00 H new ATOM 0 HE ARG A 70 -4.687 1.368 -16.473 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -4.920 -1.878 -17.840 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -5.327 -1.294 -19.457 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -5.212 2.111 -18.552 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -5.491 0.955 -19.858 1.00 0.00 H new ATOM 1044 N ASP A 71 -1.178 -4.681 -15.689 1.00 0.00 N ATOM 1045 CA ASP A 71 -0.095 -5.384 -16.368 1.00 0.00 C ATOM 1046 C ASP A 71 0.334 -6.616 -15.577 1.00 0.00 C ATOM 1047 O ASP A 71 1.227 -6.545 -14.734 1.00 0.00 O ATOM 1048 CB ASP A 71 1.099 -4.450 -16.570 1.00 0.00 C ATOM 1049 CG ASP A 71 2.107 -5.006 -17.557 1.00 0.00 C ATOM 1050 OD1 ASP A 71 2.901 -5.886 -17.163 1.00 0.00 O ATOM 1051 OD2 ASP A 71 2.102 -4.561 -18.724 1.00 0.00 O ATOM 0 H ASP A 71 -0.933 -4.319 -14.768 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.460 -5.710 -17.342 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.744 -3.482 -16.924 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.589 -4.279 -15.612 1.00 0.00 H new ATOM 1056 N GLY A 72 -0.311 -7.745 -15.855 1.00 0.00 N ATOM 1057 CA GLY A 72 0.017 -8.976 -15.160 1.00 0.00 C ATOM 1058 C GLY A 72 0.377 -8.743 -13.706 1.00 0.00 C ATOM 1059 O GLY A 72 1.231 -9.436 -13.152 1.00 0.00 O ATOM 0 H GLY A 72 -1.054 -7.829 -16.549 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -0.831 -9.658 -15.216 1.00 0.00 H new ATOM 0 HA3 GLY A 72 0.852 -9.463 -15.664 1.00 0.00 H new ATOM 1063 N ARG A 73 -0.275 -7.765 -13.087 1.00 0.00 N ATOM 1064 CA ARG A 73 -0.017 -7.441 -11.689 1.00 0.00 C ATOM 1065 C ARG A 73 -1.239 -6.789 -11.047 1.00 0.00 C ATOM 1066 O ARG A 73 -2.047 -6.157 -11.728 1.00 0.00 O ATOM 1067 CB ARG A 73 1.190 -6.508 -11.574 1.00 0.00 C ATOM 1068 CG ARG A 73 0.876 -5.060 -11.909 1.00 0.00 C ATOM 1069 CD ARG A 73 2.071 -4.156 -11.651 1.00 0.00 C ATOM 1070 NE ARG A 73 3.266 -4.614 -12.354 1.00 0.00 N ATOM 1071 CZ ARG A 73 4.347 -3.863 -12.533 1.00 0.00 C ATOM 1072 NH1 ARG A 73 4.382 -2.624 -12.062 1.00 0.00 N ATOM 1073 NH2 ARG A 73 5.395 -4.351 -13.184 1.00 0.00 N ATOM 0 H ARG A 73 -0.986 -7.183 -13.531 1.00 0.00 H new ATOM 0 HA ARG A 73 0.198 -8.370 -11.161 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.583 -6.560 -10.559 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.977 -6.863 -12.239 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.580 -4.984 -12.955 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.028 -4.723 -11.312 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.832 -3.140 -11.966 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.272 -4.118 -10.580 1.00 0.00 H new ATOM 0 HE ARG A 73 3.271 -5.563 -12.728 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.578 -2.246 -11.561 1.00 0.00 H new ATOM 0 HH12 ARG A 73 5.213 -2.049 -12.201 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.371 -5.304 -13.548 1.00 0.00 H new ATOM 0 HH22 ARG A 73 6.225 -3.773 -13.321 1.00 0.00 H new ATOM 1087 N TYR A 74 -1.367 -6.949 -9.735 1.00 0.00 N ATOM 1088 CA TYR A 74 -2.492 -6.380 -9.002 1.00 0.00 C ATOM 1089 C TYR A 74 -2.055 -5.161 -8.195 1.00 0.00 C ATOM 1090 O TYR A 74 -1.313 -5.282 -7.220 1.00 0.00 O ATOM 1091 CB TYR A 74 -3.104 -7.428 -8.072 1.00 0.00 C ATOM 1092 CG TYR A 74 -3.573 -8.674 -8.789 1.00 0.00 C ATOM 1093 CD1 TYR A 74 -4.495 -8.597 -9.826 1.00 0.00 C ATOM 1094 CD2 TYR A 74 -3.096 -9.928 -8.429 1.00 0.00 C ATOM 1095 CE1 TYR A 74 -4.927 -9.732 -10.483 1.00 0.00 C ATOM 1096 CE2 TYR A 74 -3.521 -11.069 -9.082 1.00 0.00 C ATOM 1097 CZ TYR A 74 -4.437 -10.966 -10.108 1.00 0.00 C ATOM 1098 OH TYR A 74 -4.864 -12.100 -10.760 1.00 0.00 O ATOM 0 H TYR A 74 -0.706 -7.468 -9.157 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.243 -6.064 -9.726 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.367 -7.708 -7.319 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.947 -6.984 -7.543 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -4.880 -7.633 -10.123 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -2.380 -10.013 -7.625 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -5.645 -9.654 -11.286 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -3.138 -12.036 -8.791 1.00 0.00 H new ATOM 0 HH TYR A 74 -4.422 -12.885 -10.375 1.00 0.00 H new ATOM 1108 N ILE A 75 -2.521 -3.988 -8.609 1.00 0.00 N ATOM 1109 CA ILE A 75 -2.181 -2.746 -7.925 1.00 0.00 C ATOM 1110 C ILE A 75 -3.182 -2.437 -6.818 1.00 0.00 C ATOM 1111 O ILE A 75 -4.387 -2.361 -7.060 1.00 0.00 O ATOM 1112 CB ILE A 75 -2.132 -1.559 -8.905 1.00 0.00 C ATOM 1113 CG1 ILE A 75 -1.187 -1.868 -10.068 1.00 0.00 C ATOM 1114 CG2 ILE A 75 -1.695 -0.294 -8.182 1.00 0.00 C ATOM 1115 CD1 ILE A 75 -1.015 -0.712 -11.029 1.00 0.00 C ATOM 0 H ILE A 75 -3.135 -3.871 -9.415 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.192 -2.886 -7.488 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.132 -1.397 -9.308 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.212 -2.147 -9.669 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.566 -2.731 -10.615 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.665 0.536 -8.887 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.403 -0.068 -7.385 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.703 -0.443 -7.755 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.332 -1.002 -11.828 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -1.982 -0.447 -11.456 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.606 0.146 -10.496 1.00 0.00 H new ATOM 1127 N TYR A 76 -2.676 -2.257 -5.603 1.00 0.00 N ATOM 1128 CA TYR A 76 -3.526 -1.956 -4.458 1.00 0.00 C ATOM 1129 C TYR A 76 -3.593 -0.452 -4.210 1.00 0.00 C ATOM 1130 O TYR A 76 -2.594 0.255 -4.341 1.00 0.00 O ATOM 1131 CB TYR A 76 -3.004 -2.668 -3.208 1.00 0.00 C ATOM 1132 CG TYR A 76 -2.807 -4.155 -3.396 1.00 0.00 C ATOM 1133 CD1 TYR A 76 -3.840 -5.050 -3.144 1.00 0.00 C ATOM 1134 CD2 TYR A 76 -1.588 -4.666 -3.824 1.00 0.00 C ATOM 1135 CE1 TYR A 76 -3.665 -6.409 -3.314 1.00 0.00 C ATOM 1136 CE2 TYR A 76 -1.404 -6.024 -3.997 1.00 0.00 C ATOM 1137 CZ TYR A 76 -2.445 -6.891 -3.741 1.00 0.00 C ATOM 1138 OH TYR A 76 -2.265 -8.245 -3.911 1.00 0.00 O ATOM 0 H TYR A 76 -1.681 -2.314 -5.386 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.531 -2.314 -4.679 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.056 -2.219 -2.914 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -3.703 -2.503 -2.388 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -4.796 -4.676 -2.809 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.770 -3.990 -4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -4.478 -7.091 -3.114 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.450 -6.405 -4.331 1.00 0.00 H new ATOM 0 HH TYR A 76 -3.136 -8.694 -3.907 1.00 0.00 H new ATOM 1148 N TYR A 77 -4.778 0.029 -3.849 1.00 0.00 N ATOM 1149 CA TYR A 77 -4.978 1.448 -3.584 1.00 0.00 C ATOM 1150 C TYR A 77 -5.520 1.668 -2.175 1.00 0.00 C ATOM 1151 O TYR A 77 -6.733 1.727 -1.966 1.00 0.00 O ATOM 1152 CB TYR A 77 -5.938 2.050 -4.611 1.00 0.00 C ATOM 1153 CG TYR A 77 -5.422 1.986 -6.032 1.00 0.00 C ATOM 1154 CD1 TYR A 77 -5.543 0.823 -6.783 1.00 0.00 C ATOM 1155 CD2 TYR A 77 -4.814 3.087 -6.622 1.00 0.00 C ATOM 1156 CE1 TYR A 77 -5.074 0.760 -8.081 1.00 0.00 C ATOM 1157 CE2 TYR A 77 -4.342 3.032 -7.919 1.00 0.00 C ATOM 1158 CZ TYR A 77 -4.474 1.867 -8.644 1.00 0.00 C ATOM 1159 OH TYR A 77 -4.005 1.808 -9.936 1.00 0.00 O ATOM 0 H TYR A 77 -5.614 -0.544 -3.733 1.00 0.00 H new ATOM 0 HA TYR A 77 -4.012 1.946 -3.664 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.892 1.525 -4.556 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.131 3.091 -4.350 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.011 -0.046 -6.345 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.709 4.001 -6.057 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.177 -0.151 -8.652 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.872 3.897 -8.363 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.302 2.601 -10.429 1.00 0.00 H new ATOM 1169 N LEU A 78 -4.614 1.789 -1.211 1.00 0.00 N ATOM 1170 CA LEU A 78 -4.999 2.004 0.179 1.00 0.00 C ATOM 1171 C LEU A 78 -5.822 3.279 0.326 1.00 0.00 C ATOM 1172 O LEU A 78 -5.371 4.366 -0.038 1.00 0.00 O ATOM 1173 CB LEU A 78 -3.756 2.080 1.067 1.00 0.00 C ATOM 1174 CG LEU A 78 -2.732 0.959 0.887 1.00 0.00 C ATOM 1175 CD1 LEU A 78 -1.334 1.455 1.222 1.00 0.00 C ATOM 1176 CD2 LEU A 78 -3.096 -0.240 1.749 1.00 0.00 C ATOM 0 H LEU A 78 -3.607 1.742 -1.367 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.612 1.160 0.495 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.259 3.032 0.881 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.078 2.087 2.108 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.744 0.646 -0.157 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.618 0.644 1.088 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.073 