USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1008 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 141 ASN : amide:sc= 0.364 X(o=0.36,f=0) USER MOD Set 1.2: A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 90 SER OG : rot 180:sc= 0.373 USER MOD Set 2.2: A 91 GLN : amide:sc= 0.369 X(o=0.74,f=0.66) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.0755 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN :FLIP amide:sc= -0.388 F(o=-1.2,f=-0.39) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -39:sc= 0.47 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN :FLIP amide:sc= -0.0073 F(o=-1.3,f=-0.0073) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 30:sc= 0.0472 USER MOD Single : A 57 THR OG1 : rot 180:sc=-0.00217 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 69 SER OG : rot -179:sc= 1.33 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 HIS :FLIP no HD1:sc= 0 F(o=-1,f=0) USER MOD Single : A 75 HIS : no HE2:sc= -0.282 K(o=-0.28,f=-4.8!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0144) USER MOD Single : A 86 LYS NZ :NH3+ -169:sc= 1.32 (180deg=1.11) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 176:sc= 0.0245 (180deg=0.0215) USER MOD Single : A 93 CYS SG : rot 180:sc= -0.475 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ -164:sc= 1.44 (180deg=1.25) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ -179:sc= 0.839 (180deg=0.837) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 120 N VAL A 8 5.611 -9.461 -16.379 1.00 0.00 N ATOM 121 CA VAL A 8 7.027 -9.851 -16.550 1.00 0.00 C ATOM 122 C VAL A 8 7.689 -9.184 -17.764 1.00 0.00 C ATOM 123 O VAL A 8 8.863 -8.822 -17.683 1.00 0.00 O ATOM 124 CB VAL A 8 7.124 -11.391 -16.599 1.00 0.00 C ATOM 125 CG1 VAL A 8 8.437 -11.939 -17.157 1.00 0.00 C ATOM 126 CG2 VAL A 8 6.956 -11.963 -15.184 1.00 0.00 C ATOM 0 HA VAL A 8 7.591 -9.487 -15.691 1.00 0.00 H new ATOM 0 HB VAL A 8 6.330 -11.699 -17.279 1.00 0.00 H new ATOM 0 HG11 VAL A 8 8.408 -13.029 -17.151 1.00 0.00 H new ATOM 0 HG12 VAL A 8 8.574 -11.586 -18.179 1.00 0.00 H new ATOM 0 HG13 VAL A 8 9.267 -11.594 -16.540 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.025 -13.050 -15.221 1.00 0.00 H new ATOM 0 HG22 VAL A 8 7.741 -11.571 -14.538 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.982 -11.674 -14.788 1.00 0.00 H new ATOM 136 N CYS A 9 6.957 -8.964 -18.857 1.00 0.00 N ATOM 137 CA CYS A 9 7.512 -8.321 -20.050 1.00 0.00 C ATOM 138 C CYS A 9 7.679 -6.807 -19.897 1.00 0.00 C ATOM 139 O CYS A 9 8.756 -6.302 -20.194 1.00 0.00 O ATOM 140 CB CYS A 9 6.661 -8.647 -21.273 1.00 0.00 C ATOM 141 SG CYS A 9 6.737 -10.391 -21.750 1.00 0.00 S ATOM 0 H CYS A 9 5.974 -9.223 -18.941 1.00 0.00 H new ATOM 0 HA CYS A 9 8.514 -8.728 -20.186 1.00 0.00 H new ATOM 0 HB2 CYS A 9 5.625 -8.378 -21.069 1.00 0.00 H new ATOM 0 HB3 CYS A 9 6.991 -8.033 -22.111 1.00 0.00 H new ATOM 146 N ILE A 10 6.690 -6.060 -19.389 1.00 0.00 N ATOM 147 CA ILE A 10 6.887 -4.617 -19.106 1.00 0.00 C ATOM 148 C ILE A 10 7.949 -4.393 -18.013 1.00 0.00 C ATOM 149 O ILE A 10 8.709 -3.424 -18.071 1.00 0.00 O ATOM 150 CB ILE A 10 5.549 -3.897 -18.810 1.00 0.00 C ATOM 151 CG1 ILE A 10 5.695 -2.384 -18.527 1.00 0.00 C ATOM 152 CG2 ILE A 10 4.771 -4.531 -17.651 1.00 0.00 C ATOM 153 CD1 ILE A 10 6.373 -1.575 -19.638 1.00 0.00 C ATOM 0 H ILE A 10 5.760 -6.414 -19.166 1.00 0.00 H new ATOM 0 HA ILE A 10 7.280 -4.155 -20.012 1.00 0.00 H new ATOM 0 HB ILE A 10 4.989 -4.021 -19.737 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.704 -1.967 -18.349 1.00 0.00 H new ATOM 0 HG13 ILE A 10 6.265 -2.256 -17.607 1.00 0.00 H new ATOM 0 HG21 ILE A 10 3.843 -3.982 -17.492 1.00 0.00 H new ATOM 0 HG22 ILE A 10 4.542 -5.569 -17.891 1.00 0.00 H new ATOM 0 HG23 ILE A 10 5.374 -4.493 -16.744 1.00 0.00 H new ATOM 0 HD11 ILE A 10 6.427 -0.527 -19.344 1.00 0.00 H new ATOM 0 HD12 ILE A 10 7.380 -1.958 -19.804 1.00 0.00 H new ATOM 0 HD13 ILE A 10 5.795 -1.664 -20.558 1.00 0.00 H new ATOM 165 N SER A 11 8.087 -5.341 -17.077 1.00 0.00 N ATOM 166 CA SER A 11 9.177 -5.378 -16.084 1.00 0.00 C ATOM 167 C SER A 11 10.576 -5.645 -16.685 1.00 0.00 C ATOM 168 O SER A 11 11.565 -5.577 -15.954 1.00 0.00 O ATOM 169 CB SER A 11 8.891 -6.432 -15.006 1.00 0.00 C ATOM 170 OG SER A 11 7.638 -6.200 -14.382 1.00 0.00 O ATOM 0 H SER A 11 7.434 -6.119 -16.984 1.00 0.00 H new ATOM 0 HA SER A 11 9.201 -4.377 -15.653 1.00 0.00 H new ATOM 0 HB2 SER A 11 8.899 -7.426 -15.454 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.682 -6.414 -14.257 1.00 0.00 H new ATOM 0 HG SER A 11 7.480 -6.886 -13.701 1.00 0.00 H new ATOM 176 N TYR A 12 10.688 -5.931 -17.994 1.00 0.00 N ATOM 177 CA TYR A 12 11.946 -6.311 -18.655 1.00 0.00 C ATOM 178 C TYR A 12 12.192 -5.645 -20.023 1.00 0.00 C ATOM 179 O TYR A 12 13.173 -4.916 -20.150 1.00 0.00 O ATOM 180 CB TYR A 12 12.039 -7.841 -18.714 1.00 0.00 C ATOM 181 CG TYR A 12 13.219 -8.295 -19.548 1.00 0.00 C ATOM 182 CD1 TYR A 12 14.531 -7.918 -19.194 1.00 0.00 C ATOM 183 CD2 TYR A 12 12.988 -8.993 -20.747 1.00 0.00 C ATOM 184 CE1 TYR A 12 15.605 -8.220 -20.053 1.00 0.00 C ATOM 185 CE2 TYR A 12 14.055 -9.288 -21.614 1.00 0.00 C ATOM 186 CZ TYR A 12 15.367 -8.912 -21.262 1.00 0.00 C ATOM 187 OH TYR A 12 16.396 -9.228 -22.085 1.00 0.00 O ATOM 0 H TYR A 12 9.893 -5.904 -18.632 1.00 0.00 H new ATOM 0 HA TYR A 12 12.759 -5.918 -18.045 1.00 0.00 H new ATOM 0 HB2 TYR A 12 12.131 -8.240 -17.704 1.00 0.00 H new ATOM 0 HB3 TYR A 12 11.118 -8.246 -19.134 1.00 0.00 H new ATOM 0 HD1 TYR A 12 14.712 -7.398 -18.265 1.00 0.00 H new ATOM 0 HD2 TYR A 12 11.986 -9.304 -21.003 1.00 0.00 H new ATOM 0 HE1 TYR A 12 16.609 -7.923 -19.788 1.00 0.00 H new ATOM 0 HE2 TYR A 12 13.870 -9.801 -22.546 1.00 0.00 H new ATOM 0 HH TYR A 12 16.053 -9.703 -22.870 1.00 0.00 H new ATOM 197 N LEU A 13 11.305 -5.781 -21.020 1.00 0.00 N ATOM 198 CA LEU A 13 11.404 -5.098 -22.326 1.00 0.00 C ATOM 199 C LEU A 13 11.502 -3.586 -22.136 1.00 0.00 C ATOM 200 O LEU A 13 12.363 -2.937 -22.730 1.00 0.00 O ATOM 201 CB LEU A 13 10.183 -5.421 -23.215 1.00 0.00 C ATOM 202 CG LEU A 13 10.227 -6.748 -23.994 1.00 0.00 C ATOM 203 CD1 LEU A 13 11.400 -6.794 -24.968 1.00 0.00 C ATOM 204 CD2 LEU A 13 10.337 -7.950 -23.065 1.00 0.00 C ATOM 0 H LEU A 13 10.482 -6.379 -20.943 1.00 0.00 H new ATOM 0 HA LEU A 13 12.306 -5.460 -22.818 1.00 0.00 H new ATOM 0 HB2 LEU A 13 9.294 -5.426 -22.584 1.00 0.00 H new ATOM 0 HB3 LEU A 13 10.060 -4.609 -23.932 1.00 0.00 H new ATOM 0 HG LEU A 13 9.288 -6.797 -24.546 1.00 0.00 H new ATOM 0 HD11 LEU A 13 11.396 -7.746 -25.498 1.00 0.00 H new ATOM 0 HD12 LEU A 13 11.309 -5.979 -25.686 1.00 0.00 H new ATOM 0 HD13 LEU A 13 12.335 -6.690 -24.417 1.00 0.00 H new ATOM 0 HD21 LEU A 13 10.365 -8.865 -23.656 1.00 0.00 H new ATOM 0 HD22 LEU A 13 11.250 -7.871 -22.475 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.475 -7.975 -22.398 1.00 0.00 H new ATOM 216 N GLY A 14 10.668 -3.054 -21.239 1.00 0.00 N ATOM 217 CA GLY A 14 10.584 -1.633 -20.927 1.00 0.00 C ATOM 218 C GLY A 14 11.828 -1.023 -20.265 1.00 0.00 C ATOM 219 O GLY A 14 11.985 0.200 -20.275 1.00 0.00 O ATOM 0 H GLY A 14 10.016 -3.620 -20.696 1.00 0.00 H new ATOM 0 HA2 GLY A 14 10.382 -1.088 -21.849 1.00 0.00 H new ATOM 0 HA3 GLY A 14 9.730 -1.474 -20.269 1.00 0.00 H new ATOM 223 N ARG A 15 12.731 -1.855 -19.717 1.00 0.00 N ATOM 224 CA ARG A 15 14.047 -1.438 -19.186 1.00 0.00 C ATOM 225 C ARG A 15 15.203 -1.826 -20.112 1.00 0.00 C ATOM 226 O ARG A 15 16.209 -1.122 -20.154 1.00 0.00 O ATOM 227 CB ARG A 15 14.247 -1.941 -17.745 1.00 0.00 C ATOM 228 CG ARG A 15 14.255 -3.468 -17.571 1.00 0.00 C ATOM 229 CD ARG A 15 14.524 -3.906 -16.126 1.00 0.00 C ATOM 230 NE ARG A 15 15.900 -3.585 -15.690 1.00 0.00 N ATOM 231 CZ ARG A 15 16.388 -3.732 -14.471 1.00 0.00 C ATOM 232 NH1 ARG A 15 15.668 -4.193 -13.488 1.00 0.00 N ATOM 233 NH2 ARG A 15 17.624 -3.414 -14.211 1.00 0.00 N ATOM 0 H ARG A 15 12.566 -2.858 -19.628 1.00 0.00 H new ATOM 0 HA ARG A 15 14.053 -0.349 -19.151 1.00 0.00 H new ATOM 0 HB2 ARG A 15 15.190 -1.545 -17.368 1.00 0.00 H new ATOM 0 HB3 ARG A 15 13.455 -1.526 -17.121 1.00 0.00 H new ATOM 0 HG2 ARG A 15 13.294 -3.870 -17.894 1.00 0.00 H new ATOM 0 HG3 ARG A 15 15.016 -3.898 -18.223 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.811 -3.417 -15.462 1.00 0.00 H new ATOM 0 HD3 ARG A 15 14.358 -4.980 -16.037 1.00 0.00 H new ATOM 0 HE ARG A 15 16.533 -3.214 -16.398 1.00 0.00 H new ATOM 0 HH11 ARG A 15 14.695 -4.454 -13.647 1.00 0.00 H new ATOM 0 HH12 ARG A 15 16.078 -4.293 -12.559 1.00 0.00 H new ATOM 0 HH21 ARG A 15 18.223 -3.048 -14.951 1.00 0.00 H new ATOM 0 HH22 ARG A 15 17.993 -3.531 -13.267 1.00 0.00 H new ATOM 247 N PHE A 16 15.039 -2.885 -20.907 1.00 0.00 N ATOM 248 CA PHE A 16 15.969 -3.269 -21.964 1.00 0.00 C ATOM 249 C PHE A 16 16.101 -2.183 -23.030 1.00 0.00 C ATOM 250 O PHE A 16 17.192 -1.632 -23.200 1.00 0.00 O ATOM 251 CB PHE A 16 15.538 -4.616 -22.553 1.00 0.00 C ATOM 252 CG PHE A 16 15.927 -4.879 -23.997 1.00 0.00 C ATOM 253 CD1 PHE A 16 17.223 -4.590 -24.454 1.00 0.00 C ATOM 254 CD2 PHE A 16 14.967 -5.340 -24.912 1.00 0.00 C ATOM 255 CE1 PHE A 16 17.562 -4.738 -25.804 1.00 0.00 C ATOM 256 CE2 PHE A 16 15.287 -5.454 -26.268 1.00 0.00 C ATOM 257 CZ PHE A 16 16.585 -5.162 -26.715 1.00 0.00 C ATOM 0 H PHE A 16 14.238 -3.511 -20.830 1.00 0.00 H new ATOM 0 HA PHE A 16 16.965 -3.383 -21.536 1.00 0.00 H new ATOM 0 HB2 PHE A 16 15.960 -5.409 -21.936 1.00 0.00 H new ATOM 0 HB3 PHE A 16 14.454 -4.693 -22.472 1.00 0.00 H new ATOM 0 HD1 PHE A 16 17.970 -4.248 -23.753 1.00 0.00 H new ATOM 0 HD2 PHE A 16 13.979 -5.607 -24.567 1.00 0.00 H new ATOM 0 HE1 PHE A 16 18.567 -4.528 -26.140 1.00 0.00 H new ATOM 0 HE2 PHE A 16 14.533 -5.768 -26.974 1.00 0.00 H new ATOM 0 HZ PHE A 16 16.831 -5.264 -27.762 1.00 0.00 H new ATOM 267 N TYR A 17 15.007 -1.841 -23.721 1.00 0.00 N ATOM 268 CA TYR A 17 15.070 -0.779 -24.723 1.00 0.00 C ATOM 269 C TYR A 17 15.524 0.564 -24.120 1.00 0.00 C ATOM 270 O TYR A 17 16.157 1.369 -24.797 1.00 0.00 O ATOM 271 CB TYR A 17 13.725 -0.640 -25.464 1.00 0.00 C ATOM 272 CG TYR A 17 12.791 0.387 -24.851 1.00 0.00 C ATOM 273 CD1 TYR A 17 13.059 1.746 -25.085 1.00 0.00 C ATOM 274 CD2 TYR A 17 11.730 0.023 -24.003 1.00 0.00 C ATOM 275 CE1 TYR A 17 12.316 2.738 -24.422 1.00 0.00 C ATOM 276 CE2 TYR A 17 10.981 1.020 -23.343 1.00 0.00 C ATOM 277 CZ TYR A 17 11.284 2.381 -23.539 1.00 0.00 C ATOM 278 OH TYR A 17 10.582 3.355 -22.895 1.00 0.00 O ATOM 0 H TYR A 17 14.090 -2.274 -23.607 1.00 0.00 H new ATOM 0 HA TYR A 17 15.828 -1.066 -25.452 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.919 -0.367 -26.501 1.00 0.00 H new ATOM 0 HB3 TYR A 17 13.226 -1.609 -25.477 1.00 0.00 H new ATOM 0 HD1 TYR A 17 13.839 2.030 -25.777 1.00 0.00 H new ATOM 0 HD2 TYR A 17 11.489 -1.019 -23.857 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.540 3.781 -24.593 1.00 0.00 H new ATOM 0 HE2 TYR A 17 10.172 0.738 -22.685 1.00 0.00 H new ATOM 0 HH TYR A 17 9.902 2.943 -22.321 1.00 0.00 H new ATOM 288 N GLN A 18 15.194 0.828 -22.851 1.00 0.00 N ATOM 289 CA GLN A 18 15.580 2.076 -22.198 1.00 0.00 C ATOM 290 C GLN A 18 17.099 2.159 -22.007 1.00 0.00 C ATOM 291 O GLN A 18 17.671 3.219 -22.245 1.00 0.00 O ATOM 292 CB GLN A 18 14.825 2.183 -20.865 1.00 0.00 C ATOM 293 CG GLN A 18 15.328 3.250 -19.890 1.00 0.00 C ATOM 294 CD GLN A 18 15.127 4.691 -20.360 1.00 0.00 C ATOM 295 OE1 GLN A 18 16.116 5.292 -20.989 1.00 0.00 O flip ATOM 296 NE2 GLN A 18 14.087 5.301 -20.151 1.00 0.00 N flip ATOM 0 H GLN A 18 14.660 0.192 -22.259 1.00 0.00 H new ATOM 0 HA GLN A 18 15.308 2.922 -22.829 1.00 0.00 H new ATOM 0 HB2 GLN A 18 13.775 2.383 -21.080 1.00 0.00 H new ATOM 0 HB3 GLN A 18 14.870 1.215 -20.367 1.00 0.00 H new ATOM 0 HG2 GLN A 18 14.819 3.119 -18.935 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.390 3.086 -19.710 1.00 0.00 H new ATOM 0 HE21 GLN A 18 13.316 4.843 -19.665 1.00 0.00 H new ATOM 0 HE22 GLN A 18 13.991 6.267 -20.463 1.00 0.00 H new ATOM 305 N ASP A 19 17.772 1.076 -21.616 1.00 0.00 N ATOM 306 CA ASP A 19 19.224 1.038 -21.447 1.00 0.00 C ATOM 307 C ASP A 19 19.978 1.389 -22.738 1.00 0.00 C ATOM 308 O ASP A 19 21.040 2.003 -22.667 1.00 0.00 O ATOM 309 CB ASP A 19 19.609 -0.358 -20.959 1.00 0.00 C ATOM 310 CG ASP A 19 21.123 -0.522 -20.830 1.00 0.00 C ATOM 311 OD1 ASP A 19 21.686 -0.168 -19.764 1.00 0.00 O ATOM 312 OD2 ASP A 19 21.749 -1.026 -21.793 1.00 0.00 O ATOM 0 H ASP A 19 17.317 0.188 -21.405 1.00 0.00 H new ATOM 0 HA ASP A 19 19.511 1.794 -20.716 1.00 0.00 H new ATOM 0 HB2 ASP A 19 19.140 -0.546 -19.993 1.00 0.00 H new ATOM 0 HB3 ASP A 19 19.221 -1.104 -21.652 1.00 0.00 H new ATOM 317 N LEU A 20 19.413 1.052 -23.907 1.00 0.00 N ATOM 318 CA LEU A 20 19.912 1.452 -25.231 1.00 0.00 C ATOM 319 C LEU A 20 20.018 2.983 -25.343 1.00 0.00 C ATOM 320 O LEU A 20 21.119 3.537 -25.371 1.00 0.00 O ATOM 321 CB LEU A 20 19.023 0.842 -26.331 1.00 0.00 C ATOM 322 CG LEU A 20 19.043 -0.696 -26.372 1.00 0.00 C ATOM 323 CD1 LEU A 20 17.982 -1.233 -27.333 1.00 0.00 C ATOM 324 CD2 LEU A 20 20.402 -1.196 -26.846 1.00 0.00 C ATOM 0 H LEU A 20 18.572 0.477 -23.959 1.00 0.00 H new ATOM 0 HA LEU A 20 20.921 1.063 -25.366 1.00 0.00 H new ATOM 0 HB2 LEU A 20 17.997 1.178 -26.182 1.00 0.00 H new ATOM 0 HB3 LEU A 20 19.346 1.225 -27.299 1.00 0.00 H new ATOM 0 HG LEU A 20 18.838 -1.050 -25.362 1.00 0.00 H new ATOM 0 HD11 LEU A 20 18.018 -2.322 -27.343 1.00 0.00 H new ATOM 0 HD12 LEU A 20 16.995 -0.905 -27.006 1.00 0.00 H new ATOM 0 HD13 LEU A 20 18.175 -0.855 -28.337 1.00 0.00 H new ATOM 0 HD21 LEU A 20 20.401 -2.286 -26.870 1.00 0.00 H new ATOM 0 HD22 LEU A 20 20.603 -0.811 -27.846 1.00 0.00 H new ATOM 0 HD23 LEU A 20 21.176 -0.849 -26.162 1.00 0.00 H new ATOM 336 N LYS A 21 18.883 3.691 -25.360 1.00 0.00 N ATOM 337 CA LYS A 21 18.870 5.159 -25.506 1.00 0.00 C ATOM 338 C LYS A 21 19.420 5.910 -24.283 1.00 0.00 C ATOM 339 O LYS A 21 19.796 7.075 -24.401 1.00 0.00 O ATOM 340 CB LYS A 21 17.468 5.667 -25.889 1.00 0.00 C ATOM 341 CG LYS A 21 16.366 5.211 -24.925 1.00 0.00 C ATOM 342 CD LYS A 21 15.251 6.258 -24.813 1.00 0.00 C ATOM 343 CE LYS A 21 14.212 5.853 -23.765 1.00 0.00 C ATOM 344 NZ LYS A 21 12.991 6.702 -23.849 1.00 0.00 N ATOM 0 H LYS A 21 17.956 3.273 -25.274 1.00 0.00 H new ATOM 0 HA LYS A 21 19.557 5.382 -26.322 1.00 0.00 H new ATOM 0 HB2 LYS A 21 17.482 6.756 -25.923 1.00 0.00 H new ATOM 0 HB3 LYS A 21 17.227 5.320 -26.894 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.946 4.266 -25.271 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.795 5.028 -23.940 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.681 7.224 -24.548 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.766 6.381 -25.781 1.00 0.00 H new ATOM 0 HE2 LYS A 21 13.939 4.807 -23.907 1.00 0.00 H new ATOM 0 HE3 LYS A 21 14.647 5.937 -22.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 12.308 6.400 -23.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 13.248 7.697 -23.