USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1062 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 115 SER OG : rot 180:sc= 0.125 USER MOD Set 1.2: A 118 THR OG1 : rot -128:sc= 0.256 USER MOD Set 2.1: A 97 HIS : no HD1:sc= -1.07 X(o=-1.1,f=-1) USER MOD Set 2.2: A 122 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 47 GLN : amide:sc= -0.12 K(o=-0.24,f=-2.1) USER MOD Set 3.2: A 52 GLN : amide:sc= -0.117 X(o=-0.24,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -41:sc= 0.0376 USER MOD Single : A 32 ASN : amide:sc= -0.0273 K(o=-0.027,f=-0.77) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.612 K(o=-0.61,f=-3.4!) USER MOD Single : A 59 THR OG1 : rot 162:sc= 0.744 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot -170:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -1.06 K(o=-1.1,f=-3.7!) USER MOD Single : A 74 ASN : amide:sc= 0.934 K(o=0.93,f=0) USER MOD Single : A 79 GLN : amide:sc= 0.694 K(o=0.69,f=-0.064) USER MOD Single : A 86 THR OG1 : rot -122:sc= 0.262 USER MOD Single : A 92 GLN : amide:sc= 0.928 K(o=0.93,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl 168:sc= -1.19 (180deg=-1.48) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.00294 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HE2:sc= 0.651 K(o=0.65,f=-2.3!) USER MOD Single : A 116 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.00432 USER MOD Single : A 124 HIS : no HE2:sc= 0.396 K(o=0.4,f=-2.4!) USER MOD Single : A 133 HIS : no HD1:sc= -0.507 X(o=-0.51,f=-0.53) USER MOD Single : A 134 HIS : no HD1:sc= -0.02 X(o=-0.02,f=-0.02) USER MOD Single : A 135 SER OG : rot -140:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot -170:sc= 0.0361 USER MOD Single : A 157 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 158 HIS : no HD1:sc= -0.131 X(o=-0.13,f=-0.4) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 138 N SER A 24 16.995 4.999 -7.819 1.00 0.00 N ATOM 139 CA SER A 24 16.719 6.397 -8.185 1.00 0.00 C ATOM 140 C SER A 24 15.293 6.803 -7.767 1.00 0.00 C ATOM 141 O SER A 24 14.409 5.953 -7.617 1.00 0.00 O ATOM 142 CB SER A 24 16.891 6.606 -9.701 1.00 0.00 C ATOM 143 OG SER A 24 18.243 6.445 -10.118 1.00 0.00 O ATOM 0 HA SER A 24 17.434 7.026 -7.655 1.00 0.00 H new ATOM 0 HB2 SER A 24 16.261 5.897 -10.237 1.00 0.00 H new ATOM 0 HB3 SER A 24 16.547 7.605 -9.969 1.00 0.00 H new ATOM 0 HG SER A 24 18.306 6.585 -11.086 1.00 0.00 H new ATOM 149 N GLY A 25 15.066 8.108 -7.575 1.00 0.00 N ATOM 150 CA GLY A 25 13.763 8.679 -7.216 1.00 0.00 C ATOM 151 C GLY A 25 13.653 10.167 -7.553 1.00 0.00 C ATOM 152 O GLY A 25 14.262 10.642 -8.514 1.00 0.00 O ATOM 0 H GLY A 25 15.799 8.811 -7.667 1.00 0.00 H new ATOM 0 HA2 GLY A 25 12.977 8.134 -7.738 1.00 0.00 H new ATOM 0 HA3 GLY A 25 13.592 8.540 -6.148 1.00 0.00 H new ATOM 156 N VAL A 26 12.874 10.900 -6.754 1.00 0.00 N ATOM 157 CA VAL A 26 12.683 12.361 -6.864 1.00 0.00 C ATOM 158 C VAL A 26 14.022 13.124 -6.875 1.00 0.00 C ATOM 159 O VAL A 26 14.896 12.883 -6.043 1.00 0.00 O ATOM 160 CB VAL A 26 11.718 12.881 -5.768 1.00 0.00 C ATOM 161 CG1 VAL A 26 12.161 12.579 -4.325 1.00 0.00 C ATOM 162 CG2 VAL A 26 11.456 14.385 -5.909 1.00 0.00 C ATOM 0 H VAL A 26 12.340 10.488 -5.988 1.00 0.00 H new ATOM 0 HA VAL A 26 12.215 12.558 -7.829 1.00 0.00 H new ATOM 0 HB VAL A 26 10.798 12.322 -5.940 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.426 12.980 -3.627 1.00 0.00 H new ATOM 0 HG12 VAL A 26 12.242 11.501 -4.187 1.00 0.00 H new ATOM 0 HG13 VAL A 26 13.130 13.042 -4.137 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.775 14.711 -5.123 1.00 0.00 H new ATOM 0 HG22 VAL A 26 12.397 14.928 -5.822 1.00 0.00 H new ATOM 0 HG23 VAL A 26 11.009 14.587 -6.882 1.00 0.00 H new ATOM 172 N ASP A 27 14.182 14.041 -7.839 1.00 0.00 N ATOM 173 CA ASP A 27 15.434 14.781 -8.079 1.00 0.00 C ATOM 174 C ASP A 27 15.712 15.870 -7.022 1.00 0.00 C ATOM 175 O ASP A 27 16.871 16.142 -6.699 1.00 0.00 O ATOM 176 CB ASP A 27 15.369 15.385 -9.491 1.00 0.00 C ATOM 177 CG ASP A 27 16.680 16.088 -9.888 1.00 0.00 C ATOM 178 OD1 ASP A 27 17.673 15.381 -10.182 1.00 0.00 O ATOM 179 OD2 ASP A 27 16.705 17.341 -9.929 1.00 0.00 O1- ATOM 0 H ASP A 27 13.435 14.295 -8.485 1.00 0.00 H new ATOM 0 HA ASP A 27 16.267 14.083 -7.996 1.00 0.00 H new ATOM 0 HB2 ASP A 27 15.150 14.597 -10.211 1.00 0.00 H new ATOM 0 HB3 ASP A 27 14.547 16.099 -9.541 1.00 0.00 H new ATOM 184 N LEU A 28 14.646 16.450 -6.456 1.00 0.00 N ATOM 185 CA LEU A 28 14.666 17.361 -5.306 1.00 0.00 C ATOM 186 C LEU A 28 13.796 16.772 -4.178 1.00 0.00 C ATOM 187 O LEU A 28 14.232 15.825 -3.522 1.00 0.00 O ATOM 188 CB LEU A 28 14.347 18.821 -5.724 1.00 0.00 C ATOM 189 CG LEU A 28 13.160 19.064 -6.690 1.00 0.00 C ATOM 190 CD1 LEU A 28 12.521 20.430 -6.398 1.00 0.00 C ATOM 191 CD2 LEU A 28 13.595 19.049 -8.165 1.00 0.00 C ATOM 0 H LEU A 28 13.701 16.289 -6.805 1.00 0.00 H new ATOM 0 HA LEU A 28 15.672 17.441 -4.893 1.00 0.00 H new ATOM 0 HB2 LEU A 28 14.160 19.394 -4.816 1.00 0.00 H new ATOM 0 HB3 LEU A 28 15.242 19.238 -6.185 1.00 0.00 H new ATOM 0 HG LEU A 28 12.450 18.253 -6.527 1.00 0.00 H new ATOM 0 HD11 LEU A 28 11.687 20.595 -7.080 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.158 20.450 -5.370 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.264 21.216 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.728 19.224 -8.802 1.00 0.00 H new ATOM 0 HD22 LEU A 28 14.334 19.833 -8.335 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.032 18.080 -8.405 1.00 0.00 H new ATOM 203 N GLY A 29 12.579 17.289 -3.952 1.00 0.00 N ATOM 204 CA GLY A 29 11.641 16.764 -2.941 1.00 0.00 C ATOM 205 C GLY A 29 10.146 16.947 -3.233 1.00 0.00 C ATOM 206 O GLY A 29 9.352 16.872 -2.294 1.00 0.00 O ATOM 0 H GLY A 29 12.213 18.089 -4.468 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.836 15.699 -2.815 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.864 17.243 -1.988 1.00 0.00 H new ATOM 210 N THR A 30 9.752 17.215 -4.492 1.00 0.00 N ATOM 211 CA THR A 30 8.378 17.646 -4.846 1.00 0.00 C ATOM 212 C THR A 30 7.867 17.208 -6.230 1.00 0.00 C ATOM 213 O THR A 30 6.730 17.514 -6.576 1.00 0.00 O ATOM 214 CB THR A 30 8.285 19.169 -4.623 1.00 0.00 C ATOM 215 OG1 THR A 30 6.958 19.542 -4.332 1.00 0.00 O ATOM 216 CG2 THR A 30 8.783 19.991 -5.815 1.00 0.00 C ATOM 0 H THR A 30 10.375 17.140 -5.296 1.00 0.00 H new ATOM 0 HA THR A 30 7.693 17.117 -4.184 1.00 0.00 H new ATOM 0 HB THR A 30 8.940 19.388 -3.780 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.344 19.044 -4.911 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.689 21.053 -5.589 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.829 19.753 -6.010 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.187 19.753 -6.696 1.00 0.00 H new ATOM 224 N GLU A 31 8.650 16.468 -7.026 1.00 0.00 N ATOM 225 CA GLU A 31 8.275 16.058 -8.397 1.00 0.00 C ATOM 226 C GLU A 31 6.939 15.293 -8.442 1.00 0.00 C ATOM 227 O GLU A 31 6.121 15.497 -9.339 1.00 0.00 O ATOM 228 CB GLU A 31 9.402 15.189 -8.986 1.00 0.00 C ATOM 229 CG GLU A 31 9.217 14.780 -10.456 1.00 0.00 C ATOM 230 CD GLU A 31 9.174 15.971 -11.430 1.00 0.00 C ATOM 231 OE1 GLU A 31 10.004 16.902 -11.302 1.00 0.00 O ATOM 232 OE2 GLU A 31 8.337 15.961 -12.363 1.00 0.00 O1- ATOM 0 H GLU A 31 9.569 16.132 -6.740 1.00 0.00 H new ATOM 0 HA GLU A 31 8.139 16.962 -8.991 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.343 15.731 -8.893 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.494 14.285 -8.384 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.032 14.116 -10.744 1.00 0.00 H new ATOM 0 HG3 GLU A 31 8.293 14.210 -10.552 1.00 0.00 H new ATOM 239 N ASN A 32 6.688 14.441 -7.444 1.00 0.00 N ATOM 240 CA ASN A 32 5.449 13.675 -7.315 1.00 0.00 C ATOM 241 C ASN A 32 4.202 14.529 -7.009 1.00 0.00 C ATOM 242 O ASN A 32 3.093 14.095 -7.315 1.00 0.00 O ATOM 243 CB ASN A 32 5.647 12.586 -6.249 1.00 0.00 C ATOM 244 CG ASN A 32 6.059 13.152 -4.890 1.00 0.00 C ATOM 245 OD1 ASN A 32 7.231 13.400 -4.637 1.00 0.00 O ATOM 246 ND2 ASN A 32 5.117 13.404 -4.000 1.00 0.00 N ATOM 0 H ASN A 32 7.353 14.262 -6.691 1.00 0.00 H new ATOM 0 HA ASN A 32 5.246 13.228 -8.288 1.00 0.00 H new ATOM 0 HB2 ASN A 32 4.721 12.022 -6.136 1.00 0.00 H new ATOM 0 HB3 ASN A 32 6.408 11.884 -6.591 1.00 0.00 H new ATOM 0 HD21 ASN A 32 5.364 13.807 -3.096 1.00 0.00 H new ATOM 0 HD22 ASN A 32 4.142 13.195 -4.216 1.00 0.00 H new ATOM 253 N LEU A 33 4.349 15.730 -6.430 1.00 0.00 N ATOM 254 CA LEU A 33 3.227 16.571 -5.980 1.00 0.00 C ATOM 255 C LEU A 33 2.287 16.949 -7.139 1.00 0.00 C ATOM 256 O LEU A 33 1.069 16.984 -6.967 1.00 0.00 O ATOM 257 CB LEU A 33 3.810 17.822 -5.291 1.00 0.00 C ATOM 258 CG LEU A 33 2.792 18.621 -4.450 1.00 0.00 C ATOM 259 CD1 LEU A 33 2.469 17.902 -3.130 1.00 0.00 C ATOM 260 CD2 LEU A 33 3.346 20.018 -4.141 1.00 0.00 C ATOM 0 H LEU A 33 5.262 16.151 -6.258 1.00 0.00 H new ATOM 0 HA LEU A 33 2.616 16.010 -5.273 1.00 0.00 H new ATOM 0 HB2 LEU A 33 4.634 17.516 -4.647 1.00 0.00 H new ATOM 0 HB3 LEU A 33 4.229 18.479 -6.053 1.00 0.00 H new ATOM 0 HG LEU A 33 1.875 18.706 -5.033 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.749 18.491 -2.562 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.046 16.921 -3.344 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.382 17.784 -2.547 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.620 20.574 -3.547 1.00 0.00 H new ATOM 0 HD22 LEU A 33 4.277 19.925 -3.582 1.00 0.00 H new ATOM 0 HD23 LEU A 33 3.535 20.549 -5.074 1.00 0.00 H new ATOM 272 N TYR A 34 2.848 17.142 -8.336 1.00 0.00 N ATOM 273 CA TYR A 34 2.142 17.463 -9.587 1.00 0.00 C ATOM 274 C TYR A 34 1.098 16.409 -10.020 1.00 0.00 C ATOM 275 O TYR A 34 0.161 16.732 -10.753 1.00 0.00 O ATOM 276 CB TYR A 34 3.200 17.635 -10.692 1.00 0.00 C ATOM 277 CG TYR A 34 4.007 18.921 -10.610 1.00 0.00 C ATOM 278 CD1 TYR A 34 3.705 19.987 -11.481 1.00 0.00 C ATOM 279 CD2 TYR A 34 5.058 19.059 -9.679 1.00 0.00 C ATOM 280 CE1 TYR A 34 4.442 21.185 -11.424 1.00 0.00 C ATOM 281 CE2 TYR A 34 5.791 20.259 -9.608 1.00 0.00 C ATOM 282 CZ TYR A 34 5.488 21.326 -10.482 1.00 0.00 C ATOM 283 OH TYR A 34 6.204 22.484 -10.418 1.00 0.00 O ATOM 0 H TYR A 34 3.857 17.076 -8.469 1.00 0.00 H new ATOM 0 HA TYR A 34 1.573 18.377 -9.415 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.886 16.789 -10.653 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.702 17.597 -11.661 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.903 19.884 -12.197 1.00 0.00 H new ATOM 0 HD2 TYR A 34 5.301 18.240 -9.018 1.00 0.00 H new ATOM 0 HE1 TYR A 34 4.209 21.996 -12.099 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.586 20.364 -8.884 1.00 0.00 H new ATOM 0 HH TYR A 34 6.883 22.411 -9.715 1.00 0.00 H new ATOM 293 N PHE A 35 1.252 15.162 -9.559 1.00 0.00 N ATOM 294 CA PHE A 35 0.403 14.006 -9.878 1.00 0.00 C ATOM 295 C PHE A 35 -0.067 13.247 -8.613 1.00 0.00 C ATOM 296 O PHE A 35 -0.567 12.125 -8.714 1.00 0.00 O ATOM 297 CB PHE A 35 1.190 13.108 -10.848 1.00 0.00 C ATOM 298 CG PHE A 35 1.173 13.543 -12.299 1.00 0.00 C ATOM 299 CD1 PHE A 35 2.217 14.331 -12.823 1.00 0.00 C ATOM 300 CD2 PHE A 35 0.133 13.111 -13.144 1.00 0.00 C ATOM 301 CE1 PHE A 35 2.217 14.684 -14.185 1.00 0.00 C ATOM 302 CE2 PHE A 35 0.135 13.463 -14.506 1.00 0.00 C ATOM 303 CZ PHE A 35 1.178 14.249 -15.026 1.00 0.00 C ATOM 0 H PHE A 35 2.010 14.919 -8.921 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.519 14.343 -10.352 1.00 0.00 H new ATOM 0 HB2 PHE A 35 2.226 13.062 -10.513 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.789 12.096 -10.785 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.017 14.664 -12.179 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.669 12.507 -12.745 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.016 15.290 -14.585 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -0.664 13.130 -15.152 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.181 14.519 -16.072 1.00 0.00 H new ATOM 313 N GLN A 36 0.078 13.859 -7.429 1.00 0.00 N ATOM 314 CA GLN A 36 -0.365 13.362 -6.116 1.00 0.00 C ATOM 315 C GLN A 36 0.439 12.125 -5.648 1.00 0.00 C ATOM 316 O GLN A 36 1.449 11.739 -6.240 1.00 0.00 O ATOM 317 CB GLN A 36 -1.896 13.110 -6.093 1.00 0.00 C ATOM 318 CG GLN A 36 -2.735 14.243 -6.712 1.00 0.00 C ATOM 319 CD GLN A 36 -4.217 14.126 -6.346 1.00 0.00 C ATOM 320 OE1 GLN A 36 -4.993 13.417 -6.976 1.00 0.00 O ATOM 321 NE2 GLN A 36 -4.668 14.803 -5.307 1.00 0.00 N ATOM 0 H GLN A 36 0.535 14.768 -7.357 1.00 0.00 H new ATOM 0 HA GLN A 36 -0.155 14.149 -5.391 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.108 12.184 -6.627 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -2.212 12.962 -5.060 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -2.352 15.205 -6.371 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -2.627 14.223 -7.796 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -4.035 15.398 -4.772 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -5.650 14.732 -5.039 1.00 0.00 H new ATOM 330 N SER A 37 -0.019 11.461 -4.582 1.00 0.00 N ATOM 331 CA SER A 37 0.579 10.228 -4.039 1.00 0.00 C ATOM 332 C SER A 37 0.693 9.095 -5.075 1.00 0.00 C ATOM 333 O SER A 37 1.572 8.237 -4.962 1.00 0.00 O ATOM 334 CB SER A 37 -0.265 9.737 -2.853 1.00 0.00 C ATOM 335 OG SER A 37 -0.472 10.776 -1.902 1.00 0.00 O ATOM 0 H SER A 37 -0.837 11.771 -4.056 1.00 0.00 H new ATOM 0 HA SER A 37 1.593 10.480 -3.729 1.00 0.00 H new ATOM 0 HB2 SER A 37 -1.227 9.374 -3.214 1.00 0.00 H new ATOM 0 HB3 SER A 37 0.233 8.895 -2.373 1.00 0.00 H new ATOM 0 HG SER A 37 -1.013 10.436 -1.159 1.00 0.00 H new ATOM 341 N MET A 38 -0.145 9.119 -6.123 1.00 0.00 N ATOM 342 CA MET A 38 -0.087 8.193 -7.257 1.00 0.00 C ATOM 343 C MET A 38 1.274 8.230 -7.963 1.00 0.00 C ATOM 344 O MET A 38 1.827 7.173 -8.251 1.00 0.00 O ATOM 345 CB MET A 38 -1.236 8.492 -8.233 1.00 0.00 C ATOM 346 CG MET A 38 -1.305 7.444 -9.351 1.00 0.00 C ATOM 347 SD MET A 38 -2.634 7.726 -10.546 1.00 0.00 S ATOM 348 CE MET A 38 -2.249 6.378 -11.691 1.00 0.00 C ATOM 0 H MET A 38 -0.899 9.801 -6.204 1.00 0.00 H new ATOM 0 HA MET A 38 -0.206 7.179 -6.874 1.00 0.00 H new ATOM 0 HB2 MET A 38 -2.181 8.511 -7.690 1.00 0.00 H new ATOM 0 HB3 MET A 38 -1.098 9.482 -8.668 1.00 0.00 H new ATOM 0 HG2 MET A 38 -0.352 7.429 -9.880 1.00 0.00 H new ATOM 0 HG3 MET A 38 -1.436 6.459 -8.903 1.00 0.00 H new ATOM 0 HE1 MET A 38 -2.967 6.381 -12.511 1.00 0.00 H new ATOM 0 HE2 MET A 38 -1.243 6.514 -12.088 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.305 5.426 -11.164 1.00 0.00 H new ATOM 358 N ARG A 39 1.873 9.402 -8.199 1.00 0.00 N ATOM 359 CA ARG A 39 3.220 9.456 -8.788 1.00 0.00 C ATOM 360 C ARG A 39 4.292 9.019 -7.786 1.00 0.00 C ATOM 361 O ARG A 39 5.219 8.310 -8.174 1.00 0.00 O ATOM 362 CB ARG A 39 3.479 10.848 -9.371 1.00 0.00 C ATOM 363 CG ARG A 39 4.840 11.033 -10.069 1.00 0.00 C ATOM 364 CD ARG A 39 5.045 10.146 -11.307 1.00 0.00 C ATOM 365 NE ARG A 39 4.156 10.534 -12.420 1.00 0.00 N ATOM 366 CZ ARG A 39 3.937 9.843 -13.534 1.00 0.00 C ATOM 367 NH1 ARG A 39 4.490 8.667 -13.750 1.00 0.00 N1+ ATOM 368 NH2 ARG A 39 3.149 10.339 -14.463 1.00 0.00 N ATOM 0 H ARG A 39 1.458 10.312 -7.997 1.00 0.00 H new ATOM 0 HA ARG A 39 3.276 8.741 -9.609 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.689 11.075 -10.087 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.400 11.580 -8.567 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.944 12.077 -10.364 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.634 10.824 -9.352 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.083 10.212 -11.632 1.00 0.00 H new ATOM 0 HD3 ARG A 39 4.860 9.105 -11.042 1.00 0.00 H new ATOM 0 HE ARG A 39 3.661 11.421 -12.325 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.109 8.258 -13.050 1.00 0.00 H new ATOM 0 HH12 ARG A 39 4.299 8.165 -14.617 1.00 0.00 H new ATOM 0 HH21 ARG A 39 2.710 11.249 -14.326 1.00 0.00 H new ATOM 0 HH22 ARG A 39 2.977 9.813 -15.320 1.00 0.00 H new ATOM 382 N ALA A 40 4.150 9.368 -6.503 1.00 0.00 N ATOM 383 CA ALA A 40 5.094 8.963 -5.455 1.00 0.00 C ATOM 384 C ALA A 40 5.235 7.433 -5.398 1.00 0.00 C ATOM 385 O ALA A 40 6.342 6.911 -5.509 1.00 0.00 O ATOM 386 CB ALA A 40 4.645 9.551 -4.108 1.00 0.00 C ATOM 0 H ALA A 40 3.377 9.939 -6.161 1.00 0.00 H new ATOM 0 HA ALA A 40 6.083 9.357 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.345 9.251 -3.328 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.621 10.639 -4.176 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.649 9.181 -3.863 1.00 0.00 H new ATOM 392 N GLN A 41 4.113 6.716 -5.301 1.00 0.00 N ATOM 393 CA GLN A 41 4.092 5.252 -5.209 1.00 0.00 C ATOM 394 C GLN A 41 4.512 4.550 -6.514 1.00 0.00 C ATOM 395 O GLN A 41 5.210 3.536 -6.451 1.00 0.00 O ATOM 396 CB GLN A 41 2.706 4.812 -4.710 1.00 0.00 C ATOM 397 CG GLN A 41 1.584 5.008 -5.745 1.00 0.00 C ATOM 398 CD GLN A 41 0.165 4.971 -5.182 1.00 0.00 C ATOM 399 OE1 GLN A 41 -0.090 5.225 -4.017 1.00 0.00 O ATOM 400 NE2 GLN A 41 -0.821 4.649 -5.995 1.00 0.00 N ATOM 0 H GLN A 41 3.185 7.138 -5.284 1.00 0.00 H new ATOM 0 HA GLN A 41 4.848 4.937 -4.489 1.00 0.00 H new ATOM 0 HB2 GLN A 41 2.748 3.760 -4.428 1.00 0.00 H new ATOM 0 HB3 GLN A 41 2.459 5.374 -3.809 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.735 5.966 -6.243 1.00 0.00 H new ATOM 0 HG3 GLN A 41 1.675 4.234 -6.507 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.626 4.433 -6.973 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -1.779 4.615 -5.646 1.00 0.00 H new ATOM 409 N LEU A 42 4.155 5.095 -7.689 1.00 0.00 N ATOM 410 CA LEU A 42 4.589 4.560 -8.987 1.00 0.00 C ATOM 411 C LEU A 42 6.111 4.657 -9.153 1.00 0.00 C ATOM 412 O LEU A 42 6.738 3.692 -9.586 1.00 0.00 O ATOM 413 CB LEU A 42 3.856 5.293 -10.137 1.00 0.00 C ATOM 414 CG LEU A 42 2.608 4.587 -10.717 1.00 0.00 C ATOM 415 CD1 LEU A 42 3.015 3.359 -11.547 1.00 0.00 C ATOM 416 CD2 LEU A 42 1.565 4.166 -9.672 1.00 0.00 C ATOM 0 H LEU A 42 3.558 5.918 -7.764 1.00 0.00 H new ATOM 0 HA LEU A 42 4.327 3.503 -9.025 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.556 6.277 -9.778 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.566 5.452 -10.948 1.00 0.00 H new ATOM 0 HG LEU A 42 2.130 5.338 -11.345 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.122 2.877 -11.946 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.656 3.673 -12.371 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.555 2.655 -10.914 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.726 3.680 -10.170 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.019 3.472 -8.964 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.208 5.047 -9.138 1.00 0.00 H new ATOM 428 N ILE A 43 6.723 5.789 -8.787 1.00 0.00 N ATOM 429 CA ILE A 43 8.185 5.970 -8.862 1.00 0.00 C ATOM 430 C ILE A 43 8.908 5.146 -7.784 1.00 0.00 C ATOM 431 O ILE A 43 9.869 4.451 -8.114 1.00 0.00 O ATOM 432 CB ILE A 43 8.539 7.478 -8.823 1.00 0.00 C ATOM 433 CG1 ILE A 43 7.949 8.256 -10.028 1.00 0.00 C ATOM 434 CG2 ILE A 43 10.060 7.714 -8.755 1.00 0.00 C ATOM 435 CD1 ILE A 43 8.369 7.775 -11.424 1.00 0.00 C ATOM 0 H ILE A 43 6.225 6.605 -8.431 1.00 0.00 H new ATOM 0 HA ILE A 43 8.544 5.584 -9.816 1.00 0.00 H new ATOM 0 HB ILE A 43 8.083 7.861 -7.910 1.00 0.00 H new ATOM 0 HG12 ILE A 43 6.862 8.211 -9.964 1.00 0.00 H new ATOM 0 HG13 ILE A 43 8.231 9.304 -9.929 1.00 0.00 H new ATOM 0 HG21 ILE A 43 10.261 8.785 -8.729 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.461 7.248 -7.855 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.536 7.276 -9.633 1.00 0.00 H new ATOM 0 HD11 ILE A 43 7.892 8.397 -12.182 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.452 7.848 -11.523 1.00 0.00 H new ATOM 0 HD13 ILE A 43 8.061 6.738 -11.559 1.00 0.00 H new ATOM 447 N GLU A 44 8.420 5.158 -6.538 1.00 0.00 N ATOM 448 CA GLU A 44 9.018 4.469 -5.381 1.00 0.00 C ATOM 449 C GLU A 44 9.255 2.966 -5.612 1.00 0.00 C ATOM 450 O GLU A 44 10.225 2.420 -5.084 1.00 0.00 O ATOM 451 CB GLU A 44 8.114 4.696 -4.152 1.00 0.00 C ATOM 452 CG GLU A 44 8.538 4.005 -2.845 1.00 0.00 C ATOM 453 CD GLU A 44 9.918 4.435 -2.312 1.00 0.00 C ATOM 454 OE1 GLU A 44 10.331 5.602 -2.515 1.00 0.00 O ATOM 455 OE2 GLU A 44 10.576 3.618 -1.625 1.00 0.00 O1- ATOM 0 H GLU A 44 7.568 5.664 -6.296 1.00 0.00 H new ATOM 0 HA GLU A 44 10.007 4.896 -5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 44 8.055 5.768 -3.966 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.108 4.361 -4.403 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.788 4.210 -2.081 1.00 0.00 H new ATOM 0 HG3 GLU A 44 8.544 2.927 -3.005 1.00 0.00 H new ATOM 462 N ARG A 45 8.404 2.297 -6.404 1.00 0.00 N ATOM 463 CA ARG A 45 8.600 0.895 -6.802 1.00 0.00 C ATOM 464 C ARG A 45 9.138 0.755 -8.232 1.00 0.00 C ATOM 465 O ARG A 45 10.086 -0.002 -8.461 1.00 0.00 O ATOM 466 CB ARG A 45 7.279 0.137 -6.585 1.00 0.00 C ATOM 467 CG ARG A 45 7.351 -1.388 -6.785 1.00 0.00 C ATOM 468 CD ARG A 45 8.536 -2.098 -6.107 1.00 0.00 C ATOM 469 NE ARG A 45 8.709 -1.732 -4.687 1.00 0.00 N ATOM 470 CZ ARG A 45 9.866 -1.582 -4.045 1.00 0.00 C ATOM 471 NH1 ARG A 45 11.029 -1.770 -4.634 1.00 0.00 N1+ ATOM 472 NH2 ARG A 45 9.871 -1.245 -2.776 1.00 0.00 N ATOM 0 H ARG A 45 7.557 2.715 -6.788 1.00 0.00 H new ATOM 0 HA ARG A 45 9.373 0.450 -6.175 1.00 0.00 H new ATOM 0 HB2 ARG A 45 6.927 0.337 -5.573 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.532 0.541 -7.268 1.00 0.00 H new ATOM 0 HG2 ARG A 45 6.426 -1.828 -6.412 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.393 -1.593 -7.855 1.00 0.00 H new ATOM 0 HD2 ARG A 45 8.394 -3.176 -6.181 1.00 0.00 H new ATOM 0 HD3 ARG A 45 9.451 -1.859 -6.649 1.00 0.00 H new ATOM 0 HE ARG A 45 7.859 -1.579 -4.145 1.00 0.00 H new ATOM 0 HH11 ARG A 45 11.065 -2.041 -5.617 1.00 0.00 H new ATOM 0 HH12 ARG A 45 11.894 -1.645 -4.107 1.00 0.00 H new ATOM 0 HH21 ARG A 45 8.990 -1.099 -2.284 1.00 0.00 H new ATOM 0 HH22 ARG A 45 10.756 -1.130 -2.282 1.00 0.00 H new ATOM 486 N GLY A 46 8.591 1.499 -9.198 1.00 0.00 N ATOM 487 CA GLY A 46 8.905 1.342 -10.625 1.00 0.00 C ATOM 488 C GLY A 46 10.308 1.807 -11.008 1.00 0.00 C ATOM 489 O GLY A 46 10.919 1.201 -11.885 1.00 0.00 O ATOM 0 H GLY A 46 7.910 2.235 -9.011 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.795 0.292 -10.897 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.176 1.902 -11.211 1.00 0.00 H new ATOM 493 N GLN A 47 10.841 2.844 -10.353 1.00 0.00 N ATOM 494 CA GLN A 47 12.197 3.362 -10.596 1.00 0.00 C ATOM 495 C GLN A 47 13.255 2.717 -9.669 1.00 0.00 C ATOM 496 O GLN A 47 14.456 2.870 -9.891 1.00 0.00 O ATOM 497 CB GLN A 47 12.153 4.900 -10.503 1.00 0.00 C ATOM 498 CG GLN A 47 13.291 5.574 -11.288 1.00 0.00 C ATOM 499 CD GLN A 47 13.204 7.102 -11.258 1.00 0.00 C ATOM 500 OE1 GLN A 47 13.896 7.776 -10.511 1.00 0.00 O ATOM 501 NE2 GLN A 47 12.367 7.722 -12.065 1.00 0.00 N ATOM 0 H GLN A 47 10.338 3.356 -9.629 1.00 0.00 H new ATOM 0 HA GLN A 47 12.521 3.083 -11.599 1.00 0.00 H new ATOM 0 HB2 GLN A 47 11.195 5.256 -10.882 1.00 0.00 H new ATOM 0 HB3 GLN A 47 12.212 5.199 -9.456 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.249 5.260 -10.873 1.00 0.00 H new ATOM 0 HG3 GLN A 47 13.265 5.233 -12.323 1.00 0.00 H new ATOM 0 HE21 GLN A 47 11.777 7.184 -12.699 1.00 0.00 H new ATOM 0 HE22 GLN A 47 12.309 8.740 -12.055 1.00 0.00 H new ATOM 510 N LEU A 48 12.825 1.938 -8.666 1.00 0.00 N ATOM 511 CA LEU A 48 13.685 1.022 -7.902 1.00 0.00 C ATOM 512 C LEU A 48 13.941 -0.282 -8.675 1.00 0.00 C ATOM 513 O LEU A 48 15.066 -0.779 -8.692 1.00 0.00 O ATOM 514 CB LEU A 48 13.032 0.750 -6.527 1.00 0.00 C ATOM 515 CG LEU A 48 13.508 1.658 -5.371 1.00 0.00 C ATOM 516 CD1 LEU A 48 14.909 1.245 -4.894 1.00 0.00 C ATOM 517 CD2 LEU A 48 13.499 3.155 -5.716 1.00 0.00 C ATOM 0 H LEU A 48 11.853 1.926 -8.357 1.00 0.00 H new ATOM 0 HA LEU A 48 14.659 1.487 -7.748 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.952 0.859 -6.630 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.223 -0.287 -6.253 1.00 0.00 H new ATOM 0 HG LEU A 48 12.784 1.515 -4.569 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.223 1.898 -4.080 1.00 0.00 H new ATOM 0 HD12 LEU A 48 14.884 0.213 -4.543 1.00 0.00 H new ATOM 0 HD13 LEU A 48 15.615 1.330 -5.720 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.845 3.729 -4.856 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.160 3.337 -6.564 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.486 3.463 -5.973 1.00 0.00 H new ATOM 529 N ILE A 49 12.918 -0.837 -9.336 1.00 0.00 N ATOM 530 CA ILE A 49 13.060 -2.049 -10.170 1.00 0.00 C ATOM 531 C ILE A 49 13.771 -1.725 -11.494 1.00 0.00 C ATOM 532 O ILE A 49 14.766 -2.367 -11.836 1.00 0.00 O ATOM 533 CB ILE A 49 11.677 -2.709 -10.395 1.00 0.00 C ATOM 534 CG1 ILE A 49 11.099 -3.206 -9.051 1.00 0.00 C ATOM 535 CG2 ILE A 49 11.785 -3.889 -11.384 1.00 0.00 C ATOM 536 CD1 ILE A 49 9.617 -3.583 -9.133 1.00 0.00 C ATOM 0 H ILE A 49 11.969 -0.464 -9.312 1.00 0.00 H new ATOM 0 HA ILE A 49 13.687 -2.769 -9.644 1.00 0.00 H new ATOM 0 HB ILE A 49 11.009 -1.960 -10.820 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.669 -4.072 -8.716 1.00 0.00 H new ATOM 0 HG13 ILE A 49 11.228 -2.429 -8.298 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.801 -4.336 -11.526 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.161 -3.528 -12.341 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.469 -4.637 -10.984 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.274 -3.924 -8.156 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.036 -2.712 -9.438 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.485 -4.382 -9.863 1.00 0.00 H new ATOM 548 N ALA A 50 13.265 -0.730 -12.228 1.00 0.00 N ATOM 549 CA ALA A 50 13.742 -0.329 -13.551 1.00 0.00 C ATOM 550 C ALA A 50 13.499 1.178 -13.757 1.00 0.00 C ATOM 551 O ALA A 50 14.160 1.981 -13.103 1.00 0.00 O ATOM 552 CB ALA A 50 13.107 -1.249 -14.611 1.00 0.00 C ATOM 0 H ALA A 50 12.483 -0.162 -11.903 1.00 0.00 H new ATOM 0 HA ALA A 50 14.820 -0.458 -13.651 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.456 -0.958 -15.602 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.393 -2.282 -14.414 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.022 -1.158 -14.568 1.00 0.00 H new ATOM 558 N GLU A 51 12.561 1.571 -14.626 1.00 0.00 N ATOM 559 CA GLU A 51 12.265 2.969 -14.966 1.00 0.00 C ATOM 560 C GLU A 51 10.814 3.107 -15.477 1.00 0.00 C ATOM 561 O GLU A 51 10.548 2.984 -16.672 1.00 0.00 O ATOM 562 CB GLU A 51 13.316 3.495 -15.981 1.00 0.00 C ATOM 563 CG GLU A 51 14.340 4.458 -15.359 1.00 0.00 C ATOM 564 CD GLU A 51 15.514 4.746 -16.311 1.00 0.00 C ATOM 565 OE1 GLU A 51 15.279 5.110 -17.489 1.00 0.00 O ATOM 566 OE2 GLU A 51 16.686 4.636 -15.881 1.00 0.00 O1- ATOM 0 H GLU A 51 11.970 0.907 -15.127 1.00 0.00 H new ATOM 0 HA GLU A 51 12.337 3.590 -14.073 1.00 0.00 H new ATOM 0 HB2 GLU A 51 13.844 2.647 -16.417 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.800 4.003 -16.796 1.00 0.00 H new ATOM 0 HG2 GLU A 51 13.846 5.394 -15.099 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.722 4.031 -14.431 1.00 0.00 H new ATOM 573 N GLN A 52 9.870 3.372 -14.557 1.00 0.00 N ATOM 574 CA GLN A 52 8.472 3.770 -14.842 1.00 0.00 C ATOM 575 C GLN A 52 7.683 2.715 -15.657 1.00 0.00 C ATOM 576 O GLN A 52 6.895 3.060 -16.541 1.00 0.00 O ATOM 577 CB GLN A 52 8.434 5.180 -15.483 1.00 0.00 C ATOM 578 CG GLN A 52 8.927 6.302 -14.549 1.00 0.00 C ATOM 579 CD GLN A 52 10.089 7.107 -15.132 1.00 0.00 C ATOM 580 OE1 GLN A 52 9.926 8.187 -15.685 1.00 0.00 O ATOM 581 NE2 GLN A 52 11.310 6.621 -15.023 1.00 0.00 N ATOM 0 H GLN A 52 10.062 3.314 -13.557 1.00 0.00 H new ATOM 0 HA GLN A 52 7.948 3.821 -13.887 1.00 0.00 H new ATOM 0 HB2 GLN A 52 9.046 5.175 -16.385 1.00 0.00 H new ATOM 0 HB3 GLN A 52 7.412 5.401 -15.793 1.00 0.00 H new ATOM 0 HG2 GLN A 52 8.098 6.977 -14.334 1.00 0.00 H new ATOM 0 HG3 GLN A 52 9.237 5.865 -13.600 1.00 0.00 H new ATOM 0 HE21 GLN A 52 11.462 5.722 -14.565 1.00 0.00 H new ATOM 0 HE22 GLN A 52 12.102 7.144 -15.397 1.00 0.00 H new ATOM 590 N LEU A 53 7.902 1.420 -15.375 1.00 0.00 N ATOM 591 CA LEU A 53 7.393 0.310 -16.203 1.00 0.00 C ATOM 592 C LEU A 53 6.979 -0.947 -15.418 1.00 0.00 C ATOM 593 O LEU A 53 6.004 -1.599 -15.793 1.00 0.00 O ATOM 594 CB LEU A 53 8.458 -0.007 -17.281 1.00 0.00 C ATOM 595 CG LEU A 53 7.952 0.303 -18.705 1.00 0.00 C ATOM 596 CD1 LEU A 53 9.127 0.555 -19.659 1.00 0.00 C ATOM 597 CD2 LEU A 53 7.077 -0.846 -19.230 1.00 0.00 C ATOM 0 H LEU A 53 8.438 1.111 -14.564 1.00 0.00 H new ATOM 0 HA LEU A 53 6.460 0.639 -16.661 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.359 0.574 -17.082 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.737 -1.059 -17.217 1.00 0.00 H new ATOM 0 HG LEU A 53 7.347 1.208 -18.658 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.746 0.771 -20.657 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.710 1.404 -19.302 1.00 0.00 H new ATOM 0 HD13 LEU A 53 9.761 -0.331 -19.697 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.730 -0.609 -20.236 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.661 -1.766 -19.256 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.219 -0.980 -18.572 1.00 0.00 H new ATOM 609 N ALA A 54 7.670 -1.282 -14.323 1.00 0.00 N ATOM 610 CA ALA A 54 7.265 -2.363 -13.417 1.00 0.00 C ATOM 611 C ALA A 54 5.954 -2.018 -12.658 1.00 0.00 C ATOM 612 O ALA A 54 5.691 -0.831 -12.424 1.00 0.00 O ATOM 613 CB ALA A 54 8.434 -2.650 -12.465 1.00 0.00 C ATOM 0 H ALA A 54 8.528 -0.810 -14.039 1.00 0.00 H new ATOM 0 HA ALA A 54 7.039 -3.262 -13.990 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.157 -3.452 -11.780 1.00 0.00 H new ATOM 0 HB2 ALA A 54 9.308 -2.952 -13.042 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.668 -1.751 -11.895 1.00 0.00 H new ATOM 619 N PRO A 55 5.136 -3.020 -12.264 1.00 0.00 N ATOM 620 CA PRO A 55 3.848 -2.797 -11.608 1.00 0.00 C ATOM 621 C PRO A 55 4.007 -2.199 -10.206 1.00 0.00 C ATOM 622 O PRO A 55 5.017 -2.407 -9.535 1.00 0.00 O ATOM 623 CB PRO A 55 3.151 -4.163 -11.570 1.00 0.00 C ATOM 624 CG PRO A 55 4.310 -5.156 -11.603 1.00 0.00 C ATOM 625 CD PRO A 55 5.347 -4.448 -12.473 1.00 0.00 C ATOM 0 HA PRO A 55 3.255 -2.066 -12.158 1.00 0.00 H new ATOM 0 HB2 PRO A 55 2.547 -4.281 -10.670 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.484 -4.297 -12.421 1.00 0.00 H new ATOM 0 HG2 PRO A 55 4.694 -5.361 -10.604 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.010 -6.112 -12.031 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.359 -4.739 -12.190 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.222 -4.712 -13.523 1.00 0.00 H new ATOM 633 N LEU A 56 2.981 -1.468 -9.757 1.00 0.00 N ATOM 634 CA LEU A 56 2.961 -0.817 -8.444 1.00 0.00 C ATOM 635 C LEU A 56 2.593 -1.773 -7.298 1.00 0.00 C ATOM 636 O LEU A 56 3.163 -1.651 -6.216 1.00 0.00 O ATOM 637 CB LEU A 56 2.052 0.433 -8.478 1.00 0.00 C ATOM 638 CG LEU A 56 0.569 0.217 -8.876 1.00 0.00 C ATOM 639 CD1 LEU A 56 -0.345 1.173 -8.097 1.00 0.00 C ATOM 640 CD2 LEU A 56 0.341 0.424 -10.383 1.00 0.00 C ATOM 0 H LEU A 56 2.133 -1.311 -10.301 1.00 0.00 H new ATOM 0 HA LEU A 56 3.980 -0.495 -8.228 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.074 0.894 -7.490 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.488 1.150 -9.174 1.00 0.00 H new ATOM 0 HG LEU A 56 0.324 -0.816 -8.628 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.381 1.006 -8.391 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.237 0.990 -7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.067 2.203 -8.318 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.711 0.263 -10.617 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.622 1.441 -10.657 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.950 -0.285 -10.944 1.00 0.00 H new ATOM 652 N ALA A 57 1.668 -2.716 -7.526 1.00 0.00 N ATOM 653 CA ALA A 57 1.136 -3.607 -6.488 1.00 0.00 C ATOM 654 C ALA A 57 1.579 -5.065 -6.636 1.00 0.00 C ATOM 655 O ALA A 57 2.016 -5.653 -5.653 1.00 0.00 O ATOM 656 CB ALA A 57 -0.396 -3.500 -6.481 1.00 0.00 C ATOM 0 H ALA A 57 1.264 -2.883 -8.448 1.00 0.00 H new ATOM 0 HA ALA A 57 1.549 -3.278 -5.534 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -0.803 -4.158 -5.713 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.688 -2.471 -6.269 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -0.786 -3.795 -7.455 1.00 0.00 H new ATOM 662 N ALA A 58 1.495 -5.653 -7.835 1.00 0.00 N ATOM 663 CA ALA A 58 1.692 -7.095 -8.040 1.00 0.00 C ATOM 664 C ALA A 58 3.059 -7.599 -7.531 1.00 0.00 C ATOM 665 O ALA A 58 3.120 -8.560 -6.759 1.00 0.00 O ATOM 666 CB ALA A 58 1.475 -7.396 -9.530 1.00 0.00 C ATOM 0 H ALA A 58 1.288 -5.142 -8.693 1.00 0.00 H new ATOM 0 HA ALA A 58 0.963 -7.642 -7.442 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.616 -8.462 -9.710 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.463 -7.110 -9.815 1.00 0.00 H new ATOM 0 HB3 ALA A 58 2.193 -6.830 -10.124 1.00 0.00 H new ATOM 672 N THR A 59 4.144 -6.909 -7.912 1.00 0.00 N ATOM 673 CA THR A 59 5.521 -7.204 -7.471 1.00 0.00 C ATOM 674 C THR A 59 5.777 -6.789 -6.024 1.00 0.00 C ATOM 675 O THR A 59 6.485 -7.494 -5.310 1.00 0.00 O ATOM 676 CB THR A 59 6.530 -6.567 -8.435 1.00 0.00 C ATOM 677 OG1 THR A 59 7.818 -7.038 -8.114 1.00 0.00 O ATOM 678 CG2 THR A 59 6.550 -5.039 -8.370 1.00 0.00 C ATOM 0 H THR A 59 4.091 -6.114 -8.548 1.00 0.00 H new ATOM 0 HA THR A 59 5.652 -8.286 -7.496 1.00 0.00 H new ATOM 0 HB THR A 59 6.227 -6.847 -9.444 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.421 -6.883 -8.871 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.285 -4.654 -9.077 1.00 0.00 H new ATOM 0 HG22 THR A 59 5.564 -4.651 -8.625 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.815 -4.721 -7.362 1.00 0.00 H new ATOM 686 N ALA A 60 5.188 -5.677 -5.573 1.00 0.00 N ATOM 687 CA ALA A 60 5.353 -5.146 -4.219 1.00 0.00 C ATOM 688 C ALA A 60 4.690 -6.039 -3.155 1.00 0.00 C ATOM 689 O ALA A 60 5.238 -6.218 -2.067 1.00 0.00 O ATOM 690 CB ALA A 60 4.785 -3.727 -4.195 1.00 0.00 C ATOM 0 H ALA A 60 4.570 -5.110 -6.153 1.00 0.00 H new ATOM 0 HA ALA A 60 6.413 -5.129 -3.966 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.896 -3.308 -3.195 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.325 -3.107 -4.910 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.729 -3.753 -4.462 1.00 0.00 H new ATOM 696 N LEU A 61 3.536 -6.625 -3.483 1.00 0.00 N ATOM 697 CA LEU A 61 2.808 -7.573 -2.641 1.00 0.00 C ATOM 698 C LEU A 61 3.548 -8.913 -2.617 1.00 0.00 C ATOM 699 O LEU A 61 3.756 -9.458 -1.537 1.00 0.00 O ATOM 700 CB LEU A 61 1.358 -7.665 -3.167 1.00 0.00 C ATOM 701 CG LEU A 61 0.306 -8.378 -2.288 1.00 0.00 C ATOM 702 CD1 LEU A 61 0.492 -9.900 -2.221 1.00 0.00 C ATOM 703 CD2 LEU A 61 0.231 -7.789 -0.871 1.00 0.00 C ATOM 0 H LEU A 61 3.069 -6.446 -4.372 1.00 0.00 H new ATOM 0 HA LEU A 61 2.759 -7.243 -1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 61 1.006 -6.650 -3.351 1.00 0.00 H new ATOM 0 HB3 LEU A 61 1.385 -8.172 -4.131 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.644 -8.193 -2.789 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.281 -10.334 -1.587 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.417 -10.320 -3.224 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.473 -10.129 -1.804 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.523 -8.325 -0.294 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.201 -7.890 -0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.038 -6.734 -0.929 1.00 0.00 H new ATOM 715 N ALA A 62 4.032 -9.399 -3.766 1.00 0.00 N ATOM 716 CA ALA A 62 4.822 -10.633 -3.861 1.00 0.00 C ATOM 717 C ALA A 62 6.104 -10.608 -2.997 1.00 0.00 C ATOM 718 O ALA A 62 6.453 -11.631 -2.403 1.00 0.00 O ATOM 719 CB ALA A 62 5.139 -10.888 -5.341 1.00 0.00 C ATOM 0 H ALA A 62 3.885 -8.942 -4.666 1.00 0.00 H new ATOM 0 HA ALA A 62 4.230 -11.454 -3.456 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.726 -11.801 -5.435 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.209 -10.995 -5.899 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.707 -10.048 -5.741 1.00 0.00 H new ATOM 725 N ARG A 63 6.769 -9.447 -2.885 1.00 0.00 N ATOM 726 CA ARG A 63 7.930 -9.224 -1.999 1.00 0.00 C ATOM 727 C ARG A 63 7.563 -8.720 -0.581 1.00 0.00 C ATOM 728 O ARG A 63 8.449 -8.531 0.252 1.00 0.00 O ATOM 729 CB ARG A 63 8.930 -8.280 -2.694 1.00 0.00 C ATOM 730 CG ARG A 63 8.438 -6.827 -2.736 1.00 0.00 C ATOM 731 CD ARG A 63 9.391 -5.873 -3.461 1.00 0.00 C ATOM 732 NE ARG A 63 9.427 -6.128 -4.912 1.00 0.00 N ATOM 733 CZ ARG A 63 10.447 -5.874 -5.723 1.00 0.00 C ATOM 734 NH1 ARG A 63 11.564 -5.321 -5.296 1.00 0.00 N1+ ATOM 735 NH2 ARG A 63 10.353 -6.177 -6.996 1.00 0.00 N ATOM 0 H ARG A 63 6.511 -8.617 -3.419 1.00 0.00 H new ATOM 0 HA ARG A 63 8.392 -10.197 -1.832 1.00 0.00 H new ATOM 0 HB2 ARG A 63 9.886 -8.321 -2.172 1.00 0.00 H new ATOM 0 HB3 ARG A 63 9.107 -8.629 -3.711 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.465 -6.797 -3.227 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.291 -6.473 -1.716 1.00 0.00 H new ATOM 0 HD2 ARG A 63 9.080 -4.844 -3.281 1.00 0.00 H new ATOM 0 HD3 ARG A 63 10.394 -5.980 -3.049 1.00 0.00 H new ATOM 0 HE ARG A 63 8.592 -6.537 -5.332 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.667 -5.073 -4.312 1.00 0.00 H new ATOM 0 HH12 ARG A 63 12.326 -5.141 -5.949 1.00 0.00 H new ATOM 0 HH21 ARG A 63 9.500 -6.605 -7.357 1.00 0.00 H new ATOM 0 HH22 ARG A 63 11.133 -5.985 -7.625 1.00 0.00 H new ATOM 749 N LYS A 64 6.277 -8.456 -0.310 1.00 0.00 N ATOM 750 CA LYS A 64 5.733 -7.950 0.966 1.00 0.00 C ATOM 751 C LYS A 64 6.336 -6.587 1.411 1.00 0.00 C ATOM 752 O LYS A 64 6.549 -6.336 2.600 1.00 0.00 O ATOM 753 CB LYS A 64 5.748 -9.066 2.051 1.00 0.00 C ATOM 754 CG LYS A 64 4.585 -10.074 1.929 1.00 0.00 C ATOM 755 CD LYS A 64 4.803 -11.215 0.919 1.00 0.00 C ATOM 756 CE LYS A 64 3.475 -11.847 0.463 1.00 0.00 C ATOM 757 NZ LYS A 64 2.791 -12.619 1.535 1.00 0.00 N1+ ATOM 0 H LYS A 64 5.547 -8.596 -1.009 1.00 0.00 H new ATOM 0 HA LYS A 64 4.685 -7.699 0.803 1.00 0.00 H new ATOM 0 HB2 LYS A 64 6.692 -9.607 1.989 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.711 -8.601 3.036 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.401 -10.511 2.911 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.683 -9.530 1.648 1.00 0.00 H new ATOM 0 HD2 LYS A 64 5.339 -10.832 0.050 1.00 0.00 H new ATOM 0 HD3 LYS A 64 5.433 -11.982 1.370 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.809 -11.060 0.110 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.666 -12.506 -0.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 1.905 -13.018 1.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.410 -13.390 1.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.579 -11.989 2.335 1.00 0.00 H new ATOM 771 N ASP A 65 6.590 -5.670 0.468 1.00 0.00 N ATOM 772 CA ASP A 65 7.136 -4.322 0.726 1.00 0.00 C ATOM 773 C ASP A 65 6.039 -3.326 1.160 1.00 0.00 C ATOM 774 O ASP A 65 5.615 -2.448 0.399 1.00 0.00 O ATOM 775 CB ASP A 65 7.965 -3.817 -0.478 1.00 0.00 C ATOM 776 CG ASP A 65 9.479 -4.003 -0.272 1.00 0.00 C ATOM 777 OD1 ASP A 65 10.173 -2.974 -0.091 1.00 0.00 O ATOM 778 OD2 ASP A 65 9.969 -5.152 -0.311 1.00 0.00 O1- ATOM 0 H ASP A 65 6.419 -5.845 -0.522 1.00 0.00 H new ATOM 0 HA ASP A 65 7.820 -4.396 1.571 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.656 -4.350 -1.377 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.751 -2.761 -0.645 1.00 0.00 H new ATOM 783 N THR A 66 5.619 -3.430 2.431 1.00 0.00 N ATOM 784 CA THR A 66 4.641 -2.530 3.088 1.00 0.00 C ATOM 785 C THR A 66 5.016 -1.048 2.980 1.00 0.00 C ATOM 786 O THR A 66 4.128 -0.202 2.987 1.00 0.00 O ATOM 787 CB THR A 66 4.375 -2.956 4.538 1.00 0.00 C ATOM 788 OG1 THR A 66 3.966 -4.307 4.545 1.00 0.00 O ATOM 789 CG2 THR A 66 3.215 -2.183 5.169 1.00 0.00 C ATOM 0 H THR A 66 5.957 -4.163 3.054 1.00 0.00 H new ATOM 0 HA THR A 66 3.707 -2.635 2.537 1.00 0.00 H new ATOM 0 HB THR A 66 5.295 -2.773 5.093 1.00 0.00 H new ATOM 0 HG1 THR A 66 3.643 -4.546 5.439 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.067 -2.521 6.195 1.00 0.00 H new ATOM 0 HG22 THR A 66 3.445 -1.117 5.168 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.306 -2.359 4.594 1.00 0.00 H new ATOM 797 N ALA A 67 6.297 -0.721 2.773 1.00 0.00 N ATOM 798 CA ALA A 67 6.778 0.636 2.494 1.00 0.00 C ATOM 799 C ALA A 67 6.003 1.327 1.357 1.00 0.00 C ATOM 800 O ALA A 67 5.566 2.464 1.525 1.00 0.00 O ATOM 801 CB ALA A 67 8.276 0.552 2.166 1.00 0.00 C ATOM 0 H ALA A 67 7.047 -1.412 2.796 1.00 0.00 H new ATOM 0 HA ALA A 67 6.611 1.252 3.377 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.659 1.550 1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.812 0.131 3.017 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.422 -0.085 1.294 1.00 0.00 H new ATOM 807 N VAL A 68 5.794 0.636 0.232 1.00 0.00 N ATOM 808 CA VAL A 68 4.967 1.125 -0.892 1.00 0.00 C ATOM 809 C VAL A 68 3.537 0.565 -0.843 1.00 0.00 C ATOM 810 O VAL A 68 2.613 1.253 -1.278 1.00 0.00 O ATOM 811 CB VAL A 68 5.647 0.873 -2.260 1.00 0.00 C ATOM 812 CG1 VAL A 68 5.848 -0.619 -2.565 1.00 0.00 C ATOM 813 CG2 VAL A 68 4.878 1.541 -3.411 1.00 0.00 C ATOM 0 H VAL A 68 6.195 -0.288 0.068 1.00 0.00 H new ATOM 0 HA VAL A 68 4.882 2.206 -0.777 1.00 0.00 H new ATOM 0 HB VAL A 68 6.634 1.329 -2.182 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.329 -0.730 -3.537 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.477 -1.066 -1.796 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.881 -1.121 -2.579 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.387 1.341 -4.354 1.00 0.00 H new ATOM 0 HG22 VAL A 68 3.865 1.140 -3.453 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.835 2.617 -3.244 1.00 0.00 H new ATOM 823 N LEU A 69 3.326 -0.627 -0.257 1.00 0.00 N ATOM 824 CA LEU A 69 1.986 -1.198 -0.086 1.00 0.00 C ATOM 825 C LEU A 69 1.076 -0.285 0.754 1.00 0.00 C ATOM 826 O LEU A 69 -0.094 -0.147 0.422 1.00 0.00 O ATOM 827 CB LEU A 69 2.053 -2.651 0.438 1.00 0.00 C ATOM 828 CG LEU A 69 1.572 -3.747 -0.538 1.00 0.00 C ATOM 829 CD1 LEU A 69 0.109 -3.614 -0.999 1.00 0.00 C ATOM 830 CD2 LEU A 69 2.519 -3.813 -1.738 1.00 0.00 C ATOM 0 H LEU A 69 4.076 -1.215 0.107 1.00 0.00 H new ATOM 0 HA LEU A 69 1.518 -1.253 -1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.084 -2.868 0.717 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.456 -2.716 1.348 1.00 0.00 H new ATOM 0 HG LEU A 69 1.597 -4.681 0.023 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.133 -4.429 -1.681 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.551 -3.658 -0.133 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.026 -2.661 -1.510 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.180 -4.586 -2.427 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.527 -2.850 -2.249 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.526 -4.050 -1.394 1.00 0.00 H new ATOM 842 N ASN A 70 1.620 0.444 1.737 1.00 0.00 N ATOM 843 CA ASN A 70 0.925 1.526 2.448 1.00 0.00 C ATOM 844 C ASN A 70 0.320 2.568 1.488 1.00 0.00 C ATOM 845 O ASN A 70 -0.887 2.811 1.527 1.00 0.00 O ATOM 846 CB ASN A 70 1.896 2.194 3.446 1.00 0.00 C ATOM 847 CG ASN A 70 1.440 3.597 3.862 1.00 0.00 C ATOM 848 OD1 ASN A 70 0.426 3.789 4.510 1.00 0.00 O ATOM 849 ND2 ASN A 70 2.123 4.634 3.420 1.00 0.00 N ATOM 0 H ASN A 70 2.574 0.296 2.067 1.00 0.00 H new ATOM 0 HA ASN A 70 0.089 1.086 2.992 1.00 0.00 H new ATOM 0 HB2 ASN A 70 1.987 1.568 4.333 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.887 2.256 2.997 1.00 0.00 H new ATOM 0 HD21 ASN A 70 1.801 5.580 3.622 1.00 0.00 H new ATOM 0 HD22 ASN A 70 2.974 4.490 2.876 1.00 0.00 H new ATOM 856 N ARG A 71 1.145 3.187 0.633 1.00 0.00 N ATOM 857 CA ARG A 71 0.708 4.266 -0.263 1.00 0.00 C ATOM 858 C ARG A 71 -0.315 3.756 -1.282 1.00 0.00 C ATOM 859 O ARG A 71 -1.415 4.302 -1.365 1.00 0.00 O ATOM 860 CB ARG A 71 1.921 4.906 -0.957 1.00 0.00 C ATOM 861 CG ARG A 71 2.618 5.975 -0.095 1.00 0.00 C ATOM 862 CD ARG A 71 4.154 5.906 -0.141 1.00 0.00 C ATOM 863 NE ARG A 71 4.700 5.152 1.005 1.00 0.00 N ATOM 864 CZ ARG A 71 4.994 5.637 2.207 1.00 0.00 C ATOM 865 NH1 ARG A 71 4.809 6.900 2.528 1.00 0.00 N1+ ATOM 866 NH2 ARG A 71 5.458 4.819 3.122 1.00 0.00 N ATOM 0 H ARG A 71 2.134 2.954 0.543 1.00 0.00 H new ATOM 0 HA ARG A 71 0.215 5.033 0.334 1.00 0.00 H new ATOM 0 HB2 ARG A 71 2.640 4.127 -1.210 1.00 0.00 H new ATOM 0 HB3 ARG A 71 1.598 5.358 -1.895 1.00 0.00 H new ATOM 0 HG2 ARG A 71 2.298 6.962 -0.428 1.00 0.00 H new ATOM 0 HG3 ARG A 71 2.290 5.866 0.939 1.00 0.00 H new ATOM 0 HD2 ARG A 71 4.470 5.434 -1.071 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.564 6.916 -0.141 1.00 0.00 H new ATOM 0 HE ARG A 71 4.869 4.157 0.859 1.00 0.00 H new ATOM 0 HH11 ARG A 71 4.426 7.550 1.842 1.00 0.00 H new ATOM 0 HH12 ARG A 71 5.049 7.229 3.463 1.00 0.00 H new ATOM 0 HH21 ARG A 71 5.587 3.831 2.905 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.690 5.171 4.051 1.00 0.00 H new ATOM 880 N ILE A 72 -0.009 2.659 -1.988 1.00 0.00 N ATOM 881 CA ILE A 72 -0.937 2.094 -2.988 1.00 0.00 C ATOM 882 C ILE A 72 -2.227 1.589 -2.340 1.00 0.00 C ATOM 883 O ILE A 72 -3.276 1.713 -2.957 1.00 0.00 O ATOM 884 CB ILE A 72 -0.287 1.019 -3.891 1.00 0.00 C ATOM 885 CG1 ILE A 72 -0.102 -0.305 -3.134 1.00 0.00 C ATOM 886 CG2 ILE A 72 1.015 1.543 -4.522 1.00 0.00 C ATOM 887 CD1 ILE A 72 0.789 -1.315 -3.852 1.00 0.00 C ATOM 0 H ILE A 72 0.867 2.145 -1.889 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.200 2.918 -3.651 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.965 0.804 -4.717 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.324 -0.094 -2.153 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.081 -0.755 -2.966 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.452 0.768 -5.152 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.797 2.423 -5.127 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.719 1.810 -3.734 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.868 -2.221 -3.252 1.00 0.00 H new ATOM 0 HD12 ILE A 72 0.355 -1.559 -4.822 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.781 -0.887 -3.996 1.00 0.00 H new ATOM 899 N ALA A 73 -2.206 1.101 -1.096 1.00 0.00 N ATOM 900 CA ALA A 73 -3.435 0.764 -0.386 1.00 0.00 C ATOM 901 C ALA A 73 -4.285 2.013 -0.110 1.00 0.00 C ATOM 902 O ALA A 73 -5.450 2.068 -0.498 1.00 0.00 O ATOM 903 CB ALA A 73 -3.112 -0.009 0.893 1.00 0.00 C ATOM 0 H ALA A 73 -1.352 0.932 -0.564 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.037 0.116 -1.023 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -4.038 -0.254 1.413 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.584 -0.928 0.639 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.484 0.604 1.540 1.00 0.00 H new ATOM 909 N ASN A 74 -3.684 3.051 0.472 1.00 0.00 N ATOM 910 CA ASN A 74 -4.365 4.316 0.757 1.00 0.00 C ATOM 911 C ASN A 74 -4.830 5.080 -0.509 1.00 0.00 C ATOM 912 O ASN A 74 -5.582 6.041 -0.379 1.00 0.00 O ATOM 913 CB ASN A 74 -3.473 5.187 1.657 1.00 0.00 C ATOM 914 CG ASN A 74 -3.525 4.748 3.120 1.00 0.00 C ATOM 915 OD1 ASN A 74 -4.357 5.200 3.898 1.00 0.00 O ATOM 916 ND2 ASN A 74 -2.643 3.864 3.544 1.00 0.00 N ATOM 0 H ASN A 74 -2.706 3.039 0.761 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.288 4.074 1.285 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -2.444 5.139 1.301 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -3.788 6.228 1.580 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.655 3.558 4.517 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.949 3.486 2.899 1.00 0.00 H new ATOM 923 N GLU A 75 -4.425 4.680 -1.722 1.00 0.00 N ATOM 924 CA GLU A 75 -4.896 5.265 -2.988 1.00 0.00 C ATOM 925 C GLU A 75 -5.782 4.303 -3.801 1.00 0.00 C ATOM 926 O GLU A 75 -6.924 4.634 -4.118 1.00 0.00 O ATOM 927 CB GLU A 75 -3.693 5.706 -3.838 1.00 0.00 C ATOM 928 CG GLU A 75 -2.953 6.930 -3.279 1.00 0.00 C ATOM 929 CD GLU A 75 -3.836 8.187 -3.195 1.00 0.00 C ATOM 930 OE1 GLU A 75 -3.783 8.888 -2.159 1.00 0.00 O ATOM 931 OE2 GLU A 75 -4.547 8.503 -4.178 1.00 0.00 O1- ATOM 0 H GLU A 75 -3.749 3.928 -1.855 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.513 6.126 -2.730 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.992 4.875 -3.918 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.037 5.931 -4.848 