2.282 0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.307 1.796 2.257 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.356 -1.028 1.608 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.114 0.058 2.797 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.080 -0.610 1.460 1.00 0.00 H new ATOM 1188 N ILE A 79 -7.030 3.140 0.861 1.00 0.00 N ATOM 1189 CA ILE A 79 -7.914 4.282 1.059 1.00 0.00 C ATOM 1190 C ILE A 79 -8.095 4.587 2.542 1.00 0.00 C ATOM 1191 O ILE A 79 -8.698 3.807 3.280 1.00 0.00 O ATOM 1192 CB ILE A 79 -9.297 4.040 0.424 1.00 0.00 C ATOM 1193 CG1 ILE A 79 -9.162 3.855 -1.089 1.00 0.00 C ATOM 1194 CG2 ILE A 79 -10.235 5.195 0.741 1.00 0.00 C ATOM 1195 CD1 ILE A 79 -10.234 2.971 -1.687 1.00 0.00 C ATOM 0 H ILE A 79 -7.419 2.248 1.165 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.442 5.134 0.570 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.720 3.128 0.846 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -9.197 4.832 -1.571 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.184 3.426 -1.309 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.208 5.009 0.286 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -10.351 5.284 1.821 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.819 6.121 0.344 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -10.076 2.884 -2.762 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.185 1.982 -1.232 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -11.214 3.409 -1.498 1.00 0.00 H new ATOM 1207 N THR A 80 -7.568 5.729 2.974 1.00 0.00 N ATOM 1208 CA THR A 80 -7.671 6.139 4.368 1.00 0.00 C ATOM 1209 C THR A 80 -8.696 7.255 4.539 1.00 0.00 C ATOM 1210 O THR A 80 -9.267 7.429 5.616 1.00 0.00 O ATOM 1211 CB THR A 80 -6.313 6.616 4.916 1.00 0.00 C ATOM 1212 OG1 THR A 80 -5.794 7.666 4.091 1.00 0.00 O ATOM 1213 CG2 THR A 80 -5.317 5.467 4.969 1.00 0.00 C ATOM 0 H THR A 80 -7.065 6.386 2.377 1.00 0.00 H new ATOM 0 HA THR A 80 -7.994 5.263 4.931 1.00 0.00 H new ATOM 0 HB THR A 80 -6.466 6.991 5.928 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.814 7.645 4.112 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.365 5.828 5.359 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.702 4.682 5.620 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.169 5.067 3.966 1.00 0.00 H new ATOM 1221 N LYS A 81 -8.925 8.010 3.470 1.00 0.00 N ATOM 1222 CA LYS A 81 -9.882 9.109 3.500 1.00 0.00 C ATOM 1223 C LYS A 81 -10.718 9.138 2.224 1.00 0.00 C ATOM 1224 O LYS A 81 -10.294 8.642 1.180 1.00 0.00 O ATOM 1225 CB LYS A 81 -9.153 10.443 3.675 1.00 0.00 C ATOM 1226 CG LYS A 81 -8.110 10.711 2.604 1.00 0.00 C ATOM 1227 CD LYS A 81 -6.971 11.564 3.136 1.00 0.00 C ATOM 1228 CE LYS A 81 -6.152 12.169 2.006 1.00 0.00 C ATOM 1229 NZ LYS A 81 -6.861 13.304 1.353 1.00 0.00 N ATOM 0 H LYS A 81 -8.460 7.880 2.571 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.550 8.953 4.347 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.885 11.251 3.668 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.670 10.458 4.652 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.715 9.765 2.235 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.577 11.214 1.757 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.373 12.361 3.762 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.325 10.956 3.770 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.195 12.515 2.396 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -5.935 11.401 1.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.256 13.710 0.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -7.747 12.962 0.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -7.076 14.033 2.063 1.00 0.00 H new ATOM 1243 N LYS A 82 -11.908 9.722 2.315 1.00 0.00 N ATOM 1244 CA LYS A 82 -12.803 9.819 1.168 1.00 0.00 C ATOM 1245 C LYS A 82 -12.458 11.031 0.309 1.00 0.00 C ATOM 1246 O LYS A 82 -12.154 10.898 -0.876 1.00 0.00 O ATOM 1247 CB LYS A 82 -14.257 9.908 1.636 1.00 0.00 C ATOM 1248 CG LYS A 82 -14.648 8.819 2.619 1.00 0.00 C ATOM 1249 CD LYS A 82 -15.724 9.295 3.581 1.00 0.00 C ATOM 1250 CE LYS A 82 -15.824 8.390 4.799 1.00 0.00 C ATOM 1251 NZ LYS A 82 -17.058 8.655 5.588 1.00 0.00 N ATOM 0 H LYS A 82 -12.275 10.136 3.172 1.00 0.00 H new ATOM 0 HA LYS A 82 -12.677 8.921 0.563 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -14.421 10.881 2.100 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -14.913 9.854 0.767 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -15.007 7.947 2.073 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.770 8.503 3.182 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -15.503 10.313 3.901 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -16.685 9.323 3.068 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -15.815 7.348 4.479 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -14.949 8.537 5.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -17.088 8.018 6.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -17.055 9.642 5.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -17.894 8.491 4.991 1.00 0.00 H new ATOM 1265 N ARG A 83 -12.507 12.213 0.915 1.00 0.00 N ATOM 1266 CA ARG A 83 -12.200 13.449 0.206 1.00 0.00 C ATOM 1267 C ARG A 83 -11.137 14.252 0.949 1.00 0.00 C ATOM 1268 O ARG A 83 -10.957 14.096 2.156 1.00 0.00 O ATOM 1269 CB ARG A 83 -13.465 14.292 0.035 1.00 0.00 C ATOM 1270 CG ARG A 83 -14.672 13.493 -0.427 1.00 0.00 C ATOM 1271 CD ARG A 83 -15.813 14.403 -0.854 1.00 0.00 C ATOM 1272 NE ARG A 83 -16.832 13.684 -1.614 1.00 0.00 N ATOM 1273 CZ ARG A 83 -17.998 14.215 -1.965 1.00 0.00 C ATOM 1274 NH1 ARG A 83 -18.291 15.462 -1.626 1.00 0.00 N ATOM 1275 NH2 ARG A 83 -18.873 13.497 -2.657 1.00 0.00 N ATOM 0 H ARG A 83 -12.757 12.340 1.896 1.00 0.00 H new ATOM 0 HA ARG A 83 -11.811 13.187 -0.778 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.701 14.774 0.984 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.268 15.086 -0.686 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -14.387 12.850 -1.260 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -15.008 12.840 0.379 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -16.269 14.852 0.029 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -15.418 15.219 -1.459 1.00 0.00 H new ATOM 0 HE ARG A 83 -16.638 12.722 -1.890 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -17.620 16.017 -1.094 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -19.187 15.867 -1.897 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -18.651 12.537 -2.920 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -19.768 13.905 -2.926 1.00 0.00 H new ATOM 1289 N ALA A 84 -10.434 15.111 0.218 1.00 0.00 N ATOM 1290 CA ALA A 84 -9.389 15.940 0.807 1.00 0.00 C ATOM 1291 C ALA A 84 -9.842 16.529 2.139 1.00 0.00 C ATOM 1292 O ALA A 84 -9.088 16.544 3.111 1.00 0.00 O ATOM 1293 CB ALA A 84 -8.990 17.049 -0.154 1.00 0.00 C ATOM 0 H ALA A 84 -10.569 15.251 -0.783 1.00 0.00 H new ATOM 0 HA ALA A 84 -8.521 15.308 0.995 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -8.209 17.660 0.299 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -8.617 16.611 -1.080 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.858 17.672 -0.371 1.00 0.00 H new ATOM 1299 N SER A 85 -11.079 17.016 2.175 1.00 0.00 N ATOM 1300 CA SER A 85 -11.631 17.611 3.386 1.00 0.00 C ATOM 1301 C SER A 85 -11.274 16.777 4.613 1.00 0.00 C ATOM 1302 O SER A 85 -10.940 17.315 5.669 1.00 0.00 O ATOM 1303 CB SER A 85 -13.150 17.743 3.269 1.00 0.00 C ATOM 1304 OG SER A 85 -13.660 18.648 4.233 1.00 0.00 O ATOM 0 H SER A 85 -11.717 17.010 1.379 1.00 0.00 H new ATOM 0 HA SER A 85 -11.196 18.603 3.504 1.00 0.00 H new ATOM 0 HB2 SER A 85 -13.412 18.087 2.268 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.614 16.766 3.402 1.00 0.00 H new ATOM 0 HG SER A 85 -14.633 18.716 4.136 1.00 0.00 H new ATOM 1310 N HIS A 86 -11.349 15.458 4.465 1.00 0.00 N ATOM 1311 CA HIS A 86 -11.034 14.547 5.560 1.00 0.00 C ATOM 1312 C HIS A 86 -9.582 14.085 5.482 1.00 0.00 C ATOM 1313 O HIS A 86 -9.174 13.444 4.512 1.00 0.00 O ATOM 1314 CB HIS A 86 -11.969 13.337 5.530 1.00 0.00 C ATOM 1315 CG HIS A 86 -13.313 13.633 4.939 1.00 0.00 C ATOM 1316 ND1 HIS A 86 -13.794 13.003 3.811 1.00 0.00 N ATOM 1317 CD2 HIS A 86 -14.280 14.497 5.327 1.00 0.00 C ATOM 1318 CE1 HIS A 86 -14.999 13.468 3.530 1.00 0.00 C ATOM 1319 NE2 HIS A 86 -15.317 14.375 4.435 1.00 0.00 N ATOM 0 H HIS A 86 -11.625 14.996 3.598 1.00 0.00 H new ATOM 0 HA HIS A 86 -11.176 15.083 6.498 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -11.498 12.538 4.958 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -12.102 12.966 6.546 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -14.243 15.159 6.179 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -15.618 13.159 2.701 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -16.191 14.900 4.467 1.00 0.00 H new ATOM 1327 N LYS A 87 -8.805 14.414 6.508 1.00 0.00 N ATOM 1328 CA LYS A 87 -7.399 14.033 6.557 1.00 0.00 C ATOM 1329 C LYS A 87 -7.245 12.573 6.968 1.00 0.00 C ATOM 1330 O LYS A 87 -8.075 12.013 7.684 1.00 0.00 O ATOM 1331 CB LYS A 87 -6.640 14.932 7.536 1.00 0.00 C ATOM 1332 CG LYS A 87 -5.867 16.051 6.859 1.00 0.00 C ATOM 1333 CD LYS A 87 -6.713 16.762 5.816 1.00 0.00 C ATOM 1334 CE LYS A 87 -5.885 17.158 4.603 1.00 0.00 C ATOM 1335 NZ LYS A 87 -5.150 18.434 4.826 1.00 0.00 N ATOM 0 H LYS A 87 -9.126 14.944 7.318 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.980 14.157 5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.348 15.366 8.242 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.947 14.321 8.115 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.533 16.769 7.608 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.973 15.643 6.387 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -7.530 16.112 5.504 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -7.164 17.651 6.256 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.174 16.364 4.374 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.537 17.261 3.