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.563 6.602 -24.792 1.00 0.00 H new ATOM 358 N ASP A 22 19.523 5.248 -23.129 1.00 0.00 N ATOM 359 CA ASP A 22 20.088 5.835 -21.893 1.00 0.00 C ATOM 360 C ASP A 22 21.590 6.158 -22.011 1.00 0.00 C ATOM 361 O ASP A 22 22.087 7.080 -21.356 1.00 0.00 O ATOM 362 CB ASP A 22 19.846 4.901 -20.696 1.00 0.00 C ATOM 363 CG ASP A 22 20.357 5.502 -19.376 1.00 0.00 C ATOM 364 OD1 ASP A 22 19.741 6.480 -18.887 1.00 0.00 O ATOM 365 OD2 ASP A 22 21.345 4.979 -18.804 1.00 0.00 O ATOM 0 H ASP A 22 19.217 4.282 -23.016 1.00 0.00 H new ATOM 0 HA ASP A 22 19.569 6.781 -21.735 1.00 0.00 H new ATOM 0 HB2 ASP A 22 18.779 4.693 -20.610 1.00 0.00 H new ATOM 0 HB3 ASP A 22 20.343 3.948 -20.875 1.00 0.00 H new ATOM 370 N ARG A 23 22.298 5.434 -22.892 1.00 0.00 N ATOM 371 CA ARG A 23 23.732 5.592 -23.190 1.00 0.00 C ATOM 372 C ARG A 23 24.018 5.981 -24.643 1.00 0.00 C ATOM 373 O ARG A 23 25.177 5.958 -25.057 1.00 0.00 O ATOM 374 CB ARG A 23 24.496 4.326 -22.757 1.00 0.00 C ATOM 375 CG ARG A 23 24.098 3.071 -23.553 1.00 0.00 C ATOM 376 CD ARG A 23 24.475 1.784 -22.806 1.00 0.00 C ATOM 377 NE ARG A 23 23.628 0.647 -23.210 1.00 0.00 N ATOM 378 CZ ARG A 23 23.830 -0.230 -24.167 1.00 0.00 C ATOM 379 NH1 ARG A 23 24.792 -0.129 -25.044 1.00 0.00 N ATOM 380 NH2 ARG A 23 23.035 -1.250 -24.236 1.00 0.00 N ATOM 0 H ARG A 23 21.868 4.689 -23.441 1.00 0.00 H new ATOM 0 HA ARG A 23 24.096 6.438 -22.607 1.00 0.00 H new ATOM 0 HB2 ARG A 23 25.566 4.498 -22.875 1.00 0.00 H new ATOM 0 HB3 ARG A 23 24.317 4.147 -21.697 1.00 0.00 H new ATOM 0 HG2 ARG A 23 23.024 3.083 -23.739 1.00 0.00 H new ATOM 0 HG3 ARG A 23 24.590 3.085 -24.526 1.00 0.00 H new ATOM 0 HD2 ARG A 23 25.521 1.545 -22.999 1.00 0.00 H new ATOM 0 HD3 ARG A 23 24.378 1.946 -21.732 1.00 0.00 H new ATOM 0 HE ARG A 23 22.769 0.525 -22.674 1.00 0.00 H new ATOM 0 HH11 ARG A 23 25.435 0.662 -25.007 1.00 0.00 H new ATOM 0 HH12 ARG A 23 24.901 -0.841 -25.766 1.00 0.00 H new ATOM 0 HH21 ARG A 23 22.279 -1.354 -23.559 1.00 0.00 H new ATOM 0 HH22 ARG A 23 23.165 -1.949 -24.967 1.00 0.00 H new ATOM 394 N ASP A 24 22.984 6.372 -25.402 1.00 0.00 N ATOM 395 CA ASP A 24 23.127 6.912 -26.763 1.00 0.00 C ATOM 396 C ASP A 24 23.878 5.940 -27.701 1.00 0.00 C ATOM 397 O ASP A 24 24.828 6.296 -28.403 1.00 0.00 O ATOM 398 CB ASP A 24 23.730 8.329 -26.684 1.00 0.00 C ATOM 399 CG ASP A 24 23.773 9.053 -28.038 1.00 0.00 C ATOM 400 OD1 ASP A 24 22.808 8.928 -28.833 1.00 0.00 O ATOM 401 OD2 ASP A 24 24.754 9.795 -28.299 1.00 0.00 O ATOM 0 H ASP A 24 22.016 6.322 -25.086 1.00 0.00 H new ATOM 0 HA ASP A 24 22.146 7.009 -27.228 1.00 0.00 H new ATOM 0 HB2 ASP A 24 23.148 8.924 -25.981 1.00 0.00 H new ATOM 0 HB3 ASP A 24 24.742 8.263 -26.284 1.00 0.00 H new ATOM 406 N VAL A 25 23.441 4.674 -27.691 1.00 0.00 N ATOM 407 CA VAL A 25 23.939 3.596 -28.576 1.00 0.00 C ATOM 408 C VAL A 25 23.741 3.891 -30.082 1.00 0.00 C ATOM 409 O VAL A 25 24.312 3.204 -30.929 1.00 0.00 O ATOM 410 CB VAL A 25 23.322 2.246 -28.136 1.00 0.00 C ATOM 411 CG1 VAL A 25 21.805 2.274 -28.229 1.00 0.00 C ATOM 412 CG2 VAL A 25 23.810 1.030 -28.934 1.00 0.00 C ATOM 0 H VAL A 25 22.712 4.356 -27.053 1.00 0.00 H new ATOM 0 HA VAL A 25 25.021 3.538 -28.461 1.00 0.00 H new ATOM 0 HB VAL A 25 23.657 2.130 -27.105 1.00 0.00 H new ATOM 0 HG11 VAL A 25 21.403 1.311 -27.913 1.00 0.00 H new ATOM 0 HG12 VAL A 25 21.415 3.060 -27.582 1.00 0.00 H new ATOM 0 HG13 VAL A 25 21.507 2.471 -29.259 1.00 0.00 H new ATOM 0 HG21 VAL A 25 23.326 0.129 -28.557 1.00 0.00 H new ATOM 0 HG22 VAL A 25 23.561 1.162 -29.987 1.00 0.00 H new ATOM 0 HG23 VAL A 25 24.890 0.933 -28.826 1.00 0.00 H new ATOM 422 N THR A 26 22.940 4.913 -30.421 1.00 0.00 N ATOM 423 CA THR A 26 22.533 5.373 -31.777 1.00 0.00 C ATOM 424 C THR A 26 21.990 4.267 -32.706 1.00 0.00 C ATOM 425 O THR A 26 21.948 4.410 -33.932 1.00 0.00 O ATOM 426 CB THR A 26 23.605 6.279 -32.418 1.00 0.00 C ATOM 427 OG1 THR A 26 23.080 6.960 -33.541 1.00 0.00 O ATOM 428 CG2 THR A 26 24.870 5.542 -32.858 1.00 0.00 C ATOM 0 H THR A 26 22.519 5.496 -29.697 1.00 0.00 H new ATOM 0 HA THR A 26 21.654 5.999 -31.625 1.00 0.00 H new ATOM 0 HB THR A 26 23.887 6.975 -31.628 1.00 0.00 H new ATOM 0 HG1 THR A 26 22.496 6.357 -34.046 1.00 0.00 H new ATOM 0 HG21 THR A 26 25.570 6.252 -33.298 1.00 0.00 H new ATOM 0 HG22 THR A 26 25.332 5.064 -31.994 1.00 0.00 H new ATOM 0 HG23 THR A 26 24.611 4.783 -33.597 1.00 0.00 H new ATOM 436 N PHE A 27 21.538 3.172 -32.097 1.00 0.00 N ATOM 437 CA PHE A 27 20.784 2.061 -32.668 1.00 0.00 C ATOM 438 C PHE A 27 19.650 2.505 -33.627 1.00 0.00 C ATOM 439 O PHE A 27 18.862 3.400 -33.308 1.00 0.00 O ATOM 440 CB PHE A 27 20.267 1.209 -31.496 1.00 0.00 C ATOM 441 CG PHE A 27 19.189 1.789 -30.575 1.00 0.00 C ATOM 442 CD1 PHE A 27 19.246 3.100 -30.043 1.00 0.00 C ATOM 443 CD2 PHE A 27 18.154 0.937 -30.153 1.00 0.00 C ATOM 444 CE1 PHE A 27 18.312 3.522 -29.082 1.00 0.00 C ATOM 445 CE2 PHE A 27 17.183 1.380 -29.238 1.00 0.00 C ATOM 446 CZ PHE A 27 17.274 2.667 -28.685 1.00 0.00 C ATOM 0 H PHE A 27 21.706 3.029 -31.101 1.00 0.00 H new ATOM 0 HA PHE A 27 21.442 1.471 -33.306 1.00 0.00 H new ATOM 0 HB2 PHE A 27 19.879 0.279 -31.911 1.00 0.00 H new ATOM 0 HB3 PHE A 27 21.124 0.948 -30.876 1.00 0.00 H new ATOM 0 HD1 PHE A 27 20.014 3.781 -30.379 1.00 0.00 H new ATOM 0 HD2 PHE A 27 18.104 -0.071 -30.537 1.00 0.00 H new ATOM 0 HE1 PHE A 27 18.394 4.508 -28.648 1.00 0.00 H new ATOM 0 HE2 PHE A 27 16.367 0.730 -28.960 1.00 0.00 H new ATOM 0 HZ PHE A 27 16.548 2.997 -27.957 1.00 0.00 H new ATOM 456 N SER A 28 19.582 1.882 -34.815 1.00 0.00 N ATOM 457 CA SER A 28 18.603 2.189 -35.880 1.00 0.00 C ATOM 458 C SER A 28 18.502 1.097 -36.974 1.00 0.00 C ATOM 459 O SER A 28 17.382 0.649 -37.247 1.00 0.00 O ATOM 460 CB SER A 28 18.914 3.563 -36.504 1.00 0.00 C ATOM 461 OG SER A 28 18.003 3.886 -37.540 1.00 0.00 O ATOM 0 H SER A 28 20.222 1.130 -35.072 1.00 0.00 H new ATOM 0 HA SER A 28 17.624 2.214 -35.401 1.00 0.00 H new ATOM 0 HB2 SER A 28 18.874 4.331 -35.732 1.00 0.00 H new ATOM 0 HB3 SER A 28 19.930 3.562 -36.900 1.00 0.00 H new ATOM 0 HG SER A 28 18.229 4.764 -37.912 1.00 0.00 H new ATOM 467 N PRO A 29 19.620 0.612 -37.574 1.00 0.00 N ATOM 468 CA PRO A 29 19.606 -0.522 -38.516 1.00 0.00 C ATOM 469 C PRO A 29 19.465 -1.876 -37.778 1.00 0.00 C ATOM 470 O PRO A 29 19.037 -1.920 -36.622 1.00 0.00 O ATOM 471 CB PRO A 29 20.921 -0.370 -39.304 1.00 0.00 C ATOM 472 CG PRO A 29 21.879 0.216 -38.274 1.00 0.00 C ATOM 473 CD PRO A 29 20.970 1.177 -37.514 1.00 0.00 C ATOM 0 HA PRO A 29 18.748 -0.515 -39.188 1.00 0.00 H new ATOM 0 HB2 PRO A 29 21.276 -1.328 -39.684 1.00 0.00 H new ATOM 0 HB3 PRO A 29 20.801 0.290 -40.164 1.00 0.00 H new ATOM 0 HG2 PRO A 29 22.299 -0.551 -37.623 1.00 0.00 H new ATOM 0 HG3 PRO A 29 22.718 0.731 -38.742 1.00 0.00 H new ATOM 0 HD2 PRO A 29 21.299 1.286 -36.481 1.00 0.00 H new ATOM 0 HD3 PRO A 29 20.995 2.170 -37.963 1.00 0.00 H new ATOM 481 N ALA A 30 19.880 -2.986 -38.408 1.00 0.00 N ATOM 482 CA ALA A 30 19.957 -4.340 -37.832 1.00 0.00 C ATOM 483 C ALA A 30 20.752 -4.477 -36.503 1.00 0.00 C ATOM 484 O ALA A 30 20.815 -5.554 -35.909 1.00 0.00 O ATOM 485 CB ALA A 30 20.480 -5.291 -38.914 1.00 0.00 C ATOM 0 H ALA A 30 20.186 -2.964 -39.381 1.00 0.00 H new ATOM 0 HA ALA A 30 18.945 -4.606 -37.526 1.00 0.00 H new ATOM 0 HB1 ALA A 30 20.546 -6.301 -38.510 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.799 -5.284 -39.765 1.00 0.00 H new ATOM 0 HB3 ALA A 30 21.468 -4.965 -39.238 1.00 0.00 H new ATOM 491 N THR A 31 21.362 -3.392 -36.008 1.00 0.00 N ATOM 492 CA THR A 31 21.905 -3.297 -34.645 1.00 0.00 C ATOM 493 C THR A 31 20.833 -3.632 -33.607 1.00 0.00 C ATOM 494 O THR A 31 21.094 -4.442 -32.727 1.00 0.00 O ATOM 495 CB THR A 31 22.446 -1.876 -34.401 1.00 0.00 C ATOM 496 OG1 THR A 31 23.684 -1.714 -35.055 1.00 0.00 O ATOM 497 CG2 THR A 31 22.646 -1.503 -32.932 1.00 0.00 C ATOM 0 H THR A 31 21.495 -2.540 -36.553 1.00 0.00 H new ATOM 0 HA THR A 31 22.716 -4.018 -34.544 1.00 0.00 H new ATOM 0 HB THR A 31 21.675 -1.215 -34.798 1.00 0.00 H new ATOM 0 HG1 THR A 31 24.021 -0.808 -34.897 1.00 0.00 H new ATOM 0 HG21 THR A 31 23.029 -0.485 -32.864 1.00 0.00 H new ATOM 0 HG22 THR A 31 21.693 -1.568 -32.407 1.00 0.00 H new ATOM 0 HG23 THR A 31 23.359 -2.190 -32.476 1.00 0.00 H new ATOM 505 N ILE A 32 19.628 -3.050 -33.703 1.00 0.00 N ATOM 506 CA ILE A 32 18.595 -3.164 -32.650 1.00 0.00 C ATOM 507 C ILE A 32 18.257 -4.626 -32.322 1.00 0.00 C ATOM 508 O ILE A 32 18.259 -5.039 -31.162 1.00 0.00 O ATOM 509 CB ILE A 32 17.300 -2.418 -33.044 1.00 0.00 C ATOM 510 CG1 ILE A 32 17.587 -0.982 -33.542 1.00 0.00 C ATOM 511 CG2 ILE A 32 16.340 -2.465 -31.845 1.00 0.00 C ATOM 512 CD1 ILE A 32 16.583 0.092 -33.152 1.00 0.00 C ATOM 0 H ILE A 32 19.339 -2.490 -34.505 1.00 0.00 H new ATOM 0 HA ILE A 32 19.020 -2.701 -31.760 1.00 0.00 H new ATOM 0 HB ILE A 32 16.826 -2.912 -33.892 1.00 0.00 H new ATOM 0 HG12 ILE A 32 18.567 -0.683 -33.170 1.00 0.00 H new ATOM 0 HG13 ILE A 32 17.653 -1.006 -34.630 1.00 0.00 H new ATOM 0 HG21 ILE A 32 15.416 -1.944 -32.098 1.00 0.00 H new ATOM 0 HG22 ILE A 32 16.116 -3.503 -31.599 1.00 0.00 H new ATOM 0 HG23 ILE A 32 16.806 -1.981 -30.987 1.00 0.00 H new ATOM 0 HD11 ILE A 32 16.899 1.051 -33.562 1.00 0.00 H new ATOM 0 HD12 ILE A 32 15.601 -0.167 -33.548 1.00 0.00 H new ATOM 0 HD13 ILE A 32 16.529 0.162 -32.066 1.00 0.00 H new ATOM 524 N GLU A 33 17.980 -5.410 -33.365 1.00 0.00 N ATOM 525 CA GLU A 33 17.702 -6.855 -33.247 1.00 0.00 C ATOM 526 C GLU A 33 18.846 -7.618 -32.564 1.00 0.00 C ATOM 527 O GLU A 33 18.589 -8.521 -31.769 1.00 0.00 O ATOM 528 CB GLU A 33 17.345 -7.532 -34.587 1.00 0.00 C ATOM 529 CG GLU A 33 17.501 -6.696 -35.850 1.00 0.00 C ATOM 530 CD GLU A 33 16.830 -7.377 -37.053 1.00 0.00 C ATOM 531 OE1 GLU A 33 15.624 -7.112 -37.277 1.00 0.00 O ATOM 532 OE2 GLU A 33 17.490 -8.171 -37.769 1.00 0.00 O ATOM 0 H GLU A 33 17.940 -5.065 -34.324 1.00 0.00 H new ATOM 0 HA GLU A 33 16.817 -6.909 -32.613 1.00 0.00 H new ATOM 0 HB2 GLU A 33 17.965 -8.422 -34.692 1.00 0.00 H new ATOM 0 HB3 GLU A 33 16.310 -7.869 -34.530 1.00 0.00 H new ATOM 0 HG2 GLU A 33 17.061 -5.711 -35.694 1.00 0.00 H new ATOM 0 HG3 GLU A 33 18.560 -6.543 -36.059 1.00 0.00 H new ATOM 539 N ASN A 34 20.098 -7.242 -32.830 1.00 0.00 N ATOM 540 CA ASN A 34 21.262 -7.841 -32.174 1.00 0.00 C ATOM 541 C ASN A 34 21.275 -7.597 -30.652 1.00 0.00 C ATOM 542 O ASN A 34 21.575 -8.522 -29.899 1.00 0.00 O ATOM 543 CB ASN A 34 22.546 -7.327 -32.852 1.00 0.00 C ATOM 544 CG ASN A 34 23.796 -8.031 -32.352 1.00 0.00 C ATOM 545 OD1 ASN A 34 23.876 -9.251 -32.299 1.00 0.00 O ATOM 546 ND2 ASN A 34 24.820 -7.289 -31.987 1.00 0.00 N ATOM 0 H ASN A 34 20.334 -6.515 -33.505 1.00 0.00 H new ATOM 0 HA ASN A 34 21.205 -8.923 -32.293 1.00 0.00 H new ATOM 0 HB2 ASN A 34 22.463 -7.465 -33.930 1.00 0.00 H new ATOM 0 HB3 ASN A 34 22.642 -6.256 -32.674 1.00 0.00 H new ATOM 0 HD21 ASN A 34 25.679 -7.731 -31.660 1.00 0.00 H new ATOM 0 HD22 ASN A 34 24.754 -6.272 -32.031 1.00 0.00 H new ATOM 553 N GLU A 35 20.915 -6.397 -30.176 1.00 0.00 N ATOM 554 CA GLU A 35 20.936 -6.034 -28.745 1.00 0.00 C ATOM 555 C GLU A 35 20.112 -6.977 -27.867 1.00 0.00 C ATOM 556 O GLU A 35 20.586 -7.371 -26.802 1.00 0.00 O ATOM 557 CB GLU A 35 20.435 -4.599 -28.526 1.00 0.00 C ATOM 558 CG GLU A 35 21.107 -3.559 -29.421 1.00 0.00 C ATOM 559 CD GLU A 35 22.628 -3.471 -29.161 1.00 0.00 C ATOM 560 OE1 GLU A 35 23.045 -2.938 -28.102 1.00 0.00 O ATOM 561 OE2 GLU A 35 23.427 -3.956 -30.000 1.00 0.00 O ATOM 0 H GLU A 35 20.596 -5.639 -30.779 1.00 0.00 H new ATOM 0 HA GLU A 35 21.980 -6.120 -28.445 1.00 0.00 H new ATOM 0 HB2 GLU A 35 19.359 -4.571 -28.700 1.00 0.00 H new ATOM 0 HB3 GLU A 35 20.597 -4.324 -27.484 1.00 0.00 H new ATOM 0 HG2 GLU A 35 20.932 -3.812 -30.467 1.00 0.00 H new ATOM 0 HG3 GLU A 35 20.652 -2.584 -29.249 1.00 0.00 H new ATOM 568 N LEU A 36 18.924 -7.378 -28.340 1.00 0.00 N ATOM 569 CA LEU A 36 18.016 -8.300 -27.630 1.00 0.00 C ATOM 570 C LEU A 36 18.734 -9.592 -27.191 1.00 0.00 C ATOM 571 O LEU A 36 18.466 -10.114 -26.113 1.00 0.00 O ATOM 572 CB LEU A 36 16.784 -8.633 -28.507 1.00 0.00 C ATOM 573 CG LEU A 36 15.433 -8.746 -27.761 1.00 0.00 C ATOM 574 CD1 LEU A 36 14.354 -9.293 -28.689 1.00 0.00 C ATOM 575 CD2 LEU A 36 15.405 -9.591 -26.485 1.00 0.00 C ATOM 0 H LEU A 36 18.558 -7.068 -29.240 1.00 0.00 H new ATOM 0 HA LEU A 36 17.678 -7.793 -26.726 1.00 0.00 H new ATOM 0 HB2 LEU A 36 16.690 -7.864 -29.274 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.973 -9.575 -29.021 1.00 0.00 H new ATOM 0 HG LEU A 36 15.253 -7.718 -27.446 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.411 -9.366 -28.147 1.00 0.00 H new ATOM 0 HD12 LEU A 36 14.233 -8.623 -29.541 1.00 0.00 H new ATOM 0 HD13 LEU A 36 14.646 -10.282 -29.043 1.00 0.00 H new ATOM 0 HD21 LEU A 36 14.399 -9.584 -26.066 1.00 0.00 H new ATOM 0 HD22 LEU A 36 15.693 -10.616 -26.721 1.00 0.00 H new ATOM 0 HD23 LEU A 36 16.104 -9.176 -25.758 1.00 0.00 H new ATOM 587 N ILE A 37 19.678 -10.095 -27.995 1.00 0.00 N ATOM 588 CA ILE A 37 20.420 -11.345 -27.737 1.00 0.00 C ATOM 589 C ILE A 37 21.375 -11.184 -26.560 1.00 0.00 C ATOM 590 O ILE A 37 21.306 -11.943 -25.593 1.00 0.00 O ATOM 591 CB ILE A 37 21.183 -11.826 -29.004 1.00 0.00 C ATOM 592 CG1 ILE A 37 20.269 -12.475 -30.063 1.00 0.00 C ATOM 593 CG2 ILE A 37 22.317 -12.814 -28.671 1.00 0.00 C ATOM 594 CD1 ILE A 37 19.166 -11.552 -30.581 1.00 0.00 C ATOM 0 H ILE A 37 19.957 -9.638 -28.863 1.00 0.00 H new ATOM 0 HA ILE A 37 19.688 -12.111 -27.478 1.00 0.00 H new ATOM 0 HB ILE A 37 21.605 -10.912 -29.422 1.00 0.00 H new ATOM 0 HG12 ILE A 37 20.880 -12.802 -30.904 1.00 0.00 H new ATOM 0 HG13 ILE A 37 19.811 -13.367 -29.636 1.00 0.00 H new ATOM 0 HG21 ILE A 37 22.817 -13.118 -29.591 1.00 0.00 H new ATOM 0 HG22 ILE A 37 23.037 -12.332 -28.009 1.00 0.00 H new ATOM 0 HG23 ILE A 37 21.901 -13.692 -28.177 1.00 0.00 H new ATOM 0 HD11 ILE A 37 18.567 -12.081 -31.322 1.00 0.00 H new ATOM 0 HD12 ILE A 37 18.529 -11.245 -29.751 1.00 0.00 H new ATOM 0 HD13 ILE A 37 19.615 -10.671 -31.040 1.00 0.00 H new ATOM 606 N LYS A 38 22.239 -10.163 -26.612 1.00 0.00 N ATOM 607 CA LYS A 38 23.215 -9.863 -25.539 1.00 0.00 C ATOM 608 C LYS A 38 22.549 -9.445 -24.230 1.00 0.00 C ATOM 609 O LYS A 38 23.189 -9.418 -23.182 1.00 0.00 O ATOM 610 CB LYS A 38 24.181 -8.768 -25.996 1.00 0.00 C ATOM 611 CG LYS A 38 24.982 -9.192 -27.237 1.00 0.00 C ATOM 612 CD LYS A 38 24.661 -8.305 -28.445 1.00 0.00 C ATOM 613 CE LYS A 38 25.105 -6.839 -28.309 1.00 0.00 C ATOM 614 NZ LYS A 38 26.588 -6.688 -28.265 1.00 0.00 N ATOM 0 H LYS A 38 22.287 -9.515 -27.399 1.00 0.00 H new ATOM 0 HA LYS A 38 23.760 -10.787 -25.344 1.00 0.00 H new ATOM 0 HB2 LYS A 38 23.621 -7.860 -26.218 1.00 0.00 H new ATOM 0 HB3 LYS A 38 24.868 -8.528 -25.185 1.00 0.00 H new ATOM 0 HG2 LYS A 38 26.049 -9.138 -27.018 1.00 0.00 H new ATOM 0 HG3 LYS A 38 24.758 -10.231 -27.478 1.00 0.00 H new ATOM 0 HD2 LYS A 38 25.136 -8.733 -29.328 1.00 0.00 H new ATOM 0 HD3 LYS A 38 23.585 -8.329 -28.619 1.00 0.00 H new ATOM 0 HE2 LYS A 38 24.710 -6.265 -29.147 1.00 0.00 H new ATOM 0 HE3 LYS A 38 24.674 -6.416 -27.