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.573 6.694 -2.285 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.089 7.143 -3.908 1.00 0.00 H new ATOM 938 N ALA A 76 -5.272 3.121 -4.162 1.00 0.00 N ATOM 939 CA ALA A 76 -5.927 2.163 -5.054 1.00 0.00 C ATOM 940 C ALA A 76 -6.838 1.168 -4.316 1.00 0.00 C ATOM 941 O ALA A 76 -7.888 0.815 -4.854 1.00 0.00 O ATOM 942 CB ALA A 76 -4.847 1.432 -5.864 1.00 0.00 C ATOM 0 H ALA A 76 -4.364 2.796 -3.830 1.00 0.00 H new ATOM 0 HA ALA A 76 -6.588 2.718 -5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.319 0.714 -6.534 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.279 2.155 -6.449 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.175 0.907 -5.185 1.00 0.00 H new ATOM 948 N LEU A 77 -6.487 0.739 -3.094 1.00 0.00 N ATOM 949 CA LEU A 77 -7.355 -0.123 -2.269 1.00 0.00 C ATOM 950 C LEU A 77 -8.449 0.697 -1.545 1.00 0.00 C ATOM 951 O LEU A 77 -9.427 0.142 -1.048 1.00 0.00 O ATOM 952 CB LEU A 77 -6.550 -0.979 -1.275 1.00 0.00 C ATOM 953 CG LEU A 77 -5.668 -2.127 -1.831 1.00 0.00 C ATOM 954 CD1 LEU A 77 -6.513 -3.382 -2.071 1.00 0.00 C ATOM 955 CD2 LEU A 77 -4.866 -1.829 -3.109 1.00 0.00 C ATOM 0 H LEU A 77 -5.600 0.977 -2.650 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.853 -0.811 -2.953 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.903 -0.309 -0.709 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.255 -1.416 -0.567 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.923 -2.270 -1.048 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -5.879 -4.178 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.962 -3.703 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.300 -3.159 -2.792 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.292 -2.711 -3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.551 -1.567 -3.915 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.186 -0.997 -2.926 1.00 0.00 H new ATOM 967 N ASP A 78 -8.317 2.023 -1.520 1.00 0.00 N ATOM 968 CA ASP A 78 -9.336 2.972 -1.052 1.00 0.00 C ATOM 969 C ASP A 78 -10.565 3.052 -1.987 1.00 0.00 C ATOM 970 O ASP A 78 -11.619 3.534 -1.577 1.00 0.00 O ATOM 971 CB ASP A 78 -8.679 4.360 -0.897 1.00 0.00 C ATOM 972 CG ASP A 78 -8.502 4.770 0.576 1.00 0.00 C ATOM 973 OD1 ASP A 78 -8.971 5.868 0.950 1.00 0.00 O ATOM 974 OD2 ASP A 78 -7.898 3.994 1.348 1.00 0.00 O1- ATOM 0 H ASP A 78 -7.466 2.487 -1.837 1.00 0.00 H new ATOM 0 HA ASP A 78 -9.714 2.617 -0.093 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.706 4.354 -1.388 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.289 5.106 -1.407 1.00 0.00 H new ATOM 979 N GLN A 79 -10.441 2.588 -3.236 1.00 0.00 N ATOM 980 CA GLN A 79 -11.463 2.707 -4.282 1.00 0.00 C ATOM 981 C GLN A 79 -12.686 1.784 -4.041 1.00 0.00 C ATOM 982 O GLN A 79 -12.546 0.722 -3.421 1.00 0.00 O ATOM 983 CB GLN A 79 -10.821 2.391 -5.643 1.00 0.00 C ATOM 984 CG GLN A 79 -9.672 3.325 -6.050 1.00 0.00 C ATOM 985 CD GLN A 79 -9.093 2.935 -7.413 1.00 0.00 C ATOM 986 OE1 GLN A 79 -9.221 3.645 -8.404 1.00 0.00 O ATOM 987 NE2 GLN A 79 -8.445 1.792 -7.520 1.00 0.00 N ATOM 0 H GLN A 79 -9.602 2.105 -3.556 1.00 0.00 H new ATOM 0 HA GLN A 79 -11.841 3.729 -4.262 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.447 1.367 -5.623 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.593 2.433 -6.411 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.032 4.353 -6.086 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.887 3.289 -5.295 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -8.331 1.192 -6.703 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -8.057 1.508 -8.420 1.00 0.00 H new ATOM 996 N PRO A 80 -13.887 2.136 -4.554 1.00 0.00 N ATOM 997 CA PRO A 80 -15.136 1.418 -4.270 1.00 0.00 C ATOM 998 C PRO A 80 -15.192 -0.023 -4.807 1.00 0.00 C ATOM 999 O PRO A 80 -16.016 -0.808 -4.343 1.00 0.00 O ATOM 1000 CB PRO A 80 -16.253 2.278 -4.877 1.00 0.00 C ATOM 1001 CG PRO A 80 -15.549 3.078 -5.969 1.00 0.00 C ATOM 1002 CD PRO A 80 -14.178 3.323 -5.349 1.00 0.00 C ATOM 0 HA PRO A 80 -15.235 1.288 -3.192 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -17.054 1.662 -5.286 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -16.704 2.932 -4.131 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -15.481 2.521 -6.903 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -16.069 4.010 -6.191 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -13.421 3.474 -6.119 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -14.184 4.219 -4.728 1.00 0.00 H new ATOM 1010 N ASP A 81 -14.324 -0.402 -5.751 1.00 0.00 N ATOM 1011 CA ASP A 81 -14.263 -1.748 -6.337 1.00 0.00 C ATOM 1012 C ASP A 81 -13.565 -2.801 -5.444 1.00 0.00 C ATOM 1013 O ASP A 81 -13.544 -3.985 -5.784 1.00 0.00 O ATOM 1014 CB ASP A 81 -13.607 -1.657 -7.725 1.00 0.00 C ATOM 1015 CG ASP A 81 -12.209 -1.018 -7.704 1.00 0.00 C ATOM 1016 OD1 ASP A 81 -11.205 -1.753 -7.853 1.00 0.00 O ATOM 1017 OD2 ASP A 81 -12.139 0.222 -7.542 1.00 0.00 O1- ATOM 0 H ASP A 81 -13.627 0.233 -6.139 1.00 0.00 H new ATOM 0 HA ASP A 81 -15.288 -2.109 -6.427 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.533 -2.658 -8.149 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.252 -1.078 -8.385 1.00 0.00 H new ATOM 1022 N VAL A 82 -13.008 -2.380 -4.308 1.00 0.00 N ATOM 1023 CA VAL A 82 -12.086 -3.162 -3.458 1.00 0.00 C ATOM 1024 C VAL A 82 -12.821 -3.904 -2.328 1.00 0.00 C ATOM 1025 O VAL A 82 -13.835 -3.419 -1.822 1.00 0.00 O ATOM 1026 CB VAL A 82 -11.008 -2.222 -2.876 1.00 0.00 C ATOM 1027 CG1 VAL A 82 -10.018 -2.966 -1.961 1.00 0.00 C ATOM 1028 CG2 VAL A 82 -10.229 -1.522 -4.011 1.00 0.00 C ATOM 0 H VAL A 82 -13.189 -1.449 -3.933 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.617 -3.924 -4.081 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.531 -1.479 -2.274 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.279 -2.263 -1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.559 -3.415 -1.128 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.514 -3.747 -2.530 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.474 -0.864 -3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.744 -2.272 -4.636 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.919 -0.936 -4.618 1.00 0.00 H new ATOM 1038 N ARG A 83 -12.291 -5.068 -1.912 1.00 0.00 N ATOM 1039 CA ARG A 83 -12.864 -5.900 -0.842 1.00 0.00 C ATOM 1040 C ARG A 83 -12.357 -5.472 0.553 1.00 0.00 C ATOM 1041 O ARG A 83 -13.169 -4.998 1.347 1.00 0.00 O ATOM 1042 CB ARG A 83 -12.617 -7.400 -1.099 1.00 0.00 C ATOM 1043 CG ARG A 83 -12.983 -7.931 -2.502 1.00 0.00 C ATOM 1044 CD ARG A 83 -14.285 -8.742 -2.534 1.00 0.00 C ATOM 1045 NE ARG A 83 -15.449 -7.966 -2.072 1.00 0.00 N ATOM 1046 CZ ARG A 83 -16.147 -7.079 -2.771 1.00 0.00 C ATOM 1047 NH1 ARG A 83 -15.828 -6.751 -4.006 1.00 0.00 N1+ ATOM 1048 NH2 ARG A 83 -17.198 -6.507 -2.226 1.00 0.00 N ATOM 0 H ARG A 83 -11.441 -5.461 -2.316 1.00 0.00 H new ATOM 0 HA ARG A 83 -13.942 -5.740 -0.853 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -11.562 -7.607 -0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.182 -7.970 -0.361 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.073 -7.088 -3.188 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.168 -8.555 -2.869 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.466 -9.091 -3.551 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.172 -9.628 -1.909 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.751 -8.128 -1.111 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -15.021 -7.183 -4.456 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -16.388 -6.065 -4.512 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -17.472 -6.746 -1.273 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -17.740 -5.824 -2.756 1.00 0.00 H new ATOM 1062 N ALA A 84 -11.051 -5.592 0.855 1.00 0.00 N ATOM 1063 CA ALA A 84 -10.427 -5.261 2.157 1.00 0.00 C ATOM 1064 C ALA A 84 -8.889 -5.424 2.163 1.00 0.00 C ATOM 1065 O ALA A 84 -8.352 -6.348 1.555 1.00 0.00 O ATOM 1066 CB ALA A 84 -11.031 -6.133 3.277 1.00 0.00 C ATOM 0 H ALA A 84 -10.372 -5.935 0.175 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.641 -4.207 2.333 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.563 -5.879 4.228 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -12.104 -5.952 3.341 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.853 -7.185 3.055 1.00 0.00 H new ATOM 1072 N VAL A 85 -8.174 -4.580 2.913 1.00 0.00 N ATOM 1073 CA VAL A 85 -6.706 -4.652 3.074 1.00 0.00 C ATOM 1074 C VAL A 85 -6.265 -4.014 4.405 1.00 0.00 C ATOM 1075 O VAL A 85 -6.922 -3.088 4.888 1.00 0.00 O ATOM 1076 CB VAL A 85 -6.014 -4.000 1.849 1.00 0.00 C ATOM 1077 CG1 VAL A 85 -5.992 -2.473 1.952 1.00 0.00 C ATOM 1078 CG2 VAL A 85 -4.604 -4.524 1.578 1.00 0.00 C ATOM 0 H VAL A 85 -8.598 -3.814 3.436 1.00 0.00 H new ATOM 0 HA VAL A 85 -6.398 -5.697 3.115 1.00 0.00 H new ATOM 0 HB VAL A 85 -6.628 -4.293 0.998 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.499 -2.056 1.074 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.014 -2.097 2.007 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -5.448 -2.177 2.849 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.189 -4.018 0.706 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.971 -4.331 2.444 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -4.644 -5.597 1.390 1.00 0.00 H new ATOM 1088 N THR A 86 -5.148 -4.481 4.982 1.00 0.00 N ATOM 1089 CA THR A 86 -4.628 -4.062 6.305 1.00 0.00 C ATOM 1090 C THR A 86 -3.154 -4.426 6.425 1.00 0.00 C ATOM 1091 O THR A 86 -2.750 -5.406 5.812 1.00 0.00 O ATOM 1092 CB THR A 86 -5.379 -4.719 7.483 1.00 0.00 C ATOM 1093 OG1 THR A 86 -6.634 -5.234 7.110 1.00 0.00 O ATOM 1094 CG2 THR A 86 -5.619 -3.705 8.601 1.00 0.00 C ATOM 0 H THR A 86 -4.559 -5.182 4.533 1.00 0.00 H new ATOM 0 HA THR A 86 -4.777 -2.984 6.363 1.00 0.00 H new ATOM 0 HB THR A 86 -4.742 -5.537 7.819 1.00 0.00 H new ATOM 0 HG1 THR A 86 -7.334 -4.818 7.655 1.00 0.00 H new ATOM 0 HG21 THR A 86 -6.149 -4.187 9.422 1.00 0.00 H new ATOM 0 HG22 THR A 86 -4.662 -3.326 8.960 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.217 -2.877 8.219 1.00 0.00 H new ATOM 1102 N PHE A 87 -2.367 -3.690 7.221 1.00 0.00 N ATOM 1103 CA PHE A 87 -0.922 -3.909 7.407 1.00 0.00 C ATOM 1104 C PHE A 87 -0.468 -3.471 8.810 1.00 0.00 C ATOM 1105 O PHE A 87 -0.800 -2.362 9.237 1.00 0.00 O ATOM 1106 CB PHE A 87 -0.113 -3.112 6.363 1.00 0.00 C ATOM 1107 CG PHE A 87 -0.584 -3.187 4.923 1.00 0.00 C ATOM 1108 CD1 PHE A 87 -1.694 -2.426 4.515 1.00 0.00 C ATOM 1109 CD2 PHE A 87 0.083 -3.995 3.985 1.00 0.00 C ATOM 1110 CE1 PHE A 87 -2.149 -2.473 3.193 1.00 0.00 C ATOM 1111 CE2 PHE A 87 -0.383 -4.057 2.660 1.00 0.00 C ATOM 1112 CZ PHE A 87 -1.493 -3.289 2.263 1.00 0.00 C ATOM 0 H PHE A 87 -2.724 -2.906 7.768 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.741 -4.977 7.284 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -0.110 -2.064 6.664 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.920 -3.457 6.400 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.202 -1.797 5.231 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.950 -4.566 4.281 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.002 -1.883 2.891 1.00 0.00 H new ATOM 0 HE2 PHE A 87 0.113 -4.696 1.945 1.00 0.00 H new ATOM 0 HZ PHE A 87 -1.839 -3.329 1.241 1.00 0.00 H new ATOM 1122 N LEU A 88 0.342 -4.287 9.498 1.00 0.00 N ATOM 1123 CA LEU A 88 0.834 -4.022 10.860 1.00 0.00 C ATOM 1124 C LEU A 88 2.205 -4.672 11.117 1.00 0.00 C ATOM 1125 O LEU A 88 2.487 -5.763 10.623 1.00 0.00 O ATOM 1126 CB LEU A 88 -0.250 -4.459 11.871 1.00 0.00 C ATOM 1127 CG LEU A 88 0.124 -4.388 13.372 1.00 0.00 C ATOM 1128 CD1 LEU A 88 -1.007 -3.786 14.218 1.00 0.00 C ATOM 1129 CD2 LEU A 88 0.453 -5.786 13.915 1.00 0.00 C ATOM 0 H LEU A 88 0.682 -5.170 9.116 1.00 0.00 H new ATOM 0 HA LEU A 88 1.009 -2.953 10.985 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.132 -3.839 11.711 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.535 -5.485 11.640 1.00 0.00 H new ATOM 0 HG LEU A 88 0.999 -3.742 13.446 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.702 -3.755 15.264 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.221 -2.775 13.872 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.902 -4.400 14.119 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.713 -5.714 14.971 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.415 -6.435 13.798 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.295 -6.203 13.362 1.00 0.00 H new ATOM 1141 N ASP A 89 3.050 -4.000 11.904 1.00 0.00 N ATOM 1142 CA ASP A 89 4.378 -4.482 12.318 1.00 0.00 C ATOM 1143 C ASP A 89 4.393 -5.140 13.716 1.00 0.00 C ATOM 1144 O ASP A 89 3.468 -4.962 14.509 1.00 0.00 O ATOM 1145 CB ASP A 89 5.389 -3.319 12.270 1.00 0.00 C ATOM 1146 CG ASP A 89 6.832 -3.771 11.987 1.00 0.00 C ATOM 1147 OD1 ASP A 89 7.716 -2.888 11.897 1.00 0.00 O ATOM 1148 OD2 ASP A 89 7.066 -4.998 11.871 1.00 0.00 O1- ATOM 0 H ASP A 89 2.826 -3.080 12.283 1.00 0.00 H new ATOM 0 HA ASP A 89 4.660 -5.263 11.612 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.081 -2.612 11.500 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.363 -2.786 13.221 1.00 0.00 H new ATOM 1153 N ALA A 90 5.489 -5.835 14.055 1.00 0.00 N ATOM 1154 CA ALA A 90 5.712 -6.499 15.352 1.00 0.00 C ATOM 1155 C ALA A 90 5.531 -5.575 16.565 1.00 0.00 C ATOM 1156 O ALA A 90 5.050 -6.013 17.612 1.00 0.00 O ATOM 1157 CB ALA A 90 7.135 -7.071 15.367 1.00 0.00 C ATOM 0 H ALA A 90 6.272 -5.956 13.413 1.00 0.00 H new ATOM 0 HA ALA A 90 4.956 -7.279 15.444 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.318 -7.567 16.320 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.246 -7.791 14.556 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.854 -6.262 15.235 1.00 0.00 H new ATOM 1163 N ARG A 91 5.849 -4.285 16.406 1.00 0.00 N ATOM 1164 CA ARG A 91 5.676 -3.229 17.416 1.00 0.00 C ATOM 1165 C ARG A 91 4.196 -2.928 17.749 1.00 0.00 C ATOM 1166 O ARG A 91 3.915 -2.096 18.610 1.00 0.00 O ATOM 1167 CB ARG A 91 6.440 -1.984 16.916 1.00 0.00 C ATOM 1168 CG ARG A 91 6.832 -1.012 18.044 1.00 0.00 C ATOM 1169 CD ARG A 91 7.877 0.020 17.596 1.00 0.00 C ATOM 1170 NE ARG A 91 9.184 -0.609 17.316 1.00 0.00 N ATOM 1171 CZ ARG A 91 10.329 0.016 17.067 1.00 0.00 C ATOM 1172 NH1 ARG A 91 10.424 1.330 17.063 1.00 0.00 N1+ ATOM 1173 NH2 ARG A 91 11.412 -0.688 16.816 1.00 0.00 N ATOM 0 H ARG A 91 6.250 -3.932 15.537 1.00 0.00 H new ATOM 0 HA ARG A 91 6.088 -3.568 18.367 1.00 0.00 H new ATOM 0 HB2 ARG A 91 7.341 -2.306 16.394 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.823 -1.456 16.190 1.00 0.00 H new ATOM 0 HG2 ARG A 91 5.941 -0.492 18.397 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.225 -1.579 18.888 1.00 0.00 H new ATOM 0 HD2 ARG A 91 7.522 0.533 16.702 1.00 0.00 H new ATOM 0 HD3 ARG A 91 7.996 0.777 18.371 1.00 0.00 H new ATOM 0 HE ARG A 91 9.210 -1.629 17.314 1.00 0.00 H new ATOM 0 HH11 ARG A 91 9.601 1.901 17.255 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.320 1.776 16.868 1.00 0.00 H new ATOM 0 HH21 ARG A 91 11.369 -1.707 16.814 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.295 -0.215 16.624 1.00 0.00 H new ATOM 1187 N GLN A 92 3.256 -3.589 17.058 1.00 0.00 N ATOM 1188 CA GLN A 92 1.803 -3.396 17.119 1.00 0.00 C ATOM 1189 C GLN A 92 1.424 -2.008 16.576 1.00 0.00 C ATOM 1190 O GLN A 92 0.600 -1.300 17.148 1.00 0.00 O ATOM 1191 CB GLN A 92 1.219 -3.725 18.511 1.00 0.00 C ATOM 1192 CG GLN A 92 1.454 -5.187 18.942 1.00 0.00 C ATOM 1193 CD GLN A 92 2.334 -5.303 20.190 1.00 0.00 C ATOM 1194 OE1 GLN A 92 1.896 -5.087 21.314 1.00 0.00 O ATOM 1195 NE2 GLN A 92 3.601 -5.643 20.060 1.00 0.00 N ATOM 0 H GLN A 92 3.510 -4.323 16.397 1.00 0.00 H new ATOM 0 HA GLN A 92 1.327 -4.122 16.460 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.664 -3.060 19.251 1.00 0.00 H new ATOM 0 HB3 GLN A 92 0.148 -3.523 18.505 1.00 0.00 H new ATOM 0 HG2 GLN A 92 0.493 -5.663 19.135 1.00 0.00 H new ATOM 0 HG3 GLN A 92 1.921 -5.732 18.122 1.00 0.00 H new ATOM 0 HE21 GLN A 92 3.987 -5.828 19.134 1.00 0.00 H new ATOM 0 HE22 