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.598 18.670 3.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -5.830 19.197 5.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.508 18.328 5.638 1.00 0.00 H new ATOM 1349 N PRO A 88 -6.156 11.939 6.507 1.00 0.00 N ATOM 1350 CA PRO A 88 -5.867 10.535 6.816 1.00 0.00 C ATOM 1351 C PRO A 88 -5.487 10.330 8.278 1.00 0.00 C ATOM 1352 O PRO A 88 -4.586 10.991 8.795 1.00 0.00 O ATOM 1353 CB PRO A 88 -4.682 10.209 5.904 1.00 0.00 C ATOM 1354 CG PRO A 88 -4.022 11.521 5.655 1.00 0.00 C ATOM 1355 CD PRO A 88 -5.124 12.544 5.648 1.00 0.00 C ATOM 0 HA PRO A 88 -6.735 9.895 6.656 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -3.998 9.506 6.380 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -5.014 9.750 4.973 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -3.289 11.742 6.431 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.489 11.515 4.704 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.785 13.502 6.041 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -5.496 12.727 4.640 1.00 0.00 H new ATOM 1363 N THR A 89 -6.179 9.409 8.941 1.00 0.00 N ATOM 1364 CA THR A 89 -5.914 9.117 10.344 1.00 0.00 C ATOM 1365 C THR A 89 -5.186 7.787 10.501 1.00 0.00 C ATOM 1366 O THR A 89 -5.657 6.751 10.031 1.00 0.00 O ATOM 1367 CB THR A 89 -7.217 9.076 11.165 1.00 0.00 C ATOM 1368 OG1 THR A 89 -8.203 8.295 10.481 1.00 0.00 O ATOM 1369 CG2 THR A 89 -7.751 10.481 11.403 1.00 0.00 C ATOM 0 H THR A 89 -6.928 8.852 8.529 1.00 0.00 H new ATOM 0 HA THR A 89 -5.281 9.921 10.720 1.00 0.00 H new ATOM 0 HB THR A 89 -6.998 8.619 12.130 1.00 0.00 H new ATOM 0 HG1 THR A 89 -9.027 8.273 11.010 1.00 0.00 H new ATOM 0 HG21 THR A 89 -8.671 10.427 11.985 1.00 0.00 H new ATOM 0 HG22 THR A 89 -7.010 11.064 11.950 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.955 10.960 10.445 1.00 0.00 H new ATOM 1377 N TYR A 90 -4.036 7.822 11.165 1.00 0.00 N ATOM 1378 CA TYR A 90 -3.242 6.619 11.383 1.00 0.00 C ATOM 1379 C TYR A 90 -4.140 5.412 11.634 1.00 0.00 C ATOM 1380 O TYR A 90 -3.874 4.315 11.144 1.00 0.00 O ATOM 1381 CB TYR A 90 -2.291 6.817 12.565 1.00 0.00 C ATOM 1382 CG TYR A 90 -1.201 7.830 12.302 1.00 0.00 C ATOM 1383 CD1 TYR A 90 -0.473 7.807 11.119 1.00 0.00 C ATOM 1384 CD2 TYR A 90 -0.899 8.813 13.237 1.00 0.00 C ATOM 1385 CE1 TYR A 90 0.524 8.730 10.875 1.00 0.00 C ATOM 1386 CE2 TYR A 90 0.096 9.742 13.001 1.00 0.00 C ATOM 1387 CZ TYR A 90 0.805 9.696 11.819 1.00 0.00 C ATOM 1388 OH TYR A 90 1.798 10.619 11.579 1.00 0.00 O ATOM 0 H TYR A 90 -3.633 8.671 11.562 1.00 0.00 H new ATOM 0 HA TYR A 90 -2.657 6.432 10.483 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -2.867 7.133 13.435 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.833 5.860 12.816 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.691 7.053 10.377 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -1.452 8.851 14.164 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.081 8.696 9.950 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.317 10.500 13.738 1.00 0.00 H new ATOM 0 HH TYR A 90 1.868 11.230 12.342 1.00 0.00 H new ATOM 1398 N GLU A 91 -5.205 5.624 12.401 1.00 0.00 N ATOM 1399 CA GLU A 91 -6.142 4.553 12.718 1.00 0.00 C ATOM 1400 C GLU A 91 -6.622 3.856 11.448 1.00 0.00 C ATOM 1401 O GLU A 91 -6.550 2.633 11.334 1.00 0.00 O ATOM 1402 CB GLU A 91 -7.340 5.107 13.492 1.00 0.00 C ATOM 1403 CG GLU A 91 -8.218 4.030 14.108 1.00 0.00 C ATOM 1404 CD GLU A 91 -9.588 4.547 14.500 1.00 0.00 C ATOM 1405 OE1 GLU A 91 -10.399 4.828 13.593 1.00 0.00 O ATOM 1406 OE2 GLU A 91 -9.849 4.670 15.715 1.00 0.00 O ATOM 0 H GLU A 91 -5.440 6.527 12.814 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.623 3.823 13.339 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.978 5.765 14.282 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -7.945 5.717 12.821 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.333 3.210 13.399 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.722 3.622 14.989 1.00 0.00 H new ATOM 1413 N ASN A 92 -7.112 4.644 10.496 1.00 0.00 N ATOM 1414 CA ASN A 92 -7.604 4.103 9.235 1.00 0.00 C ATOM 1415 C ASN A 92 -6.473 3.454 8.442 1.00 0.00 C ATOM 1416 O ASN A 92 -6.631 2.362 7.896 1.00 0.00 O ATOM 1417 CB ASN A 92 -8.256 5.209 8.402 1.00 0.00 C ATOM 1418 CG ASN A 92 -9.714 5.421 8.763 1.00 0.00 C ATOM 1419 OD1 ASN A 92 -10.494 4.471 8.827 1.00 0.00 O ATOM 1420 ND2 ASN A 92 -10.087 6.673 9.001 1.00 0.00 N ATOM 0 H ASN A 92 -7.179 5.659 10.574 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.349 3.340 9.462 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.709 6.141 8.548 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -8.179 4.957 7.344 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -11.055 6.878 9.249 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -9.406 7.429 8.936 1.00 0.00 H new ATOM 1427 N LEU A 93 -5.333 4.133 8.385 1.00 0.00 N ATOM 1428 CA LEU A 93 -4.174 3.623 7.660 1.00 0.00 C ATOM 1429 C LEU A 93 -3.880 2.179 8.051 1.00 0.00 C ATOM 1430 O LEU A 93 -3.961 1.273 7.221 1.00 0.00 O ATOM 1431 CB LEU A 93 -2.950 4.498 7.937 1.00 0.00 C ATOM 1432 CG LEU A 93 -1.609 3.948 7.450 1.00 0.00 C ATOM 1433 CD1 LEU A 93 -1.453 4.170 5.954 1.00 0.00 C ATOM 1434 CD2 LEU A 93 -0.460 4.595 8.210 1.00 0.00 C ATOM 0 H LEU A 93 -5.186 5.038 8.832 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.401 3.652 6.594 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.111 5.471 7.473 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.883 4.665 9.012 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.587 2.875 7.641 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.493 3.772 5.625 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.258 3.660 5.425 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.497 5.238 5.738 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.487 4.192 7.851 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.479 5.673 8.050 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.563 4.384 9.274 1.00 0.00 H new ATOM 1446 N GLN A 94 -3.542 1.971 9.319 1.00 0.00 N ATOM 1447 CA GLN A 94 -3.237 0.636 9.819 1.00 0.00 C ATOM 1448 C GLN A 94 -4.167 -0.403 9.200 1.00 0.00 C ATOM 1449 O GLN A 94 -3.719 -1.322 8.514 1.00 0.00 O ATOM 1450 CB GLN A 94 -3.358 0.599 11.344 1.00 0.00 C ATOM 1451 CG GLN A 94 -2.436 -0.414 12.003 1.00 0.00 C ATOM 1452 CD GLN A 94 -2.980 -0.925 13.323 1.00 0.00 C ATOM 1453 OE1 GLN A 94 -3.739 -0.235 14.004 1.00 0.00 O ATOM 1454 NE2 GLN A 94 -2.592 -2.140 13.693 1.00 0.00 N ATOM 0 H GLN A 94 -3.472 2.710 10.019 1.00 0.00 H new ATOM 0 HA GLN A 94 -2.212 0.396 9.536 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -3.139 1.590 11.742 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -4.389 0.368 11.613 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.284 -1.255 11.327 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.460 0.042 12.169 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -1.962 -2.677 13.098 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -2.924 -2.536 14.572 1.00 0.00 H new ATOM 1463 N LYS A 95 -5.464 -0.250 9.445 1.00 0.00 N ATOM 1464 CA LYS A 95 -6.458 -1.173 8.910 1.00 0.00 C ATOM 1465 C LYS A 95 -6.214 -1.437 7.428 1.00 0.00 C ATOM 1466 O LYS A 95 -6.090 -2.586 7.004 1.00 0.00 O ATOM 1467 CB LYS A 95 -7.867 -0.612 9.115 1.00 0.00 C ATOM 1468 CG LYS A 95 -8.197 -0.310 10.566 1.00 0.00 C ATOM 1469 CD LYS A 95 -8.723 -1.540 11.286 1.00 0.00 C ATOM 1470 CE LYS A 95 -9.104 -1.224 12.724 1.00 0.00 C ATOM 1471 NZ LYS A 95 -9.230 -2.458 13.549 1.00 0.00 N ATOM 0 H LYS A 95 -5.851 0.505 10.011 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.368 -2.117 9.448 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.974 0.301 8.529 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.593 -1.326 8.727 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.305 0.056 11.074 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.940 0.486 10.613 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -9.592 -1.930 10.756 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.964 -2.323 11.273 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.352 -0.569 13.163 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.048 -0.680 12.