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 26.832 -5.681 -28.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 26.966 -7.212 -27.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 27.002 -7.066 -29.141 1.00 0.00 H new ATOM 628 N PHE A 39 21.252 -9.171 -24.307 1.00 0.00 N ATOM 629 CA PHE A 39 20.366 -8.942 -23.186 1.00 0.00 C ATOM 630 C PHE A 39 19.824 -10.274 -22.663 1.00 0.00 C ATOM 631 O PHE A 39 20.234 -10.734 -21.602 1.00 0.00 O ATOM 632 CB PHE A 39 19.283 -7.966 -23.677 1.00 0.00 C ATOM 633 CG PHE A 39 19.464 -6.594 -23.084 1.00 0.00 C ATOM 634 CD1 PHE A 39 20.290 -5.647 -23.716 1.00 0.00 C ATOM 635 CD2 PHE A 39 18.800 -6.271 -21.885 1.00 0.00 C ATOM 636 CE1 PHE A 39 20.453 -4.372 -23.148 1.00 0.00 C ATOM 637 CE2 PHE A 39 18.965 -4.999 -21.315 1.00 0.00 C ATOM 638 CZ PHE A 39 19.812 -4.064 -21.934 1.00 0.00 C ATOM 0 H PHE A 39 20.771 -9.100 -25.203 1.00 0.00 H new ATOM 0 HA PHE A 39 20.873 -8.494 -22.331 1.00 0.00 H new ATOM 0 HB2 PHE A 39 19.317 -7.900 -24.764 1.00 0.00 H new ATOM 0 HB3 PHE A 39 18.298 -8.351 -23.412 1.00 0.00 H new ATOM 0 HD1 PHE A 39 20.798 -5.899 -24.635 1.00 0.00 H new ATOM 0 HD2 PHE A 39 18.165 -7.001 -21.405 1.00 0.00 H new ATOM 0 HE1 PHE A 39 21.067 -3.633 -23.641 1.00 0.00 H new ATOM 0 HE2 PHE A 39 18.444 -4.740 -20.405 1.00 0.00 H new ATOM 0 HZ PHE A 39 19.972 -3.100 -21.474 1.00 0.00 H new ATOM 648 N CYS A 40 19.015 -10.962 -23.463 1.00 0.00 N ATOM 649 CA CYS A 40 18.369 -12.247 -23.184 1.00 0.00 C ATOM 650 C CYS A 40 19.317 -13.366 -22.725 1.00 0.00 C ATOM 651 O CYS A 40 18.884 -14.293 -22.040 1.00 0.00 O ATOM 652 CB CYS A 40 17.690 -12.635 -24.496 1.00 0.00 C ATOM 653 SG CYS A 40 17.028 -14.304 -24.670 1.00 0.00 S ATOM 0 H CYS A 40 18.774 -10.614 -24.391 1.00 0.00 H new ATOM 0 HA CYS A 40 17.683 -12.130 -22.345 1.00 0.00 H new ATOM 0 HB2 CYS A 40 16.871 -11.936 -24.663 1.00 0.00 H new ATOM 0 HB3 CYS A 40 18.410 -12.480 -25.299 1.00 0.00 H new ATOM 658 N ARG A 41 20.608 -13.282 -23.065 1.00 0.00 N ATOM 659 CA ARG A 41 21.604 -14.299 -22.684 1.00 0.00 C ATOM 660 C ARG A 41 21.977 -14.262 -21.200 1.00 0.00 C ATOM 661 O ARG A 41 22.381 -15.283 -20.642 1.00 0.00 O ATOM 662 CB ARG A 41 22.854 -14.216 -23.575 1.00 0.00 C ATOM 663 CG ARG A 41 23.721 -12.975 -23.291 1.00 0.00 C ATOM 664 CD ARG A 41 24.960 -12.911 -24.198 1.00 0.00 C ATOM 665 NE ARG A 41 25.926 -13.986 -23.886 1.00 0.00 N ATOM 666 CZ ARG A 41 27.047 -14.250 -24.533 1.00 0.00 C ATOM 667 NH1 ARG A 41 27.427 -13.566 -25.578 1.00 0.00 N ATOM 668 NH2 ARG A 41 27.821 -15.222 -24.140 1.00 0.00 N ATOM 0 H ARG A 41 20.994 -12.511 -23.610 1.00 0.00 H new ATOM 0 HA ARG A 41 21.125 -15.264 -22.849 1.00 0.00 H new ATOM 0 HB2 ARG A 41 23.456 -15.113 -23.429 1.00 0.00 H new ATOM 0 HB3 ARG A 41 22.547 -14.205 -24.621 1.00 0.00 H new ATOM 0 HG2 ARG A 41 23.122 -12.075 -23.433 1.00 0.00 H new ATOM 0 HG3 ARG A 41 24.037 -12.986 -22.248 1.00 0.00 H new ATOM 0 HD2 ARG A 41 24.652 -12.991 -25.240 1.00 0.00 H new ATOM 0 HD3 ARG A 41 25.445 -11.942 -24.082 1.00 0.00 H new ATOM 0 HE ARG A 41 25.704 -14.585 -23.090 1.00 0.00 H new ATOM 0 HH11 ARG A 41 26.851 -12.797 -25.921 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.300 -13.800 -26.051 1.00 0.00 H new ATOM 0 HH21 ARG A 41 27.562 -15.784 -23.329 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.685 -15.421 -24.644 1.00 0.00 H new ATOM 682 N GLU A 42 21.830 -13.093 -20.571 1.00 0.00 N ATOM 683 CA GLU A 42 22.206 -12.853 -19.169 1.00 0.00 C ATOM 684 C GLU A 42 21.125 -12.118 -18.355 1.00 0.00 C ATOM 685 O GLU A 42 21.334 -11.856 -17.169 1.00 0.00 O ATOM 686 CB GLU A 42 23.565 -12.128 -19.134 1.00 0.00 C ATOM 687 CG GLU A 42 23.545 -10.727 -19.767 1.00 0.00 C ATOM 688 CD GLU A 42 24.916 -10.041 -19.622 1.00 0.00 C ATOM 689 OE1 GLU A 42 25.871 -10.414 -20.346 1.00 0.00 O ATOM 690 OE2 GLU A 42 25.052 -9.127 -18.772 1.00 0.00 O ATOM 0 H GLU A 42 21.439 -12.269 -21.028 1.00 0.00 H new ATOM 0 HA GLU A 42 22.299 -13.820 -18.674 1.00 0.00 H new ATOM 0 HB2 GLU A 42 23.892 -12.042 -18.098 1.00 0.00 H new ATOM 0 HB3 GLU A 42 24.304 -12.739 -19.652 1.00 0.00 H new ATOM 0 HG2 GLU A 42 23.282 -10.804 -20.822 1.00 0.00 H new ATOM 0 HG3 GLU A 42 22.777 -10.119 -19.290 1.00 0.00 H new ATOM 697 N ALA A 43 19.977 -11.796 -18.976 1.00 0.00 N ATOM 698 CA ALA A 43 18.937 -10.921 -18.423 1.00 0.00 C ATOM 699 C ALA A 43 18.514 -11.239 -16.961 1.00 0.00 C ATOM 700 O ALA A 43 18.845 -10.472 -16.052 1.00 0.00 O ATOM 701 CB ALA A 43 17.759 -10.937 -19.413 1.00 0.00 C ATOM 0 H ALA A 43 19.743 -12.150 -19.904 1.00 0.00 H new ATOM 0 HA ALA A 43 19.345 -9.915 -18.324 1.00 0.00 H new ATOM 0 HB1 ALA A 43 16.960 -10.296 -19.039 1.00 0.00 H new ATOM 0 HB2 ALA A 43 18.094 -10.570 -20.383 1.00 0.00 H new ATOM 0 HB3 ALA A 43 17.387 -11.956 -19.519 1.00 0.00 H new ATOM 707 N ARG A 44 17.806 -12.365 -16.748 1.00 0.00 N ATOM 708 CA ARG A 44 17.371 -12.974 -15.464 1.00 0.00 C ATOM 709 C ARG A 44 16.647 -14.308 -15.755 1.00 0.00 C ATOM 710 O ARG A 44 16.142 -14.495 -16.855 1.00 0.00 O ATOM 711 CB ARG A 44 16.467 -11.970 -14.702 1.00 0.00 C ATOM 712 CG ARG A 44 15.846 -12.460 -13.386 1.00 0.00 C ATOM 713 CD ARG A 44 16.914 -12.733 -12.320 1.00 0.00 C ATOM 714 NE ARG A 44 16.303 -13.129 -11.035 1.00 0.00 N ATOM 715 CZ ARG A 44 16.943 -13.364 -9.901 1.00 0.00 C ATOM 716 NH1 ARG A 44 18.241 -13.267 -9.801 1.00 0.00 N ATOM 717 NH2 ARG A 44 16.277 -13.708 -8.834 1.00 0.00 N ATOM 0 H ARG A 44 17.492 -12.927 -17.539 1.00 0.00 H new ATOM 0 HA ARG A 44 18.229 -13.193 -14.829 1.00 0.00 H new ATOM 0 HB2 ARG A 44 17.055 -11.077 -14.489 1.00 0.00 H new ATOM 0 HB3 ARG A 44 15.658 -11.668 -15.368 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.144 -11.713 -13.015 1.00 0.00 H new ATOM 0 HG3 ARG A 44 15.275 -13.370 -13.570 1.00 0.00 H new ATOM 0 HD2 ARG A 44 17.582 -13.522 -12.666 1.00 0.00 H new ATOM 0 HD3 ARG A 44 17.523 -11.840 -12.176 1.00 0.00 H new ATOM 0 HE ARG A 44 15.288 -13.231 -11.020 1.00 0.00 H new ATOM 0 HH11 ARG A 44 18.797 -13.002 -10.614 1.00 0.00 H new ATOM 0 HH12 ARG A 44 18.699 -13.456 -8.910 1.00 0.00 H new ATOM 0 HH21 ARG A 44 15.262 -13.796 -8.873 1.00 0.00 H new ATOM 0 HH22 ARG A 44 16.771 -13.889 -7.960 1.00 0.00 H new ATOM 731 N GLY A 45 16.572 -15.234 -14.793 1.00 0.00 N ATOM 732 CA GLY A 45 16.038 -16.604 -14.947 1.00 0.00 C ATOM 733 C GLY A 45 14.758 -16.799 -15.793 1.00 0.00 C ATOM 734 O GLY A 45 14.716 -17.721 -16.609 1.00 0.00 O ATOM 0 H GLY A 45 16.894 -15.048 -13.843 1.00 0.00 H new ATOM 0 HA2 GLY A 45 16.823 -17.220 -15.385 1.00 0.00 H new ATOM 0 HA3 GLY A 45 15.842 -16.999 -13.950 1.00 0.00 H new ATOM 738 N LYS A 46 13.733 -15.945 -15.645 1.00 0.00 N ATOM 739 CA LYS A 46 12.480 -15.998 -16.448 1.00 0.00 C ATOM 740 C LYS A 46 12.503 -15.049 -17.642 1.00 0.00 C ATOM 741 O LYS A 46 11.971 -15.351 -18.710 1.00 0.00 O ATOM 742 CB LYS A 46 11.266 -15.696 -15.560 1.00 0.00 C ATOM 743 CG LYS A 46 11.135 -16.734 -14.435 1.00 0.00 C ATOM 744 CD LYS A 46 9.757 -16.684 -13.772 1.00 0.00 C ATOM 745 CE LYS A 46 9.482 -15.354 -13.058 1.00 0.00 C ATOM 746 NZ LYS A 46 8.129 -15.372 -12.435 1.00 0.00 N ATOM 0 H LYS A 46 13.741 -15.188 -14.961 1.00 0.00 H new ATOM 0 HA LYS A 46 12.403 -17.010 -16.845 1.00 0.00 H new ATOM 0 HB2 LYS A 46 11.364 -14.699 -15.130 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.360 -15.694 -16.165 1.00 0.00 H new ATOM 0 HG2 LYS A 46 11.308 -17.731 -14.839 1.00 0.00 H new ATOM 0 HG3 LYS A 46 11.906 -16.556 -13.685 1.00 0.00 H new ATOM 0 HD2 LYS A 46 8.990 -16.849 -14.529 1.00 0.00 H new ATOM 0 HD3 LYS A 46 9.676 -17.499 -13.053 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.239 -15.180 -12.294 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.552 -14.531 -13.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 7.956 -14.466 -11.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 7.409 -15.517 -13.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.076 -16.146 -11.743 1.00 0.00 H new ATOM 760 N GLU A 47 13.210 -13.938 -17.504 1.00 0.00 N ATOM 761 CA GLU A 47 13.573 -13.002 -18.570 1.00 0.00 C ATOM 762 C GLU A 47 14.398 -13.661 -19.695 1.00 0.00 C ATOM 763 O GLU A 47 14.431 -13.176 -20.820 1.00 0.00 O ATOM 764 CB GLU A 47 14.323 -11.800 -17.979 1.00 0.00 C ATOM 765 CG GLU A 47 13.452 -10.838 -17.160 1.00 0.00 C ATOM 766 CD GLU A 47 12.804 -11.362 -15.851 1.00 0.00 C ATOM 767 OE1 GLU A 47 13.255 -12.376 -15.265 1.00 0.00 O ATOM 768 OE2 GLU A 47 11.837 -10.719 -15.374 1.00 0.00 O ATOM 0 H GLU A 47 13.569 -13.644 -16.596 1.00 0.00 H new ATOM 0 HA GLU A 47 12.645 -12.663 -19.030 1.00 0.00 H new ATOM 0 HB2 GLU A 47 15.129 -12.169 -17.344 1.00 0.00 H new ATOM 0 HB3 GLU A 47 14.788 -11.244 -18.793 1.00 0.00 H new ATOM 0 HG2 GLU A 47 14.063 -9.972 -16.904 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.651 -10.482 -17.808 1.00 0.00 H new ATOM 775 N ASN A 48 15.029 -14.801 -19.398 1.00 0.00 N ATOM 776 CA ASN A 48 15.732 -15.692 -20.333 1.00 0.00 C ATOM 777 C ASN A 48 14.792 -16.674 -21.071 1.00 0.00 C ATOM 778 O ASN A 48 15.206 -17.295 -22.051 1.00 0.00 O ATOM 779 CB ASN A 48 16.770 -16.499 -19.530 1.00 0.00 C ATOM 780 CG ASN A 48 17.960 -15.727 -18.971 1.00 0.00 C ATOM 781 OD1 ASN A 48 18.069 -14.438 -19.198 1.00 0.00 O flip ATOM 782 ND2 ASN A 48 18.829 -16.291 -18.322 1.00 0.00 N flip ATOM 0 H ASN A 48 15.066 -15.150 -18.440 1.00 0.00 H new ATOM 0 HA ASN A 48 16.196 -15.070 -21.098 1.00 0.00 H new ATOM 0 HB2 ASN A 48 16.256 -16.980 -18.698 1.00 0.00 H new ATOM 0 HB3 ASN A 48 17.152 -17.294 -20.171 1.00 0.00 H new ATOM 0 HD21 ASN A 48 18.759 -17.292 -18.137 1.00 0.00 H new ATOM 0 HD22 ASN A 48 19.624 -15.761 -17.965 1.00 0.00 H new ATOM 789 N ARG A 49 13.536 -16.832 -20.618 1.00 0.00 N ATOM 790 CA ARG A 49 12.549 -17.758 -21.179 1.00 0.00 C ATOM 791 C ARG A 49 11.521 -17.035 -22.051 1.00 0.00 C ATOM 792 O ARG A 49 11.208 -17.506 -23.137 1.00 0.00 O ATOM 793 CB ARG A 49 11.907 -18.543 -20.013 1.00 0.00 C ATOM 794 CG ARG A 49 10.650 -19.326 -20.409 1.00 0.00 C ATOM 795 CD ARG A 49 10.874 -20.242 -21.612 1.00 0.00 C ATOM 796 NE ARG A 49 11.335 -21.590 -21.222 1.00 0.00 N ATOM 797 CZ ARG A 49 10.589 -22.642 -20.919 1.00 0.00 C ATOM 798 NH1 ARG A 49 9.287 -22.619 -20.970 1.00 0.00 N ATOM 799 NH2 ARG A 49 11.154 -23.754 -20.543 1.00 0.00 N ATOM 0 H ARG A 49 13.173 -16.300 -19.827 1.00 0.00 H new ATOM 0 HA ARG A 49 13.038 -18.464 -21.850 1.00 0.00 H new ATOM 0 HB2 ARG A 49 12.643 -19.237 -19.607 1.00 0.00 H new ATOM 0 HB3 ARG A 49 11.652 -17.845 -19.215 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.318 -19.924 -19.560 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.848 -18.624 -20.637 1.00 0.00 H new ATOM 0 HD2 ARG A 49 9.945 -20.329 -22.176 1.00 0.00 H new ATOM 0 HD3 ARG A 49 11.609 -19.789 -22.277 1.00 0.00 H new ATOM 0 HE ARG A 49 12.345 -21.727 -21.181 1.00 0.00 H new ATOM 0 HH11 ARG A 49 8.803 -21.767 -21.252 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.752 -23.453 -20.728 1.00 0.00 H new ATOM 0 HH21 ARG A 49 12.170 -23.814 -20.482 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.580 -24.564 -20.310 1.00 0.00 H new ATOM 813 N LEU A 50 11.064 -15.852 -21.652 1.00 0.00 N ATOM 814 CA LEU A 50 10.208 -15.004 -22.505 1.00 0.00 C ATOM 815 C LEU A 50 10.799 -14.722 -23.898 1.00 0.00 C ATOM 816 O LEU A 50 10.053 -14.537 -24.854 1.00 0.00 O ATOM 817 CB LEU A 50 9.830 -13.707 -21.770 1.00 0.00 C ATOM 818 CG LEU A 50 10.977 -12.812 -21.262 1.00 0.00 C ATOM 819 CD1 LEU A 50 11.554 -11.859 -22.303 1.00 0.00 C ATOM 820 CD2 LEU A 50 10.470 -11.956 -20.103 1.00 0.00 C ATOM 0 H LEU A 50 11.269 -15.448 -20.738 1.00 0.00 H new ATOM 0 HA LEU A 50 9.300 -15.576 -22.696 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.210 -13.110 -22.439 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.209 -13.975 -20.915 1.00 0.00 H new ATOM 0 HG LEU A 50 11.771 -13.500 -20.973 1.00 0.00 H new ATOM 0 HD11 LEU A 50 12.354 -11.271 -21.854 1.00 0.00 H new ATOM 0 HD12 LEU A 50 11.951 -12.432 -23.141 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.770 -11.191 -22.660 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.278 -11.321 -19.739 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.644 -11.333 -20.445 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.126 -12.603 -19.296 1.00 0.00 H new ATOM 832 N CYS A 51 12.131 -14.727 -24.012 1.00 0.00 N ATOM 833 CA CYS A 51 12.887 -14.371 -25.222 1.00 0.00 C ATOM 834 C CYS A 51 13.258 -15.571 -26.111 1.00 0.00 C ATOM 835 O CYS A 51 13.581 -15.398 -27.288 1.00 0.00 O ATOM 836 CB CYS A 51 14.116 -13.559 -24.815 1.00 0.00 C ATOM 837 SG CYS A 51 15.274 -14.321 -23.660 1.00 0.00 S ATOM 0 H CYS A 51 12.738 -14.989 -23.235 1.00 0.00 H new ATOM 0 HA CYS A 51 12.233 -13.767 -25.851 1.00 0.00 H new ATOM 0 HB2 CYS A 51 14.665 -13.303 -25.721 1.00 0.00 H new ATOM 0 HB3 CYS A 51 13.770 -12.623 -24.376 1.00 0.00 H new ATOM 842 N TYR A 52 13.122 -16.785 -25.584 1.00 0.00 N ATOM 843 CA TYR A 52 13.202 -18.057 -26.328 1.00 0.00 C ATOM 844 C TYR A 52 12.062 -18.171 -27.355 1.00 0.00 C ATOM 845 O TYR A 52 12.252 -18.666 -28.466 1.00 0.00 O ATOM 846 CB TYR A 52 13.178 -19.224 -25.316 1.00 0.00 C ATOM 847 CG TYR A 52 12.606 -20.535 -25.820 1.00 0.00 C ATOM 848 CD1 TYR A 52 13.339 -21.321 -26.726 1.00 0.00 C ATOM 849 CD2 TYR A 52 11.330 -20.953 -25.389 1.00 0.00 C ATOM 850 CE1 TYR A 52 12.789 -22.520 -27.218 1.00 0.00 C ATOM 851 CE2 TYR A 52 10.783 -22.157 -25.873 1.00 0.00 C ATOM 852 CZ TYR A 52 11.508 -22.939 -26.799 1.00 0.00 C ATOM 853 OH TYR A 52 10.979 -24.093 -27.283 1.00 0.00 O ATOM 0 H TYR A 52 12.946 -16.924 -24.589 1.00 0.00 H new ATOM 0 HA TYR A 52 14.133 -18.094 -26.893 1.00 0.00 H new ATOM 0 HB2 TYR A 52 14.198 -19.403 -24.976 1.00 0.00 H new ATOM 0 HB3 TYR A 52 12.602 -18.911 -24.445 1.00 0.00 H new ATOM 0 HD1 TYR A 52 14.322 -21.006 -27.044 1.00 0.00 H new ATOM 0 HD2 TYR A 52 10.772 -20.350 -24.688 1.00 0.00 H new ATOM 0 HE1 TYR A 52 13.349 -23.121 -27.919 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.810 -22.482 -25.536 1.00 0.00 H new ATOM 0 HH TYR A 52 10.092 -24.235 -26.892 1.00 0.00 H new ATOM 863 N TYR A 53 10.893 -17.626 -27.015 1.00 0.00 N ATOM 864 CA TYR A 53 9.743 -17.527 -27.911 1.00 0.00 C ATOM 865 C TYR A 53 9.950 -16.468 -29.012 1.00 0.00 C ATOM 866 O TYR A 53 9.387 -16.593 -30.102 1.00 0.00 O ATOM 867 CB TYR A 53 8.499 -17.213 -27.067 1.00 0.00 C ATOM 868 CG TYR A 53 8.214 -18.241 -25.986 1.00 0.00 C ATOM 869 CD1 TYR A 53 7.875 -19.561 -26.338 1.00 0.00 C ATOM 870 CD2 TYR A 53 8.287 -17.876 -24.626 1.00 0.00 C ATOM 871 CE1 TYR A 53 7.626 -20.520 -25.335 1.00 0.00 C ATOM 872 CE2 TYR A 53 8.035 -18.832 -23.623 1.00 0.00 C ATOM 873 CZ TYR A 53 7.713 -20.158 -23.974 1.00 0.00 C ATOM 874 OH TYR A 53 7.514 -21.092 -23.005 1.00 0.00 O ATOM 0 H TYR A 53 10.717 -17.234 -26.090 1.00 0.00 H new ATOM 0 HA TYR A 53 9.615 -18.478 -28.429 1.00 0.00 H new ATOM 0 HB2 TYR A 53 8.625 -16.236 -26.601 1.00 0.00 H new ATOM 0 HB3 TYR A 53 7.633 -17.143 -27.726 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.805 -19.840 -27.379 1.00 0.00 H new ATOM 0 HD2 TYR A 53 8.537 -16.861 -24.353 1.00 0.00 H new ATOM 0 HE1 