GLN A 92 4.195 -5.722 20.885 1.00 0.00 H new ATOM 1204 N GLU A 93 2.055 -1.617 15.465 1.00 0.00 N ATOM 1205 CA GLU A 93 1.801 -0.383 14.724 1.00 0.00 C ATOM 1206 C GLU A 93 1.116 -0.739 13.400 1.00 0.00 C ATOM 1207 O GLU A 93 1.720 -1.416 12.570 1.00 0.00 O ATOM 1208 CB GLU A 93 3.149 0.330 14.488 1.00 0.00 C ATOM 1209 CG GLU A 93 3.062 1.552 13.558 1.00 0.00 C ATOM 1210 CD GLU A 93 4.393 2.324 13.425 1.00 0.00 C ATOM 1211 OE1 GLU A 93 4.431 3.301 12.643 1.00 0.00 O ATOM 1212 OE2 GLU A 93 5.398 1.979 14.088 1.00 0.00 O1- ATOM 0 H GLU A 93 2.791 -2.181 15.040 1.00 0.00 H new ATOM 0 HA GLU A 93 1.146 0.287 15.280 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.553 0.647 15.450 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.856 -0.384 14.066 1.00 0.00 H new ATOM 0 HG2 GLU A 93 2.742 1.223 12.569 1.00 0.00 H new ATOM 0 HG3 GLU A 93 2.295 2.229 13.933 1.00 0.00 H new ATOM 1219 N ARG A 94 -0.120 -0.266 13.187 1.00 0.00 N ATOM 1220 CA ARG A 94 -0.786 -0.289 11.876 1.00 0.00 C ATOM 1221 C ARG A 94 -0.082 0.712 10.953 1.00 0.00 C ATOM 1222 O ARG A 94 -0.053 1.908 11.253 1.00 0.00 O ATOM 1223 CB ARG A 94 -2.296 0.034 12.005 1.00 0.00 C ATOM 1224 CG ARG A 94 -3.171 -1.234 11.981 1.00 0.00 C ATOM 1225 CD ARG A 94 -4.524 -1.100 12.702 1.00 0.00 C ATOM 1226 NE ARG A 94 -5.590 -0.471 11.893 1.00 0.00 N ATOM 1227 CZ ARG A 94 -6.091 0.755 12.028 1.00 0.00 C ATOM 1228 NH1 ARG A 94 -5.469 1.701 12.699 1.00 0.00 N1+ ATOM 1229 NH2 ARG A 94 -7.245 1.054 11.469 1.00 0.00 N ATOM 0 H ARG A 94 -0.690 0.147 13.925 1.00 0.00 H new ATOM 0 HA ARG A 94 -0.715 -1.290 11.451 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.471 0.576 12.935 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -2.595 0.694 11.191 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -3.355 -1.512 10.943 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.613 -2.052 12.436 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -4.857 -2.091 13.011 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.381 -0.514 13.610 1.00 0.00 H new ATOM 0 HE ARG A 94 -5.987 -1.042 11.146 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -4.569 1.507 13.139 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -5.887 2.628 12.779 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.751 0.348 10.935 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -7.633 1.992 11.570 1.00 0.00 H new ATOM 1243 N LEU A 95 0.471 0.232 9.835 1.00 0.00 N ATOM 1244 CA LEU A 95 1.035 1.094 8.787 1.00 0.00 C ATOM 1245 C LEU A 95 -0.075 1.614 7.867 1.00 0.00 C ATOM 1246 O LEU A 95 -0.036 2.774 7.464 1.00 0.00 O ATOM 1247 CB LEU A 95 2.117 0.365 7.960 1.00 0.00 C ATOM 1248 CG LEU A 95 3.381 -0.021 8.760 1.00 0.00 C ATOM 1249 CD1 LEU A 95 3.233 -1.417 9.376 1.00 0.00 C ATOM 1250 CD2 LEU A 95 4.642 -0.008 7.881 1.00 0.00 C ATOM 0 H LEU A 95 0.541 -0.765 9.629 1.00 0.00 H new ATOM 0 HA LEU A 95 1.514 1.938 9.283 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.683 -0.539 7.533 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.410 1.003 7.126 1.00 0.00 H new ATOM 0 HG LEU A 95 3.489 0.725 9.547 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.136 -1.666 9.934 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.376 -1.429 10.049 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.083 -2.150 8.584 1.00 0.00 H new ATOM 0 HD21 LEU A 95 5.508 -0.285 8.483 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.524 -0.721 7.065 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.790 0.991 7.471 1.00 0.00 H new ATOM 1262 N ALA A 96 -1.067 0.768 7.562 1.00 0.00 N ATOM 1263 CA ALA A 96 -2.118 1.041 6.585 1.00 0.00 C ATOM 1264 C ALA A 96 -3.323 0.102 6.735 1.00 0.00 C ATOM 1265 O ALA A 96 -3.276 -0.909 7.436 1.00 0.00 O ATOM 1266 CB ALA A 96 -1.507 0.959 5.178 1.00 0.00 C ATOM 0 H ALA A 96 -1.159 -0.148 8.002 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.509 2.043 6.761 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.278 1.160 4.434 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.710 1.697 5.084 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -1.099 -0.039 5.016 1.00 0.00 H new ATOM 1272 N HIS A 97 -4.403 0.450 6.042 1.00 0.00 N ATOM 1273 CA HIS A 97 -5.731 -0.155 6.129 1.00 0.00 C ATOM 1274 C HIS A 97 -6.677 0.540 5.138 1.00 0.00 C ATOM 1275 O HIS A 97 -6.638 1.765 5.008 1.00 0.00 O ATOM 1276 CB HIS A 97 -6.263 -0.076 7.573 1.00 0.00 C ATOM 1277 CG HIS A 97 -6.002 1.247 8.247 1.00 0.00 C ATOM 1278 ND1 HIS A 97 -6.621 2.446 7.985 1.00 0.00 N ATOM 1279 CD2 HIS A 97 -5.010 1.499 9.155 1.00 0.00 C ATOM 1280 CE1 HIS A 97 -6.036 3.391 8.739 1.00 0.00 C ATOM 1281 NE2 HIS A 97 -5.047 2.857 9.475 1.00 0.00 N ATOM 0 H HIS A 97 -4.374 1.209 5.362 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.670 -1.210 5.862 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -7.337 -0.263 7.565 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.805 -0.870 8.163 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.318 0.773 9.555 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.320 4.433 8.752 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -4.444 3.346 10.136 1.00 0.00 H new ATOM 1289 N ALA A 98 -7.529 -0.232 4.457 1.00 0.00 N ATOM 1290 CA ALA A 98 -8.429 0.233 3.398 1.00 0.00 C ATOM 1291 C ALA A 98 -9.490 -0.829 3.050 1.00 0.00 C ATOM 1292 O ALA A 98 -9.325 -2.023 3.326 1.00 0.00 O ATOM 1293 CB ALA A 98 -7.608 0.718 2.190 1.00 0.00 C ATOM 0 H ALA A 98 -7.614 -1.233 4.634 1.00 0.00 H new ATOM 0 HA ALA A 98 -8.999 1.091 3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.283 1.062 1.406 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.959 1.538 2.497 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.000 -0.103 1.810 1.00 0.00 H new ATOM 1299 N GLY A 99 -10.612 -0.369 2.495 1.00 0.00 N ATOM 1300 CA GLY A 99 -11.876 -1.113 2.430 1.00 0.00 C ATOM 1301 C GLY A 99 -12.832 -0.736 3.580 1.00 0.00 C ATOM 1302 O GLY A 99 -12.408 -0.074 4.534 1.00 0.00 O ATOM 0 H GLY A 99 -10.671 0.555 2.067 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.363 -0.916 1.475 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.669 -2.182 2.467 1.00 0.00 H new ATOM 1306 N PRO A 100 -14.112 -1.151 3.499 1.00 0.00 N ATOM 1307 CA PRO A 100 -15.211 -0.601 4.294 1.00 0.00 C ATOM 1308 C PRO A 100 -15.119 -0.908 5.794 1.00 0.00 C ATOM 1309 O PRO A 100 -15.483 -0.059 6.604 1.00 0.00 O ATOM 1310 CB PRO A 100 -16.490 -1.186 3.676 1.00 0.00 C ATOM 1311 CG PRO A 100 -16.024 -2.475 3.001 1.00 0.00 C ATOM 1312 CD PRO A 100 -14.621 -2.110 2.529 1.00 0.00 C ATOM 0 HA PRO A 100 -15.186 0.488 4.257 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -17.245 -1.385 4.437 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -16.936 -0.498 2.957 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -16.013 -3.316 3.695 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -16.672 -2.756 2.170 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -13.983 -2.993 2.480 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -14.645 -1.678 1.528 1.00 0.00 H new ATOM 1320 N SER A 101 -14.629 -2.091 6.183 1.00 0.00 N ATOM 1321 CA SER A 101 -14.492 -2.464 7.606 1.00 0.00 C ATOM 1322 C SER A 101 -13.106 -2.140 8.198 1.00 0.00 C ATOM 1323 O SER A 101 -12.969 -2.052 9.421 1.00 0.00 O ATOM 1324 CB SER A 101 -14.786 -3.964 7.774 1.00 0.00 C ATOM 1325 OG SER A 101 -16.147 -4.271 7.491 1.00 0.00 O ATOM 0 H SER A 101 -14.318 -2.813 5.533 1.00 0.00 H new ATOM 0 HA SER A 101 -15.214 -1.862 8.158 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.139 -4.538 7.111 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.549 -4.269 8.793 1.00 0.00 H new ATOM 0 HG SER A 101 -16.296 -5.233 7.606 1.00 0.00 H new ATOM 1331 N MET A 102 -12.068 -1.986 7.362 1.00 0.00 N ATOM 1332 CA MET A 102 -10.665 -1.879 7.806 1.00 0.00 C ATOM 1333 C MET A 102 -10.250 -0.437 8.113 1.00 0.00 C ATOM 1334 O MET A 102 -9.550 -0.184 9.097 1.00 0.00 O ATOM 1335 CB MET A 102 -9.727 -2.449 6.731 1.00 0.00 C ATOM 1336 CG MET A 102 -10.000 -3.909 6.353 1.00 0.00 C ATOM 1337 SD MET A 102 -9.823 -5.108 7.695 1.00 0.00 S ATOM 1338 CE MET A 102 -11.535 -5.287 8.242 1.00 0.00 C ATOM 0 H MET A 102 -12.177 -1.931 6.349 1.00 0.00 H new ATOM 0 HA MET A 102 -10.585 -2.453 8.729 1.00 0.00 H new ATOM 0 HB2 MET A 102 -9.808 -1.834 5.834 1.00 0.00 H new ATOM 0 HB3 MET A 102 -8.699 -2.365 7.083 1.00 0.00 H new ATOM 0 HG2 MET A 102 -11.013 -3.980 5.957 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.322 -4.190 5.547 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.615 -6.143 8.913 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.845 -4.384 8.767 1.00 0.00 H new ATOM 0 HE3 MET A 102 -12.179 -5.443 7.377 1.00 0.00 H new ATOM 1348 N LEU A 103 -10.669 0.505 7.261 1.00 0.00 N ATOM 1349 CA LEU A 103 -10.455 1.942 7.424 1.00 0.00 C ATOM 1350 C LEU A 103 -11.730 2.562 8.009 1.00 0.00 C ATOM 1351 O LEU A 103 -12.769 2.597 7.349 1.00 0.00 O ATOM 1352 CB LEU A 103 -10.059 2.524 6.048 1.00 0.00 C ATOM 1353 CG LEU A 103 -9.996 4.062 5.930 1.00 0.00 C ATOM 1354 CD1 LEU A 103 -8.989 4.706 6.893 1.00 0.00 C ATOM 1355 CD2 LEU A 103 -9.627 4.455 4.493 1.00 0.00 C ATOM 0 H LEU A 103 -11.184 0.277 6.411 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.647 2.168 8.119 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.082 2.123 5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.769 2.156 5.307 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.985 4.433 6.199 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -8.996 5.787 6.757 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.264 4.468 7.920 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -7.990 4.321 6.686 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.583 5.541 4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.655 4.033 4.239 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.381 4.070 3.806 1.00 0.00 H new ATOM 1367 N THR A 104 -11.639 3.084 9.238 1.00 0.00 N ATOM 1368 CA THR A 104 -12.751 3.732 9.961 1.00 0.00 C ATOM 1369 C THR A 104 -13.296 4.948 9.210 1.00 0.00 C ATOM 1370 O THR A 104 -14.500 5.191 9.219 1.00 0.00 O ATOM 1371 CB THR A 104 -12.289 4.119 11.376 1.00 0.00 C ATOM 1372 OG1 THR A 104 -11.584 3.031 11.938 1.00 0.00 O ATOM 1373 CG2 THR A 104 -13.463 4.445 12.300 1.00 0.00 C ATOM 0 H THR A 104 -10.771 3.070 9.774 1.00 0.00 H new ATOM 0 HA THR A 104 -13.571 3.017 10.032 1.00 0.00 H new ATOM 0 HB THR A 104 -11.664 5.007 11.286 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.283 3.267 12.840 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.086 4.712 13.287 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.028 5.281 11.889 1.00 0.00 H new ATOM 0 HG23 THR A 104 -14.113 3.574 12.384 1.00 0.00 H new ATOM 1381 N VAL A 105 -12.416 5.676 8.519 1.00 0.00 N ATOM 1382 CA VAL A 105 -12.708 6.894 7.735 1.00 0.00 C ATOM 1383 C VAL A 105 -12.939 6.560 6.241 1.00 0.00 C ATOM 1384 O VAL A 105 -12.481 7.276 5.353 1.00 0.00 O ATOM 1385 CB VAL A 105 -11.617 7.987 7.948 1.00 0.00 C ATOM 1386 CG1 VAL A 105 -12.144 9.394 7.601 1.00 0.00 C ATOM 1387 CG2 VAL A 105 -11.111 8.048 9.406 1.00 0.00 C ATOM 0 H VAL A 105 -11.428 5.425 8.485 1.00 0.00 H new ATOM 0 HA VAL A 105 -13.641 7.317 8.106 1.00 0.00 H new ATOM 0 HB VAL A 105 -10.802 7.701 7.283 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -11.355 10.128 7.762 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -12.455 9.419 6.557 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -12.996 9.631 8.239 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -10.353 8.826 9.496 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -11.944 8.274 10.071 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -10.678 7.086 9.681 1.00 0.00 H new ATOM 1397 N ALA A 106 -13.619 5.441 5.946 1.00 0.00 N ATOM 1398 CA ALA A 106 -14.011 5.038 4.588 1.00 0.00 C ATOM 1399 C ALA A 106 -15.528 5.246 4.348 1.00 0.00 C ATOM 1400 O ALA A 106 -16.317 4.340 4.642 1.00 0.00 O ATOM 1401 CB ALA A 106 -13.591 3.577 4.350 1.00 0.00 C ATOM 0 H ALA A 106 -13.918 4.778 6.661 1.00 0.00 H new ATOM 0 HA ALA A 106 -13.496 5.673 3.867 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.880 3.275 3.344 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.510 3.487 4.460 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.085 2.933 5.078 1.00 0.00 H new ATOM 1407 N PRO A 107 -15.958 6.403 3.796 1.00 0.00 N ATOM 1408 CA PRO A 107 -17.352 6.640 3.414 1.00 0.00 C ATOM 1409 C PRO A 107 -17.753 5.940 2.098 1.00 0.00 C ATOM 1410 O PRO A 107 -18.947 5.801 1.837 1.00 0.00 O ATOM 1411 CB PRO A 107 -17.472 8.164 3.296 1.00 0.00 C ATOM 1412 CG PRO A 107 -16.077 8.599 2.856 1.00 0.00 C ATOM 1413 CD PRO A 107 -15.171 7.616 3.596 1.00 0.00 C ATOM 0 HA PRO A 107 -18.032 6.220 4.155 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -18.230 8.452 2.568 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -17.753 8.619 4.246 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -15.953 8.529 1.775 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -15.868 9.632 3.135 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -14.272 7.405 3.017 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -14.846 8.030 4.550 1.00 0.00 H new ATOM 1421 N ALA A 108 -16.770 5.513 1.287 1.00 0.00 N ATOM 1422 CA ALA A 108 -16.896 4.870 -0.034 1.00 0.00 C ATOM 1423 C ALA A 108 -17.450 5.805 -1.142 1.00 0.00 C ATOM 1424 O ALA A 108 -17.842 6.948 -0.897 1.00 0.00 O ATOM 1425 CB ALA A 108 -17.674 3.547 0.094 1.00 0.00 C ATOM 0 H ALA A 108 -15.792 5.616 1.558 1.00 0.00 H new ATOM 0 HA ALA A 108 -15.888 4.637 -0.378 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -17.762 3.080 -0.887 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -17.143 2.876 0.769 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -18.669 3.747 0.491 1.00 0.00 H new ATOM 1431 N GLY A 109 -17.461 5.307 -2.386 1.00 0.00 N ATOM 1432 CA GLY A 109 -18.081 5.950 -3.559 1.00 0.00 C ATOM 1433 C GLY A 109 -17.162 6.860 -4.384 1.00 0.00 C ATOM 1434 O GLY A 109 -17.466 7.120 -5.547 1.00 0.00 O ATOM 0 H GLY A 109 -17.024 4.414 -2.614 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -18.472 5.170 -4.213 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -18.934 6.538 -3.219 1.00 0.00 H new ATOM 1438 N ASP A 110 -16.040 7.316 -3.822 1.00 0.00 N ATOM 1439 CA ASP A 110 -14.995 8.085 -4.516 1.00 0.00 C ATOM 1440 C ASP A 110 -13.726 7.241 -4.726 1.00 0.00 C ATOM 1441 O ASP A 110 -13.390 6.393 -3.898 1.00 0.00 O ATOM 1442 CB ASP A 110 -14.633 9.351 -3.722 1.00 0.00 C ATOM 1443 CG ASP A 110 -15.818 10.312 -3.542 1.00 0.00 C ATOM 1444 OD1 ASP A 110 -16.307 10.858 -4.561 1.00 0.00 O ATOM 1445 OD2 ASP A 110 -16.231 10.551 -2.383 1.00 0.00 O1- ATOM 0 H ASP A 110 -15.823 7.157 -2.838 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.395 8.368 -5.489 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -14.256 9.061 -2.741 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -13.824 9.874 -4.233 1.00 0.00 H new ATOM 1450 N ALA A 111 -12.996 7.502 -5.817 1.00 0.00 N ATOM 1451 CA ALA A 111 -11.694 6.887 -6.079 1.00 0.00 C ATOM 1452 C ALA A 111 -10.578 7.609 -5.296 1.00 0.00 C ATOM 1453 O ALA A 111 -10.111 7.108 -4.276 1.00 0.00 O ATOM 1454 CB ALA A 111 -11.463 6.843 -7.598 1.00 0.00 C ATOM 0 H ALA A 111 -13.296 8.150 -6.546 1.00 0.00 H new ATOM 0 HA ALA A 111 -11.675 5.859 -5.718 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -10.495 6.386 -7.806 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -12.250 6.255 -8.069 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -11.479 7.857 -7.998 1.00 0.00 H new ATOM 1460 N SER A 112 -10.162 8.794 -5.749 1.00 0.00 N ATOM 1461 CA SER A 112 -9.040 9.545 -5.157 1.00 0.00 C ATOM 1462 C SER A 112 -9.440 10.340 -3.901 1.00 0.00 C ATOM 1463 O SER A 112 -8.695 10.385 -2.921 1.00 0.00 O ATOM 1464 CB SER A 112 -8.466 10.520 -6.198 1.00 0.00 C ATOM 1465 OG SER A 112 -8.184 9.868 -7.432 1.00 0.00 O ATOM 0 H SER A 112 -10.594 9.267 -6.543 1.00 0.00 H new ATOM 0 HA SER A 112 -8.296 8.808 -4.855 1.00 0.00 H new ATOM 0 HB2 SER A 112 -9.176 11.330 -6.368 1.00 0.00 H new ATOM 0 HB3 SER A 112 -7.554 10.972 -5.809 1.00 0.00 H new ATOM 0 HG SER A 112 -7.822 10.518 -8.070 1.00 0.00 H new ATOM 1471 N HIS A 113 -10.631 10.956 -3.895 1.00 0.00 N ATOM 1472 CA HIS A 113 -11.082 11.853 -2.814 1.00 0.00 C ATOM 1473 C HIS A 113 -11.348 11.110 -1.481 1.00 0.00 C ATOM 1474 O HIS A 113 -11.465 11.731 -0.420 1.00 0.00 O ATOM 1475 CB HIS A 113 -12.320 12.632 -3.304 1.00 0.00 C ATOM 1476 CG HIS A 113 -12.549 13.959 -2.614 1.00 0.00 C ATOM 1477 ND1 HIS A 113 -12.428 14.225 -1.269 1.00 0.00 N ATOM 1478 CD2 HIS A 113 -12.922 15.132 -3.216 1.00 0.00 C ATOM 1479 CE1 HIS A 113 -12.710 15.522 -1.066 1.00 0.00 C ATOM 1480 NE2 HIS A 113 -13.020 16.124 -2.229 1.00 0.00 N ATOM 0 H HIS A 113 -11.315 10.847 -4.644 1.00 0.00 H new ATOM 0 HA HIS A 113 -10.278 12.553 -2.586 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -12.221 12.808 -4.375 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -13.203 12.008 -3.164 1.00 0.00 H new ATOM 0 HD1 HIS A 113 -12.168 13.551 -0.549 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -13.109 15.269 -4.271 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -12.691 16.013 -0.104 1.00 0.00 H new ATOM 1488 N LEU A 114 -11.400 9.774 -1.526 1.00 0.00 N ATOM 1489 CA LEU A 114 -11.501 8.883 -0.370 1.00 0.00 C ATOM 1490 C LEU A 114 -10.311 9.043 0.597 1.00 0.00 C ATOM 1491 O LEU A 114 -10.488 8.928 1.810 1.00 0.00 O ATOM 1492 CB LEU A 114 -11.655 7.442 -0.921 1.00 0.00 C ATOM 1493 CG LEU A 114 -12.775 6.583 -0.303 1.00 0.00 C ATOM 1494 CD1 LEU A 114 -12.510 6.226 1.164 1.00 0.00 C ATOM 1495 CD2 LEU A 114 -14.167 7.211 -0.486 1.00 0.00 C ATOM 0 H LEU A 114 -11.371 9.264 -2.409 1.00 0.00 H new ATOM 0 HA LEU A 114 -12.370 9.137 0.237 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -11.827 7.505 -1.995 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -10.708 6.920 -0.780 1.00 0.00 H new ATOM 0 HG LEU A 114 -12.768 5.647 -0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -13.332 5.621 1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -11.580 5.663 1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -12.429 7.140 1.752 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -14.920 6.566 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -14.191 8.189 -0.006 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -14.378 7.323 -1.549 1.00 0.00 H new ATOM 1507 N SER A 115 -9.129 9.404 0.090 1.00 0.00 N ATOM 1508 CA SER A 115 -7.922 9.644 0.895 1.00 0.00 C ATOM 1509 C SER A 115 -7.506 11.127 0.861 1.00 0.00 C ATOM 1510 O SER A 115 -6.420 11.498 0.405 1.00 0.00 O ATOM 1511 CB SER A 115 -6.811 8.686 0.448 1.00 0.00 C ATOM 1512 OG SER A 115 -5.837 8.508 1.471 1.00 0.00 O ATOM 0 H SER A 115 -8.978 9.541 -0.909 1.00 0.00 H new ATOM 0 HA SER A 115 -8.133 9.431 1.943 1.00 0.00 H new ATOM 0 HB2 SER A 115 -7.244 7.721 0.184 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.331 9.076 -0.450 1.00 0.00 H new ATOM 0 HG SER A 115 -5.143 7.892 1.158 1.00 0.00 H new ATOM 1518 N MET A 116 -8.406 12.002 1.332 1.00 0.00 N ATOM 1519 CA MET A 116 -8.163 13.449 1.456 1.00 0.00 C ATOM 1520 C MET A 116 -7.097 13.750 2.527 1.00 0.00 C ATOM 1521 O MET A 116 -6.198 14.564 2.312 1.00 0.00 O ATOM 1522 CB MET A 116 -9.503 14.153 1.746 1.00 0.00 C ATOM 1523 CG MET A 116 -9.554 15.607 1.259 1.00 0.00 C ATOM 1524 SD MET A 116 -8.600 16.814 2.216 1.00 0.00 S ATOM 1525 CE MET A 116 -9.108 18.311 1.334 1.00 0.00 C ATOM 0 H MET A 116 -9.336 11.722 1.642 1.00 0.00 H new ATOM 0 HA MET A 116 -7.761 13.836 0.520 1.00 0.00 H new ATOM 0 HB2 MET A 116 -10.308 13.592 1.272 1.00 0.00 H new ATOM 0 HB3 MET A 116 -9.689 14.132 2.820 1.00 0.00 H new ATOM 0 HG2 MET A 116 -9.202 15.634 0.228 1.00 0.00 H new ATOM 0 HG3 MET A 116 -10.596 15.927 1.248 1.00 0.00 H new ATOM 0 HE1 MET A 116 -8.621 19.179 1.779 1.00 0.00 H new ATOM 0 HE2 MET A 116 -8.820 18.231 0.286 1.00 0.00 H new ATOM 0 HE3 MET A 116 -10.190 18.426 1.405 1.00 0.00 H new ATOM 1535 N SER A 117 -7.141 13.035 3.654 1.00 0.00 N ATOM 1536 CA SER A 117 -6.125 13.081 4.715 1.00 0.00 C ATOM 1537 C SER A 117 -6.118 11.773 5.531 1.00 0.00 C ATOM 1538 O SER A 117 -7.159 11.351 6.052 1.00 0.00 O ATOM 1539 CB SER A 117 -6.374 14.288 5.634 1.00 0.00 C ATOM 1540 OG SER A 117 -5.324 14.446 6.581 1.00 0.00 O ATOM 0 H SER A 117 -7.904 12.390 3.862 1.00 0.00 H new ATOM 0 HA SER A 117 -5.146 13.190 4.248 1.00 0.00 H new ATOM 0 HB2 SER A 117 -6.462 15.193 5.033 1.00 0.00 H new ATOM 0 HB3 SER A 117 -7.321 14.159 6.157 1.00 0.00 H new ATOM 0 HG SER A 117 -5.510 15.222 7.149 1.00 0.00 H new ATOM 1546 N THR A 118 -4.941 11.139 5.636 1.00 0.00 N ATOM 1547 CA THR A 118 -4.685 9.864 6.336 1.00 0.00 C ATOM 1548 C THR A 118 -3.286 9.897 6.943 1.00 0.00 C ATOM 1549 O THR A 118 -3.150 9.990 8.163 1.00 0.00 O ATOM 1550 CB THR A 118 -4.835 8.648 5.398 1.00 0.00 C ATOM 1551 OG1 THR A 118 -4.223 8.927 4.152 1.00 0.00 O ATOM 1552 CG2 THR A 118 -6.294 8.262 5.156 1.00 0.00 C ATOM 0 H THR A 118 -4.094 11.519 5.213 1.00 0.00 H new ATOM 0 HA THR A 118 -5.430 9.752 7.124 1.00 0.00 H new ATOM 0 HB THR A 118 -4.347 7.808 5.892 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.857 8.743 3.428 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.337 7.401 4.489 1.00 0.00 H new ATOM 0 HG22 THR A 118 -6.766 8.009 6.106 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.821 9.100 4.700 1.00 0.00 H new ATOM 1560 N GLU A 119 -2.265 9.863 6.082 1.00 0.00 N ATOM 1561 CA GLU A 119 -0.833 9.895 6.408 1.00 0.00 C ATOM 1562 C GLU A 119 -0.403 8.633 7.197 1.00 0.00 C ATOM 1563 O GLU A 119 -1.154 7.658 7.279 1.00 0.00 O ATOM 1564 CB GLU A 119 -0.482 11.234 7.102 1.00 0.00 C ATOM 1565 CG GLU A 119 0.978 11.678 6.895 1.00 0.00 C ATOM 1566 CD GLU A 119 1.064 13.142 6.428 1.00 0.00 C ATOM 1567 OE1 GLU A 119 1.166 14.059 7.277 1.00 0.00 O ATOM 1568 OE2 GLU A 119 1.035 13.384 5.198 1.00 0.00 O1- ATOM 0 H GLU A 119 -2.424 9.809 5.076 1.00 0.00 H new ATOM 0 HA GLU A 119 -0.246 9.860 5.490 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.145 12.012 6.725 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.675 11.140 8.171 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.531 11.560 7.827 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.454 11.032 6.158 1.00 0.00 H new ATOM 1575 N LEU A 120 0.806 8.619 7.774 1.00 0.00 N ATOM 1576 CA LEU A 120 1.310 7.508 8.600 1.00 0.00 C ATOM 1577 C LEU A 120 1.000 7.692 10.101 1.00 0.00 C ATOM 1578 O LEU A 120 1.269 6.798 10.902 1.00 0.00 O ATOM 1579 CB LEU A 120 2.821 7.314 8.332 1.00 0.00 C ATOM 1580 CG LEU A 120 3.203 6.531 7.054 1.00 0.00 C ATOM 1581 CD1 LEU A 120 2.712 5.075 7.093 1.00 0.00 C ATOM 1582 CD2 LEU A 120 2.730 7.201 5.755 1.00 0.00 C ATOM 0 H LEU A 120 1.471 9.387 7.681 1.00 0.00 H new ATOM 0 HA LEU A 120 0.783 6.599 8.310 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.287 8.298 8.281 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.256 6.800 9.189 1.00 0.00 H new ATOM 0 HG LEU A 120 4.293 6.537 7.046 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.005 4.568 6.174 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.156 4.564 7.947 1.00 0.00 H new ATOM 0 HD13 LEU A 120 1.626 5.060 7.186 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.034 6.595 4.901 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.644 7.292 5.767 1.00 0.00 H new ATOM 0 HD23 LEU A 120 3.176 8.192 5.673 1.00 0.00 H new ATOM 1594 N ASP A 121 0.405 8.824 10.494 1.00 0.00 N ATOM 1595 CA ASP A 121 0.033 9.155 11.881 1.00 0.00 C ATOM 1596 C ASP A 121 -1.175 8.357 12.420 1.00 0.00 C ATOM 1597 O ASP A 121 -1.474 8.427 13.616 1.00 0.00 O ATOM 1598 CB ASP A 121 -0.245 10.665 11.973 1.00 0.00 C ATOM 1599 CG ASP A 121 1.037 11.499 11.826 1.00 0.00 C ATOM 1600 OD1 ASP A 121 1.287 12.023 10.716 1.00 0.00 O ATOM 1601 OD2 ASP A 121 1.781 11.635 12.827 1.00 0.00 O1- ATOM 0 H ASP A 121 0.159 9.563 9.835 1.00 0.00 H new ATOM 0 HA ASP A 121 0.875 8.870 12.512 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -0.954 10.951 11.196 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -0.715 10.889 12.931 1.00 0.00 H new ATOM 1606 N THR A 122 -1.867 7.593 11.561 1.00 0.00 N ATOM 1607 CA THR A 122 -3.035 6.757 11.895 1.00 0.00 C ATOM 1608 C THR A 122 -2.618 5.410 12.525 1.00 0.00 C ATOM 1609 O THR A 122 -2.983 4.319 12.082 1.00 0.00 O ATOM 1610 CB THR A 122 -3.989 6.701 10.687 1.00 0.00 C ATOM 1611 OG1 THR A 122 -5.217 6.115 11.062 1.00 0.00 O ATOM 1612 CG2 THR A 122 -3.427 5.997 9.448 1.00 0.00 C ATOM 0 H THR A 122 -1.619 7.537 10.573 1.00 0.00 H new ATOM 0 HA THR A 122 -3.622 7.210 12.694 1.00 0.00 H new ATOM 0 HB THR A 122 -4.133 7.739 10.388 1.00 0.00 H new ATOM 0 HG1 THR A 122 -5.816 6.086 10.287 1.00 0.00 H new ATOM 0 HG21 THR A 122 -4.173 6.009 8.653 1.00 0.00 H new ATOM 0 HG22 THR A 122 -2.529 6.515 9.111 1.00 0.00 H new ATOM 0 HG23 THR A 122 -3.179 4.965 9.697 1.00 0.00 H new ATOM 1620 N THR A 123 -1.810 5.504 13.588 1.00 0.00 N ATOM 1621 CA THR A 123 -1.284 4.394 14.402 1.00 0.00 C ATOM 1622 C THR A 123 -2.421 3.588 15.045 1.00 0.00 C ATOM 1623 O THR A 123 -3.522 4.091 15.260 1.00 0.00 O ATOM 1624 CB THR A 123 -0.321 4.969 15.459 1.00 0.00 C ATOM 1625 OG1 THR A 123 0.612 5.819 14.824 1.00 0.00 O ATOM 1626 CG2 THR A 123 0.486 3.920 16.231 1.00 0.00 C ATOM 0 H THR A 123 -1.485 6.410 13.926 1.00 0.00 H new ATOM 0 HA THR A 123 -0.738 3.699 13.764 1.00 0.00 H new ATOM 0 HB THR A 123 -0.959 5.487 16.175 1.00 0.00 H new ATOM 0 HG1 THR A 123 1.226 6.189 15.493 1.00 0.00 H new ATOM 0 HG21 THR A 123 1.135 4.418 16.951 1.00 0.00 H new ATOM 0 HG22 THR A 123 -0.195 3.252 16.758 1.00 0.00 H new ATOM 0 HG23 THR A 123 1.093 3.343 15.534 1.00 0.00 H new ATOM 1634 N HIS A 124 -2.141 2.328 15.378 1.00 0.00 N ATOM 1635 CA HIS A 124 -3.062 1.392 16.051 1.00 0.00 C ATOM 1636 C HIS A 124 -3.641 1.949 17.369 1.00 0.00 C ATOM 1637 O HIS A 124 -4.841 1.808 17.621 1.00 0.00 O ATOM 1638 CB HIS A 124 -2.274 0.086 16.274 1.00 0.00 C ATOM 1639 CG HIS A 124 -2.816 -0.903 17.281 1.00 0.00 C ATOM 1640 ND1 HIS A 124 -2.035 -1.706 18.076 1.00 0.00 N ATOM 1641 CD2 HIS A 124 -4.118 -1.199 17.582 1.00 0.00 C ATOM 1642 CE1 HIS A 124 -2.837 -2.468 18.835 1.00 0.00 C ATOM 1643 NE2 HIS A 124 -4.126 -2.194 18.570 1.00 0.00 N ATOM 0 H HIS A 124 -1.232 1.908 15.182 1.00 0.00 H new ATOM 0 HA HIS A 124 -3.938 1.221 15.426 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.193 -0.424 15.314 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -1.262 0.354 16.579 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -1.015 -1.721 18.087 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -4.990 -0.744 17.135 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -2.496 -3.197 19.555 1.00 0.00 H new ATOM 1651 N PHE A 125 -2.803 2.596 18.190 1.00 0.00 N ATOM 1652 CA PHE A 125 -3.205 3.269 19.430 1.00 0.00 C ATOM 1653 C PHE A 125 -3.814 2.258 20.434 1.00 0.00 C ATOM 1654 O PHE A 125 -3.299 1.145 20.563 1.00 0.00 O ATOM 1655 CB PHE A 125 -4.090 4.484 19.062 1.00 0.00 C ATOM 1656 CG PHE A 125 -3.990 5.658 20.015 1.00 0.00 C ATOM 1657 CD1 PHE A 125 -2.782 6.378 20.096 1.00 0.00 C ATOM 1658 CD2 PHE A 125 -5.100 6.068 20.779 1.00 0.00 C ATOM 1659 CE1 PHE A 125 -2.677 7.493 20.946 1.00 0.00 C ATOM 1660 CE2 PHE A 125 -4.993 7.183 21.631 1.00 0.00 C ATOM 1661 CZ PHE A 125 -3.783 7.894 21.715 1.00 0.00 C ATOM 0 H PHE A 125 -1.802 2.667 18.005 1.00 0.00 H new ATOM 0 HA PHE A 125 -2.348 3.673 19.969 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.819 4.823 18.062 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -5.129 4.158 19.018 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.933 6.072 19.503 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -6.032 5.527 20.711 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.748 8.040 21.008 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -5.842 7.493 22.222 1.00 0.00 H new ATOM 0 HZ PHE A 125 -3.703 8.749 22.371 1.00 0.00 H new ATOM 1671 N LEU A 126 -4.890 2.622 21.146 1.00 0.00 N ATOM 1672 CA LEU A 126 -5.611 1.758 22.098 1.00 0.00 C ATOM 1673 C LEU A 126 -7.072 1.495 21.657 1.00 0.00 C ATOM 1674 O LEU A 126 -7.986 1.463 22.487 1.00 0.00 O ATOM 1675 CB LEU A 126 -5.500 2.381 23.509 1.00 0.00 C ATOM 1676 CG LEU A 126 -5.673 1.340 24.640 1.00 0.00 C ATOM 1677 CD1 LEU A 126 -4.346 0.621 24.934 1.00 0.00 C ATOM 1678 CD2 LEU A 126 -6.191 2.009 25.920 1.00 0.00 C ATOM 0 H LEU A 126 -5.297 3.555 21.075 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.150 0.771 22.120 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -4.529 2.865 23.612 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.256 3.158 23.618 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.404 0.605 24.303 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.495 -0.105 25.733 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.004 0.107 24.036 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.597 1.351 25.242 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.305 1.258 26.702 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.481 2.768 26.247 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.156 2.476 25.722 1.00 0.00 H new ATOM 1690 N LEU A 127 -7.323 1.354 20.348 1.00 0.00 N ATOM 1691 CA LEU A 127 -8.673 1.121 19.803 1.00 0.00 C ATOM 1692 C LEU A 127 -9.276 -0.235 20.256 1.00 0.00 C ATOM 1693 O LEU A 127 -8.524 -1.186 20.499 1.00 0.00 O ATOM 1694 CB LEU A 127 -8.658 1.245 18.262 1.00 0.00 C ATOM 1695 CG LEU A 127 -9.027 2.649 17.740 1.00 0.00 C ATOM 1696 CD1 LEU A 127 -7.957 3.704 18.055 1.00 0.00 C ATOM 1697 CD2 LEU A 127 -9.261 2.585 16.224 1.00 0.00 C ATOM 0 H LEU A 127 -6.596 1.398 19.634 1.00 0.00 H new ATOM 0 HA LEU A 127 -9.325 1.894 20.210 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -7.665 0.983 17.897 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -9.354 0.519 17.843 1.00 0.00 H new ATOM 0 HG LEU A 127 -9.937 2.956 18.255 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -8.273 4.671 17.663 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.824 3.776 19.134 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -7.014 3.415 17.591 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -9.522 3.577 15.854 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -8.353 2.241 15.730 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -10.075 1.892 16.010 1.00 0.00 H new ATOM 1709 N PRO A 128 -10.623 -0.351 20.339 1.00 0.00 N ATOM 1710 CA PRO A 128 -11.314 -1.553 20.817 1.00 0.00 C ATOM 1711 C PRO A 128 -11.363 -2.693 19.784 1.00 0.00 C ATOM 1712 O PRO A 128 -11.456 -3.856 20.174 1.00 0.00 O ATOM 1713 CB PRO A 128 -12.728 -1.081 21.174 1.00 0.00 C ATOM 1714 CG PRO A 128 -12.973 0.076 20.207 1.00 0.00 C ATOM 1715 CD PRO A 128 -11.591 0.716 20.096 1.00 0.00 C ATOM 0 HA PRO A 128 -10.778 -1.982 21.664 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -13.462 -1.876 21.042 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.793 -0.757 22.213 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -13.337 -0.273 19.241 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -13.714 0.776 20.592 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -11.445 1.156 19.110 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -11.475 1.519 20.824 1.00 0.00 H new ATOM 1723 N VAL A 129 -11.291 -2.380 18.485 1.00 0.00 N ATOM 1724 CA VAL A 129 -11.313 -3.336 17.365 1.00 0.00 C ATOM 1725 C VAL A 129 -10.723 -2.669 16.118 1.00 0.00 C ATOM 1726 O VAL A 129 -10.933 -1.476 15.891 1.00 0.00 O ATOM 1727 CB VAL A 129 -12.730 -3.916 17.107 1.00 0.00 C ATOM 1728 CG1 VAL A 129 -13.780 -2.845 16.754 1.00 0.00 C ATOM 1729 CG2 VAL A 129 -12.713 -4.995 16.010 1.00 0.00 C ATOM 0 H VAL A 129 -11.212 -1.413 18.169 1.00 0.00 H new ATOM 0 HA VAL A 129 -10.695 -4.194 17.630 1.00 0.00 H new ATOM 0 HB VAL A 129 -13.026 -4.365 18.055 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -14.745 -3.323 16.587 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -13.864 -2.134 17.576 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -13.474 -2.320 15.849 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -13.723 -5.376 15.859 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -12.345 -4.562 15.080 