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.491 -2.200 14.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -9.966 -3.072 13.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.322 -2.965 13.557 1.00 0.00 H new ATOM 1485 N SER A 96 -6.146 -0.365 6.644 1.00 0.00 N ATOM 1486 CA SER A 96 -5.919 -0.482 5.209 1.00 0.00 C ATOM 1487 C SER A 96 -4.774 -1.447 4.916 1.00 0.00 C ATOM 1488 O SER A 96 -4.900 -2.343 4.079 1.00 0.00 O ATOM 1489 CB SER A 96 -5.610 0.891 4.607 1.00 0.00 C ATOM 1490 OG SER A 96 -6.714 1.768 4.744 1.00 0.00 O ATOM 0 H SER A 96 -6.245 0.593 6.979 1.00 0.00 H new ATOM 0 HA SER A 96 -6.828 -0.875 4.754 1.00 0.00 H new ATOM 0 HB2 SER A 96 -4.738 1.320 5.100 1.00 0.00 H new ATOM 0 HB3 SER A 96 -5.358 0.781 3.552 1.00 0.00 H new ATOM 0 HG SER A 96 -6.807 2.033 5.683 1.00 0.00 H new ATOM 1496 N LEU A 97 -3.658 -1.259 5.610 1.00 0.00 N ATOM 1497 CA LEU A 97 -2.489 -2.113 5.426 1.00 0.00 C ATOM 1498 C LEU A 97 -2.823 -3.568 5.738 1.00 0.00 C ATOM 1499 O LEU A 97 -2.289 -4.484 5.114 1.00 0.00 O ATOM 1500 CB LEU A 97 -1.341 -1.638 6.319 1.00 0.00 C ATOM 1501 CG LEU A 97 -0.650 -0.343 5.892 1.00 0.00 C ATOM 1502 CD1 LEU A 97 0.054 0.302 7.076 1.00 0.00 C ATOM 1503 CD2 LEU A 97 0.337 -0.612 4.765 1.00 0.00 C ATOM 0 H LEU A 97 -3.537 -0.523 6.306 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.181 -2.046 4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.725 -1.505 7.330 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.592 -2.428 6.364 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.410 0.348 5.526 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.540 1.223 6.753 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.676 0.530 7.853 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.803 -0.384 7.472 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.820 0.321 4.474 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.092 -1.321 5.104 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.193 -1.029 3.909 1.00 0.00 H new ATOM 1515 N GLU A 98 -3.712 -3.772 6.706 1.00 0.00 N ATOM 1516 CA GLU A 98 -4.118 -5.116 7.098 1.00 0.00 C ATOM 1517 C GLU A 98 -5.015 -5.745 6.036 1.00 0.00 C ATOM 1518 O GLU A 98 -5.042 -6.965 5.875 1.00 0.00 O ATOM 1519 CB GLU A 98 -4.848 -5.080 8.442 1.00 0.00 C ATOM 1520 CG GLU A 98 -3.925 -4.872 9.631 1.00 0.00 C ATOM 1521 CD GLU A 98 -3.379 -6.175 10.181 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -4.122 -7.179 10.174 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -2.210 -6.191 10.619 1.00 0.00 O ATOM 0 H GLU A 98 -4.164 -3.024 7.232 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.220 -5.725 7.197 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.588 -4.280 8.423 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.393 -6.015 8.575 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.095 -4.231 9.334 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.466 -4.348 10.419 1.00 0.00 H new ATOM 1530 N ALA A 99 -5.748 -4.904 5.315 1.00 0.00 N ATOM 1531 CA ALA A 99 -6.645 -5.376 4.268 1.00 0.00 C ATOM 1532 C ALA A 99 -5.878 -5.684 2.986 1.00 0.00 C ATOM 1533 O ALA A 99 -6.212 -6.622 2.262 1.00 0.00 O ATOM 1534 CB ALA A 99 -7.733 -4.347 4.000 1.00 0.00 C ATOM 0 H ALA A 99 -5.738 -3.891 5.437 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.111 -6.299 4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.395 -4.714 3.216 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.308 -4.179 4.911 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.277 -3.410 3.681 1.00 0.00 H new ATOM 1540 N MET A 100 -4.851 -4.887 2.711 1.00 0.00 N ATOM 1541 CA MET A 100 -4.037 -5.076 1.516 1.00 0.00 C ATOM 1542 C MET A 100 -3.358 -6.442 1.530 1.00 0.00 C ATOM 1543 O MET A 100 -3.594 -7.273 0.654 1.00 0.00 O ATOM 1544 CB MET A 100 -2.984 -3.971 1.410 1.00 0.00 C ATOM 1545 CG MET A 100 -1.889 -4.269 0.398 1.00 0.00 C ATOM 1546 SD MET A 100 -0.814 -2.852 0.101 1.00 0.00 S ATOM 1547 CE MET A 100 0.011 -2.715 1.685 1.00 0.00 C ATOM 0 H MET A 100 -4.563 -4.105 3.299 1.00 0.00 H new ATOM 0 HA MET A 100 -4.694 -5.026 0.648 1.00 0.00 H new ATOM 0 HB2 MET A 100 -3.475 -3.037 1.137 1.00 0.00 H new ATOM 0 HB3 MET A 100 -2.530 -3.818 2.389 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.289 -5.107 0.753 1.00 0.00 H new ATOM 0 HG3 MET A 100 -2.344 -4.579 -0.543 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.737 -1.903 1.648 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.725 -2.509 2.462 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.524 -3.650 1.910 1.00 0.00 H new ATOM 1557 N LYS A 101 -2.513 -6.667 2.530 1.00 0.00 N ATOM 1558 CA LYS A 101 -1.799 -7.932 2.660 1.00 0.00 C ATOM 1559 C LYS A 101 -2.752 -9.112 2.502 1.00 0.00 C ATOM 1560 O LYS A 101 -2.525 -10.001 1.682 1.00 0.00 O ATOM 1561 CB LYS A 101 -1.097 -8.008 4.017 1.00 0.00 C ATOM 1562 CG LYS A 101 -2.050 -7.975 5.199 1.00 0.00 C ATOM 1563 CD LYS A 101 -1.305 -7.807 6.513 1.00 0.00 C ATOM 1564 CE LYS A 101 -2.086 -8.399 7.676 1.00 0.00 C ATOM 1565 NZ LYS A 101 -1.991 -9.885 7.709 1.00 0.00 N ATOM 0 H LYS A 101 -2.305 -5.989 3.263 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.051 -7.982 1.868 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.509 -8.925 4.061 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -0.398 -7.176 4.102 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.758 -7.156 5.074 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.631 -8.897 5.225 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.330 -8.290 6.444 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.123 -6.748 6.697 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.708 -7.990 8.613 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.132 -8.104 7.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.859 -10.279 8.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.876 -10.247 6.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.172 -10.168 8.284 1.00 0.00 H new ATOM 1579 N SER A 102 -3.821 -9.114 3.293 1.00 0.00 N ATOM 1580 CA SER A 102 -4.807 -10.187 3.243 1.00 0.00 C ATOM 1581 C SER A 102 -4.977 -10.702 1.816 1.00 0.00 C ATOM 1582 O SER A 102 -4.991 -11.910 1.578 1.00 0.00 O ATOM 1583 CB SER A 102 -6.152 -9.698 3.784 1.00 0.00 C ATOM 1584 OG SER A 102 -6.916 -10.774 4.301 1.00 0.00 O ATOM 0 H SER A 102 -4.026 -8.385 3.976 1.00 0.00 H new ATOM 0 HA SER A 102 -4.449 -11.006 3.867 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.985 -8.958 4.566 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.709 -9.202 2.989 1.00 0.00 H new ATOM 0 HG SER A 102 -7.770 -10.435 4.642 1.00 0.00 H new ATOM 1590 N HIS A 103 -5.107 -9.776 0.871 1.00 0.00 N ATOM 1591 CA HIS A 103 -5.275 -10.135 -0.532 1.00 0.00 C ATOM 1592 C HIS A 103 -4.048 -10.876 -1.055 1.00 0.00 C ATOM 1593 O HIS A 103 -4.168 -11.909 -1.715 1.00 0.00 O ATOM 1594 CB HIS A 103 -5.527 -8.884 -1.374 1.00 0.00 C ATOM 1595 CG HIS A 103 -6.021 -9.181 -2.757 1.00 0.00 C ATOM 1596 ND1 HIS A 103 -5.189 -9.245 -3.855 1.00 0.00 N ATOM 1597 CD2 HIS A 103 -7.269 -9.435 -3.216 1.00 0.00 C ATOM 1598 CE1 HIS A 103 -5.905 -9.523 -4.930 1.00 0.00 C ATOM 1599 NE2 HIS A 103 -7.170 -9.643 -4.569 1.00 0.00 N ATOM 0 H HIS A 103 -5.099 -8.772 1.052 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.138 -10.797 -0.611 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.256 -8.254 -0.864 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -4.603 -8.310 -1.443 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.174 -9.468 -2.627 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.521 -9.633 -5.933 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -7.947 -9.856 -5.194 1.00 0.00 H new ATOM 1607 N CYS A 104 -2.869 -10.341 -0.757 1.00 0.00 N ATOM 1608 CA CYS A 104 -1.619 -10.950 -1.198 1.00 0.00 C ATOM 1609 C CYS A 104 -1.635 -12.456 -0.959 1.00 0.00 C ATOM 1610 O CYS A 104 -1.587 -13.246 -1.902 1.00 0.00 O ATOM 1611 CB CYS A 104 -0.434 -10.317 -0.469 1.00 0.00 C ATOM 1612 SG CYS A 104 -0.160 -8.577 -0.877 1.00 0.00 S ATOM 0 H CYS A 104 -2.752 -9.487 -0.212 1.00 0.00 H new ATOM 0 HA CYS A 104 -1.514 -10.772 -2.268 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.593 -10.406 0.606 1.00 0.00 H new ATOM 0 HB3 CYS A 104 0.468 -10.881 -0.706 1.00 0.00 H new ATOM 0 HG CYS A 104 0.862 -8.130 -0.209 1.00 0.00 H new ATOM 1618 N LEU A 105 -1.699 -12.847 0.309 1.00 0.00 N ATOM 1619 CA LEU A 105 -1.719 -14.260 0.674 1.00 0.00 C ATOM 1620 C LEU A 105 -2.813 -15.003 -0.085 1.00 0.00 C ATOM 1621 O LEU