TYR A 53 7.368 -21.533 -25.609 1.00 0.00 H new ATOM 0 HE2 TYR A 53 8.089 -18.548 -22.582 1.00 0.00 H new ATOM 0 HH TYR A 53 7.791 -21.972 -23.337 1.00 0.00 H new ATOM 884 N ILE A 54 10.784 -15.454 -28.749 1.00 0.00 N ATOM 885 CA ILE A 54 11.054 -14.331 -29.666 1.00 0.00 C ATOM 886 C ILE A 54 12.122 -14.735 -30.695 1.00 0.00 C ATOM 887 O ILE A 54 11.975 -14.482 -31.892 1.00 0.00 O ATOM 888 CB ILE A 54 11.488 -13.075 -28.864 1.00 0.00 C ATOM 889 CG1 ILE A 54 10.472 -12.730 -27.753 1.00 0.00 C ATOM 890 CG2 ILE A 54 11.685 -11.891 -29.819 1.00 0.00 C ATOM 891 CD1 ILE A 54 10.794 -11.471 -26.938 1.00 0.00 C ATOM 0 H ILE A 54 11.303 -15.387 -27.874 1.00 0.00 H new ATOM 0 HA ILE A 54 10.141 -14.083 -30.207 1.00 0.00 H new ATOM 0 HB ILE A 54 12.436 -13.293 -28.372 1.00 0.00 H new ATOM 0 HG12 ILE A 54 9.489 -12.607 -28.208 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.403 -13.577 -27.070 1.00 0.00 H new ATOM 0 HG21 ILE A 54 11.990 -11.012 -29.251 1.00 0.00 H new ATOM 0 HG22 ILE A 54 12.457 -12.137 -30.549 1.00 0.00 H new ATOM 0 HG23 ILE A 54 10.749 -11.682 -30.337 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.021 -11.317 -26.185 1.00 0.00 H new ATOM 0 HD12 ILE A 54 11.759 -11.593 -26.447 1.00 0.00 H new ATOM 0 HD13 ILE A 54 10.831 -10.607 -27.602 1.00 0.00 H new ATOM 903 N GLY A 55 13.181 -15.389 -30.211 1.00 0.00 N ATOM 904 CA GLY A 55 14.284 -15.914 -31.031 1.00 0.00 C ATOM 905 C GLY A 55 15.675 -15.451 -30.588 1.00 0.00 C ATOM 906 O GLY A 55 16.651 -15.641 -31.314 1.00 0.00 O ATOM 0 H GLY A 55 13.301 -15.574 -29.215 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.252 -17.003 -31.007 1.00 0.00 H new ATOM 0 HA3 GLY A 55 14.126 -15.613 -32.067 1.00 0.00 H new ATOM 910 N ALA A 56 15.768 -14.800 -29.426 1.00 0.00 N ATOM 911 CA ALA A 56 17.001 -14.207 -28.913 1.00 0.00 C ATOM 912 C ALA A 56 17.894 -15.218 -28.161 1.00 0.00 C ATOM 913 O ALA A 56 19.008 -14.872 -27.761 1.00 0.00 O ATOM 914 CB ALA A 56 16.590 -13.049 -28.009 1.00 0.00 C ATOM 0 H ALA A 56 14.970 -14.669 -28.804 1.00 0.00 H new ATOM 0 HA ALA A 56 17.613 -13.862 -29.746 1.00 0.00 H new ATOM 0 HB1 ALA A 56 17.481 -12.573 -27.600 1.00 0.00 H new ATOM 0 HB2 ALA A 56 16.022 -12.320 -28.587 1.00 0.00 H new ATOM 0 HB3 ALA A 56 15.973 -13.426 -27.193 1.00 0.00 H new ATOM 920 N THR A 57 17.425 -16.456 -27.950 1.00 0.00 N ATOM 921 CA THR A 57 18.226 -17.512 -27.296 1.00 0.00 C ATOM 922 C THR A 57 18.915 -18.427 -28.317 1.00 0.00 C ATOM 923 O THR A 57 18.520 -18.522 -29.482 1.00 0.00 O ATOM 924 CB THR A 57 17.384 -18.356 -26.324 1.00 0.00 C ATOM 925 OG1 THR A 57 16.453 -19.148 -27.014 1.00 0.00 O ATOM 926 CG2 THR A 57 16.634 -17.520 -25.289 1.00 0.00 C ATOM 0 H THR A 57 16.489 -16.756 -28.223 1.00 0.00 H new ATOM 0 HA THR A 57 18.996 -16.994 -26.724 1.00 0.00 H new ATOM 0 HB THR A 57 18.102 -18.985 -25.797 1.00 0.00 H new ATOM 0 HG1 THR A 57 15.933 -19.675 -26.372 1.00 0.00 H new ATOM 0 HG21 THR A 57 16.061 -18.178 -24.636 1.00 0.00 H new ATOM 0 HG22 THR A 57 17.348 -16.951 -24.694 1.00 0.00 H new ATOM 0 HG23 THR A 57 15.957 -16.833 -25.797 1.00 0.00 H new ATOM 934 N ASP A 58 19.937 -19.161 -27.866 1.00 0.00 N ATOM 935 CA ASP A 58 20.615 -20.222 -28.634 1.00 0.00 C ATOM 936 C ASP A 58 19.776 -21.521 -28.776 1.00 0.00 C ATOM 937 O ASP A 58 20.203 -22.499 -29.392 1.00 0.00 O ATOM 938 CB ASP A 58 21.976 -20.495 -27.972 1.00 0.00 C ATOM 939 CG ASP A 58 22.914 -21.359 -28.835 1.00 0.00 C ATOM 940 OD1 ASP A 58 23.214 -20.970 -29.990 1.00 0.00 O ATOM 941 OD2 ASP A 58 23.408 -22.404 -28.341 1.00 0.00 O ATOM 0 H ASP A 58 20.329 -19.034 -26.933 1.00 0.00 H new ATOM 0 HA ASP A 58 20.752 -19.871 -29.657 1.00 0.00 H new ATOM 0 HB2 ASP A 58 22.465 -19.544 -27.758 1.00 0.00 H new ATOM 0 HB3 ASP A 58 21.813 -20.992 -27.016 1.00 0.00 H new ATOM 946 N ASP A 59 18.564 -21.528 -28.214 1.00 0.00 N ATOM 947 CA ASP A 59 17.662 -22.684 -28.095 1.00 0.00 C ATOM 948 C ASP A 59 16.370 -22.547 -28.928 1.00 0.00 C ATOM 949 O ASP A 59 15.643 -23.528 -29.119 1.00 0.00 O ATOM 950 CB ASP A 59 17.288 -22.837 -26.615 1.00 0.00 C ATOM 951 CG ASP A 59 18.491 -23.243 -25.750 1.00 0.00 C ATOM 952 OD1 ASP A 59 18.905 -24.426 -25.806 1.00 0.00 O ATOM 953 OD2 ASP A 59 19.011 -22.392 -24.988 1.00 0.00 O ATOM 0 H ASP A 59 18.161 -20.684 -27.807 1.00 0.00 H new ATOM 0 HA ASP A 59 18.189 -23.556 -28.482 1.00 0.00 H new ATOM 0 HB2 ASP A 59 16.879 -21.896 -26.246 1.00 0.00 H new ATOM 0 HB3 ASP A 59 16.503 -23.586 -26.516 1.00 0.00 H new ATOM 958 N ALA A 60 16.068 -21.335 -29.408 1.00 0.00 N ATOM 959 CA ALA A 60 14.819 -20.976 -30.070 1.00 0.00 C ATOM 960 C ALA A 60 14.521 -21.731 -31.384 1.00 0.00 C ATOM 961 O ALA A 60 15.410 -22.274 -32.048 1.00 0.00 O ATOM 962 CB ALA A 60 14.835 -19.460 -30.296 1.00 0.00 C ATOM 0 H ALA A 60 16.716 -20.550 -29.341 1.00 0.00 H new ATOM 0 HA ALA A 60 14.005 -21.283 -29.413 1.00 0.00 H new ATOM 0 HB1 ALA A 60 13.913 -19.156 -30.791 1.00 0.00 H new ATOM 0 HB2 ALA A 60 14.917 -18.950 -29.336 1.00 0.00 H new ATOM 0 HB3 ALA A 60 15.687 -19.194 -30.922 1.00 0.00 H new ATOM 1014 N ILE A 64 10.693 -14.299 -35.197 1.00 0.00 N ATOM 1015 CA ILE A 64 9.794 -13.147 -34.977 1.00 0.00 C ATOM 1016 C ILE A 64 10.473 -11.943 -34.303 1.00 0.00 C ATOM 1017 O ILE A 64 9.854 -10.890 -34.175 1.00 0.00 O ATOM 1018 CB ILE A 64 8.530 -13.570 -34.196 1.00 0.00 C ATOM 1019 CG1 ILE A 64 8.845 -14.035 -32.756 1.00 0.00 C ATOM 1020 CG2 ILE A 64 7.756 -14.642 -34.984 1.00 0.00 C ATOM 1021 CD1 ILE A 64 7.593 -14.191 -31.887 1.00 0.00 C ATOM 0 HA ILE A 64 9.504 -12.809 -35.972 1.00 0.00 H new ATOM 0 HB ILE A 64 7.897 -12.688 -34.091 1.00 0.00 H new ATOM 0 HG12 ILE A 64 9.373 -14.988 -32.796 1.00 0.00 H new ATOM 0 HG13 ILE A 64 9.518 -13.317 -32.288 1.00 0.00 H new ATOM 0 HG21 ILE A 64 6.867 -14.933 -34.425 1.00 0.00 H new ATOM 0 HG22 ILE A 64 7.460 -14.239 -35.952 1.00 0.00 H new ATOM 0 HG23 ILE A 64 8.393 -15.514 -35.134 1.00 0.00 H new ATOM 0 HD11 ILE A 64 7.882 -14.520 -30.889 1.00 0.00 H new ATOM 0 HD12 ILE A 64 7.076 -13.234 -31.819 1.00 0.00 H new ATOM 0 HD13 ILE A 64 6.929 -14.931 -32.335 1.00 0.00 H new ATOM 1033 N ILE A 65 11.741 -12.074 -33.888 1.00 0.00 N ATOM 1034 CA ILE A 65 12.561 -11.025 -33.249 1.00 0.00 C ATOM 1035 C ILE A 65 12.523 -9.671 -33.972 1.00 0.00 C ATOM 1036 O ILE A 65 12.535 -8.626 -33.320 1.00 0.00 O ATOM 1037 CB ILE A 65 13.997 -11.560 -33.014 1.00 0.00 C ATOM 1038 CG1 ILE A 65 14.796 -10.721 -31.992 1.00 0.00 C ATOM 1039 CG2 ILE A 65 14.780 -11.802 -34.319 1.00 0.00 C ATOM 1040 CD1 ILE A 65 15.611 -9.532 -32.518 1.00 0.00 C ATOM 0 H ILE A 65 12.249 -12.952 -33.992 1.00 0.00 H new ATOM 0 HA ILE A 65 12.115 -10.801 -32.280 1.00 0.00 H new ATOM 0 HB ILE A 65 13.864 -12.543 -32.561 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.094 -10.342 -31.249 1.00 0.00 H new ATOM 0 HG13 ILE A 65 15.480 -11.391 -31.472 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.776 -12.176 -34.082 1.00 0.00 H new ATOM 0 HG22 ILE A 65 14.253 -12.536 -34.929 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.866 -10.866 -34.871 1.00 0.00 H new ATOM 0 HD11 ILE A 65 16.116 -9.041 -31.686 1.00 0.00 H new ATOM 0 HD12 ILE A 65 16.352 -9.887 -33.234 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.944 -8.822 -33.008 1.00 0.00 H new ATOM 1052 N ASN A 66 12.380 -9.671 -35.301 1.00 0.00 N ATOM 1053 CA ASN A 66 12.189 -8.455 -36.087 1.00 0.00 C ATOM 1054 C ASN A 66 11.021 -7.571 -35.593 1.00 0.00 C ATOM 1055 O ASN A 66 11.151 -6.352 -35.581 1.00 0.00 O ATOM 1056 CB ASN A 66 12.068 -8.802 -37.580 1.00 0.00 C ATOM 1057 CG ASN A 66 10.747 -9.454 -37.968 1.00 0.00 C ATOM 1058 OD1 ASN A 66 9.773 -8.780 -38.276 1.00 0.00 O ATOM 1059 ND2 ASN A 66 10.659 -10.769 -37.982 1.00 0.00 N ATOM 0 H ASN A 66 12.394 -10.522 -35.863 1.00 0.00 H new ATOM 0 HA ASN A 66 13.078 -7.840 -35.944 1.00 0.00 H new ATOM 0 HB2 ASN A 66 12.195 -7.891 -38.164 1.00 0.00 H new ATOM 0 HB3 ASN A 66 12.884 -9.472 -37.853 1.00 0.00 H new ATOM 0 HD21 ASN A 66 9.783 -11.219 -38.248 1.00 0.00 H new ATOM 0 HD22 ASN A 66 11.467 -11.337 -37.726 1.00 0.00 H new ATOM 1066 N GLU A 67 9.929 -8.149 -35.086 1.00 0.00 N ATOM 1067 CA GLU A 67 8.786 -7.413 -34.515 1.00 0.00 C ATOM 1068 C GLU A 67 9.127 -6.646 -33.217 1.00 0.00 C ATOM 1069 O GLU A 67 8.320 -5.845 -32.748 1.00 0.00 O ATOM 1070 CB GLU A 67 7.599 -8.366 -34.284 1.00 0.00 C ATOM 1071 CG GLU A 67 7.114 -9.016 -35.589 1.00 0.00 C ATOM 1072 CD GLU A 67 5.769 -9.738 -35.384 1.00 0.00 C ATOM 1073 OE1 GLU A 67 4.703 -9.080 -35.475 1.00 0.00 O ATOM 1074 OE2 GLU A 67 5.758 -10.970 -35.148 1.00 0.00 O ATOM 0 H GLU A 67 9.807 -9.161 -35.058 1.00 0.00 H new ATOM 0 HA GLU A 67 8.512 -6.655 -35.249 1.00 0.00 H new ATOM 0 HB2 GLU A 67 7.892 -9.144 -33.579 1.00 0.00 H new ATOM 0 HB3 GLU A 67 6.777 -7.815 -33.827 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.007 -8.253 -36.360 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.861 -9.726 -35.944 1.00 0.00 H new ATOM 1081 N VAL A 68 10.324 -6.854 -32.651 1.00 0.00 N ATOM 1082 CA VAL A 68 10.900 -6.056 -31.556 1.00 0.00 C ATOM 1083 C VAL A 68 11.870 -5.008 -32.100 1.00 0.00 C ATOM 1084 O VAL A 68 11.952 -3.920 -31.539 1.00 0.00 O ATOM 1085 CB VAL A 68 11.615 -6.945 -30.501 1.00 0.00 C ATOM 1086 CG1 VAL A 68 11.879 -6.190 -29.195 1.00 0.00 C ATOM 1087 CG2 VAL A 68 10.787 -8.185 -30.132 1.00 0.00 C ATOM 0 H VAL A 68 10.941 -7.609 -32.953 1.00 0.00 H new ATOM 0 HA VAL A 68 10.071 -5.551 -31.060 1.00 0.00 H new ATOM 0 HB VAL A 68 12.554 -7.238 -30.971 1.00 0.00 H new ATOM 0 HG11 VAL A 68 12.380 -6.851 -28.488 1.00 0.00 H new ATOM 0 HG12 VAL A 68 12.513 -5.326 -29.396 1.00 0.00 H new ATOM 0 HG13 VAL A 68 10.933 -5.855 -28.771 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.327 -8.776 -29.392 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.828 -7.872 -29.718 1.00 0.00 H new ATOM 0 HG23 VAL A 68 10.617 -8.788 -31.024 1.00 0.00 H new ATOM 1097 N SER A 69 12.560 -5.259 -33.218 1.00 0.00 N ATOM 1098 CA SER A 69 13.614 -4.370 -33.711 1.00 0.00 C ATOM 1099 C SER A 69 13.075 -3.127 -34.420 1.00 0.00 C ATOM 1100 O SER A 69 13.674 -2.056 -34.303 1.00 0.00 O ATOM 1101 CB SER A 69 14.591 -5.115 -34.631 1.00 0.00 C ATOM 1102 OG SER A 69 14.002 -5.485 -35.864 1.00 0.00 O ATOM 0 H SER A 69 12.404 -6.080 -33.803 1.00 0.00 H new ATOM 0 HA SER A 69 14.146 -4.028 -32.823 1.00 0.00 H new ATOM 0 HB2 SER A 69 15.458 -4.483 -34.822 1.00 0.00 H new ATOM 0 HB3 SER A 69 14.953 -6.009 -34.123 1.00 0.00 H new ATOM 0 HG SER A 69 14.659 -5.966 -36.409 1.00 0.00 H new ATOM 1108 N LYS A 70 11.929 -3.239 -35.107 1.00 0.00 N ATOM 1109 CA LYS A 70 11.230 -2.093 -35.700 1.00 0.00 C ATOM 1110 C LYS A 70 10.802 -1.049 -34.645 1.00 0.00 C ATOM 1111 O LYS A 70 11.288 0.079 -34.707 1.00 0.00 O ATOM 1112 CB LYS A 70 10.047 -2.501 -36.611 1.00 0.00 C ATOM 1113 CG LYS A 70 9.919 -3.997 -36.936 1.00 0.00 C ATOM 1114 CD LYS A 70 8.895 -4.307 -38.041 1.00 0.00 C ATOM 1115 CE LYS A 70 9.343 -3.785 -39.413 1.00 0.00 C ATOM 1116 NZ LYS A 70 8.375 -4.160 -40.480 1.00 0.00 N ATOM 0 H LYS A 70 11.460 -4.131 -35.267 1.00 0.00 H new ATOM 0 HA LYS A 70 11.964 -1.614 -36.348 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.122 -2.174 -36.136 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.134 -1.954 -37.550 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.894 -4.378 -37.240 1.00 0.00 H new ATOM 0 HG3 LYS A 70 9.636 -4.533 -36.030 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.740 -5.384 -38.098 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.936 -3.860 -37.780 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.444 -2.700 -39.376 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.327 -4.188 -39.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 8.707 -3.792 -41.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 8.298 -5.196 -40.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.443 -3.754 -40.261 1.00 0.00 H new ATOM 1130 N PRO A 71 9.935 -1.397 -33.667 1.00 0.00 N ATOM 1131 CA PRO A 71 9.336 -0.441 -32.727 1.00 0.00 C ATOM 1132 C PRO A 71 10.277 0.123 -31.659 1.00 0.00 C ATOM 1133 O PRO A 71 10.062 1.230 -31.178 1.00 0.00 O ATOM 1134 CB PRO A 71 8.229 -1.211 -32.047 1.00 0.00 C ATOM 1135 CG PRO A 71 8.651 -2.671 -32.130 1.00 0.00 C ATOM 1136 CD PRO A 71 9.320 -2.710 -33.493 1.00 0.00 C ATOM 0 HA PRO A 71 9.016 0.436 -33.289 1.00 0.00 H new ATOM 0 HB2 PRO A 71 8.107 -0.894 -31.011 1.00 0.00 H new ATOM 0 HB3 PRO A 71 7.273 -1.048 -32.544 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.335 -2.947 -31.328 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.800 -3.349 -32.070 1.00 0.00 H new ATOM 0 HD2 PRO A 71 10.067 -3.502 -33.540 1.00 0.00 H new ATOM 0 HD3 PRO A 71 8.593 -2.910 -34.281 1.00 0.00 H new ATOM 1144 N LEU A 72 11.301 -0.625 -31.260 1.00 0.00 N ATOM 1145 CA LEU A 72 12.258 -0.261 -30.200 1.00 0.00 C ATOM 1146 C LEU A 72 12.902 1.119 -30.357 1.00 0.00 C ATOM 1147 O LEU A 72 13.033 1.855 -29.384 1.00 0.00 O ATOM 1148 CB LEU A 72 13.370 -1.311 -30.206 1.00 0.00 C ATOM 1149 CG LEU A 72 13.517 -2.134 -28.919 1.00 0.00 C ATOM 1150 CD1 LEU A 72 12.205 -2.668 -28.334 1.00 0.00 C ATOM 1151 CD2 LEU A 72 14.506 -3.275 -29.127 1.00 0.00 C ATOM 0 H LEU A 72 11.501 -1.535 -31.675 1.00 0.00 H new ATOM 0 HA LEU A 72 11.695 -0.225 -29.267 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.193 -1.996 -31.035 1.00 0.00 H new ATOM 0 HB3 LEU A 72 14.317 -0.809 -30.404 1.00 0.00 H new ATOM 0 HG LEU A 72 13.896 -1.432 -28.176 1.00 0.00 H new ATOM 0 HD11 LEU A 72 12.415 -3.235 -27.427 1.00 0.00 H new ATOM 0 HD12 LEU A 72 11.547 -1.833 -28.095 1.00 0.00 H new ATOM 0 HD13 LEU A 72 11.719 -3.316 -29.063 1.00 0.00 H new ATOM 0 HD21 LEU A 72 14.599 -3.849 -28.205 1.00 0.00 H new ATOM 0 HD22 LEU A 72 14.148 -3.926 -29.925 1.00 0.00 H new ATOM 0 HD23 LEU A 72 15.479 -2.868 -29.400 1.00 0.00 H new ATOM 1163 N ALA A 73 13.283 1.460 -31.591 1.00 0.00 N ATOM 1164 CA ALA A 73 13.788 2.780 -31.976 1.00 0.00 C ATOM 1165 C ALA A 73 12.823 3.941 -31.636 1.00 0.00 C ATOM 1166 O ALA A 73 13.237 5.102 -31.593 1.00 0.00 O ATOM 1167 CB ALA A 73 14.069 2.779 -33.486 1.00 0.00 C ATOM 0 H ALA A 73 13.247 0.806 -32.373 1.00 0.00 H new ATOM 0 HA ALA A 73 14.695 2.955 -31.398 1.00 0.00 H new ATOM 0 HB1 ALA A 73 14.446 3.757 -33.787 1.00 0.00 H new ATOM 0 HB2 ALA A 73 14.813 2.017 -33.717 1.00 0.00 H new ATOM 0 HB3 ALA A 73 13.148 2.563 -34.027 1.00 0.00 H new ATOM 1173 N HIS A 74 11.541 3.632 -31.413 1.00 0.00 N ATOM 1174 CA HIS A 74 10.450 4.576 -31.160 1.00 0.00 C ATOM 1175 C HIS A 74 9.763 4.357 -29.799 1.00 0.00 C ATOM 1176 O HIS A 74 9.033 5.246 -29.356 1.00 0.00 O ATOM 1177 CB HIS A 74 9.388 4.421 -32.249 1.00 0.00 C ATOM 1178 CG HIS A 74 9.873 4.126 -33.641 1.00 0.00 C ATOM 1179 ND1 HIS A 74 10.074 2.869 -34.144 1.00 0.00 N flip ATOM 1180 CD2 HIS A 74 10.134 5.028 -34.647 1.00 0.00 C flip ATOM 1181 CE1 HIS A 74 10.459 3.010 -35.489 1.00 0.00 C flip ATOM 1182 NE2 HIS A 74 10.485 4.333 -35.742 1.00 0.00 N flip ATOM 0 H HIS A 74 11.221 2.664 -31.404 1.00 0.00 H new ATOM 0 HA HIS A 74 10.894 5.572 -31.159 1.00 0.00 H new ATOM 0 HB2 HIS