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -12.059 -5.812 16.313 1.00 0.00 H new ATOM 1739 N LEU A 130 -9.954 -3.438 15.342 1.00 0.00 N ATOM 1740 CA LEU A 130 -9.187 -2.981 14.183 1.00 0.00 C ATOM 1741 C LEU A 130 -8.744 -4.157 13.302 1.00 0.00 C ATOM 1742 O LEU A 130 -8.603 -5.292 13.770 1.00 0.00 O ATOM 1743 CB LEU A 130 -8.018 -2.047 14.593 1.00 0.00 C ATOM 1744 CG LEU A 130 -7.006 -2.464 15.690 1.00 0.00 C ATOM 1745 CD1 LEU A 130 -7.579 -2.389 17.116 1.00 0.00 C ATOM 1746 CD2 LEU A 130 -6.343 -3.830 15.474 1.00 0.00 C ATOM 0 H LEU A 130 -9.845 -4.438 15.513 1.00 0.00 H new ATOM 0 HA LEU A 130 -9.849 -2.372 13.567 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -7.443 -1.842 13.690 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -8.461 -1.103 14.910 1.00 0.00 H new ATOM 0 HG LEU A 130 -6.225 -1.710 15.587 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -6.816 -2.695 17.831 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -7.888 -1.366 17.330 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -8.440 -3.053 17.198 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -5.652 -4.033 16.293 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -7.109 -4.605 15.445 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -5.796 -3.824 14.531 1.00 0.00 H new ATOM 1758 N GLY A 131 -8.552 -3.882 12.007 1.00 0.00 N ATOM 1759 CA GLY A 131 -8.188 -4.889 11.005 1.00 0.00 C ATOM 1760 C GLY A 131 -9.166 -6.067 10.975 1.00 0.00 C ATOM 1761 O GLY A 131 -10.357 -5.909 11.252 1.00 0.00 O ATOM 0 H GLY A 131 -8.646 -2.943 11.621 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.156 -4.422 10.021 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -7.185 -5.259 11.215 1.00 0.00 H new ATOM 1765 N ARG A 132 -8.642 -7.260 10.671 1.00 0.00 N ATOM 1766 CA ARG A 132 -9.392 -8.528 10.684 1.00 0.00 C ATOM 1767 C ARG A 132 -9.069 -9.415 11.901 1.00 0.00 C ATOM 1768 O ARG A 132 -9.138 -10.638 11.803 1.00 0.00 O ATOM 1769 CB ARG A 132 -9.185 -9.285 9.363 1.00 0.00 C ATOM 1770 CG ARG A 132 -9.611 -8.466 8.140 1.00 0.00 C ATOM 1771 CD ARG A 132 -9.954 -9.351 6.943 1.00 0.00 C ATOM 1772 NE ARG A 132 -11.250 -10.026 7.119 1.00 0.00 N ATOM 1773 CZ ARG A 132 -11.765 -10.935 6.300 1.00 0.00 C ATOM 1774 NH1 ARG A 132 -11.126 -11.348 5.228 1.00 0.00 N1+ ATOM 1775 NH2 ARG A 132 -12.953 -11.441 6.555 1.00 0.00 N ATOM 0 H ARG A 132 -7.665 -7.377 10.403 1.00 0.00 H new ATOM 0 HA ARG A 132 -10.447 -8.271 10.781 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -8.134 -9.557 9.265 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -9.753 -10.215 9.389 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -10.476 -7.855 8.398 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -8.808 -7.782 7.865 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -9.979 -8.745 6.038 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -9.171 -10.097 6.805 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.799 -9.774 7.941 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -10.206 -10.968 5.005 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -11.550 -12.048 4.619 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -13.472 -11.134 7.378 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -13.355 -12.140 5.930 1.00 0.00 H new ATOM 1789 N HIS A 133 -8.687 -8.813 13.035 1.00 0.00 N ATOM 1790 CA HIS A 133 -8.520 -9.485 14.339 1.00 0.00 C ATOM 1791 C HIS A 133 -7.685 -10.798 14.287 1.00 0.00 C ATOM 1792 O HIS A 133 -8.035 -11.796 14.919 1.00 0.00 O ATOM 1793 CB HIS A 133 -9.895 -9.596 15.042 1.00 0.00 C ATOM 1794 CG HIS A 133 -10.998 -10.276 14.259 1.00 0.00 C ATOM 1795 ND1 HIS A 133 -11.989 -9.646 13.537 1.00 0.00 N ATOM 1796 CD2 HIS A 133 -11.210 -11.625 14.134 1.00 0.00 C ATOM 1797 CE1 HIS A 133 -12.768 -10.592 12.983 1.00 0.00 C ATOM 1798 NE2 HIS A 133 -12.338 -11.821 13.323 1.00 0.00 N ATOM 0 H HIS A 133 -8.478 -7.815 13.076 1.00 0.00 H new ATOM 0 HA HIS A 133 -7.887 -8.859 14.968 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -9.757 -10.137 15.978 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.229 -8.591 15.300 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -10.611 -12.403 14.583 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -13.621 -10.393 12.352 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.748 -12.713 13.047 1.00 0.00 H new ATOM 1806 N HIS A 134 -6.595 -10.784 13.501 1.00 0.00 N ATOM 1807 CA HIS A 134 -5.636 -11.880 13.239 1.00 0.00 C ATOM 1808 C HIS A 134 -6.127 -12.839 12.121 1.00 0.00 C ATOM 1809 O HIS A 134 -6.369 -14.027 12.350 1.00 0.00 O ATOM 1810 CB HIS A 134 -5.203 -12.625 14.525 1.00 0.00 C ATOM 1811 CG HIS A 134 -4.787 -11.740 15.678 1.00 0.00 C ATOM 1812 ND1 HIS A 134 -5.138 -11.912 16.998 1.00 0.00 N ATOM 1813 CD2 HIS A 134 -3.989 -10.629 15.620 1.00 0.00 C ATOM 1814 CE1 HIS A 134 -4.569 -10.928 17.715 1.00 0.00 C ATOM 1815 NE2 HIS A 134 -3.854 -10.113 16.915 1.00 0.00 N ATOM 0 H HIS A 134 -6.338 -9.940 12.990 1.00 0.00 H new ATOM 0 HA HIS A 134 -4.731 -11.406 12.859 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -6.028 -13.257 14.854 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -4.373 -13.287 14.279 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -3.540 -10.220 14.727 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -4.671 -10.807 18.783 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -3.323 -9.289 17.195 1.00 0.00 H new ATOM 1823 N SER A 135 -6.268 -12.341 10.884 1.00 0.00 N ATOM 1824 CA SER A 135 -6.754 -13.141 9.735 1.00 0.00 C ATOM 1825 C SER A 135 -5.786 -14.241 9.256 1.00 0.00 C ATOM 1826 O SER A 135 -6.224 -15.178 8.580 1.00 0.00 O ATOM 1827 CB SER A 135 -7.071 -12.227 8.534 1.00 0.00 C ATOM 1828 OG SER A 135 -8.462 -12.215 8.252 1.00 0.00 O ATOM 0 H SER A 135 -6.050 -11.374 10.645 1.00 0.00 H new ATOM 0 HA SER A 135 -7.648 -13.640 10.109 1.00 0.00 H new ATOM 0 HB2 SER A 135 -6.731 -11.213 8.745 1.00 0.00 H new ATOM 0 HB3 SER A 135 -6.522 -12.571 7.657 1.00 0.00 H new ATOM 0 HG SER A 135 -8.599 -12.223 7.282 1.00 0.00 H new ATOM 1834 N LEU A 136 -4.487 -14.120 9.582 1.00 0.00 N ATOM 1835 CA LEU A 136 -3.392 -15.024 9.182 1.00 0.00 C ATOM 1836 C LEU A 136 -3.057 -14.900 7.675 1.00 0.00 C ATOM 1837 O LEU A 136 -3.641 -14.087 6.958 1.00 0.00 O ATOM 1838 CB LEU A 136 -3.712 -16.477 9.632 1.00 0.00 C ATOM 1839 CG LEU A 136 -2.605 -17.172 10.450 1.00 0.00 C ATOM 1840 CD1 LEU A 136 -2.390 -16.493 11.814 1.00 0.00 C ATOM 1841 CD2 LEU A 136 -2.995 -18.640 10.677 1.00 0.00 C ATOM 0 H LEU A 136 -4.155 -13.349 10.162 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.479 -14.722 9.696 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -4.626 -16.463 10.226 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.917 -17.077 8.746 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.675 -17.101 9.887 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -1.602 -17.013 12.359 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -2.100 -15.453 11.661 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -3.315 -16.531 12.389 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -2.217 -19.138 11.255 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -3.938 -18.686 11.223 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -3.108 -19.139 9.715 1.00 0.00 H new ATOM 1853 N SER A 137 -2.079 -15.677 7.193 1.00 0.00 N ATOM 1854 CA SER A 137 -1.705 -15.807 5.762 1.00 0.00 C ATOM 1855 C SER A 137 -0.977 -14.566 5.175 1.00 0.00 C ATOM 1856 O SER A 137 -0.780 -14.456 3.960 1.00 0.00 O ATOM 1857 CB SER A 137 -2.940 -16.207 4.924 1.00 0.00 C ATOM 1858 OG SER A 137 -2.599 -16.975 3.773 1.00 0.00 O ATOM 0 H SER A 137 -1.501 -16.256 7.802 1.00 0.00 H new ATOM 0 HA SER A 137 -0.964 -16.605 5.706 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.627 -16.780 5.547 1.00 0.00 H new ATOM 0 HB3 SER A 137 -3.469 -15.307 4.611 1.00 0.00 H new ATOM 0 HG SER A 137 -3.414 -17.203 3.279 1.00 0.00 H new ATOM 1864 N GLY A 138 -0.567 -13.620 6.033 1.00 0.00 N ATOM 1865 CA GLY A 138 0.095 -12.361 5.662 1.00 0.00 C ATOM 1866 C GLY A 138 1.622 -12.453 5.635 1.00 0.00 C ATOM 1867 O GLY A 138 2.197 -13.459 5.217 1.00 0.00 O ATOM 0 H GLY A 138 -0.692 -13.714 7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -0.259 -12.051 4.679 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.201 -11.584 6.367 1.00 0.00 H new ATOM 1871 N ALA A 139 2.295 -11.388 6.082 1.00 0.00 N ATOM 1872 CA ALA A 139 3.751 -11.316 6.242 1.00 0.00 C ATOM 1873 C ALA A 139 4.215 -12.124 7.474 1.00 0.00 C ATOM 1874 O ALA A 139 4.567 -11.571 8.518 1.00 0.00 O ATOM 1875 CB ALA A 139 4.184 -9.842 6.280 1.00 0.00 C ATOM 0 H ALA A 139 1.826 -10.523 6.351 1.00 0.00 H new ATOM 0 HA ALA A 139 4.243 -11.780 5.387 1.00 0.00 H new ATOM 0 HB1 ALA A 139 5.266 -9.784 6.399 1.00 0.00 H new ATOM 0 HB2 ALA A 139 3.894 -9.354 5.350 1.00 0.00 H new ATOM 0 HB3 ALA A 139 3.699 -9.342 7.119 1.00 0.00 H new ATOM 1881 N THR A 140 4.200 -13.455 7.322 1.00 0.00 N ATOM 1882 CA THR A 140 4.784 -14.441 8.249 1.00 0.00 C ATOM 1883 C THR A 140 6.323 -14.404 8.239 1.00 0.00 C ATOM 1884 O THR A 140 6.969 -14.792 9.213 1.00 0.00 O ATOM 1885 CB THR A 140 4.207 -15.827 7.916 1.00 0.00 C ATOM 1886 OG1 THR A 140 4.557 -16.737 8.933 1.00 0.00 O ATOM 1887 CG2 THR A 140 4.667 -16.385 6.563 1.00 0.00 C ATOM 0 H THR A 140 3.761 -13.896 6.514 1.00 0.00 H new ATOM 0 HA THR A 140 4.509 -14.190 9.274 1.00 0.00 H new ATOM 0 HB THR A 140 3.126 -15.700 7.850 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.188 -17.620 8.723 1.00 0.00 H new ATOM 0 HG21 THR A 140 4.217 -17.365 6.402 1.00 0.00 H new ATOM 0 HG22 THR A 140 4.358 -15.708 5.766 1.00 0.00 H new ATOM 0 HG23 THR A 140 5.753 -16.479 6.558 1.00 0.00 H new ATOM 1895 N GLU A 141 6.906 -13.882 7.157 1.00 0.00 N ATOM 1896 CA GLU A 141 8.337 -13.599 6.996 1.00 0.00 C ATOM 1897 C GLU A 141 8.833 -12.478 7.945 1.00 0.00 C ATOM 1898 O GLU A 141 8.029 -11.646 8.384 1.00 0.00 O ATOM 1899 CB GLU A 141 8.595 -13.194 5.533 1.00 0.00 C ATOM 1900 CG GLU A 141 8.404 -14.330 4.517 1.00 0.00 C ATOM 1901 CD GLU A 141 9.528 -15.375 4.604 1.00 0.00 C ATOM 1902 OE1 GLU A 141 10.567 -15.208 3.923 1.00 0.00 O ATOM 1903 OE2 GLU A 141 9.375 -16.376 5.343 1.00 0.00 O1- ATOM 0 H GLU A 141 6.367 -13.632 6.328 1.00 0.00 H new ATOM 0 HA GLU A 141 8.891 -14.501 7.256 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.926 -12.374 5.273 1.00 0.00 H new ATOM 0 HB3 GLU A 141 9.613 -12.814 5.448 1.00 0.00 H new ATOM 0 HG2 GLU A 141 7.444 -14.815 4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 141 8.373 -13.914 3.510 1.00 0.00 H new ATOM 1910 N PRO A 142 10.148 -12.427 8.252 1.00 0.00 N ATOM 1911 CA PRO A 142 10.744 -11.440 9.153 1.00 0.00 C ATOM 1912 C PRO A 142 10.980 -10.074 8.474 1.00 0.00 C ATOM 1913 O PRO A 142 10.554 -9.826 7.344 1.00 0.00 O ATOM 1914 CB PRO A 142 12.046 -12.103 9.630 1.00 0.00 C ATOM 1915 CG PRO A 142 12.486 -12.895 8.404 1.00 0.00 C ATOM 1916 CD PRO A 142 11.156 -13.406 7.856 1.00 0.00 C ATOM 0 HA PRO A 142 10.083 -11.194 9.984 1.00 0.00 H new ATOM 0 HB2 PRO A 142 12.792 -11.365 9.925 1.00 0.00 H new ATOM 0 HB3 PRO A 142 11.879 -12.749 10.492 1.00 0.00 H new ATOM 0 HG2 PRO A 142 13.011 -12.269 7.682 1.00 0.00 H new ATOM 0 HG3 PRO A 142 13.159 -13.711 8.667 1.00 0.00 H new ATOM 0 HD2 PRO A 142 11.195 -13.507 6.771 1.00 0.00 H new ATOM 0 HD3 PRO A 142 10.922 -14.391 8.260 1.00 0.00 H new ATOM 1924 N ASP A 143 11.693 -9.184 9.175 1.00 0.00 N ATOM 1925 CA ASP A 143 12.002 -7.800 8.776 1.00 0.00 C ATOM 1926 C ASP A 143 12.858 -7.681 7.500 1.00 0.00 C ATOM 1927 O ASP A 143 12.980 -6.595 6.932 1.00 0.00 O ATOM 1928 CB ASP A 143 12.701 -7.089 9.947 1.00 0.00 C ATOM 1929 CG ASP A 143 14.099 -7.651 10.260 1.00 0.00 C ATOM 1930 OD1 ASP A 143 14.183 -8.721 10.909 1.00 0.00 O ATOM 1931 OD2 ASP A 143 15.108 -7.004 9.889 1.00 0.00 O1- ATOM 0 H ASP A 143 12.092 -9.419 10.084 1.00 0.00 H new ATOM 0 HA ASP A 143 11.051 -7.325 8.533 1.00 0.00 H new ATOM 0 HB2 ASP A 143 12.788 -6.027 9.717 1.00 0.00 H new ATOM 0 HB3 ASP A 143 12.077 -7.172 10.837 1.00 0.00 H new ATOM 1936 N ASP A 144 13.417 -8.800 7.032 1.00 0.00 N ATOM 1937 CA ASP A 144 14.144 -8.919 5.765 1.00 0.00 C ATOM 1938 C ASP A 144 13.259 -8.596 4.540 1.00 0.00 C ATOM 1939 O ASP A 144 13.779 -8.169 3.507 1.00 0.00 O ATOM 1940 CB ASP A 144 14.720 -10.342 5.680 1.00 0.00 C ATOM 1941 CG ASP A 144 15.732 -10.507 4.532 1.00 0.00 C ATOM 1942 OD1 ASP A 144 15.537 -11.408 3.681 1.00 0.00 O ATOM 1943 OD2 ASP A 144 16.749 -9.772 4.514 1.00 0.00 O1- ATOM 0 H ASP A 144 13.374 -9.681 7.544 1.00 0.00 H new ATOM 0 HA ASP A 144 14.948 -8.183 5.746 1.00 0.00 H new ATOM 0 HB2 ASP A 144 15.205 -10.590 6.624 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.904 -11.052 5.544 1.00 0.00 H new ATOM 1948 N GLU A 145 11.933 -8.745 4.674 1.00 0.00 N ATOM 1949 CA GLU A 145 10.943 -8.279 3.693 1.00 0.00 C ATOM 1950 C GLU A 145 10.565 -6.812 3.985 1.00 0.00 C ATOM 1951 O GLU A 145 10.975 -5.918 3.241 1.00 0.00 O ATOM 1952 CB GLU A 145 9.707 -9.199 3.673 1.00 0.00 C ATOM 1953 CG GLU A 145 9.997 -10.682 3.392 1.00 0.00 C ATOM 1954 CD GLU A 145 10.577 -10.961 1.994 1.00 0.00 C ATOM 1955 OE1 GLU A 145 9.818 -11.414 1.105 1.00 0.00 O ATOM 1956 OE2 GLU A 145 11.802 -10.796 1.789 1.00 0.00 O1- ATOM 0 H GLU A 145 11.511 -9.201 5.483 1.00 0.00 H new ATOM 0 HA GLU A 145 11.384 -8.322 2.697 1.00 0.00 H new ATOM 0 HB2 GLU A 145 9.201 -9.121 4.635 1.00 0.00 H new ATOM 0 HB3 GLU A 145 9.013 -8.832 2.917 1.00 0.00 H new ATOM 0 HG2 GLU A 145 10.695 -11.052 4.143 1.00 0.00 H new ATOM 0 HG3 GLU A 145 9.074 -11.249 3.509 1.00 0.00 H new ATOM 1963 N ARG A 146 9.840 -6.557 5.092 1.00 0.00 N ATOM 1964 CA ARG A 146 9.523 -5.211 5.618 1.00 0.00 C ATOM 1965 C ARG A 146 8.914 -5.253 7.031 1.00 0.00 C ATOM 1966 O ARG A 146 9.470 -4.645 7.943 1.00 0.00 O ATOM 1967 CB ARG A 146 8.604 -4.423 4.652 1.00 0.00 C ATOM 1968 CG ARG A 146 8.337 -2.969 5.087 1.00 0.00 C ATOM 1969 CD ARG A 146 9.575 -2.066 5.040 1.00 0.00 C ATOM 1970 NE ARG A 146 9.267 -0.737 5.600 1.00 0.00 N ATOM 1971 CZ ARG A 146 10.071 0.321 5.610 1.00 0.00 C ATOM 1972 NH1 ARG A 146 11.259 0.302 5.042 1.00 0.00 N1+ ATOM 1973 NH2 ARG A 146 9.681 1.431 6.198 1.00 0.00 N ATOM 0 H ARG A 146 9.446 -7.304 5.664 1.00 0.00 H new ATOM 0 HA ARG A 146 10.475 -4.685 5.693 1.00 0.00 H new ATOM 0 HB2 ARG A 146 9.056 -4.417 3.660 1.00 0.00 H new ATOM 0 HB3 ARG A 146 7.652 -4.946 4.565 1.00 0.00 H new ATOM 0 HG2 ARG A 146 7.566 -2.544 4.444 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.940 -2.971 6.102 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.388 -2.524 5.603 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.918 -1.963 4.011 1.00 0.00 H new ATOM 0 HE ARG A 146 8.346 -0.618 6.021 1.00 0.00 H new ATOM 0 HH11 ARG A 146 11.588 -0.543 4.575 1.00 0.00 H new ATOM 0 HH12 ARG A 146 11.850 1.133 5.069 1.00 0.00 H new ATOM 0 HH21 ARG A 146 8.765 1.477 6.644 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.295 2.246 6.208 1.00 0.00 H new ATOM 1987 N VAL A 147 7.778 -5.940 7.204 1.00 0.00 N ATOM 1988 CA VAL A 147 7.024 -6.040 8.477 1.00 0.00 C ATOM 1989 C VAL A 147 6.919 -7.496 8.934 1.00 0.00 C ATOM 1990 O VAL A 147 6.890 -8.397 8.096 1.00 0.00 O ATOM 1991 CB VAL A 147 5.604 -5.419 8.398 1.00 0.00 C ATOM 1992 CG1 VAL A 147 5.669 -3.937 8.007 1.00 0.00 C ATOM 1993 CG2 VAL A 147 4.649 -6.153 7.439 1.00 0.00 C ATOM 0 H VAL A 147 7.338 -6.460 6.445 1.00 0.00 H new ATOM 0 HA VAL A 147 7.591 -5.462 9.206 1.00 0.00 H new ATOM 0 HB VAL A 147 5.195 -5.527 9.402 1.00 0.00 H new ATOM 0 HG11 VAL A 147 4.660 -3.529 7.959 1.00 0.00 H new ATOM 0 HG12 VAL A 147 6.247 -3.389 8.751 1.00 0.00 H new ATOM 0 HG13 VAL A 147 6.146 -3.839 7.032 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.679 -5.657 7.442 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.062 -6.136 6.431 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.529 -7.186 7.765 1.00 0.00 H new ATOM 2003 N LEU A 148 6.845 -7.717 10.253 1.00 0.00 N ATOM 2004 CA LEU A 148 6.760 -9.059 10.853 1.00 0.00 C ATOM 2005 C LEU A 148 5.395 -9.362 11.506 1.00 0.00 C ATOM 2006 O LEU A 148 5.188 -10.477 11.991 