A 105 -2.555 -16.017 -0.733 1.00 0.00 O ATOM 1622 CB LEU A 105 -1.932 -14.414 2.181 1.00 0.00 C ATOM 1623 CG LEU A 105 -1.083 -13.511 3.075 1.00 0.00 C ATOM 1624 CD1 LEU A 105 -1.788 -12.186 3.320 1.00 0.00 C ATOM 1625 CD2 LEU A 105 -0.774 -14.205 4.394 1.00 0.00 C ATOM 0 H LEU A 105 -1.738 -12.206 1.102 1.00 0.00 H new ATOM 0 HA LEU A 105 -0.757 -14.694 0.403 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.983 -14.224 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.732 -15.451 2.452 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.142 -13.308 2.564 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.168 -11.557 3.959 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.957 -11.682 2.368 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.745 -12.368 3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.169 -13.548 5.018 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.706 -14.438 4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.226 -15.127 4.200 1.00 0.00 H new ATOM 1637 N LYS A 106 -4.036 -14.491 -0.002 1.00 0.00 N ATOM 1638 CA LYS A 106 -5.171 -15.103 -0.684 1.00 0.00 C ATOM 1639 C LYS A 106 -4.771 -15.595 -2.071 1.00 0.00 C ATOM 1640 O LYS A 106 -4.859 -16.786 -2.366 1.00 0.00 O ATOM 1641 CB LYS A 106 -6.323 -14.103 -0.799 1.00 0.00 C ATOM 1642 CG LYS A 106 -7.213 -14.055 0.432 1.00 0.00 C ATOM 1643 CD LYS A 106 -8.310 -13.014 0.287 1.00 0.00 C ATOM 1644 CE LYS A 106 -9.296 -13.079 1.443 1.00 0.00 C ATOM 1645 NZ LYS A 106 -10.065 -14.354 1.446 1.00 0.00 N ATOM 0 H LYS A 106 -4.267 -13.653 0.531 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.499 -15.959 -0.094 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -5.913 -13.109 -0.980 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -6.931 -14.360 -1.667 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.660 -15.035 0.597 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.609 -13.828 1.310 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.866 -12.020 0.242 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.839 -13.170 -0.653 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.758 -12.978 2.385 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -9.987 -12.238 1.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -10.897 -14.256 2.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.375 -14.574 0.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -9.461 -15.123 1.799 1.00 0.00 H new ATOM 1659 N ASN A 107 -4.329 -14.671 -2.918 1.00 0.00 N ATOM 1660 CA ASN A 107 -3.915 -15.012 -4.274 1.00 0.00 C ATOM 1661 C ASN A 107 -2.549 -15.692 -4.270 1.00 0.00 C ATOM 1662 O ASN A 107 -2.436 -16.881 -4.564 1.00 0.00 O ATOM 1663 CB ASN A 107 -3.869 -13.756 -5.146 1.00 0.00 C ATOM 1664 CG ASN A 107 -5.221 -13.077 -5.254 1.00 0.00 C ATOM 1665 OD1 ASN A 107 -5.588 -12.324 -4.224 1.00 0.00 O flip ATOM 1666 ND2 ASN A 107 -5.927 -13.229 -6.251 1.00 0.00 N flip ATOM 0 H ASN A 107 -4.248 -13.680 -2.689 1.00 0.00 H new ATOM 0 HA ASN A 107 -4.646 -15.707 -4.687 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.145 -13.055 -4.730 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -3.518 -14.022 -6.143 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -5.605 -13.817 -7.019 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -6.834 -12.767 -6.309 1.00 0.00 H new ATOM 1673 N GLY A 108 -1.514 -14.928 -3.934 1.00 0.00 N ATOM 1674 CA GLY A 108 -0.170 -15.474 -3.898 1.00 0.00 C ATOM 1675 C GLY A 108 0.887 -14.434 -4.215 1.00 0.00 C ATOM 1676 O GLY A 108 1.854 -14.716 -4.923 1.00 0.00 O ATOM 0 H GLY A 108 -1.582 -13.941 -3.686 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.022 -15.894 -2.910 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.095 -16.294 -4.613 1.00 0.00 H new ATOM 1680 N VAL A 109 0.702 -13.226 -3.691 1.00 0.00 N ATOM 1681 CA VAL A 109 1.647 -12.140 -3.922 1.00 0.00 C ATOM 1682 C VAL A 109 2.614 -11.995 -2.753 1.00 0.00 C ATOM 1683 O VAL A 109 2.341 -11.276 -1.791 1.00 0.00 O ATOM 1684 CB VAL A 109 0.919 -10.800 -4.141 1.00 0.00 C ATOM 1685 CG1 VAL A 109 1.922 -9.678 -4.365 1.00 0.00 C ATOM 1686 CG2 VAL A 109 -0.047 -10.904 -5.312 1.00 0.00 C ATOM 0 H VAL A 109 -0.094 -12.975 -3.104 1.00 0.00 H new ATOM 0 HA VAL A 109 2.206 -12.393 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 109 0.344 -10.568 -3.245 1.00 0.00 H new ATOM 0 HG11 VAL A 109 1.390 -8.739 -4.518 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.570 -9.590 -3.493 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.526 -9.900 -5.245 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.553 -9.949 -5.453 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.504 -11.159 -6.217 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.786 -11.679 -5.107 1.00 0.00 H new ATOM 1696 N THR A 110 3.749 -12.683 -2.842 1.00 0.00 N ATOM 1697 CA THR A 110 4.758 -12.632 -1.791 1.00 0.00 C ATOM 1698 C THR A 110 5.666 -11.420 -1.960 1.00 0.00 C ATOM 1699 O THR A 110 6.197 -10.889 -0.984 1.00 0.00 O ATOM 1700 CB THR A 110 5.620 -13.908 -1.778 1.00 0.00 C ATOM 1701 OG1 THR A 110 6.555 -13.857 -0.695 1.00 0.00 O ATOM 1702 CG2 THR A 110 6.368 -14.070 -3.093 1.00 0.00 C ATOM 0 H THR A 110 3.992 -13.282 -3.631 1.00 0.00 H new ATOM 0 HA THR A 110 4.225 -12.554 -0.844 1.00 0.00 H new ATOM 0 HB THR A 110 4.959 -14.765 -1.647 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.069 -13.824 0.155 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.970 -14.978 -3.060 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.653 -14.139 -3.912 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.018 -13.209 -3.250 1.00 0.00 H new ATOM 1710 N ASP A 111 5.842 -10.987 -3.204 1.00 0.00 N ATOM 1711 CA ASP A 111 6.686 -9.835 -3.500 1.00 0.00 C ATOM 1712 C ASP A 111 5.838 -8.600 -3.789 1.00 0.00 C ATOM 1713 O ASP A 111 4.907 -8.647 -4.595 1.00 0.00 O ATOM 1714 CB ASP A 111 7.594 -10.135 -4.693 1.00 0.00 C ATOM 1715 CG ASP A 111 8.687 -11.130 -4.353 1.00 0.00 C ATOM 1716 OD1 ASP A 111 9.520 -10.818 -3.476 1.00 0.00 O ATOM 1717 OD2 ASP A 111 8.710 -12.219 -4.963 1.00 0.00 O ATOM 0 H ASP A 111 5.412 -11.416 -4.023 1.00 0.00 H new ATOM 0 HA ASP A 111 7.303 -9.633 -2.625 1.00 0.00 H new ATOM 0 HB2 ASP A 111 6.993 -10.526 -5.514 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.047 -9.208 -5.043 1.00 0.00 H new ATOM 1722 N LEU A 112 6.164 -7.497 -3.126 1.00 0.00 N ATOM 1723 CA LEU A 112 5.432 -6.248 -3.310 1.00 0.00 C ATOM 1724 C LEU A 112 6.381 -5.054 -3.297 1.00 0.00 C ATOM 1725 O LEU A 112 7.460 -5.111 -2.708 1.00 0.00 O ATOM 1726 CB LEU A 112 4.376 -6.087 -2.216 1.00 0.00 C ATOM 1727 CG LEU A 112 3.173 -5.211 -2.567 1.00 0.00 C ATOM 1728 CD1 LEU A 112 2.206 -5.967 -3.465 1.00 0.00 C ATOM 1729 CD2 LEU A 112 2.470 -4.737 -1.303 1.00 0.00 C ATOM 0 H LEU A 112 6.931 -7.441 -2.456 1.00 0.00 H new ATOM 0 HA LEU A 112 4.937 -6.285 -4.281 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.011 -7.077 -1.943 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.858 -5.670 -1.332 1.00 0.00 H new ATOM 0 HG LEU A 112 3.532 -4.336 -3.109 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.356 -5.328 -3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.714 -6.255 -4.385 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.854 -6.861 -2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.617 -4.115 -1.573 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.125 -5.600 -0.733 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.165 -4.156 -0.696 1.00 0.00 H new ATOM 1741 N SER A 113 5.969 -3.971 -3.949 1.00 0.00 N ATOM 1742 CA SER A 113 6.783 -2.763 -4.014 1.00 0.00 C ATOM 1743 C SER A 113 5.912 -1.515 -3.908 1.00 0.00 C ATOM 1744 O SER A 113 4.777 -1.494 -4.384 1.00 0.00 O ATOM 1745 CB SER A 113 7.583 -2.730 -5.318 1.00 0.00 C ATOM 1746 OG SER A 113 8.777 -1.983 -5.165 1.00 0.00 O ATOM 0 H SER A 113 5.077 -3.906 -4.439 1.00 0.00 H new ATOM 0 HA SER A 113 7.475 -2.776 -3.172 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.824 -3.747 -5.626 1.00 0.00 H new ATOM 0 HB3 SER A 113 6.975 -2.292 -6.110 1.00 0.00 H new ATOM 0 HG SER A 113 8.934 -1.809 -4.213 1.00 0.00 H new ATOM 1752 N MET A 114 6.452 -0.476 -3.279 1.00 0.00 N ATOM 1753 CA MET A 114 5.725 0.777 -3.111 1.00 0.00 C ATOM 1754 C MET A 114 6.678 1.917 -2.768 1.00 0.00 C ATOM 1755 O MET A 114 7.573 1.781 -1.933 1.00 0.00 O ATOM 1756 CB MET A 114 4.667 0.635 -2.014 1.00 0.00 C ATOM 1757 CG MET A 114 5.251 0.351 -0.640 1.00 0.00 C ATOM 1758 SD MET A 114 3.982 0.096 0.615 1.00 0.00 S ATOM 1759 CE MET A 114 3.358 -1.515 0.143 1.00 0.00 C ATOM 0 H MET A 114 7.390 -0.477 -2.878 1.00 0.00 H new ATOM 0 HA MET A 114 5.232 1.010 -4.054 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.079 1.551 -1.967 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.983 -0.170 -2.282 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.885 -0.534 -0.695 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.889 1.183 -0.342 