A 74 8.711 3.621 -31.950 1.00 0.00 H new ATOM 0 HB3 HIS A 74 8.801 5.339 -32.283 1.00 0.00 H new ATOM 0 HD2 HIS A 74 10.068 6.103 -34.570 1.00 0.00 H new ATOM 0 HE1 HIS A 74 10.689 2.215 -36.183 1.00 0.00 H new ATOM 0 HE2 HIS A 74 10.736 4.749 -36.639 1.00 0.00 H new ATOM 1190 N HIS A 75 9.971 3.201 -29.142 1.00 0.00 N ATOM 1191 CA HIS A 75 9.579 2.950 -27.742 1.00 0.00 C ATOM 1192 C HIS A 75 8.061 2.758 -27.517 1.00 0.00 C ATOM 1193 O HIS A 75 7.568 2.923 -26.400 1.00 0.00 O ATOM 1194 CB HIS A 75 10.141 4.067 -26.835 1.00 0.00 C ATOM 1195 CG HIS A 75 11.503 4.589 -27.231 1.00 0.00 C ATOM 1196 ND1 HIS A 75 12.674 3.876 -27.263 1.00 0.00 N ATOM 1197 CD2 HIS A 75 11.787 5.829 -27.731 1.00 0.00 C ATOM 1198 CE1 HIS A 75 13.657 4.671 -27.708 1.00 0.00 C ATOM 1199 NE2 HIS A 75 13.163 5.889 -28.008 1.00 0.00 N ATOM 0 H HIS A 75 10.426 2.399 -29.578 1.00 0.00 H new ATOM 0 HA HIS A 75 10.019 1.990 -27.472 1.00 0.00 H new ATOM 0 HB2 HIS A 75 9.437 4.899 -26.831 1.00 0.00 H new ATOM 0 HB3 HIS A 75 10.196 3.691 -25.813 1.00 0.00 H new ATOM 0 HD1 HIS A 75 12.780 2.898 -26.992 1.00 0.00 H new ATOM 0 HD2 HIS A 75 11.075 6.626 -27.887 1.00 0.00 H new ATOM 0 HE1 HIS A 75 14.692 4.379 -27.811 1.00 0.00 H new ATOM 1207 N ILE A 76 7.300 2.451 -28.577 1.00 0.00 N ATOM 1208 CA ILE A 76 5.820 2.484 -28.545 1.00 0.00 C ATOM 1209 C ILE A 76 5.126 1.255 -27.906 1.00 0.00 C ATOM 1210 O ILE A 76 4.430 1.406 -26.899 1.00 0.00 O ATOM 1211 CB ILE A 76 5.185 2.828 -29.933 1.00 0.00 C ATOM 1212 CG1 ILE A 76 6.109 3.271 -31.093 1.00 0.00 C ATOM 1213 CG2 ILE A 76 4.116 3.882 -29.685 1.00 0.00 C ATOM 1214 CD1 ILE A 76 6.583 2.100 -31.961 1.00 0.00 C ATOM 0 H ILE A 76 7.685 2.173 -29.480 1.00 0.00 H new ATOM 0 HA ILE A 76 5.619 3.307 -27.859 1.00 0.00 H new ATOM 0 HB ILE A 76 4.809 1.877 -30.310 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.579 3.989 -31.719 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.977 3.786 -30.682 1.00 0.00 H new ATOM 0 HG21 ILE A 76 3.645 4.152 -30.630 1.00 0.00 H new ATOM 0 HG22 ILE A 76 3.363 3.483 -29.006 1.00 0.00 H new ATOM 0 HG23 ILE A 76 4.573 4.766 -29.241 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.227 2.474 -32.757 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.140 1.393 -31.346 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.720 1.599 -32.399 1.00 0.00 H new ATOM 1226 N PRO A 77 5.279 0.036 -28.461 1.00 0.00 N ATOM 1227 CA PRO A 77 4.560 -1.175 -28.051 1.00 0.00 C ATOM 1228 C PRO A 77 5.198 -1.929 -26.887 1.00 0.00 C ATOM 1229 O PRO A 77 4.604 -2.873 -26.393 1.00 0.00 O ATOM 1230 CB PRO A 77 4.596 -2.081 -29.279 1.00 0.00 C ATOM 1231 CG PRO A 77 5.947 -1.737 -29.895 1.00 0.00 C ATOM 1232 CD PRO A 77 6.039 -0.239 -29.659 1.00 0.00 C ATOM 0 HA PRO A 77 3.564 -0.895 -27.707 1.00 0.00 H new ATOM 0 HB2 PRO A 77 4.528 -3.135 -29.009 1.00 0.00 H new ATOM 0 HB3 PRO A 77 3.772 -1.873 -29.962 1.00 0.00 H new ATOM 0 HG2 PRO A 77 6.763 -2.275 -29.413 1.00 0.00 H new ATOM 0 HG3 PRO A 77 5.985 -1.985 -30.956 1.00 0.00 H new ATOM 0 HD2 PRO A 77 7.077 0.072 -29.540 1.00 0.00 H new ATOM 0 HD3 PRO A 77 5.637 0.313 -30.509 1.00 0.00 H new ATOM 1240 N VAL A 78 6.409 -1.558 -26.479 1.00 0.00 N ATOM 1241 CA VAL A 78 7.284 -2.151 -25.437 1.00 0.00 C ATOM 1242 C VAL A 78 6.612 -2.740 -24.188 1.00 0.00 C ATOM 1243 O VAL A 78 7.136 -3.680 -23.594 1.00 0.00 O ATOM 1244 CB VAL A 78 8.354 -1.122 -25.034 1.00 0.00 C ATOM 1245 CG1 VAL A 78 9.276 -0.858 -26.231 1.00 0.00 C ATOM 1246 CG2 VAL A 78 7.737 0.205 -24.560 1.00 0.00 C ATOM 0 H VAL A 78 6.861 -0.750 -26.907 1.00 0.00 H new ATOM 0 HA VAL A 78 7.710 -3.032 -25.917 1.00 0.00 H new ATOM 0 HB VAL A 78 8.918 -1.538 -24.199 1.00 0.00 H new ATOM 0 HG11 VAL A 78 10.036 -0.129 -25.951 1.00 0.00 H new ATOM 0 HG12 VAL A 78 9.758 -1.788 -26.531 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.689 -0.469 -27.063 1.00 0.00 H new ATOM 0 HG21 VAL A 78 8.532 0.899 -24.287 1.00 0.00 H new ATOM 0 HG22 VAL A 78 7.140 0.636 -25.363 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.101 0.022 -23.694 1.00 0.00 H new ATOM 1256 N GLU A 79 5.446 -2.226 -23.803 1.00 0.00 N ATOM 1257 CA GLU A 79 4.584 -2.817 -22.766 1.00 0.00 C ATOM 1258 C GLU A 79 3.755 -4.008 -23.290 1.00 0.00 C ATOM 1259 O GLU A 79 3.800 -5.115 -22.749 1.00 0.00 O ATOM 1260 CB GLU A 79 3.630 -1.721 -22.253 1.00 0.00 C ATOM 1261 CG GLU A 79 2.659 -2.246 -21.187 1.00 0.00 C ATOM 1262 CD GLU A 79 1.769 -1.111 -20.650 1.00 0.00 C ATOM 1263 OE1 GLU A 79 0.686 -0.859 -21.231 1.00 0.00 O ATOM 1264 OE2 GLU A 79 2.137 -0.469 -19.635 1.00 0.00 O ATOM 0 H GLU A 79 5.061 -1.372 -24.206 1.00 0.00 H new ATOM 0 HA GLU A 79 5.223 -3.198 -21.970 1.00 0.00 H new ATOM 0 HB2 GLU A 79 4.214 -0.900 -21.837 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.062 -1.316 -23.090 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.036 -3.032 -21.613 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.220 -2.693 -20.366 1.00 0.00 H new ATOM 1271 N LYS A 80 2.976 -3.745 -24.344 1.00 0.00 N ATOM 1272 CA LYS A 80 1.996 -4.657 -24.955 1.00 0.00 C ATOM 1273 C LYS A 80 2.600 -5.686 -25.902 1.00 0.00 C ATOM 1274 O LYS A 80 1.883 -6.586 -26.329 1.00 0.00 O ATOM 1275 CB LYS A 80 0.880 -3.871 -25.663 1.00 0.00 C ATOM 1276 CG LYS A 80 1.369 -2.923 -26.772 1.00 0.00 C ATOM 1277 CD LYS A 80 0.180 -2.288 -27.500 1.00 0.00 C ATOM 1278 CE LYS A 80 0.668 -1.314 -28.581 1.00 0.00 C ATOM 1279 NZ LYS A 80 -0.474 -0.686 -29.305 1.00 0.00 N ATOM 0 H LYS A 80 3.012 -2.844 -24.821 1.00 0.00 H new ATOM 0 HA LYS A 80 1.577 -5.224 -24.124 1.00 0.00 H new ATOM 0 HB2 LYS A 80 0.172 -4.579 -26.094 1.00 0.00 H new ATOM 0 HB3 LYS A 80 0.336 -3.289 -24.919 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.997 -2.143 -26.341 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.986 -3.473 -27.482 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.434 -3.066 -27.954 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.452 -1.760 -26.785 1.00 0.00 H new ATOM 0 HE2 LYS A 80 1.281 -0.538 -28.123 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.303 -1.844 -29.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.110 -0.034 -30.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.045 -1.426 -29.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.065 -0.160 -28.631 1.00 0.00 H new ATOM 1293 N ILE A 81 3.902 -5.617 -26.185 1.00 0.00 N ATOM 1294 CA ILE A 81 4.634 -6.615 -26.977 1.00 0.00 C ATOM 1295 C ILE A 81 4.258 -8.056 -26.576 1.00 0.00 C ATOM 1296 O ILE A 81 4.065 -8.899 -27.450 1.00 0.00 O ATOM 1297 CB ILE A 81 6.165 -6.343 -26.896 1.00 0.00 C ATOM 1298 CG1 ILE A 81 6.585 -5.345 -27.993 1.00 0.00 C ATOM 1299 CG2 ILE A 81 6.996 -7.640 -26.995 1.00 0.00 C ATOM 1300 CD1 ILE A 81 8.072 -4.957 -27.959 1.00 0.00 C ATOM 0 H ILE A 81 4.493 -4.850 -25.864 1.00 0.00 H new ATOM 0 HA ILE A 81 4.338 -6.516 -28.021 1.00 0.00 H new ATOM 0 HB ILE A 81 6.369 -5.909 -25.917 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.356 -5.777 -28.967 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.983 -4.441 -27.895 1.00 0.00 H new ATOM 0 HG21 ILE A 81 8.057 -7.398 -26.934 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.728 -8.307 -26.176 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.791 -8.132 -27.946 1.00 0.00 H new ATOM 0 HD11 ILE A 81 8.283 -4.252 -28.763 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.305 -4.494 -27.000 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.684 -5.850 -28.089 1.00 0.00 H new ATOM 1312 N CYS A 82 4.090 -8.332 -25.273 1.00 0.00 N ATOM 1313 CA CYS A 82 3.682 -9.668 -24.824 1.00 0.00 C ATOM 1314 C CYS A 82 2.160 -9.846 -24.728 1.00 0.00 C ATOM 1315 O CYS A 82 1.668 -10.936 -24.993 1.00 0.00 O ATOM 1316 CB CYS A 82 4.373 -10.011 -23.511 1.00 0.00 C ATOM 1317 SG CYS A 82 6.149 -10.290 -23.684 1.00 0.00 S ATOM 0 H CYS A 82 4.229 -7.656 -24.522 1.00 0.00 H new ATOM 0 HA CYS A 82 4.003 -10.373 -25.590 1.00 0.00 H new ATOM 0 HB2 CYS A 82 4.208 -9.201 -22.800 1.00 0.00 H new ATOM 0 HB3 CYS A 82 3.912 -10.904 -23.089 1.00 0.00 H new ATOM 1322 N GLU A 83 1.396 -8.786 -24.449 1.00 0.00 N ATOM 1323 CA GLU A 83 -0.078 -8.806 -24.521 1.00 0.00 C ATOM 1324 C GLU A 83 -0.603 -9.169 -25.926 1.00 0.00 C ATOM 1325 O GLU A 83 -1.695 -9.736 -26.043 1.00 0.00 O ATOM 1326 CB GLU A 83 -0.658 -7.446 -24.091 1.00 0.00 C ATOM 1327 CG GLU A 83 -0.418 -7.078 -22.613 1.00 0.00 C ATOM 1328 CD GLU A 83 -1.242 -7.913 -21.606 1.00 0.00 C ATOM 1329 OE1 GLU A 83 -2.205 -8.603 -22.017 1.00 0.00 O ATOM 1330 OE2 GLU A 83 -0.949 -7.859 -20.387 1.00 0.00 O ATOM 0 H GLU A 83 1.778 -7.884 -24.165 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.410 -9.585 -23.835 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.225 -6.667 -24.719 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.731 -7.449 -24.280 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.641 -7.201 -22.388 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.654 -6.023 -22.471 1.00 0.00 H new ATOM 1337 N LYS A 84 0.161 -8.890 -26.997 1.00 0.00 N ATOM 1338 CA LYS A 84 -0.154 -9.337 -28.370 1.00 0.00 C ATOM 1339 C LYS A 84 0.226 -10.804 -28.595 1.00 0.00 C ATOM 1340 O LYS A 84 -0.493 -11.535 -29.275 1.00 0.00 O ATOM 1341 CB LYS A 84 0.569 -8.435 -29.392 1.00 0.00 C ATOM 1342 CG LYS A 84 -0.235 -7.218 -29.881 1.00 0.00 C ATOM 1343 CD LYS A 84 -0.610 -6.183 -28.807 1.00 0.00 C ATOM 1344 CE LYS A 84 -1.898 -6.474 -28.017 1.00 0.00 C ATOM 1345 NZ LYS A 84 -3.123 -6.338 -28.853 1.00 0.00 N ATOM 0 H LYS A 84 1.021 -8.344 -26.936 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.232 -9.255 -28.509 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.498 -8.080 -28.945 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.842 -9.040 -30.256 1.00 0.00 H new ATOM 0 HG2 LYS A 84 0.341 -6.715 -30.657 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -1.152 -7.577 -30.348 1.00 0.00 H new ATOM 0 HD2 LYS A 84 0.217 -6.104 -28.101 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.713 -5.210 -29.287 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -1.850 -7.484 -27.610 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.963 -5.791 -27.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -3.966 -6.461 -28.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.142 -5.394 -29.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -3.117 -7.064 -29.598 1.00 0.00 H new ATOM 1359 N LEU A 85 1.341 -11.242 -28.008 1.00 0.00 N ATOM 1360 CA LEU A 85 1.890 -12.594 -28.160 1.00 0.00 C ATOM 1361 C LEU A 85 1.177 -13.649 -27.309 1.00 0.00 C ATOM 1362 O LEU A 85 1.118 -14.806 -27.709 1.00 0.00 O ATOM 1363 CB LEU A 85 3.395 -12.544 -27.872 1.00 0.00 C ATOM 1364 CG LEU A 85 4.248 -12.152 -29.091 1.00 0.00 C ATOM 1365 CD1 LEU A 85 4.530 -13.400 -29.926 1.00 0.00 C ATOM 1366 CD2 LEU A 85 3.629 -11.106 -30.027 1.00 0.00 C ATOM 0 H LEU A 85 1.904 -10.651 -27.396 1.00 0.00 H new ATOM 0 HA LEU A 85 1.718 -12.916 -29.187 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.578 -11.831 -27.068 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.719 -13.521 -27.512 1.00 0.00 H new ATOM 0 HG LEU A 85 5.145 -11.700 -28.668 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.134 -13.130 -30.792 1.00 0.00 H new ATOM 0 HD12 LEU A 85 5.069 -14.129 -29.321 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.588 -13.833 -30.262 1.00 0.00 H new ATOM 0 HD21 LEU A 85 4.314 -10.904 -30.851 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.687 -11.484 -30.423 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.446 -10.185 -29.473 1.00 0.00 H new ATOM 1378 N LYS A 86 0.546 -13.235 -26.211 1.00 0.00 N ATOM 1379 CA LYS A 86 -0.379 -13.996 -25.374 1.00 0.00 C ATOM 1380 C LYS A 86 -1.453 -14.730 -26.188 1.00 0.00 C ATOM 1381 O LYS A 86 -1.800 -15.875 -25.896 1.00 0.00 O ATOM 1382 CB LYS A 86 -1.007 -12.936 -24.463 1.00 0.00 C ATOM 1383 CG LYS A 86 -1.886 -13.525 -23.373 1.00 0.00 C ATOM 1384 CD LYS A 86 -2.549 -12.413 -22.546 1.00 0.00 C ATOM 1385 CE LYS A 86 -3.649 -11.652 -23.300 1.00 0.00 C ATOM 1386 NZ LYS A 86 -4.148 -10.505 -22.504 1.00 0.00 N ATOM 0 H LYS A 86 0.679 -12.287 -25.857 1.00 0.00 H new ATOM 0 HA LYS A 86 0.134 -14.786 -24.826 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.214 -12.347 -24.002 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -1.601 -12.252 -25.069 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.653 -14.158 -23.820 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.287 -14.161 -22.721 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -2.976 -12.850 -21.643 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -1.784 -11.705 -22.227 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.260 -11.295 -24.253 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -4.474 -12.328 -23.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.008 -10.123 -22.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.367 -10.822 -21.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.419 -9.764 -22.468 1.00 0.00 H new ATOM 1400 N LYS A 87 -1.965 -14.045 -27.218 1.00 0.00 N ATOM 1401 CA LYS A 87 -2.974 -14.549 -28.163 1.00 0.00 C ATOM 1402 C LYS A 87 -2.393 -15.502 -29.213 1.00 0.00 C ATOM 1403 O LYS A 87 -3.102 -16.398 -29.675 1.00 0.00 O ATOM 1404 CB LYS A 87 -3.677 -13.364 -28.852 1.00 0.00 C ATOM 1405 CG LYS A 87 -4.327 -12.345 -27.893 1.00 0.00 C ATOM 1406 CD LYS A 87 -5.329 -12.937 -26.886 1.00 0.00 C ATOM 1407 CE LYS A 87 -6.493 -13.662 -27.579 1.00 0.00 C ATOM 1408 NZ LYS A 87 -7.480 -14.188 -26.597 1.00 0.00 N ATOM 0 H LYS A 87 -1.678 -13.088 -27.425 1.00 0.00 H new ATOM 0 HA LYS A 87 -3.693 -15.128 -27.584 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -2.950 -12.842 -29.475 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -4.446 -13.755 -29.519 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -3.537 -11.837 -27.339 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.838 -11.587 -28.487 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.810 -13.634 -26.228 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.724 -12.139 -26.258 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.992 -12.976 -28.264 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.103 -14.485 -28.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.250 -14.670 -27.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.010 -14.861 -25.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.871 -13.400 -26.042 1.00 0.00 H new ATOM 1422 N LYS A 88 -1.112 -15.329 -29.577 1.00 0.00 N ATOM 1423 CA LYS A 88 -0.382 -16.226 -30.492 1.00 0.00 C ATOM 1424 C LYS A 88 -0.043 -17.557 -29.812 1.00 0.00 C ATOM 1425 O LYS A 88 -0.313 -18.618 -30.376 1.00 0.00 O ATOM 1426 CB LYS A 88 0.891 -15.550 -31.039 1.00 0.00 C ATOM 1427 CG LYS A 88 0.672 -14.153 -31.650 1.00 0.00 C ATOM 1428 CD LYS A 88 -0.326 -14.129 -32.817 1.00 0.00 C ATOM 1429 CE LYS A 88 -0.502 -12.714 -33.385 1.00 0.00 C ATOM 1430 NZ LYS A 88 -1.292 -11.828 -32.484 1.00 0.00 N ATOM 0 H LYS A 88 -0.545 -14.551 -29.240 1.00 0.00 H new ATOM 0 HA LYS A 88 -1.039 -16.438 -31.336 1.00 0.00 H new ATOM 0 HB2 LYS A 88 1.617 -15.467 -30.230 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.331 -16.197 -31.797 1.00 0.00 H new ATOM 0 HG2 LYS A 88 0.319 -13.478 -30.870 1.00 0.00 H new ATOM 0 HG3 LYS A 88 1.630 -13.766 -31.997 1.00 0.00 H new ATOM 0 HD2 LYS A 88 0.020 -14.797 -33.606 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -1.290 -14.508 -32.479 1.00 0.00 H new ATOM 0 HE2 LYS A 88 0.479 -12.271 -33.556 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.997 -12.775 -34.