1.00 0.00 O ATOM 2007 CB LEU A 148 7.871 -9.277 11.904 1.00 0.00 C ATOM 2008 CG LEU A 148 9.277 -8.688 11.660 1.00 0.00 C ATOM 2009 CD1 LEU A 148 9.367 -7.184 11.977 1.00 0.00 C ATOM 2010 CD2 LEU A 148 10.287 -9.428 12.553 1.00 0.00 C ATOM 0 H LEU A 148 6.842 -6.964 10.941 1.00 0.00 H new ATOM 0 HA LEU A 148 6.889 -9.748 10.018 1.00 0.00 H new ATOM 0 HB2 LEU A 148 7.509 -8.875 12.850 1.00 0.00 H new ATOM 0 HB3 LEU A 148 7.987 -10.353 12.038 1.00 0.00 H new ATOM 0 HG LEU A 148 9.496 -8.816 10.600 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.380 -6.832 11.785 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.667 -6.637 11.346 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.118 -7.017 13.025 1.00 0.00 H new ATOM 0 HD21 LEU A 148 11.285 -9.020 12.389 1.00 0.00 H new ATOM 0 HD22 LEU A 148 10.010 -9.300 13.599 1.00 0.00 H new ATOM 0 HD23 LEU A 148 10.283 -10.489 12.304 1.00 0.00 H new ATOM 2022 N GLY A 149 4.489 -8.377 11.576 1.00 0.00 N ATOM 2023 CA GLY A 149 3.212 -8.470 12.294 1.00 0.00 C ATOM 2024 C GLY A 149 2.174 -9.254 11.494 1.00 0.00 C ATOM 2025 O GLY A 149 1.978 -10.445 11.739 1.00 0.00 O ATOM 0 H GLY A 149 4.628 -7.473 11.124 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.370 -8.953 13.258 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.834 -7.468 12.498 1.00 0.00 H new ATOM 2029 N TRP A 150 1.539 -8.589 10.524 1.00 0.00 N ATOM 2030 CA TRP A 150 0.608 -9.177 9.551 1.00 0.00 C ATOM 2031 C TRP A 150 0.264 -8.218 8.394 1.00 0.00 C ATOM 2032 O TRP A 150 0.625 -7.041 8.394 1.00 0.00 O ATOM 2033 CB TRP A 150 -0.652 -9.764 10.240 1.00 0.00 C ATOM 2034 CG TRP A 150 -1.375 -8.938 11.267 1.00 0.00 C ATOM 2035 CD1 TRP A 150 -1.477 -9.274 12.571 1.00 0.00 C ATOM 2036 CD2 TRP A 150 -2.137 -7.689 11.123 1.00 0.00 C ATOM 2037 NE1 TRP A 150 -2.246 -8.345 13.242 1.00 0.00 N ATOM 2038 CE2 TRP A 150 -2.681 -7.350 12.400 1.00 0.00 C ATOM 2039 CE3 TRP A 150 -2.417 -6.800 10.063 1.00 0.00 C ATOM 2040 CZ2 TRP A 150 -3.465 -6.202 12.612 1.00 0.00 C ATOM 2041 CZ3 TRP A 150 -3.162 -5.623 10.277 1.00 0.00 C ATOM 2042 CH2 TRP A 150 -3.697 -5.328 11.542 1.00 0.00 C ATOM 0 H TRP A 150 1.663 -7.586 10.388 1.00 0.00 H new ATOM 0 HA TRP A 150 1.130 -10.014 9.088 1.00 0.00 H new ATOM 0 HB2 TRP A 150 -1.368 -10.015 9.457 1.00 0.00 H new ATOM 0 HB3 TRP A 150 -0.360 -10.700 10.717 1.00 0.00 H new ATOM 0 HD1 TRP A 150 -1.023 -10.143 13.023 1.00 0.00 H new ATOM 0 HE1 TRP A 150 -2.464 -8.391 14.237 1.00 0.00 H new ATOM 0 HE3 TRP A 150 -2.054 -7.026 9.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 150 -3.883 -5.997 13.587 1.00 0.00 H new ATOM 0 HZ3 TRP A 150 -3.324 -4.939 9.457 1.00 0.00 H new ATOM 0 HH2 TRP A 150 -4.283 -4.433 11.689 1.00 0.00 H new ATOM 2053 N VAL A 151 -0.468 -8.744 7.408 1.00 0.00 N ATOM 2054 CA VAL A 151 -1.057 -8.012 6.276 1.00 0.00 C ATOM 2055 C VAL A 151 -2.210 -8.836 5.699 1.00 0.00 C ATOM 2056 O VAL A 151 -2.057 -10.033 5.464 1.00 0.00 O ATOM 2057 CB VAL A 151 -0.033 -7.573 5.185 1.00 0.00 C ATOM 2058 CG1 VAL A 151 1.069 -8.609 4.928 1.00 0.00 C ATOM 2059 CG2 VAL A 151 -0.658 -7.254 3.814 1.00 0.00 C ATOM 0 H VAL A 151 -0.678 -9.742 7.373 1.00 0.00 H new ATOM 0 HA VAL A 151 -1.438 -7.066 6.661 1.00 0.00 H new ATOM 0 HB VAL A 151 0.384 -6.664 5.619 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.745 -8.238 4.158 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.627 -8.782 5.848 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.619 -9.544 4.595 1.00 0.00 H new ATOM 0 HG21 VAL A 151 0.126 -6.958 3.117 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.168 -8.138 3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -1.375 -6.440 3.921 1.00 0.00 H new ATOM 2069 N GLU A 152 -3.356 -8.191 5.490 1.00 0.00 N ATOM 2070 CA GLU A 152 -4.496 -8.745 4.757 1.00 0.00 C ATOM 2071 C GLU A 152 -4.438 -8.297 3.291 1.00 0.00 C ATOM 2072 O GLU A 152 -3.957 -7.207 2.987 1.00 0.00 O ATOM 2073 CB GLU A 152 -5.817 -8.319 5.427 1.00 0.00 C ATOM 2074 CG GLU A 152 -7.116 -8.593 4.644 1.00 0.00 C ATOM 2075 CD GLU A 152 -7.420 -10.080 4.354 1.00 0.00 C ATOM 2076 OE1 GLU A 152 -6.500 -10.858 4.017 1.00 0.00 O ATOM 2077 OE2 GLU A 152 -8.606 -10.462 4.425 1.00 0.00 O1- ATOM 0 H GLU A 152 -3.523 -7.245 5.834 1.00 0.00 H new ATOM 0 HA GLU A 152 -4.449 -9.834 4.780 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.888 -8.825 6.390 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -5.764 -7.250 5.632 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -7.952 -8.172 5.203 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -7.066 -8.059 3.695 1.00 0.00 H new ATOM 2084 N LEU A 153 -4.964 -9.131 2.393 1.00 0.00 N ATOM 2085 CA LEU A 153 -5.042 -8.902 0.952 1.00 0.00 C ATOM 2086 C LEU A 153 -6.342 -9.493 0.381 1.00 0.00 C ATOM 2087 O LEU A 153 -6.445 -10.701 0.160 1.00 0.00 O ATOM 2088 CB LEU A 153 -3.779 -9.458 0.254 1.00 0.00 C ATOM 2089 CG LEU A 153 -3.352 -10.892 0.673 1.00 0.00 C ATOM 2090 CD1 LEU A 153 -3.081 -11.772 -0.555 1.00 0.00 C ATOM 2091 CD2 LEU A 153 -2.102 -10.856 1.569 1.00 0.00 C ATOM 0 H LEU A 153 -5.366 -10.028 2.665 1.00 0.00 H new ATOM 0 HA LEU A 153 -5.072 -7.830 0.757 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -3.948 -9.449 -0.823 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -2.949 -8.780 0.452 1.00 0.00 H new ATOM 0 HG LEU A 153 -4.179 -11.324 1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -2.784 -12.769 -0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -3.985 -11.842 -1.159 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.281 -11.331 -1.149 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -1.825 -11.873 1.848 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -1.279 -10.391 1.027 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -2.316 -10.279 2.469 1.00 0.00 H new ATOM 2103 N GLU A 154 -7.329 -8.635 0.109 1.00 0.00 N ATOM 2104 CA GLU A 154 -8.590 -9.009 -0.532 1.00 0.00 C ATOM 2105 C GLU A 154 -9.009 -7.925 -1.543 1.00 0.00 C ATOM 2106 O GLU A 154 -9.304 -6.784 -1.179 1.00 0.00 O ATOM 2107 CB GLU A 154 -9.668 -9.268 0.542 1.00 0.00 C ATOM 2108 CG GLU A 154 -10.706 -10.285 0.046 1.00 0.00 C ATOM 2109 CD GLU A 154 -11.952 -10.387 0.944 1.00 0.00 C ATOM 2110 OE1 GLU A 154 -11.863 -10.186 2.176 1.00 0.00 O ATOM 2111 OE2 GLU A 154 -13.042 -10.700 0.409 1.00 0.00 O1- ATOM 0 H GLU A 154 -7.271 -7.642 0.333 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.463 -9.936 -1.091 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -9.197 -9.638 1.453 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -10.164 -8.332 0.797 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -11.017 -10.011 -0.962 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.236 -11.266 -0.021 1.00 0.00 H new ATOM 2118 N LEU A 155 -9.037 -8.291 -2.829 1.00 0.00 N ATOM 2119 CA LEU A 155 -9.251 -7.405 -3.981 1.00 0.00 C ATOM 2120 C LEU A 155 -9.358 -8.205 -5.294 1.00 0.00 C ATOM 2121 O LEU A 155 -9.193 -9.426 -5.316 1.00 0.00 O ATOM 2122 CB LEU A 155 -8.160 -6.301 -4.061 1.00 0.00 C ATOM 2123 CG LEU A 155 -6.706 -6.787 -4.290 1.00 0.00 C ATOM 2124 CD1 LEU A 155 -5.903 -5.695 -5.018 1.00 0.00 C ATOM 2125 CD2 LEU A 155 -5.990 -7.192 -2.989 1.00 0.00 C ATOM 0 H LEU A 155 -8.904 -9.263 -3.110 1.00 0.00 H new ATOM 0 HA LEU A 155 -10.206 -6.900 -3.835 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -8.423 -5.618 -4.868 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -8.187 -5.726 -3.135 1.00 0.00 H new ATOM 0 HG LEU A 155 -6.764 -7.685 -4.904 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -4.881 -6.040 -5.177 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -6.368 -5.482 -5.980 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -5.890 -4.789 -4.413 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -4.977 -7.522 -3.219 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -5.948 -6.336 -2.315 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -6.537 -8.005 -2.511 1.00 0.00 H new ATOM 2137 N SER A 156 -9.603 -7.505 -6.399 1.00 0.00 N ATOM 2138 CA SER A 156 -9.424 -8.001 -7.773 1.00 0.00 C ATOM 2139 C SER A 156 -7.952 -8.355 -8.091 1.00 0.00 C ATOM 2140 O SER A 156 -7.032 -7.929 -7.394 1.00 0.00 O ATOM 2141 CB SER A 156 -9.943 -6.923 -8.743 1.00 0.00 C ATOM 2142 OG SER A 156 -9.480 -5.624 -8.380 1.00 0.00 O ATOM 0 H SER A 156 -9.943 -6.544 -6.368 1.00 0.00 H new ATOM 0 HA SER A 156 -9.989 -8.927 -7.886 1.00 0.00 H new ATOM 0 HB2 SER A 156 -9.616 -7.157 -9.756 1.00 0.00 H new ATOM 0 HB3 SER A 156 -11.033 -6.933 -8.750 1.00 0.00 H new ATOM 0 HG SER A 156 -9.949 -4.949 -8.914 1.00 0.00 H new ATOM 2148 N HIS A 157 -7.689 -9.110 -9.165 1.00 0.00 N ATOM 2149 CA HIS A 157 -6.348 -9.661 -9.449 1.00 0.00 C ATOM 2150 C HIS A 157 -5.239 -8.606 -9.693 1.00 0.00 C ATOM 2151 O HIS A 157 -4.060 -8.935 -9.556 1.00 0.00 O ATOM 2152 CB HIS A 157 -6.450 -10.605 -10.660 1.00 0.00 C ATOM 2153 CG HIS A 157 -7.356 -11.804 -10.485 1.00 0.00 C ATOM 2154 ND1 HIS A 157 -7.908 -12.544 -11.506 1.00 0.00 N ATOM 2155 CD2 HIS A 157 -7.741 -12.400 -9.310 1.00 0.00 C ATOM 2156 CE1 HIS A 157 -8.611 -13.553 -10.963 1.00 0.00 C ATOM 2157 NE2 HIS A 157 -8.544 -13.506 -9.619 1.00 0.00 N ATOM 0 H HIS A 157 -8.392 -9.358 -9.861 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.038 -10.189 -8.547 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -6.801 -10.030 -11.517 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -5.449 -10.962 -10.904 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -7.471 -12.072 -8.317 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -9.154 -14.298 -11.526 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -8.988 -14.146 -8.960 1.00 0.00 H new ATOM 2165 N HIS A 158 -5.617 -7.370 -10.048 1.00 0.00 N ATOM 2166 CA HIS A 158 -4.772 -6.193 -10.328 1.00 0.00 C ATOM 2167 C HIS A 158 -4.140 -6.264 -11.739 1.00 0.00 C ATOM 2168 O HIS A 158 -3.497 -7.249 -12.114 1.00 0.00 O ATOM 2169 CB HIS A 158 -3.738 -5.934 -9.213 1.00 0.00 C ATOM 2170 CG HIS A 158 -3.042 -4.599 -9.338 1.00 0.00 C ATOM 2171 ND1 HIS A 158 -3.453 -3.403 -8.792 1.00 0.00 N ATOM 2172 CD2 HIS A 158 -1.875 -4.352 -10.011 1.00 0.00 C ATOM 2173 CE1 HIS A 158 -2.556 -2.460 -9.132 1.00 0.00 C ATOM 2174 NE2 HIS A 158 -1.567 -2.992 -9.876 1.00 0.00 N ATOM 0 H HIS A 158 -6.606 -7.145 -10.157 1.00 0.00 H new ATOM 0 HA HIS A 158 -5.426 -5.321 -10.329 1.00 0.00 H new ATOM 0 HB2 HIS A 158 -4.237 -5.986 -8.246 1.00 0.00 H new ATOM 0 HB3 HIS A 158 -2.991 -6.728 -9.229 1.00 0.00 H new ATOM 0 HD2 HIS A 158 -1.292 -5.081 -10.553 1.00 0.00 H new ATOM 0 HE1 HIS A 158 -2.620 -1.420 -8.848 1.00 0.00 H new ATOM 0 HE2 HIS A 158 -0.759 -2.504 -10.262 1.00 0.00 H new ATOM 2182 N GLY A 159 -4.342 -5.212 -12.545 1.00 0.00 N ATOM 2183 CA GLY A 159 -3.887 -5.121 -13.943 1.00 0.00 C ATOM 2184 C GLY A 159 -4.899 -5.630 -14.982 1.00 0.00 C ATOM 2185 O GLY A 159 -4.760 -5.299 -16.162 1.00 0.00 O ATOM 0 H GLY A 159 -4.840 -4.377 -12.236 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -3.649 -4.081 -14.167 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -2.963 -5.689 -14.048 1.00 0.00 H new ATOM 2189 N THR A 160 -5.927 -6.385 -14.562 1.00 0.00 N ATOM 2190 CA THR A 160 -7.041 -6.889 -15.393 1.00 0.00 C ATOM 2191 C THR A 160 -8.372 -6.803 -14.645 1.00 0.00 C ATOM 2192 O THR A 160 -8.413 -6.954 -13.423 1.00 0.00 O ATOM 2193 CB THR A 160 -6.804 -8.338 -15.859 1.00 0.00 C ATOM 2194 OG1 THR A 160 -6.362 -9.139 -14.781 1.00 0.00 O ATOM 2195 CG2 THR A 160 -5.770 -8.418 -16.984 1.00 0.00 C ATOM 0 H THR A 160 -6.011 -6.676 -13.588 1.00 0.00 H new ATOM 0 HA THR A 160 -7.085 -6.249 -16.274 1.00 0.00 H new ATOM 0 HB THR A 160 -7.758 -8.706 -16.236 1.00 0.00 H new ATOM 0 HG1 THR A 160 -6.218 -10.057 -15.093 1.00 0.00 H new ATOM 0 HG21 THR A 160 -5.635 -9.458 -17.281 1.00 0.00 H new ATOM 0 HG22 THR A 160 -6.118 -7.839 -17.839 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.820 -8.014 -16.634 1.00 0.00 H new ATOM 2203 N LEU A 161 -9.452 -6.561 -15.403 1.00 0.00 N ATOM 2204 CA LEU A 161 -10.863 -6.515 -14.970 1.00 0.00 C ATOM 2205 C LEU A 161 -11.086 -5.705 -13.675 1.00 0.00 C ATOM 2206 O LEU A 161 -11.459 -6.236 -12.625 1.00 0.00 O ATOM 2207 CB LEU A 161 -11.465 -7.944 -14.961 1.00 0.00 C ATOM 2208 CG LEU A 161 -12.150 -8.390 -16.272 1.00 0.00 C ATOM 2209 CD1 LEU A 161 -13.449 -7.604 -16.527 1.00 0.00 C ATOM 2210 CD2 LEU A 161 -11.231 -8.296 -17.500 1.00 0.00 C ATOM 0 H LEU A 161 -9.360 -6.380 -16.403 1.00 0.00 H new ATOM 0 HA LEU A 161 -11.428 -5.943 -15.707 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -10.670 -8.652 -14.729 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -12.193 -8.007 -14.152 1.00 0.00 H new ATOM 0 HG LEU A 161 -12.392 -9.443 -16.130 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -13.903 -7.944 -17.457 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -14.142 -7.770 -15.703 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -13.222 -6.541 -16.602 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -11.774 -8.624 -18.387 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -10.907 -7.264 -17.634 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -10.359 -8.934 -17.352 1.00 0.00 H new ATOM 2222 N LEU A 162 -10.863 -4.390 -13.773 1.00 0.00 N ATOM 2223 CA LEU A 162 -11.030 -3.420 -12.685 1.00 0.00 C ATOM 2224 C LEU A 162 -12.270 -2.546 -12.950 1.00 0.00 C ATOM 2225 O LEU A 162 -12.326 -1.840 -13.961 1.00 0.00 O ATOM 2226 CB LEU A 162 -9.748 -2.565 -12.565 1.00 0.00 C ATOM 2227 CG LEU A 162 -8.433 -3.364 -12.424 1.00 0.00 C ATOM 2228 CD1 LEU A 162 -7.242 -2.398 -12.365 1.00 0.00 C ATOM 2229 CD2 LEU A 162 -8.422 -4.263 -11.181 1.00 0.00 C ATOM 0 H LEU A 162 -10.551 -3.957 -14.642 1.00 0.00 H new ATOM 0 HA LEU A 162 -11.186 -3.940 -11.740 1.00 0.00 H new ATOM 0 HB2 LEU A 162 -9.673 -1.926 -13.445 1.00 0.00 H new ATOM 0 HB3 LEU A 162 -9.849 -1.908 -11.701 1.00 0.00 H new ATOM 0 HG LEU A 162 -8.355 -4.011 -13.298 1.00 0.00 H new ATOM 0 HD11 LEU A 162 -6.317 -2.966 -12.266 1.00 0.00 H new ATOM 0 HD12 LEU A 162 -7.208 -1.806 -13.280 1.00 0.00 H new ATOM 0 HD13 LEU A 162 -7.354 -1.734 -11.508 1.00 0.00 H new ATOM 0 HD21 LEU A 162 -7.476 -4.802 -11.130 1.00 0.00 H new ATOM 0 HD22 LEU A 162 -8.539 -3.650 -10.287 1.00 0.00 H new ATOM 0 HD23 LEU A 162 -9.243 -4.977 -11.241 1.00 0.00 H new ATOM 2241 N ARG A 163 -13.258 -2.599 -12.047 1.00 0.00 N ATOM 2242 CA ARG A 163 -14.484 -1.779 -12.093 1.00 0.00 C ATOM 2243 C ARG A 163 -14.356 -0.507 -11.226 1.00 0.00 C ATOM 2244 O ARG A 163 -13.262 -0.178 -10.763 1.00 0.00 O ATOM 2245 CB ARG A 163 -15.706 -2.667 -11.769 1.00 0.00 C ATOM 2246 CG ARG A 163 -15.861 -3.077 -10.294 1.00 0.00 C ATOM 2247 CD ARG A 163 -16.912 -4.193 -10.136 1.00 0.00 C ATOM 2248 NE ARG A 163 -17.792 -3.984 -8.970 1.00 0.00 N ATOM 2249 CZ ARG A 163 -17.465 -4.058 -7.685 1.00 0.00 C ATOM 2250 NH1 ARG A 163 -16.251 -4.380 -7.292 1.00 0.00 N1+ ATOM 2251 NH2 ARG A 163 -18.375 -3.798 -6.772 1.00 0.00 N ATOM 0 H ARG A 163 -13.230 -3.227 -11.244 1.00 0.00 H new ATOM 0 HA ARG A 163 -14.638 -1.393 -13.101 1.00 0.00 H new ATOM 0 HB2 ARG A 163 -16.608 -2.138 -12.077 1.00 0.00 H new ATOM 0 HB3 ARG A 163 -15.645 -3.572 -12.374 1.00 0.00 H new ATOM 0 HG2 ARG A 163 -14.902 -3.419 -9.906 1.00 0.00 H new ATOM 0 HG3 ARG A 163 -16.154 -2.210 -9.701 1.00 0.00 H new ATOM 0 HD2 ARG A 163 -17.519 -4.246 -11.040 1.00 0.00 H new ATOM 0 HD3 ARG A 163 -16.405 -5.153 -10.036 1.00 0.00 H new ATOM 0 HE ARG A 163 -18.765 -3.756 -9.175 1.00 0.00 H new ATOM 0 HH11 ARG A 163 -15.528 -4.582 -7.983 1.00 0.00 H new ATOM 0 HH12 ARG A 163 -16.033 -4.428 -6.297 1.00 0.00 H new ATOM 0 HH21 ARG A 163 -19.321 -3.542 -7.054 1.00 0.00 H new ATOM 0 HH22 ARG A 163 -18.134 -3.852 -5.782 1.00 0.00 H new ATOM 2265 N GLY A 164 -15.456 0.223 -11.004 1.00 0.00 N ATOM 2266 CA GLY A 164 -15.506 1.406 -10.126 1.00 0.00 C ATOM 2267 C GLY A 164 -14.799 2.617 -10.738 1.00 0.00 C ATOM 2268 O GLY A 164 -15.292 3.198 -11.712 1.00 0.00 O ATOM 0 H GLY A 164 -16.354 0.007 -11.436 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -16.546 1.660 -9.923 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -15.044 1.164 -9.169 1.00 0.00 H new