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.275 -1.467 0.029 1.00 0.00 H new ATOM 0 HE2 MET A 114 3.809 -1.817 -0.802 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.609 -2.243 0.914 1.00 0.00 H new ATOM 1769 N PRO A 115 6.486 3.069 -3.428 1.00 0.00 N ATOM 1770 CA PRO A 115 7.319 4.255 -3.209 1.00 0.00 C ATOM 1771 C PRO A 115 7.083 4.886 -1.841 1.00 0.00 C ATOM 1772 O PRO A 115 6.430 4.296 -0.980 1.00 0.00 O ATOM 1773 CB PRO A 115 6.876 5.210 -4.321 1.00 0.00 C ATOM 1774 CG PRO A 115 5.484 4.791 -4.647 1.00 0.00 C ATOM 1775 CD PRO A 115 5.439 3.303 -4.437 1.00 0.00 C ATOM 0 HA PRO A 115 8.382 4.015 -3.232 1.00 0.00 H new ATOM 0 HB2 PRO A 115 6.910 6.248 -3.989 1.00 0.00 H new ATOM 0 HB3 PRO A 115 7.527 5.133 -5.192 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.764 5.298 -4.005 1.00 0.00 H new ATOM 0 HG3 PRO A 115 5.230 5.048 -5.675 1.00 0.00 H new ATOM 0 HD2 PRO A 115 4.461 2.976 -4.084 1.00 0.00 H new ATOM 0 HD3 PRO A 115 5.642 2.761 -5.360 1.00 0.00 H new ATOM 1783 N ARG A 116 7.618 6.087 -1.647 1.00 0.00 N ATOM 1784 CA ARG A 116 7.466 6.796 -0.383 1.00 0.00 C ATOM 1785 C ARG A 116 6.035 7.296 -0.209 1.00 0.00 C ATOM 1786 O ARG A 116 5.521 8.039 -1.046 1.00 0.00 O ATOM 1787 CB ARG A 116 8.441 7.973 -0.313 1.00 0.00 C ATOM 1788 CG ARG A 116 9.795 7.609 0.275 1.00 0.00 C ATOM 1789 CD ARG A 116 10.579 8.848 0.677 1.00 0.00 C ATOM 1790 NE ARG A 116 11.315 9.418 -0.448 1.00 0.00 N ATOM 1791 CZ ARG A 116 12.059 10.515 -0.359 1.00 0.00 C ATOM 1792 NH1 ARG A 116 12.165 11.156 0.796 1.00 0.00 N ATOM 1793 NH2 ARG A 116 12.699 10.973 -1.428 1.00 0.00 N ATOM 0 H ARG A 116 8.161 6.589 -2.350 1.00 0.00 H new ATOM 0 HA ARG A 116 7.690 6.099 0.425 1.00 0.00 H new ATOM 0 HB2 ARG A 116 8.586 8.374 -1.316 1.00 0.00 H new ATOM 0 HB3 ARG A 116 7.996 8.767 0.286 1.00 0.00 H new ATOM 0 HG2 ARG A 116 9.654 6.968 1.145 1.00 0.00 H new ATOM 0 HG3 ARG A 116 10.367 7.036 -0.454 1.00 0.00 H new ATOM 0 HD2 ARG A 116 9.895 9.595 1.079 1.00 0.00 H new ATOM 0 HD3 ARG A 116 11.277 8.593 1.475 1.00 0.00 H new ATOM 0 HE ARG A 116 11.255 8.948 -1.351 1.00 0.00 H new ATOM 0 HH11 ARG A 116 11.675 10.807 1.620 1.00 0.00 H new ATOM 0 HH12 ARG A 116 12.737 11.998 0.861 1.00 0.00 H new ATOM 0 HH21 ARG A 116 12.620 10.483 -2.319 1.00 0.00 H new ATOM 0 HH22 ARG A 116 13.270 11.815 -1.359 1.00 0.00 H new ATOM 1807 N ILE A 117 5.399 6.884 0.882 1.00 0.00 N ATOM 1808 CA ILE A 117 4.028 7.291 1.166 1.00 0.00 C ATOM 1809 C ILE A 117 3.939 8.033 2.495 1.00 0.00 C ATOM 1810 O ILE A 117 4.226 7.472 3.551 1.00 0.00 O ATOM 1811 CB ILE A 117 3.077 6.080 1.202 1.00 0.00 C ATOM 1812 CG1 ILE A 117 3.675 4.960 2.057 1.00 0.00 C ATOM 1813 CG2 ILE A 117 2.797 5.584 -0.209 1.00 0.00 C ATOM 1814 CD1 ILE A 117 2.736 3.793 2.266 1.00 0.00 C ATOM 0 H ILE A 117 5.811 6.269 1.584 1.00 0.00 H new ATOM 0 HA ILE A 117 3.723 7.958 0.359 1.00 0.00 H new ATOM 0 HB ILE A 117 2.134 6.391 1.651 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.589 4.601 1.583 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.958 5.367 3.028 1.00 0.00 H new ATOM 0 HG21 ILE A 117 2.124 4.728 -0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 117 2.334 6.382 -0.790 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.733 5.287 -0.682 1.00 0.00 H new ATOM 0 HD11 ILE A 117 3.226 3.037 2.880 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.832 4.139 2.768 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.472 3.361 1.301 1.00 0.00 H new ATOM 1925 N GLN A 125 3.862 11.005 8.579 1.00 0.00 N ATOM 1926 CA GLN A 125 5.320 10.982 8.584 1.00 0.00 C ATOM 1927 C GLN A 125 5.842 9.558 8.428 1.00 0.00 C ATOM 1928 O GLN A 125 5.445 8.656 9.166 1.00 0.00 O ATOM 1929 CB GLN A 125 5.857 11.596 9.878 1.00 0.00 C ATOM 1930 CG GLN A 125 5.340 13.000 10.145 1.00 0.00 C ATOM 1931 CD GLN A 125 6.095 13.698 11.259 1.00 0.00 C ATOM 1932 OE1 GLN A 125 5.827 13.476 12.440 1.00 0.00 O ATOM 1933 NE2 GLN A 125 7.046 14.548 10.888 1.00 0.00 N ATOM 0 HA GLN A 125 5.670 11.573 7.738 1.00 0.00 H new ATOM 0 HB2 GLN A 125 5.586 10.953 10.715 1.00 0.00 H new ATOM 0 HB3 GLN A 125 6.946 11.621 9.834 1.00 0.00 H new ATOM 0 HG2 GLN A 125 5.418 13.591 9.233 1.00 0.00 H new ATOM 0 HG3 GLN A 125 4.282 12.951 10.404 1.00 0.00 H new ATOM 0 HE21 GLN A 125 7.235 14.702 9.897 1.00 0.00 H new ATOM 0 HE22 GLN A 125 7.588 15.047 11.594 1.00 0.00 H new ATOM 1942 N TRP A 126 6.735 9.362 7.464 1.00 0.00 N ATOM 1943 CA TRP A 126 7.311 8.046 7.211 1.00 0.00 C ATOM 1944 C TRP A 126 7.709 7.367 8.517 1.00 0.00 C ATOM 1945 O TRP A 126 7.557 6.155 8.666 1.00 0.00 O ATOM 1946 CB TRP A 126 8.529 8.168 6.293 1.00 0.00 C ATOM 1947 CG TRP A 126 9.093 6.844 5.876 1.00 0.00 C ATOM 1948 CD1 TRP A 126 10.353 6.376 6.120 1.00 0.00 C ATOM 1949 CD2 TRP A 126 8.417 5.817 5.141 1.00 0.00 C ATOM 1950 NE1 TRP A 126 10.501 5.121 5.580 1.00 0.00 N ATOM 1951 CE2 TRP A 126 9.328 4.755 4.976 1.00 0.00 C ATOM 1952 CE3 TRP A 126 7.131 5.691 4.609 1.00 0.00 C ATOM 1953 CZ2 TRP A 126 8.992 3.586 4.299 1.00 0.00 C ATOM 1954 CZ3 TRP A 126 6.799 4.530 3.938 1.00 0.00 C ATOM 1955 CH2 TRP A 126 7.726 3.489 3.788 1.00 0.00 C ATOM 0 H TRP A 126 7.076 10.098 6.845 1.00 0.00 H new ATOM 0 HA TRP A 126 6.555 7.433 6.720 1.00 0.00 H new ATOM 0 HB2 TRP A 126 8.249 8.732 5.403 1.00 0.00 H new ATOM 0 HB3 TRP A 126 9.304 8.740 6.803 1.00 0.00 H new ATOM 0 HD1 TRP A 126 11.120 6.913 6.658 1.00 0.00 H new ATOM 0 HE1 TRP A 126 11.348 4.554 5.622 1.00 0.00 H new ATOM 0 HE3 TRP A 126 6.410 6.487 4.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 9.705 2.784 4.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.808 4.422 3.522 1.00 0.00 H new ATOM 0 HH2 TRP A 126 7.436 2.593 3.259 1.00 0.00 H new ATOM 1966 N GLU A 127 8.218 8.155 9.458 1.00 0.00 N ATOM 1967 CA GLU A 127 8.638 7.627 10.751 1.00 0.00 C ATOM 1968 C GLU A 127 7.566 6.715 11.340 1.00 0.00 C ATOM 1969 O GLU A 127 7.861 5.621 11.818 1.00 0.00 O ATOM 1970 CB GLU A 127 8.940 8.771 11.720 1.00 0.00 C ATOM 1971 CG GLU A 127 9.878 8.380 12.850 1.00 0.00 C ATOM 1972 CD GLU A 127 11.339 8.530 12.474 1.00 0.00 C ATOM 1973 OE1 GLU A 127 11.841 7.694 11.695 1.00 0.00 O ATOM 1974 OE2 GLU A 127 11.981 9.485 12.960 1.00 0.00 O ATOM 0 H GLU A 127 8.350 9.161 9.350 1.00 0.00 H new ATOM 0 HA GLU A 127 9.545 7.041 10.599 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.379 9.600 11.165 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.004 9.133 12.145 1.00 0.00 H new ATOM 0 HG2 GLU A 127 9.666 8.997 13.723 1.00 0.00 H new ATOM 0 HG3 GLU A 127 9.685 7.346 13.136 1.00 0.00 H new ATOM 1981 N ASN A 128 6.320 7.177 11.303 1.00 0.00 N ATOM 1982 CA ASN A 128 5.203 6.405 11.835 1.00 0.00 C ATOM 1983 C ASN A 128 4.750 5.345 10.835 1.00 0.00 C ATOM 1984 O ASN A 128 4.682 4.159 11.159 1.00 0.00 O ATOM 1985 CB ASN A 128 4.034 7.330 12.179 1.00 0.00 C ATOM 1986 CG ASN A 128 4.357 8.267 13.326 1.00 0.00 C ATOM 1987 OD1 ASN A 128 5.239 9.227 13.075 1.00 0.00 O flip ATOM 1988 ND2 ASN A 128 3.819 8.130 14.425 1.00 0.00 N flip ATOM 0 H ASN A 128 6.059 8.081 10.910 1.00 0.00 H new ATOM 0 HA ASN A 128 5.540 5.904 12.742 1.00 0.00 H new ATOM 0 HB2 ASN A 128 3.766 7.916 11.299 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.163 6.729 12.439 1.00 0.00 H new ATOM 0 HD21 ASN A 128 3.146 7.378 14.573 1.00 0.00 H new ATOM 0 HD22 ASN A 128 4.046 8.769 15.187 1.00 0.00 H new ATOM 1995 N VAL A 129 4.441 5.780 9.618 1.00 0.00 N ATOM 1996 CA VAL A 129 3.996 4.870 8.570 1.00 0.00 C ATOM 1997 C VAL A 129 4.874 3.624 8.515 1.00 0.00 C ATOM 1998 O VAL A 129 4.415 2.516 8.795 1.00 0.00 O ATOM 1999 CB VAL A 129 4.008 5.553 7.190 1.00 0.00 C ATOM 2000 CG1 VAL A 129 3.615 4.566 6.101 1.00 0.00 C ATOM 2001 CG2 VAL A 129 3.083 6.761 7.186 1.00 0.00 C ATOM 0 H VAL A 129 4.491 6.758 9.333 1.00 0.00 H new ATOM 0 HA VAL A 129 2.974 4.581 8.815 1.00 0.00 H new ATOM 0 HB VAL A 129 5.021 5.899 6.984 1.00 0.00 H new ATOM 0 HG11 VAL A 129 3.629 5.067 5.133 1.00 0.00 H new ATOM 0 HG12 VAL A 129 4.321 3.736 6.090 1.00 0.00 H new ATOM 0 HG13 VAL A 129 2.612 4.187 6.298 1.00 0.00 H new ATOM 0 HG21 VAL A 129 3.104 7.232 6.203 1.00 0.00 H new ATOM 0 HG22 VAL A 129 2.066 6.441 7.414 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.416 7.476 7.938 1.00 0.00 H new ATOM 2011 N SER A 130 6.139 3.813 8.154 1.00 0.00 N ATOM 2012 CA SER A 130 7.081 2.704 8.059 1.00 0.00 C ATOM 2013 C SER A 130 6.804 1.663 9.139 1.00 0.00 C ATOM 2014 O SER A 130 6.811 0.461 8.874 1.00 0.00 O ATOM 2015 CB SER A 130 8.517 3.216 8.184 1.00 0.00 C ATOM 2016 OG SER A 130 8.664 4.051 9.319 1.00 0.00 O ATOM 0 H SER A 130 6.535 4.724 7.922 1.00 0.00 H new ATOM 0 HA SER A 130 6.954 2.233 7.084 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.202 2.372 8.259 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.789 3.768 7.285 1.00 0.00 H new ATOM 0 HG SER A 130 8.563 4.988 9.051 1.00 0.00 H new ATOM 2022 N ALA A 131 6.559 2.133 10.357 1.00 0.00 N ATOM 2023 CA ALA A 131 6.278 1.244 11.477 1.00 