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -1.324 -10.868 -32.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -2.260 -12.198 -32.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -0.845 -11.799 -31.546 1.00 0.00 H new ATOM 1444 N ASP A 89 0.484 -17.510 -28.584 1.00 0.00 N ATOM 1445 CA ASP A 89 0.674 -18.664 -27.694 1.00 0.00 C ATOM 1446 C ASP A 89 0.740 -18.225 -26.212 1.00 0.00 C ATOM 1447 O ASP A 89 1.379 -17.228 -25.867 1.00 0.00 O ATOM 1448 CB ASP A 89 1.949 -19.417 -28.101 1.00 0.00 C ATOM 1449 CG ASP A 89 2.078 -20.737 -27.324 1.00 0.00 C ATOM 1450 OD1 ASP A 89 2.618 -20.727 -26.196 1.00 0.00 O ATOM 1451 OD2 ASP A 89 1.601 -21.782 -27.831 1.00 0.00 O ATOM 0 H ASP A 89 0.802 -16.636 -28.166 1.00 0.00 H new ATOM 0 HA ASP A 89 -0.183 -19.331 -27.795 1.00 0.00 H new ATOM 0 HB2 ASP A 89 1.930 -19.621 -29.172 1.00 0.00 H new ATOM 0 HB3 ASP A 89 2.822 -18.792 -27.911 1.00 0.00 H new ATOM 1456 N SER A 90 0.074 -18.964 -25.321 1.00 0.00 N ATOM 1457 CA SER A 90 -0.090 -18.580 -23.911 1.00 0.00 C ATOM 1458 C SER A 90 1.189 -18.640 -23.062 1.00 0.00 C ATOM 1459 O SER A 90 1.330 -17.857 -22.119 1.00 0.00 O ATOM 1460 CB SER A 90 -1.167 -19.456 -23.260 1.00 0.00 C ATOM 1461 OG SER A 90 -0.817 -20.828 -23.341 1.00 0.00 O ATOM 0 H SER A 90 -0.370 -19.851 -25.556 1.00 0.00 H new ATOM 0 HA SER A 90 -0.381 -17.530 -23.933 1.00 0.00 H new ATOM 0 HB2 SER A 90 -1.293 -19.169 -22.216 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.124 -19.290 -23.754 1.00 0.00 H new ATOM 0 HG SER A 90 -1.516 -21.369 -22.919 1.00 0.00 H new ATOM 1467 N GLN A 91 2.148 -19.525 -23.371 1.00 0.00 N ATOM 1468 CA GLN A 91 3.309 -19.810 -22.506 1.00 0.00 C ATOM 1469 C GLN A 91 4.256 -18.612 -22.323 1.00 0.00 C ATOM 1470 O GLN A 91 5.068 -18.588 -21.399 1.00 0.00 O ATOM 1471 CB GLN A 91 4.093 -21.024 -23.040 1.00 0.00 C ATOM 1472 CG GLN A 91 3.266 -22.302 -23.251 1.00 0.00 C ATOM 1473 CD GLN A 91 2.517 -22.731 -21.996 1.00 0.00 C ATOM 1474 OE1 GLN A 91 3.024 -23.445 -21.137 1.00 0.00 O ATOM 1475 NE2 GLN A 91 1.286 -22.299 -21.841 1.00 0.00 N ATOM 0 H GLN A 91 2.142 -20.069 -24.234 1.00 0.00 H new ATOM 0 HA GLN A 91 2.900 -20.033 -21.521 1.00 0.00 H new ATOM 0 HB2 GLN A 91 4.554 -20.749 -23.989 1.00 0.00 H new ATOM 0 HB3 GLN A 91 4.903 -21.246 -22.345 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.551 -22.138 -24.058 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.926 -23.109 -23.569 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.861 -21.705 -22.553 1.00 0.00 H new ATOM 0 HE22 GLN A 91 0.756 -22.557 -21.009 1.00 0.00 H new ATOM 1484 N ILE A 92 4.113 -17.603 -23.183 1.00 0.00 N ATOM 1485 CA ILE A 92 4.889 -16.362 -23.234 1.00 0.00 C ATOM 1486 C ILE A 92 4.604 -15.487 -21.994 1.00 0.00 C ATOM 1487 O ILE A 92 5.498 -14.783 -21.521 1.00 0.00 O ATOM 1488 CB ILE A 92 4.562 -15.634 -24.567 1.00 0.00 C ATOM 1489 CG1 ILE A 92 5.073 -16.352 -25.846 1.00 0.00 C ATOM 1490 CG2 ILE A 92 5.138 -14.203 -24.603 1.00 0.00 C ATOM 1491 CD1 ILE A 92 4.856 -17.870 -25.972 1.00 0.00 C ATOM 0 H ILE A 92 3.402 -17.633 -23.914 1.00 0.00 H new ATOM 0 HA ILE A 92 5.957 -16.579 -23.211 1.00 0.00 H new ATOM 0 HB ILE A 92 3.472 -15.630 -24.580 1.00 0.00 H new ATOM 0 HG12 ILE A 92 4.599 -15.877 -26.705 1.00 0.00 H new ATOM 0 HG13 ILE A 92 6.143 -16.162 -25.928 1.00 0.00 H new ATOM 0 HG21 ILE A 92 4.885 -13.733 -25.553 1.00 0.00 H new ATOM 0 HG22 ILE A 92 4.715 -13.620 -23.785 1.00 0.00 H new ATOM 0 HG23 ILE A 92 6.222 -14.244 -24.496 1.00 0.00 H new ATOM 0 HD11 ILE A 92 5.268 -18.219 -26.919 1.00 0.00 H new ATOM 0 HD12 ILE A 92 5.357 -18.379 -25.149 1.00 0.00 H new ATOM 0 HD13 ILE A 92 3.789 -18.089 -25.938 1.00 0.00 H new ATOM 1503 N CYS A 93 3.394 -15.588 -21.421 1.00 0.00 N ATOM 1504 CA CYS A 93 2.951 -14.797 -20.262 1.00 0.00 C ATOM 1505 C CYS A 93 2.585 -15.637 -19.021 1.00 0.00 C ATOM 1506 O CYS A 93 2.556 -15.101 -17.915 1.00 0.00 O ATOM 1507 CB CYS A 93 1.785 -13.887 -20.669 1.00 0.00 C ATOM 1508 SG CYS A 93 2.163 -12.729 -22.003 1.00 0.00 S ATOM 0 H CYS A 93 2.681 -16.236 -21.758 1.00 0.00 H new ATOM 0 HA CYS A 93 3.807 -14.196 -19.956 1.00 0.00 H new ATOM 0 HB2 CYS A 93 0.945 -14.510 -20.974 1.00 0.00 H new ATOM 0 HB3 CYS A 93 1.461 -13.321 -19.795 1.00 0.00 H new ATOM 0 HG CYS A 93 1.111 -12.013 -22.267 1.00 0.00 H new ATOM 1513 N GLU A 94 2.413 -16.960 -19.150 1.00 0.00 N ATOM 1514 CA GLU A 94 2.276 -17.885 -18.003 1.00 0.00 C ATOM 1515 C GLU A 94 3.514 -17.897 -17.077 1.00 0.00 C ATOM 1516 O GLU A 94 3.447 -18.396 -15.953 1.00 0.00 O ATOM 1517 CB GLU A 94 2.003 -19.312 -18.500 1.00 0.00 C ATOM 1518 CG GLU A 94 0.664 -19.475 -19.235 1.00 0.00 C ATOM 1519 CD GLU A 94 -0.502 -19.678 -18.255 1.00 0.00 C ATOM 1520 OE1 GLU A 94 -1.037 -18.674 -17.721 1.00 0.00 O ATOM 1521 OE2 GLU A 94 -0.896 -20.847 -18.017 1.00 0.00 O ATOM 0 H GLU A 94 2.364 -17.427 -20.056 1.00 0.00 H new ATOM 0 HA GLU A 94 1.435 -17.518 -17.415 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.810 -19.613 -19.167 1.00 0.00 H new ATOM 0 HB3 GLU A 94 2.023 -19.992 -17.648 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.475 -18.593 -19.847 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.722 -20.327 -19.913 1.00 0.00 H new ATOM 1744 N LEU A 108 -4.281 -18.773 0.701 1.00 0.00 N ATOM 1745 CA LEU A 108 -4.014 -18.931 2.145 1.00 0.00 C ATOM 1746 C LEU A 108 -2.531 -18.751 2.544 1.00 0.00 C ATOM 1747 O LEU A 108 -2.231 -18.590 3.725 1.00 0.00 O ATOM 1748 CB LEU A 108 -4.501 -20.319 2.606 1.00 0.00 C ATOM 1749 CG LEU A 108 -5.959 -20.687 2.289 1.00 0.00 C ATOM 1750 CD1 LEU A 108 -6.290 -22.035 2.920 1.00 0.00 C ATOM 1751 CD2 LEU A 108 -6.964 -19.649 2.785 1.00 0.00 C ATOM 0 HA LEU A 108 -4.561 -18.130 2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -3.855 -21.072 2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -4.362 -20.386 3.685 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.044 -20.727 1.203 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -7.324 -22.297 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -5.626 -22.799 2.516 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -6.157 -21.974 4.000 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.974 -19.969 2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -6.878 -19.548 3.867 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.758 -18.688 2.313 1.00 0.00 H new ATOM 1763 N LYS A 109 -1.595 -18.753 1.583 1.00 0.00 N ATOM 1764 CA LYS A 109 -0.183 -18.372 1.793 1.00 0.00 C ATOM 1765 C LYS A 109 -0.001 -16.882 2.118 1.00 0.00 C ATOM 1766 O LYS A 109 0.928 -16.527 2.845 1.00 0.00 O ATOM 1767 CB LYS A 109 0.649 -18.747 0.553 1.00 0.00 C ATOM 1768 CG LYS A 109 0.737 -20.266 0.353 1.00 0.00 C ATOM 1769 CD LYS A 109 1.593 -20.599 -0.873 1.00 0.00 C ATOM 1770 CE LYS A 109 1.574 -22.114 -1.098 1.00 0.00 C ATOM 1771 NZ LYS A 109 2.411 -22.504 -2.268 1.00 0.00 N ATOM 0 H LYS A 109 -1.798 -19.023 0.621 1.00 0.00 H new ATOM 0 HA LYS A 109 0.168 -18.926 2.663 1.00 0.00 H new ATOM 0 HB2 LYS A 109 0.205 -18.291 -0.332 1.00 0.00 H new ATOM 0 HB3 LYS A 109 1.654 -18.336 0.654 1.00 0.00 H new ATOM 0 HG2 LYS A 109 1.166 -20.731 1.240 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.263 -20.681 0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 109 1.208 -20.083 -1.752 1.00 0.00 H new ATOM 0 HD3 LYS A 109 2.616 -20.253 -0.723 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.938 -22.620 -0.204 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.548 -22.446 -1.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.376 -23.536 -2.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 2.048 -22.040 -3.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.395 -22.208 -2.105 1.00 0.00 H new ATOM 1785 N LYS A 110 -0.891 -16.014 1.612 1.00 0.00 N ATOM 1786 CA LYS A 110 -0.923 -14.552 1.843 1.00 0.00 C ATOM 1787 C LYS A 110 -1.620 -14.194 3.158 1.00 0.00 C ATOM 1788 O LYS A 110 -1.192 -13.283 3.869 1.00 0.00 O ATOM 1789 CB LYS A 110 -1.629 -13.913 0.634 1.00 0.00 C ATOM 1790 CG LYS A 110 -1.616 -12.377 0.604 1.00 0.00 C ATOM 1791 CD LYS A 110 -2.714 -11.613 1.373 1.00 0.00 C ATOM 1792 CE LYS A 110 -4.114 -12.191 1.135 1.00 0.00 C ATOM 1793 NZ LYS A 110 -5.183 -11.240 1.555 1.00 0.00 N ATOM 0 H LYS A 110 -1.647 -16.323 1.000 1.00 0.00 H new ATOM 0 HA LYS A 110 0.092 -14.167 1.937 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -1.159 -14.282 -0.277 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.665 -14.252 0.618 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.651 -12.047 0.989 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -1.666 -12.066 -0.440 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -2.491 -11.640 2.440 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.702 -10.566 1.071 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -4.234 -12.430 0.078 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -4.221 -13.125 1.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -6.115 -11.666 1.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -5.084 -11.032 2.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -5.097 -10.358 1.010 1.00 0.00 H new ATOM 1807 N LEU A 111 -2.681 -14.943 3.467 1.00 0.00 N ATOM 1808 CA LEU A 111 -3.382 -14.973 4.763 1.00 0.00 C ATOM 1809 C LEU A 111 -2.400 -15.191 5.930 1.00 0.00 C ATOM 1810 O LEU A 111 -1.232 -15.540 5.749 1.00 0.00 O ATOM 1811 CB LEU A 111 -4.453 -16.088 4.780 1.00 0.00 C ATOM 1812 CG LEU A 111 -5.787 -15.849 4.051 1.00 0.00 C ATOM 1813 CD1 LEU A 111 -6.754 -15.065 4.929 1.00 0.00 C ATOM 1814 CD2 LEU A 111 -5.689 -15.123 2.714 1.00 0.00 C ATOM 0 H LEU A 111 -3.100 -15.579 2.789 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.865 -14.004 4.891 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.002 -16.985 4.356 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -4.682 -16.309 5.822 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.145 -16.857 3.842 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -7.689 -14.909 4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.950 -15.624 5.844 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.315 -14.100 5.181 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.686 -15.008 2.288 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -5.244 -14.140 2.866 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.067 -15.701 2.031 1.00 0.00 H new ATOM 1826 N ARG A 112 -2.897 -15.018 7.152 1.00 0.00 N ATOM 1827 CA ARG A 112 -2.142 -15.212 8.411 1.00 0.00 C ATOM 1828 C ARG A 112 -2.700 -16.398 9.194 1.00 0.00 C ATOM 1829 O ARG A 112 -3.889 -16.696 9.113 1.00 0.00 O ATOM 1830 CB ARG A 112 -2.182 -13.921 9.262 1.00 0.00 C ATOM 1831 CG ARG A 112 -1.120 -12.868 8.885 1.00 0.00 C ATOM 1832 CD ARG A 112 -1.306 -12.199 7.516 1.00 0.00 C ATOM 1833 NE ARG A 112 -2.568 -11.435 7.434 1.00 0.00 N ATOM 1834 CZ ARG A 112 -2.974 -10.710 6.407 1.00 0.00 C ATOM 1835 NH1 ARG A 112 -2.337 -10.698 5.270 1.00 0.00 N ATOM 1836 NH2 ARG A 112 -4.043 -9.975 6.504 1.00 0.00 N ATOM 0 H ARG A 112 -3.863 -14.731 7.310 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.103 -15.430 8.166 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.170 -13.471 9.168 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.052 -14.189 10.311 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -1.116 -12.092 9.651 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.139 -13.343 8.907 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -0.466 -11.532 7.323 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -1.293 -12.961 6.737 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.183 -11.471 8.247 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.495 -11.261 5.151 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.681 -10.125 4.499 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -4.572 -9.957 7.376 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -4.352 -9.417 5.708 1.00 0.00 H new ATOM 1850 N VAL A 113 -1.863 -17.026 10.025 1.00 0.00 N ATOM 1851 CA VAL A 113 -2.235 -18.157 10.907 1.00 0.00 C ATOM 1852 C VAL A 113 -3.483 -17.850 11.750 1.00 0.00 C ATOM 1853 O VAL A 113 -4.344 -18.713 11.913 1.00 0.00 O ATOM 1854 CB VAL A 113 -1.035 -18.550 11.797 1.00 0.00 C ATOM 1855 CG1 VAL A 113 -1.403 -19.492 12.949 1.00 0.00 C ATOM 1856 CG2 VAL A 113 0.040 -19.253 10.955 1.00 0.00 C ATOM 0 H VAL A 113 -0.882 -16.762 10.112 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.493 -19.005 10.273 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.673 -17.615 12.223 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -0.510 -19.723 13.529 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.139 -19.010 13.592 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.822 -20.414 12.546 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.881 -19.525 11.593 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.381 -20.152 10.505 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.384 -18.581 10.169 1.00 0.00 H new ATOM 1866 N LYS A 114 -3.630 -16.601 12.213 1.00 0.00 N ATOM 1867 CA LYS A 114 -4.786 -16.130 13.000 1.00 0.00 C ATOM 1868 C LYS A 114 -6.119 -16.233 12.245 1.00 0.00 C ATOM 1869 O LYS A 114 -7.163 -16.462 12.858 1.00 0.00 O ATOM 1870 CB LYS A 114 -4.539 -14.681 13.456 1.00 0.00 C ATOM 1871 CG LYS A 114 -3.307 -14.565 14.368 1.00 0.00 C ATOM 1872 CD LYS A 114 -3.125 -13.159 14.958 1.00 0.00 C ATOM 1873 CE LYS A 114 -2.846 -12.099 13.879 1.00 0.00 C ATOM 1874 NZ LYS A 114 -2.595 -10.762 14.485 1.00 0.00 N ATOM 0 H LYS A 114 -2.936 -15.872 12.049 1.00 0.00 H new ATOM 0 HA LYS A 114 -4.876 -16.788 13.864 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.404 -14.044 12.582 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.418 -14.313 13.986 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.395 -15.285 15.181 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.416 -14.833 13.801 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.022 -12.882 15.512 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.301 -13.172 15.672 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -1.982 -12.400 13.286 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.695 -12.038 13.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.410 -10.069 13.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.429 -10.466 15.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.770 -10.816 15.116 1.00 0.00 H new ATOM 1888 N GLU A 115 -6.077 -16.092 10.920 1.00 0.00 N ATOM 1889 CA GLU A 115 -7.225 -16.257 10.026 1.00 0.00 C ATOM 1890 C GLU A 115 -7.489 -17.745 9.750 1.00 0.00 C ATOM 1891 O GLU A 115 -8.634 -18.196 9.779 1.00 0.00 O ATOM 1892 CB GLU A 115 -6.935 -15.543 8.693 1.00 0.00 C ATOM 1893 CG GLU A 115 -6.439 -14.098 8.829 1.00 0.00 C ATOM 1894 CD GLU A 115 -7.576 -13.125 9.187 1.00 0.00 C ATOM 1895 OE1 GLU A 115 -7.873 -12.953 10.394 1.00 0.00 O ATOM 1896 OE2 GLU A 115 -8.180 -12.521 8.268 1.00 0.00 O ATOM 0 H GLU A 115 -5.218 -15.853 10.424 1.00 0.00 H new ATOM 0 HA GLU A 115 -8.105 -15.826 10.504 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -6.189 -16.118 8.145 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -7.844 -15.545 8.091 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -5.667 -14.051 9.598 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -5.976 -13.785 7.893 1.00 0.00 H new ATOM 1903 N LEU A 116 -6.424 -18.520 9.519 1.00 0.00 N ATOM 1904 CA LEU A 116 -6.515 -19.946 9.188 1.00 0.00 C ATOM 1905 C LEU A 116 -7.066 -20.792 10.353 1.00 0.00 C ATOM 1906 O LEU A 116 -7.895 -21.674 10.139 1.00 0.00 O ATOM 1907 CB LEU A 116 -5.161 -20.481 8.702 1.00 0.00 C ATOM 1908 CG LEU A 116 -4.545 -19.752 7.494 1.00 0.00 C ATOM 1909 CD1 LEU A 116 -3.384 -20.574 6.944 1.00 0.00 C ATOM 1910 CD2 LEU A 116 -5.526 -19.505 6.353 1.00 0.00 C ATOM 0 H LEU A 116 -5.466 -18.172 9.557 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.234 -20.038 8.374 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.454 -20.432 9.530 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.279 -21.534 8.445 1.00 0.00 H new ATOM 0 HG LEU A 116 -4.222 -18.779 7.865 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -2.947 -20.059 6.089 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.627 -20.698 7.718 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -3.747 -21.553 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -5.016 -18.988 5.540 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -5.911 -20.458 5.991 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -6.353 -18.892 6.711 1.00 0.00 H new ATOM 1922 N LYS A 117 -6.701 -20.447 11.594 1.00 0.00 N ATOM 1923 CA LYS A 117 -7.236 -20.994 12.860 1.00 0.00 C ATOM 1924 C LYS A 117 -8.755 -20.885 13.022 1.00 0.00 C ATOM 1925 O LYS A 117 -9.314 -21.553 13.894 1.00 0.00 O ATOM 1926 CB LYS A 117 -6.566 -20.282 14.051 1.00 0.00 C ATOM 1927 CG LYS A 117 -5.138 -20.769 14.315 1.00 0.00 C ATOM 1928 CD LYS A 117 -4.384 -19.847 15.284 1.00 0.00 C ATOM 1929 CE LYS A 117 -4.996 -19.866 16.692 1.00 0.00 C ATOM 1930 NZ LYS A 117 -4.209 -19.041 17.646 1.00 0.00 N ATOM 0 H LYS A 117 -5.985 -19.740 11.757 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.006 -22.059 12.833 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -6.549 -19.209 13.862 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -7.168 -20.438 14.946 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -5.170 -21.778 14.726 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -4.594 -20.826 13.372 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -3.340 -20.155 15.339 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -4.396 -18.828 14.898 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.020 -19.494 16.649 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -5.045 -20.893 17.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -4.653 -19.078 18.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -3.239 -19.411 17.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -4.184 -18.056 17.314 1.00 0.00 H new ATOM 1944 N LYS A 118 -9.433 -20.076 12.198 1.00 0.00 N ATOM 1945 CA LYS A 118 -10.903 -19.995 12.173 1.00 0.00 C ATOM 1946 C LYS A 118 -11.533 -20.990 11.194 1.00 0.00 C ATOM 1947 O LYS A 118 -12.640 -21.459 11.431 1.00 0.00 O ATOM 1948 CB LYS A 118 -11.331 -18.548 11.861 1.00 0.00 C ATOM 1949 CG LYS A 118 -12.852 -18.328 11.871 1.00 0.00 C ATOM 1950 CD LYS A 118 -13.563 -18.635 13.205 1.00 0.00 C ATOM 1951 CE LYS A 118 -13.031 -17.852 14.416 1.00 0.00 C ATOM 1952 NZ LYS A 118 -13.330 -16.398 14.327 1.00 0.00 N ATOM 0 H LYS A 118 -8.978 -19.457 11.527 1.00 0.00 H new ATOM 0 HA LYS A 118 -11.273 -20.275 13.159 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -10.873 -17.880 12.590 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -10.940 -18.268 10.883 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -13.052 -17.290 11.604 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -13.296 -18.949 11.093 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -14.626 -18.422 13.091 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -13.472 -19.701 13.412 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -13.471 -18.255 15.328 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -11.953 -17.994 14.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -12.951 -15.914 15.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -12.889 -16.005 13.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -14.359 -16.257 14.281 1.00 0.00 H new ATOM 1966 N ILE A 119 -10.841 -21.348 10.114 1.00 0.00 N ATOM 1967 CA ILE A 119 -11.414 -22.116 8.995 1.00 0.00 C ATOM 1968 C ILE A 119 -11.834 -23.526 9.436 1.00 0.00 C ATOM 1969 O ILE A 119 -12.997 -23.911 9.314 1.00 0.00 O ATOM 1970 CB ILE A 119 -10.389 -22.189 7.846 1.00 0.00 C ATOM 1971 CG1 ILE A 119 -9.812 -20.824 7.417 1.00 0.00 C ATOM 1972 CG2 ILE A 119 -11.011 -22.932 6.666 1.00 0.00 C ATOM 1973 CD1 ILE A 119 -10.788 -19.675 7.175 1.00 0.00 C ATOM 0 H ILE A 119 -9.857 -21.114 9.984 1.00 0.00 H new ATOM 0 HA ILE A 119 -12.312 -21.605 8.648 1.00 0.00 H new ATOM 0 HB ILE A 119 -9.527 -22.739 8.223 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.105 -20.505 8.183 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -9.242 -20.976 6.500 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -10.291 -22.987 5.850 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -11.286 -23.940 6.975 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -11.901 -22.400 6.329 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -10.235 -18.783 6.880 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -11.483 -19.949 6.382 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -11.344 -19.471 8.090 1.00 0.00 H new ATOM 1985 N LEU A 120 -10.886 -24.268 10.014 1.00 0.00 N ATOM 1986 CA LEU A 120 -11.096 -25.576 10.628 1.00 0.00 C ATOM 1987 C LEU A 120 -12.034 -25.508 11.851 1.00 0.00 C ATOM 1988 O LEU A 120 -12.710 -26.481 12.163 1.00 0.00 O ATOM 1989 CB LEU A 120 -9.737 -26.252 10.966 1.00 0.00 C ATOM 1990 CG LEU A 120 -8.497 -25.433 11.338 1.00 0.00 C ATOM 1991 CD1 LEU A 120 -7.777 -24.920 10.091 1.00 0.00 C ATOM 1992 CD2 LEU A 120 -8.827 -24.324 12.332 1.00 0.00 C ATOM 0 H LEU A 120 -9.915 -23.960 10.068 1.00 0.00 H new ATOM 0 HA LEU A 120 -11.605 -26.203 9.896 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -9.923 -26.936 11.794 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -9.465 -26.861 10.104 1.00 0.00 H new ATOM 0 HG LEU A 120 -7.800 -26.097 11.849 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -6.902 -24.343 10.388 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -7.463 -25.765 9.478 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -8.452 -24.286 9.516 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -7.921 -23.767 12.570 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -9.563 -23.650 11.894 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -9.233 -24.762 13.244 1.00 0.00 H new ATOM 2004 N ASP A 121 -12.103 -24.372 12.538 1.00 0.00 N ATOM 2005 CA ASP A 121 -12.975 -24.181 13.705 1.00 0.00 C ATOM 2006 C ASP A 121 -14.439 -23.926 13.302 1.00 0.00 C ATOM 2007 O ASP A 121 -15.362 -24.313 14.021 1.00 0.00 O ATOM 2008 CB ASP A 121 -12.423 -23.030 14.556 1.00 0.00 C ATOM 2009 CG ASP A 121 -13.230 -22.825 15.848 1.00 0.00 C ATOM 2010 OD1 ASP A 121 -13.134 -23.676 16.765 1.00 0.00 O ATOM 2011 OD2 ASP A 121 -13.939 -21.796 15.965 1.00 0.00 O ATOM 0 H ASP A 121 -11.552 -23.547 12.302 1.00 0.00 H new ATOM 0 HA ASP A 121 -12.978 -25.100 14.291 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -11.382 -23.233 14.808 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -12.436 -22.110 13.972 1.00 0.00 H new ATOM 2016 N ASP A 122 -14.660 -23.333 12.123 1.00 0.00 N ATOM 2017 CA ASP A 122 -15.989 -23.117 11.543 1.00 0.00 C ATOM 2018 C ASP A 122 -16.651 -24.427 11.071 1.00 0.00 C ATOM 2019 O ASP A 122 -17.878 -24.555 11.113 1.00 0.00 O ATOM 2020 CB ASP A 122 -15.878 -22.120 10.380 1.00 0.00 C ATOM 2021 CG ASP A 122 -17.263 -21.705 9.857 1.00 0.00 C ATOM 2022 OD1 ASP A 122 -17.993 -20.993 10.588 1.00 0.00 O ATOM 2023 OD2 ASP A 122 -17.618 -22.056 8.705 1.00 0.00 O ATOM 0 H ASP A 122 -13.904 -22.983 11.534 1.00 0.00 H new ATOM 0 HA ASP A 122 -16.632 -22.710 12.324 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -15.333 -21.235 10.709 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -15.302 -22.567 9.570 1.00 0.00 H new ATOM 2028 N TRP A 123 -15.843 -25.424 10.684 1.00 0.00 N ATOM 2029 CA TRP A 123 -16.315 -26.763 10.310 1.00 0.00 C ATOM 2030 C TRP A 123 -16.344 -27.734 11.500 1.00 0.00 C ATOM 2031 O TRP A 123 -17.202 -28.623 11.536 1.00 0.00 O ATOM 2032 CB TRP A 123 -15.397 -27.344 9.229 1.00 0.00 C ATOM 2033 CG TRP A 123 -15.194 -26.512 7.997 1.00 0.00 C ATOM 2034 CD1 TRP A 123 -16.103 -25.690 7.421 1.00 0.00 C ATOM 2035 CD2 TRP A 123 -13.995 -26.416 7.164 1.00 0.00 C ATOM 2036 NE1 TRP A 123 -15.556 -25.096 6.300 1.00 0.00 N ATOM 2037 CE2 TRP A 123 -14.264 -25.528 6.078 1.00 0.00 C ATOM 2038 CE3 TRP A 123 -12.719 -27.019 7.205 1.00 0.00 C ATOM 2039 CZ2 TRP A 123 -13.337 -25.285 5.054 1.00 0.00 C ATOM 2040 CZ3 TRP A 123 -11.765 -26.746 6.210 1.00 0.00 C ATOM 2041 CH2 TRP A 123 -12.084 -25.916 5.118 1.00 0.00 C ATOM 0 H TRP A 123 -14.830 -25.321 10.621 1.00 0.00 H new ATOM 0 HA TRP A 123 -17.335 -26.651 9.943 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -14.421 -27.532 9.677 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -15.800 -28.310 8.924 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -17.106 -25.524 7.784 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -16.045 -24.423 5.710 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -12.474 -27.697 8.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 -13.582 -24.627 4.234 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -10.777 -27.177 6.283 1.00 0.00 H new ATOM 0 HH2 TRP A 123 -11.363 -25.764 4.328 1.00 0.00 H new ATOM 2052 N GLY A 124 -15.411 -27.588 12.452 1.00 0.00 N ATOM 2053 CA GLY A 124 -15.277 -28.481 13.610 1.00 0.00 C ATOM 2054 C GLY A 124 -14.052 -29.402 13.575 1.00 0.00 C ATOM 2055 O GLY A 124 -13.903 -30.270 14.438 1.00 0.00 O ATOM 0 H GLY A 124 -14.721 -26.837 12.438 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -15.232 -27.875 14.515 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -16.174 -29.096 13.682 1.00 0.00 H new ATOM 2059 N GLU A 125 -13.170 -29.222 12.589 1.00 0.00 N ATOM 2060 CA GLU A 125 -11.853 -29.867 12.513 1.00 0.00 C ATOM 2061 C GLU A 125 -10.947 -29.476 13.694 1.00 0.00 C ATOM 2062 O GLU A 125 -10.276 -30.330 14.281 1.00 0.00 O ATOM 2063 CB GLU A 125 -11.155 -29.389 11.232 1.00 0.00 C ATOM 2064 CG GLU A 125 -11.634 -30.009 9.923 1.00 0.00 C ATOM 2065 CD GLU A 125 -11.311 -31.512 9.865 1.00 0.00 C ATOM 2066 OE1 GLU A 125 -10.112 -31.872 9.767 1.00 0.00 O ATOM 2067 OE2 GLU A 125 -12.247 -32.343 9.950 1.00 0.00 O ATOM 0 H GLU A 125 -13.356 -28.606 11.798 1.00 0.00 H new ATOM 0 HA GLU A 125 -12.010 -30.945 12.529 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -11.275 -28.308 11.161 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -10.087 -29.585 11.332 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -12.709 -29.862 9.820 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -11.161 -29.501 9.083 1.00 0.00 H new ATOM 2147 N GLU A 132 2.574 -24.205 12.130 1.00 0.00 N ATOM 2148 CA GLU A 132 2.970 -23.210 11.127 1.00 0.00 C ATOM 2149 C GLU A 132 1.917 -23.134 10.016 1.00 0.00 C ATOM 2150 O GLU A 132 1.164 -24.090 9.818 1.00 0.00 O ATOM 2151 CB GLU A 132 4.341 -23.582 10.540 1.00 0.00 C ATOM 2152 CG GLU A 132 4.343 -24.899 9.744 1.00 0.00 C ATOM 2153 CD GLU A 132 5.750 -25.218 9.212 1.00 0.00 C ATOM 2154 OE1 GLU A 132 6.611 -25.703 9.987 1.00 0.00 O ATOM 2155 OE2 GLU A 132 6.014 -24.982 8.007 1.00 0.00 O ATOM 0 HA GLU A 132 3.043 -22.232 11.602 1.00 0.00 H new ATOM 0 HB2 GLU A 132 4.677 -22.775 9.889 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.064 -23.659 11.352 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.998 -25.714 10.381 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.643 -24.826 8.911 1.00 0.00 H new ATOM 2162 N LYS A 133 1.874 -22.022 9.269 1.00 0.00 N ATOM 2163 CA LYS A 133 0.818 -21.715 8.283 1.00 0.00 C ATOM 2164 C LYS A 133 0.489 -22.885 7.354 1.00 0.00 C ATOM 2165 O LYS A 133 -0.651 -23.329 7.333 1.00 0.00 O ATOM 2166 CB LYS A 133 1.214 -20.439 7.524 1.00 0.00 C ATOM 2167 CG LYS A 133 -0.004 -19.757 6.884 1.00 0.00 C ATOM 2168 CD LYS A 133 0.371 -18.596 5.951 1.00 0.00 C ATOM 2169 CE LYS A 133 1.297 -17.559 6.602 1.00 0.00 C ATOM 2170 NZ LYS A 133 1.464 -16.364 5.732 1.00 0.00 N ATOM 0 H LYS A 133 2.585 -21.293 9.332 1.00 0.00 H new ATOM 0 HA LYS A 133 -0.116 -21.540 8.817 1.00 0.00 H new ATOM 0 HB2 LYS A 133 1.702 -19.745 8.209 1.00 0.00 H new ATOM 0 HB3 LYS A 133 1.941 -20.687 6.750 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -0.572 -20.497 6.321 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -0.659 -19.384 7.672 1.00 0.00 H new ATOM 0 HD2 LYS A 133 0.857 -18.998 5.062 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -0.540 -18.099 5.619 1.00 0.00 H new ATOM 0 HE2 LYS A 133 0.887 -17.256 7.565 1.00 0.00 H new ATOM 0 HE3 LYS A 133 2.271 -18.009 6.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 2.285 -15.813 6.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 1.615 -16.669 4.