0.00 C ATOM 2024 C ALA A 131 5.008 0.437 11.232 1.00 0.00 C ATOM 2025 O ALA A 131 4.998 -0.784 11.383 1.00 0.00 O ATOM 2026 CB ALA A 131 6.158 2.042 12.767 1.00 0.00 C ATOM 0 H ALA A 131 6.549 3.125 10.594 1.00 0.00 H new ATOM 0 HA ALA A 131 7.109 0.545 11.571 1.00 0.00 H new ATOM 0 HB1 ALA A 131 5.948 1.365 13.595 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.093 2.569 12.957 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.347 2.764 12.674 1.00 0.00 H new ATOM 2032 N MET A 132 3.937 1.127 10.853 1.00 0.00 N ATOM 2033 CA MET A 132 2.662 0.473 10.586 1.00 0.00 C ATOM 2034 C MET A 132 2.851 -0.737 9.678 1.00 0.00 C ATOM 2035 O MET A 132 2.135 -1.732 9.797 1.00 0.00 O ATOM 2036 CB MET A 132 1.683 1.459 9.944 1.00 0.00 C ATOM 2037 CG MET A 132 0.852 2.235 10.953 1.00 0.00 C ATOM 2038 SD MET A 132 1.739 3.645 11.645 1.00 0.00 S ATOM 2039 CE MET A 132 0.385 4.775 11.958 1.00 0.00 C ATOM 0 H MET A 132 3.927 2.139 10.724 1.00 0.00 H new ATOM 0 HA MET A 132 2.252 0.131 11.536 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.242 2.163 9.327 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.014 0.913 9.278 1.00 0.00 H new ATOM 0 HG2 MET A 132 -0.062 2.585 10.473 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.552 1.568 11.761 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.701 5.532 12.675 1.00 0.00 H new ATOM 0 HE2 MET A 132 0.092 5.258 11.026 1.00 0.00 H new ATOM 0 HE3 MET A 132 -0.463 4.223 12.363 1.00 0.00 H new ATOM 2049 N ILE A 133 3.818 -0.646 8.772 1.00 0.00 N ATOM 2050 CA ILE A 133 4.101 -1.735 7.845 1.00 0.00 C ATOM 2051 C ILE A 133 4.847 -2.869 8.540 1.00 0.00 C ATOM 2052 O ILE A 133 4.698 -4.036 8.178 1.00 0.00 O ATOM 2053 CB ILE A 133 4.933 -1.249 6.643 1.00 0.00 C ATOM 2054 CG1 ILE A 133 4.215 -0.102 5.929 1.00 0.00 C ATOM 2055 CG2 ILE A 133 5.194 -2.398 5.680 1.00 0.00 C ATOM 2056 CD1 ILE A 133 5.083 0.619 4.922 1.00 0.00 C ATOM 0 H ILE A 133 4.419 0.170 8.660 1.00 0.00 H new ATOM 0 HA ILE A 133 3.139 -2.102 7.486 1.00 0.00 H new ATOM 0 HB ILE A 133 5.892 -0.882 7.008 1.00 0.00 H new ATOM 0 HG12 ILE A 133 3.334 -0.495 5.422 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.863 0.614 6.672 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.783 -2.039 4.836 1.00 0.00 H new ATOM 0 HG22 ILE A 133 5.742 -3.187 6.195 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.244 -2.792 5.318 1.00 0.00 H new ATOM 0 HD11 ILE A 133 4.510 1.419 4.454 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.951 1.042 5.427 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.414 -0.084 4.158 1.00 0.00 H new ATOM 2068 N GLU A 134 5.648 -2.517 9.541 1.00 0.00 N ATOM 2069 CA GLU A 134 6.416 -3.507 10.287 1.00 0.00 C ATOM 2070 C GLU A 134 5.517 -4.285 11.243 1.00 0.00 C ATOM 2071 O GLU A 134 5.562 -5.514 11.292 1.00 0.00 O ATOM 2072 CB GLU A 134 7.542 -2.827 11.069 1.00 0.00 C ATOM 2073 CG GLU A 134 8.396 -1.899 10.222 1.00 0.00 C ATOM 2074 CD GLU A 134 9.815 -1.773 10.744 1.00 0.00 C ATOM 2075 OE1 GLU A 134 10.567 -2.767 10.662 1.00 0.00 O ATOM 2076 OE2 GLU A 134 10.172 -0.681 11.234 1.00 0.00 O ATOM 0 H GLU A 134 5.782 -1.555 9.854 1.00 0.00 H new ATOM 0 HA GLU A 134 6.850 -4.207 9.573 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.109 -2.259 11.892 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.180 -3.592 11.511 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.421 -2.269 9.197 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.934 -0.912 10.193 1.00 0.00 H new ATOM 2083 N GLU A 135 4.701 -3.560 12.003 1.00 0.00 N ATOM 2084 CA GLU A 135 3.793 -4.183 12.958 1.00 0.00 C ATOM 2085 C GLU A 135 2.700 -4.968 12.238 1.00 0.00 C ATOM 2086 O GLU A 135 2.242 -6.003 12.722 1.00 0.00 O ATOM 2087 CB GLU A 135 3.162 -3.121 13.862 1.00 0.00 C ATOM 2088 CG GLU A 135 2.248 -2.158 13.123 1.00 0.00 C ATOM 2089 CD GLU A 135 1.807 -0.993 13.988 1.00 0.00 C ATOM 2090 OE1 GLU A 135 2.589 -0.030 14.130 1.00 0.00 O ATOM 2091 OE2 GLU A 135 0.680 -1.045 14.523 1.00 0.00 O ATOM 0 H GLU A 135 4.651 -2.542 11.975 1.00 0.00 H new ATOM 0 HA GLU A 135 4.370 -4.876 13.570 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.594 -3.617 14.649 1.00 0.00 H new ATOM 0 HB3 GLU A 135 3.955 -2.554 14.350 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.764 -1.777 12.242 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.369 -2.696 12.769 1.00 0.00 H new ATOM 2098 N VAL A 136 2.286 -4.467 11.079 1.00 0.00 N ATOM 2099 CA VAL A 136 1.248 -5.121 10.291 1.00 0.00 C ATOM 2100 C VAL A 136 1.781 -6.381 9.618 1.00 0.00 C ATOM 2101 O VAL A 136 1.104 -7.409 9.576 1.00 0.00 O ATOM 2102 CB VAL A 136 0.683 -4.176 9.213 1.00 0.00 C ATOM 2103 CG1 VAL A 136 -0.078 -4.965 8.158 1.00 0.00 C ATOM 2104 CG2 VAL A 136 -0.209 -3.119 9.847 1.00 0.00 C ATOM 0 H VAL A 136 2.653 -3.610 10.665 1.00 0.00 H new ATOM 0 HA VAL A 136 0.449 -5.392 10.981 1.00 0.00 H new ATOM 0 HB VAL A 136 1.516 -3.670 8.724 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.470 -4.281 7.405 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.594 -5.681 7.684 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.904 -5.499 8.628 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.600 -2.460 9.072 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.038 -3.604 10.363 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.371 -2.535 10.562 1.00 0.00 H new ATOM 2114 N PHE A 137 2.998 -6.295 9.091 1.00 0.00 N ATOM 2115 CA PHE A 137 3.622 -7.428 8.419 1.00 0.00 C ATOM 2116 C PHE A 137 4.525 -8.199 9.377 1.00 0.00 C ATOM 2117 O PHE A 137 5.114 -9.215 9.009 1.00 0.00 O ATOM 2118 CB PHE A 137 4.431 -6.950 7.211 1.00 0.00 C ATOM 2119 CG PHE A 137 3.579 -6.530 6.047 1.00 0.00 C ATOM 2120 CD1 PHE A 137 2.880 -5.335 6.079 1.00 0.00 C ATOM 2121 CD2 PHE A 137 3.478 -7.332 4.921 1.00 0.00 C ATOM 2122 CE1 PHE A 137 2.095 -4.947 5.010 1.00 0.00 C ATOM 2123 CE2 PHE A 137 2.695 -6.949 3.849 1.00 0.00 C ATOM 2124 CZ PHE A 137 2.003 -5.754 3.893 1.00 0.00 C ATOM 0 H PHE A 137 3.572 -5.452 9.117 1.00 0.00 H new ATOM 0 HA PHE A 137 2.831 -8.095 8.077 1.00 0.00 H new ATOM 0 HB2 PHE A 137 5.059 -6.111 7.513 1.00 0.00 H new ATOM 0 HB3 PHE A 137 5.099 -7.750 6.892 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.949 -4.699 6.949 1.00 0.00 H new ATOM 0 HD2 PHE A 137 4.017 -8.267 4.881 1.00 0.00 H new ATOM 0 HE1 PHE A 137 1.554 -4.013 5.048 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.624 -7.583 2.978 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.391 -5.452 3.056 1.00 0.00 H new ATOM 2134 N GLU A 138 4.629 -7.707 10.608 1.00 0.00 N ATOM 2135 CA GLU A 138 5.461 -8.349 11.618 1.00 0.00 C ATOM 2136 C GLU A 138 5.300 -9.865 11.573 1.00 0.00 C ATOM 2137 O GLU A 138 6.255 -10.609 11.799 1.00 0.00 O ATOM 2138 CB GLU A 138 5.103 -7.828 13.012 1.00 0.00 C ATOM 2139 CG GLU A 138 3.968 -8.591 13.673 1.00 0.00 C ATOM 2140 CD GLU A 138 3.656 -8.081 15.067 1.00 0.00 C ATOM 2141 OE1 GLU A 138 3.633 -6.846 15.254 1.00 0.00 O ATOM 2142 OE2 GLU A 138 3.434 -8.915 15.969 1.00 0.00 O ATOM 0 H GLU A 138 4.148 -6.867 10.929 1.00 0.00 H new ATOM 0 HA GLU A 138 6.501 -8.105 11.403 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.986 -7.883 13.649 1.00 0.00 H new ATOM 0 HB3 GLU A 138 4.828 -6.776 12.938 1.00 0.00 H new ATOM 0 HG2 GLU A 138 3.074 -8.514 13.054 1.00 0.00 H new ATOM 0 HG3 GLU A 138 4.229 -9.648 13.727 1.00 0.00 H new ATOM 2149 N ALA A 139 4.085 -10.317 11.280 1.00 0.00 N ATOM 2150 CA ALA A 139 3.798 -11.744 11.204 1.00 0.00 C ATOM 2151 C ALA A 139 3.215 -12.115 9.844 1.00 0.00 C ATOM 2152 O ALA A 139 2.061 -12.532 9.745 1.00 0.00 O ATOM 2153 CB ALA A 139 2.845 -12.151 12.318 1.00 0.00 C ATOM 0 H ALA A 139 3.283 -9.715 11.091 1.00 0.00 H new ATOM 0 HA ALA A 139 4.736 -12.285 11.328 1.00 0.00 H new ATOM 0 HB1 ALA A 139 2.640 -13.219 12.249 1.00 0.00 H new ATOM 0 HB2 ALA A 139 3.299 -11.931 13.284 1.00 0.00 H new ATOM 0 HB3 ALA A 139 1.913 -11.595 12.220 1.00 0.00 H new ATOM 2159 N THR A 140 4.020 -11.959 8.798 1.00 0.00 N ATOM 2160 CA THR A 140 3.583 -12.276 7.444 1.00 0.00 C ATOM 2161 C THR A 140 4.740 -12.803 6.602 1.00 0.00 C ATOM 2162 O THR A 140 5.905 -12.657 6.971 1.00 0.00 O ATOM 2163 CB THR A 140 2.976 -11.043 6.747 1.00 0.00 C ATOM 2164 OG1 THR A 140 3.890 -9.943 6.814 1.00 0.00 O ATOM 2165 CG2 THR A 140 1.655 -10.653 7.392 1.00 0.00 C ATOM 0 H THR A 140 4.978 -11.615 8.862 1.00 0.00 H new ATOM 0 HA THR A 140 2.819 -13.049 7.531 1.00 0.00 H new ATOM 0 HB THR A 140 2.791 -11.297 5.703 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.500 -10.070 7.571 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.245 -9.780 6.883 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.952 -11.482 7.312 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.819 -10.416 8.443 1.00 0.00 H new ATOM 2173 N ASP A 141 4.410 -13.416 5.470 1.00 0.00 N ATOM 2174 CA ASP A 141 5.422 -13.964 4.575 1.00 0.00 C ATOM 2175 C ASP A 141 5.507 -13.149 3.288 1.00 0.00 C ATOM 2176 O