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 0.609 -15.774 5.784 1.00 0.00 H new ATOM 2184 N SER A 134 1.485 -23.449 6.675 1.00 0.00 N ATOM 2185 CA SER A 134 1.377 -24.636 5.811 1.00 0.00 C ATOM 2186 C SER A 134 0.619 -25.820 6.420 1.00 0.00 C ATOM 2187 O SER A 134 -0.159 -26.465 5.714 1.00 0.00 O ATOM 2188 CB SER A 134 2.775 -25.123 5.417 1.00 0.00 C ATOM 2189 OG SER A 134 3.504 -24.083 4.779 1.00 0.00 O ATOM 0 H SER A 134 2.435 -23.079 6.709 1.00 0.00 H new ATOM 0 HA SER A 134 0.797 -24.300 4.952 1.00 0.00 H new ATOM 0 HB2 SER A 134 3.312 -25.460 6.304 1.00 0.00 H new ATOM 0 HB3 SER A 134 2.693 -25.980 4.749 1.00 0.00 H new ATOM 0 HG SER A 134 4.395 -24.410 4.535 1.00 0.00 H new ATOM 2195 N ASP A 135 0.791 -26.101 7.718 1.00 0.00 N ATOM 2196 CA ASP A 135 0.062 -27.182 8.392 1.00 0.00 C ATOM 2197 C ASP A 135 -1.439 -26.886 8.580 1.00 0.00 C ATOM 2198 O ASP A 135 -2.235 -27.818 8.718 1.00 0.00 O ATOM 2199 CB ASP A 135 0.739 -27.601 9.706 1.00 0.00 C ATOM 2200 CG ASP A 135 1.993 -28.469 9.481 1.00 0.00 C ATOM 2201 OD1 ASP A 135 1.998 -29.332 8.567 1.00 0.00 O ATOM 2202 OD2 ASP A 135 2.966 -28.324 10.258 1.00 0.00 O ATOM 0 H ASP A 135 1.433 -25.591 8.325 1.00 0.00 H new ATOM 0 HA ASP A 135 0.110 -28.037 7.717 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.016 -26.709 10.267 1.00 0.00 H new ATOM 0 HB3 ASP A 135 0.025 -28.153 10.317 1.00 0.00 H new ATOM 2207 N TYR A 136 -1.841 -25.611 8.517 1.00 0.00 N ATOM 2208 CA TYR A 136 -3.246 -25.209 8.413 1.00 0.00 C ATOM 2209 C TYR A 136 -3.714 -25.272 6.951 1.00 0.00 C ATOM 2210 O TYR A 136 -4.726 -25.910 6.668 1.00 0.00 O ATOM 2211 CB TYR A 136 -3.453 -23.784 8.940 1.00 0.00 C ATOM 2212 CG TYR A 136 -3.138 -23.578 10.408 1.00 0.00 C ATOM 2213 CD1 TYR A 136 -1.826 -23.245 10.791 1.00 0.00 C ATOM 2214 CD2 TYR A 136 -4.142 -23.701 11.387 1.00 0.00 C ATOM 2215 CE1 TYR A 136 -1.497 -23.061 12.148 1.00 0.00 C ATOM 2216 CE2 TYR A 136 -3.831 -23.474 12.740 1.00 0.00 C ATOM 2217 CZ TYR A 136 -2.509 -23.164 13.130 1.00 0.00 C ATOM 2218 OH TYR A 136 -2.216 -22.990 14.447 1.00 0.00 O ATOM 0 H TYR A 136 -1.193 -24.823 8.537 1.00 0.00 H new ATOM 0 HA TYR A 136 -3.831 -25.901 9.018 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.833 -23.105 8.355 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -4.490 -23.498 8.766 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -1.062 -23.129 10.036 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -5.148 -23.969 11.100 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -0.479 -22.843 12.436 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -4.609 -23.537 13.486 1.00 0.00 H new ATOM 0 HH TYR A 136 -3.031 -23.095 14.980 1.00 0.00 H new ATOM 2228 N ILE A 137 -2.971 -24.663 6.010 1.00 0.00 N ATOM 2229 CA ILE A 137 -3.314 -24.601 4.571 1.00 0.00 C ATOM 2230 C ILE A 137 -3.677 -25.997 4.043 1.00 0.00 C ATOM 2231 O ILE A 137 -4.724 -26.178 3.428 1.00 0.00 O ATOM 2232 CB ILE A 137 -2.145 -24.011 3.734 1.00 0.00 C ATOM 2233 CG1 ILE A 137 -1.729 -22.598 4.207 1.00 0.00 C ATOM 2234 CG2 ILE A 137 -2.479 -23.985 2.228 1.00 0.00 C ATOM 2235 CD1 ILE A 137 -0.537 -21.976 3.467 1.00 0.00 C ATOM 0 H ILE A 137 -2.095 -24.189 6.230 1.00 0.00 H new ATOM 0 HA ILE A 137 -4.176 -23.942 4.468 1.00 0.00 H new ATOM 0 HB ILE A 137 -1.298 -24.678 3.894 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -2.586 -21.932 4.103 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -1.490 -22.646 5.269 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -1.638 -23.566 1.676 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -2.672 -25.000 1.880 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.364 -23.371 2.062 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -0.330 -20.987 3.877 1.00 0.00 H new ATOM 0 HD12 ILE A 137 0.340 -22.611 3.591 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -0.773 -21.887 2.407 1.00 0.00 H new ATOM 2247 N ARG A 138 -2.832 -26.990 4.325 1.00 0.00 N ATOM 2248 CA ARG A 138 -2.919 -28.366 3.797 1.00 0.00 C ATOM 2249 C ARG A 138 -4.177 -29.111 4.253 1.00 0.00 C ATOM 2250 O ARG A 138 -4.806 -29.781 3.439 1.00 0.00 O ATOM 2251 CB ARG A 138 -1.625 -29.145 4.118 1.00 0.00 C ATOM 2252 CG ARG A 138 -1.498 -29.556 5.594 1.00 0.00 C ATOM 2253 CD ARG A 138 -0.076 -29.952 6.015 1.00 0.00 C ATOM 2254 NE ARG A 138 0.421 -31.175 5.358 1.00 0.00 N ATOM 2255 CZ ARG A 138 1.532 -31.818 5.680 1.00 0.00 C ATOM 2256 NH1 ARG A 138 2.310 -31.427 6.656 1.00 0.00 N ATOM 2257 NH2 ARG A 138 1.886 -32.883 5.022 1.00 0.00 N ATOM 0 H ARG A 138 -2.036 -26.860 4.950 1.00 0.00 H new ATOM 0 HA ARG A 138 -3.014 -28.292 2.714 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -1.587 -30.040 3.497 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.766 -28.532 3.846 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -1.834 -28.729 6.220 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -2.169 -30.394 5.786 1.00 0.00 H new ATOM 0 HD2 ARG A 138 0.602 -29.129 5.790 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -0.054 -30.097 7.095 1.00 0.00 H new ATOM 0 HE ARG A 138 -0.137 -31.556 4.594 1.00 0.00 H new ATOM 0 HH11 ARG A 138 2.068 -30.599 7.200 1.00 0.00 H new ATOM 0 HH12 ARG A 138 3.158 -31.950 6.873 1.00 0.00 H new ATOM 0 HH21 ARG A 138 1.307 -33.225 4.255 1.00 0.00 H new ATOM 0 HH22 ARG A 138 2.743 -33.376 5.273 1.00 0.00 H new ATOM 2271 N LYS A 139 -4.584 -28.954 5.524 1.00 0.00 N ATOM 2272 CA LYS A 139 -5.827 -29.555 6.048 1.00 0.00 C ATOM 2273 C LYS A 139 -7.072 -28.754 5.668 1.00 0.00 C ATOM 2274 O LYS A 139 -8.160 -29.323 5.561 1.00 0.00 O ATOM 2275 CB LYS A 139 -5.745 -29.812 7.566 1.00 0.00 C ATOM 2276 CG LYS A 139 -5.854 -28.562 8.462 1.00 0.00 C ATOM 2277 CD LYS A 139 -5.897 -28.906 9.960 1.00 0.00 C ATOM 2278 CE LYS A 139 -7.182 -29.661 10.341 1.00 0.00 C ATOM 2279 NZ LYS A 139 -7.182 -30.097 11.763 1.00 0.00 N ATOM 0 H LYS A 139 -4.066 -28.411 6.215 1.00 0.00 H new ATOM 0 HA LYS A 139 -5.929 -30.526 5.564 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -6.540 -30.505 7.842 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -4.799 -30.310 7.781 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -5.005 -27.906 8.268 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -6.753 -28.006 8.195 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -5.030 -29.514 10.217 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -5.828 -27.989 10.545 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -8.044 -29.019 10.160 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -7.293 -30.533 9.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -8.068 -30.601 11.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -6.375 -30.731 11.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -7.103 -29.265 12.381 1.00 0.00 H new ATOM 2293 N ILE A 140 -6.912 -27.450 5.407 1.00 0.00 N ATOM 2294 CA ILE A 140 -7.984 -26.616 4.853 1.00 0.00 C ATOM 2295 C ILE A 140 -8.268 -27.007 3.406 1.00 0.00 C ATOM 2296 O ILE A 140 -9.406 -27.294 3.068 1.00 0.00 O ATOM 2297 CB ILE A 140 -7.642 -25.115 4.993 1.00 0.00 C ATOM 2298 CG1 ILE A 140 -7.697 -24.688 6.477 1.00 0.00 C ATOM 2299 CG2 ILE A 140 -8.588 -24.248 4.143 1.00 0.00 C ATOM 2300 CD1 ILE A 140 -7.006 -23.346 6.754 1.00 0.00 C ATOM 0 H ILE A 140 -6.041 -26.947 5.573 1.00 0.00 H new ATOM 0 HA ILE A 140 -8.896 -26.790 5.425 1.00 0.00 H new ATOM 0 HB ILE A 140 -6.628 -24.962 4.623 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -8.739 -24.622 6.790 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.229 -25.461 7.087 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -8.323 -23.197 4.261 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -8.495 -24.529 3.094 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -9.616 -24.402 4.471 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -7.083 -23.109 7.815 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -5.955 -23.413 6.473 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -7.488 -22.561 6.171 1.00 0.00 H new ATOM 2312 N ASN A 141 -7.236 -27.077 2.560 1.00 0.00 N ATOM 2313 CA ASN A 141 -7.348 -27.373 1.116 1.00 0.00 C ATOM 2314 C ASN A 141 -8.136 -28.663 0.776 1.00 0.00 C ATOM 2315 O ASN A 141 -8.727 -28.770 -0.298 1.00 0.00 O ATOM 2316 CB ASN A 141 -5.941 -27.452 0.490 1.00 0.00 C ATOM 2317 CG ASN A 141 -5.416 -26.105 0.019 1.00 0.00 C ATOM 2318 OD1 ASN A 141 -5.058 -25.915 -1.136 1.00 0.00 O ATOM 2319 ND2 ASN A 141 -5.347 -25.140 0.901 1.00 0.00 N ATOM 0 H ASN A 141 -6.273 -26.927 2.861 1.00 0.00 H new ATOM 0 HA ASN A 141 -7.925 -26.551 0.693 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -5.248 -27.869 1.221 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -5.965 -28.140 -0.355 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -4.993 -24.223 0.627 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -5.647 -25.305 1.862 1.00 0.00 H new ATOM 2326 N GLU A 142 -8.166 -29.626 1.699 1.00 0.00 N ATOM 2327 CA GLU A 142 -8.894 -30.902 1.605 1.00 0.00 C ATOM 2328 C GLU A 142 -10.424 -30.744 1.637 1.00 0.00 C ATOM 2329 O GLU A 142 -11.140 -31.553 1.047 1.00 0.00 O ATOM 2330 CB GLU A 142 -8.472 -31.781 2.792 1.00 0.00 C ATOM 2331 CG GLU A 142 -7.073 -32.393 2.630 1.00 0.00 C ATOM 2332 CD GLU A 142 -7.045 -33.492 1.551 1.00 0.00 C ATOM 2333 OE1 GLU A 142 -7.386 -34.659 1.863 1.00 0.00 O ATOM 2334 OE2 GLU A 142 -6.678 -33.206 0.383 1.00 0.00 O ATOM 0 H GLU A 142 -7.658 -29.537 2.579 1.00 0.00 H new ATOM 0 HA GLU A 142 -8.641 -31.348 0.643 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.496 -31.184 3.704 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -9.199 -32.583 2.917 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -6.363 -31.609 2.367 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -6.748 -32.812 3.582 1.00 0.00 H new ATOM 2341 N LEU A 143 -10.906 -29.704 2.324 1.00 0.00 N ATOM 2342 CA LEU A 143 -12.288 -29.398 2.703 1.00 0.00 C ATOM 2343 C LEU A 143 -12.706 -27.988 2.236 1.00 0.00 C ATOM 2344 O LEU A 143 -13.876 -27.632 2.274 1.00 0.00 O ATOM 2345 CB LEU A 143 -12.298 -29.458 4.238 1.00 0.00 C ATOM 2346 CG LEU A 143 -11.844 -30.766 4.904 1.00 0.00 C ATOM 2347 CD1 LEU A 143 -12.019 -30.673 6.417 1.00 0.00 C ATOM 2348 CD2 LEU A 143 -12.571 -31.998 4.370 1.00 0.00 C ATOM 0 H LEU A 143 -10.271 -28.981 2.663 1.00 0.00 H new ATOM 0 HA LEU A 143 -12.987 -30.097 2.243 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -11.662 -28.654 4.609 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -13.312 -29.244 4.576 1.00 0.00 H new ATOM 0 HG LEU A 143 -10.790 -30.891 4.656 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -11.694 -31.605 6.879 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -11.419 -29.849 6.803 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -13.069 -30.498 6.652 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -12.204 -32.888 4.882 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -13.642 -31.894 4.547 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -12.387 -32.093 3.300 1.00 0.00 H new ATOM 2360 N MET A 144 -11.762 -27.182 1.750 1.00 0.00 N ATOM 2361 CA MET A 144 -11.987 -25.843 1.209 1.00 0.00 C ATOM 2362 C MET A 144 -13.050 -25.824 0.092 1.00 0.00 C ATOM 2363 O MET A 144 -13.975 -25.020 0.191 1.00 0.00 O ATOM 2364 CB MET A 144 -10.624 -25.273 0.768 1.00 0.00 C ATOM 2365 CG MET A 144 -10.718 -24.046 -0.147 1.00 0.00 C ATOM 2366 SD MET A 144 -9.262 -23.753 -1.189 1.00 0.00 S ATOM 2367 CE MET A 144 -8.053 -23.169 0.028 1.00 0.00 C ATOM 0 H MET A 144 -10.780 -27.456 1.722 1.00 0.00 H new ATOM 0 HA MET A 144 -12.408 -25.199 1.981 1.00 0.00 H new ATOM 0 HB2 MET A 144 -10.051 -25.006 1.656 1.00 0.00 H new ATOM 0 HB3 MET A 144 -10.067 -26.055 0.252 1.00 0.00 H new ATOM 0 HG2 MET A 144 -11.590 -24.158 -0.791 1.00 0.00 H new ATOM 0 HG3 MET A 144 -10.888 -23.164 0.470 1.00 0.00 H new ATOM 0 HE1 MET A 144 -7.110 -22.951 -0.472 1.00 0.00 H new ATOM 0 HE2 MET A 144 -8.427 -22.265 0.508 1.00 0.00 H new ATOM 0 HE3 MET A 144 -7.894 -23.940 0.782 1.00 0.00 H new ATOM 2377 N PRO A 145 -12.968 -26.663 -0.962 1.00 0.00 N ATOM 2378 CA PRO A 145 -13.877 -26.574 -2.114 1.00 0.00 C ATOM 2379 C PRO A 145 -15.315 -26.983 -1.827 1.00 0.00 C ATOM 2380 O PRO A 145 -16.258 -26.250 -2.125 1.00 0.00 O ATOM 2381 CB PRO A 145 -13.285 -27.503 -3.163 1.00 0.00 C ATOM 2382 CG PRO A 145 -12.351 -28.439 -2.396 1.00 0.00 C ATOM 2383 CD PRO A 145 -11.862 -27.566 -1.262 1.00 0.00 C ATOM 0 HA PRO A 145 -13.947 -25.532 -2.427 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -14.066 -28.063 -3.678 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -12.741 -26.942 -3.923 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -12.874 -29.322 -2.030 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -11.529 -28.791 -3.019 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -11.597 -28.165 -0.391 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -10.969 -27.011 -1.550 1.00 0.00 H new ATOM 2391 N LYS A 146 -15.468 -28.157 -1.214 1.00 0.00 N ATOM 2392 CA LYS A 146 -16.754 -28.732 -0.796 1.00 0.00 C ATOM 2393 C LYS A 146 -17.512 -27.800 0.149 1.00 0.00 C ATOM 2394 O LYS A 146 -18.745 -27.771 0.123 1.00 0.00 O ATOM 2395 CB LYS A 146 -16.590 -30.132 -0.165 1.00 0.00 C ATOM 2396 CG LYS A 146 -15.333 -30.331 0.685 1.00 0.00 C ATOM 2397 CD LYS A 146 -14.205 -31.017 -0.103 1.00 0.00 C ATOM 2398 CE LYS A 146 -14.156 -32.515 0.231 1.00 0.00 C ATOM 2399 NZ LYS A 146 -12.989 -33.179 -0.408 1.00 0.00 N ATOM 0 H LYS A 146 -14.675 -28.757 -0.985 1.00 0.00 H new ATOM 0 HA LYS A 146 -17.347 -28.848 -1.703 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -17.463 -30.336 0.456 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -16.587 -30.873 -0.964 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -14.985 -29.364 1.048 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -15.579 -30.931 1.561 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -14.365 -30.881 -1.173 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -13.249 -30.552 0.138 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -14.103 -32.646 1.312 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -15.076 -32.994 -0.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -12.996 -34.193 -0.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -13.044 -33.060 -1.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -12.110 -32.749 -0.056 1.00 0.00 H new ATOM 2413 N TYR A 147 -16.777 -27.038 0.964 1.00 0.00 N ATOM 2414 CA TYR A 147 -17.307 -26.205 2.055 1.00 0.00 C ATOM 2415 C TYR A 147 -17.147 -24.701 1.778 1.00 0.00 C ATOM 2416 O TYR A 147 -17.411 -23.848 2.626 1.00 0.00 O ATOM 2417 CB TYR A 147 -16.701 -26.633 3.400 1.00 0.00 C ATOM 2418 CG TYR A 147 -16.752 -28.118 3.744 1.00 0.00 C ATOM 2419 CD1 TYR A 147 -17.702 -28.982 3.166 1.00 0.00 C ATOM 2420 CD2 TYR A 147 -15.813 -28.644 4.641 1.00 0.00 C ATOM 2421 CE1 TYR A 147 -17.710 -30.357 3.481 1.00 0.00 C ATOM 2422 CE2 TYR A 147 -15.803 -30.015 4.956 1.00 0.00 C ATOM 2423 CZ TYR A 147 -16.755 -30.877 4.380 1.00 0.00 C ATOM 2424 OH TYR A 147 -16.729 -32.206 4.664 1.00 0.00 O ATOM 0 H TYR A 147 -15.762 -26.980 0.882 1.00 0.00 H new ATOM 0 HA TYR A 147 -18.383 -26.372 2.113 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -15.658 -26.318 3.417 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -17.212 -26.085 4.191 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -18.432 -28.588 2.474 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -15.087 -27.988 5.097 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -18.445 -31.010 3.035 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -15.065 -30.406 5.640 1.00 0.00 H new ATOM 0 HH TYR A 147 -16.007 -32.390 5.301 1.00 0.00 H new ATOM 2434 N ALA A 148 -16.761 -24.364 0.551 1.00 0.00 N ATOM 2435 CA ALA A 148 -16.850 -22.996 0.032 1.00 0.00 C ATOM 2436 C ALA A 148 -18.286 -22.395 0.131 1.00 0.00 C ATOM 2437 O ALA A 148 -18.417 -21.239 0.545 1.00 0.00 O ATOM 2438 CB ALA A 148 -16.287 -22.936 -1.397 1.00 0.00 C ATOM 0 H ALA A 148 -16.376 -25.032 -0.117 1.00 0.00 H new ATOM 0 HA ALA A 148 -16.235 -22.362 0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -16.358 -21.915 -1.773 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -15.243 -23.249 -1.390 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -16.861 -23.601 -2.042 1.00 0.00 H new