ASP A 141 5.721 -13.699 2.207 1.00 0.00 O ATOM 2177 CB ASP A 141 5.108 -15.425 4.249 1.00 0.00 C ATOM 2178 CG ASP A 141 3.619 -15.686 4.136 1.00 0.00 C ATOM 2179 OD1 ASP A 141 2.955 -15.796 5.187 1.00 0.00 O ATOM 2180 OD2 ASP A 141 3.118 -15.780 2.996 1.00 0.00 O ATOM 0 H ASP A 141 3.450 -13.546 5.151 1.00 0.00 H new ATOM 0 HA ASP A 141 6.386 -13.912 5.081 1.00 0.00 H new ATOM 0 HB2 ASP A 141 5.594 -15.698 3.312 1.00 0.00 H new ATOM 0 HB3 ASP A 141 5.528 -16.066 5.024 1.00 0.00 H new ATOM 2185 N ILE A 142 5.337 -11.837 3.411 1.00 0.00 N ATOM 2186 CA ILE A 142 5.394 -10.948 2.258 1.00 0.00 C ATOM 2187 C ILE A 142 6.505 -9.915 2.415 1.00 0.00 C ATOM 2188 O ILE A 142 6.687 -9.341 3.489 1.00 0.00 O ATOM 2189 CB ILE A 142 4.055 -10.217 2.043 1.00 0.00 C ATOM 2190 CG1 ILE A 142 2.902 -11.222 2.000 1.00 0.00 C ATOM 2191 CG2 ILE A 142 4.099 -9.397 0.763 1.00 0.00 C ATOM 2192 CD1 ILE A 142 1.581 -10.645 2.459 1.00 0.00 C ATOM 0 H ILE A 142 5.159 -11.366 4.298 1.00 0.00 H new ATOM 0 HA ILE A 142 5.601 -11.572 1.389 1.00 0.00 H new ATOM 0 HB ILE A 142 3.889 -9.538 2.880 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.793 -11.594 0.981 1.00 0.00 H new ATOM 0 HG13 ILE A 142 3.153 -12.078 2.627 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.146 -8.887 0.625 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.899 -8.660 0.830 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.284 -10.056 -0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.809 -11.413 2.402 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.673 -10.299 3.488 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.307 -9.807 1.818 1.00 0.00 H new ATOM 2204 N LYS A 143 7.245 -9.682 1.336 1.00 0.00 N ATOM 2205 CA LYS A 143 8.337 -8.715 1.351 1.00 0.00 C ATOM 2206 C LYS A 143 7.962 -7.459 0.572 1.00 0.00 C ATOM 2207 O LYS A 143 7.274 -7.531 -0.446 1.00 0.00 O ATOM 2208 CB LYS A 143 9.603 -9.337 0.759 1.00 0.00 C ATOM 2209 CG LYS A 143 10.160 -10.485 1.583 1.00 0.00 C ATOM 2210 CD LYS A 143 11.590 -10.813 1.187 1.00 0.00 C ATOM 2211 CE LYS A 143 12.309 -11.582 2.285 1.00 0.00 C ATOM 2212 NZ LYS A 143 12.710 -10.696 3.412 1.00 0.00 N ATOM 0 H LYS A 143 7.108 -10.150 0.440 1.00 0.00 H new ATOM 0 HA LYS A 143 8.527 -8.435 2.387 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.385 -9.695 -0.247 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.367 -8.565 0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 143 10.125 -10.225 2.641 1.00 0.00 H new ATOM 0 HG3 LYS A 143 9.533 -11.367 1.450 1.00 0.00 H new ATOM 0 HD2 LYS A 143 11.589 -11.402 0.270 1.00 0.00 H new ATOM 0 HD3 LYS A 143 12.130 -9.891 0.973 1.00 0.00 H new ATOM 0 HE2 LYS A 143 11.660 -12.374 2.659 1.00 0.00 H new ATOM 0 HE3 LYS A 143 13.194 -12.065 1.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 13.312 -11.226 4.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 13.238 -9.880 3.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 11.860 -10.362 3.910 1.00 0.00 H new ATOM 2226 N ILE A 144 8.420 -6.309 1.056 1.00 0.00 N ATOM 2227 CA ILE A 144 8.134 -5.038 0.403 1.00 0.00 C ATOM 2228 C ILE A 144 9.420 -4.285 0.080 1.00 0.00 C ATOM 2229 O ILE A 144 10.392 -4.339 0.835 1.00 0.00 O ATOM 2230 CB ILE A 144 7.236 -4.144 1.279 1.00 0.00 C ATOM 2231 CG1 ILE A 144 5.890 -4.827 1.529 1.00 0.00 C ATOM 2232 CG2 ILE A 144 7.034 -2.788 0.619 1.00 0.00 C ATOM 2233 CD1 ILE A 144 5.229 -4.403 2.823 1.00 0.00 C ATOM 0 H ILE A 144 8.991 -6.232 1.898 1.00 0.00 H new ATOM 0 HA ILE A 144 7.608 -5.270 -0.523 1.00 0.00 H new ATOM 0 HB ILE A 144 7.728 -3.989 2.239 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.220 -4.606 0.698 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.036 -5.907 1.542 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.397 -2.168 1.250 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.000 -2.300 0.487 1.00 0.00 H new ATOM 0 HG23 ILE A 144 6.560 -2.924 -0.353 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.279 -4.926 2.935 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.880 -4.649 3.662 1.00 0.00 H new ATOM 0 HD13 ILE A 144 5.051 -3.328 2.805 1.00 0.00 H new ATOM 2245 N THR A 145 9.420 -3.581 -1.048 1.00 0.00 N ATOM 2246 CA THR A 145 10.586 -2.816 -1.472 1.00 0.00 C ATOM 2247 C THR A 145 10.204 -1.382 -1.823 1.00 0.00 C ATOM 2248 O THR A 145 9.325 -1.148 -2.653 1.00 0.00 O ATOM 2249 CB THR A 145 11.272 -3.465 -2.688 1.00 0.00 C ATOM 2250 OG1 THR A 145 11.448 -4.868 -2.460 1.00 0.00 O ATOM 2251 CG2 THR A 145 12.621 -2.817 -2.958 1.00 0.00 C ATOM 0 H THR A 145 8.625 -3.525 -1.684 1.00 0.00 H new ATOM 0 HA THR A 145 11.282 -2.809 -0.633 1.00 0.00 H new ATOM 0 HB THR A 145 10.634 -3.316 -3.559 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.883 -5.274 -3.239 1.00 0.00 H new ATOM 0 HG21 THR A 145 13.087 -3.292 -3.821 1.00 0.00 H new ATOM 0 HG22 THR A 145 12.481 -1.755 -3.160 1.00 0.00 H new ATOM 0 HG23 THR A 145 13.264 -2.939 -2.086 1.00 0.00 H new ATOM 2259 N VAL A 146 10.872 -0.424 -1.188 1.00 0.00 N ATOM 2260 CA VAL A 146 10.604 0.987 -1.435 1.00 0.00 C ATOM 2261 C VAL A 146 11.680 1.604 -2.323 1.00 0.00 C ATOM 2262 O VAL A 146 12.800 1.852 -1.876 1.00 0.00 O ATOM 2263 CB VAL A 146 10.523 1.782 -0.118 1.00 0.00 C ATOM 2264 CG1 VAL A 146 10.375 3.270 -0.401 1.00 0.00 C ATOM 2265 CG2 VAL A 146 9.373 1.277 0.739 1.00 0.00 C ATOM 0 H VAL A 146 11.603 -0.600 -0.499 1.00 0.00 H new ATOM 0 HA VAL A 146 9.642 1.042 -1.944 1.00 0.00 H new ATOM 0 HB VAL A 146 11.450 1.632 0.435 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.319 3.816 0.541 1.00 0.00 H new ATOM 0 HG12 VAL A 146 11.235 3.619 -0.972 1.00 0.00 H new ATOM 0 HG13 VAL A 146 9.464 3.442 -0.975 1.00 0.00 H new ATOM 0 HG21 VAL A 146 9.331 1.850 1.665 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.435 1.395 0.196 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.527 0.223 0.971 1.00 0.00 H new ATOM 2275 N TYR A 147 11.332 1.848 -3.581 1.00 0.00 N ATOM 2276 CA TYR A 147 12.269 2.434 -4.533 1.00 0.00 C ATOM 2277 C TYR A 147 12.292 3.954 -4.409 1.00 0.00 C ATOM 2278 O TYR A 147 11.308 4.630 -4.712 1.00 0.00 O ATOM 2279 CB TYR A 147 11.894 2.033 -5.961 1.00 0.00 C ATOM 2280 CG TYR A 147 12.211 0.591 -6.288 1.00 0.00 C ATOM 2281 CD1 TYR A 147 11.475 -0.446 -5.728 1.00 0.00 C ATOM 2282 CD2 TYR A 147 13.244 0.267 -7.158 1.00 0.00 C ATOM 2283 CE1 TYR A 147 11.761 -1.765 -6.024 1.00 0.00 C ATOM 2284 CE2 TYR A 147 13.537 -1.049 -7.460 1.00 0.00 C ATOM 2285 CZ TYR A 147 12.793 -2.061 -6.890 1.00 0.00 C ATOM 2286 OH TYR A 147 13.080 -3.374 -7.188 1.00 0.00 O ATOM 0 H TYR A 147 10.408 1.649 -3.966 1.00 0.00 H new ATOM 0 HA TYR A 147 13.265 2.054 -4.305 1.00 0.00 H new ATOM 0 HB2 TYR A 147 10.828 2.205 -6.110 1.00 0.00 H new ATOM 0 HB3 TYR A 147 12.422 2.680 -6.662 1.00 0.00 H new ATOM 0 HD1 TYR A 147 10.666 -0.217 -5.050 1.00 0.00 H new ATOM 0 HD2 TYR A 147 13.828 1.057 -7.606 1.00 0.00 H new ATOM 0 HE1 TYR A 147 11.180 -2.560 -5.580 1.00 0.00 H new ATOM 0 HE2 TYR A 147 14.344 -1.284 -8.138 1.00 0.00 H new ATOM 0 HH TYR A 147 13.834 -3.410 -7.814 1.00 0.00 H new ATOM 2296 N THR A 148 13.424 4.488 -3.960 1.00 0.00 N ATOM 2297 CA THR A 148 13.578 5.927 -3.795 1.00 0.00 C ATOM 2298 C THR A 148 14.706 6.464 -4.668 1.00 0.00 C ATOM 2299 O THR A 148 15.883 6.339 -4.326 1.00 0.00 O ATOM 2300 CB THR A 148 13.861 6.297 -2.326 1.00 0.00 C ATOM 2301 OG1 THR A 148 14.957 5.522 -1.828 1.00 0.00 O ATOM 2302 CG2 THR A 148 12.631 6.060 -1.462 1.00 0.00 C ATOM 0 H THR A 148 14.248 3.944 -3.704 1.00 0.00 H new ATOM 0 HA THR A 148 12.637 6.382 -4.102 1.00 0.00 H new ATOM 0 HB THR A 148 14.117 7.356 -2.284 1.00 0.00 H new ATOM 0 HG1 THR A 148 15.702 5.563 -2.463 1.00 0.00 H new ATOM 0 HG21 THR A 148 12.855 6.328 -0.429 1.00 0.00 H new ATOM 0 HG22 THR A 148 11.807 6.674 -1.826 1.00 0.00 H new ATOM 0 HG23 THR A 148 12.349 5.008 -1.511 1.00 0.00 H new ATOM 2310 N LEU A 149 14.341 7.061 -5.797 1.00 0.00 N ATOM 2311 CA LEU A 149 15.324 7.618 -6.720 1.00 0.00 C ATOM 2312 C LEU A 149 15.245 9.142 -6.745 1.00 0.00 C ATOM 2313 O LEU A 149 16.062 9.805 -7.384 1.00 0.00 O ATOM 2314 CB LEU A 149 15.103 7.062 -8.128 1.00 0.00 C ATOM 2315 CG LEU A 149 13.962 7.693 -8.927 1.00 0.00 C ATOM 2316 CD1 LEU A 149 14.221 7.563 -10.420 1.00 0.00 C ATOM 2317 CD2 LEU A 149 12.633 7.051 -8.557 1.00 0.00 C ATOM 0 H LEU A 149 13.372 7.172 -6.095 1.00 0.00 H new ATOM 0 HA LEU A 149 16.316 7.329 -6.373 1.00 0.00 H new ATOM 0 HB2 LEU A 149 16.027 7.183 -8.694 1.00 0.00 H new ATOM 0 HB3 LEU A 149 14.916 5.991 -8.049 1.00 0.00 H new ATOM 0 HG LEU A 149 13.912 8.753 -8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 149 13.399 8.017 -10.973 1.00 0.00 H new ATOM 0 HD12 LEU A 149 15.152 8.070 -10.673 1.00 0.00 H new ATOM 0 HD13 LEU A 149 14.298 6.509 -10.686 1.00 0.00 H new ATOM 0 HD21 LEU A 149 11.833 7.512 -9.135 1.00 0.00 H new ATOM 0 HD22 LEU A 149 12.671 5.984 -8.777 1.00 0.00 H new ATOM 0 HD23 LEU A 149 12.442 7.196 -7.494 1.00 0.00 H new