USER MOD reduce.3.24.130724 H: found=0, std=0, add=854, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 856 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 13 THR OG1 : rot 73:sc= -0.259 USER MOD Set 1.2: A 134 MET CE :methyl 137:sc= -0.105 (180deg=-2.19!) USER MOD Set 2.1: A 121 MET CE :methyl -168:sc= -0.72 (180deg=-1.29!) USER MOD Set 2.2: A 129 THR OG1 : rot 141:sc= 1.15 USER MOD Set 3.1: A 31 HIS : no HD1:sc= 0.934 K(o=2,f=-8!) USER MOD Set 3.2: A 43 SER OG : rot -59:sc= 1.02 USER MOD Set 4.1: A 12 ASN : amide:sc= 2 K(o=3,f=-7) USER MOD Set 4.2: A 25 ASN : amide:sc= 0.998 K(o=3,f=-6.4!) USER MOD Single : A 15 THR OG1 : rot 118:sc= 1.15 USER MOD Single : A 17 TYR OH : rot 30:sc= -0.176 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc=-0.00589 K(o=-0.0059,f=-0.93) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0311 USER MOD Single : A 55 SER OG : rot 180:sc= 0.00403 USER MOD Single : A 58 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 96 THR OG1 : rot -100:sc= -3! USER MOD Single : A 100 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 107 GLN : amide:sc= -0.379 K(o=-0.38,f=-3.3) USER MOD Single : A 114 MET CE :methyl 180:sc= -2.72! (180deg=-2.72!) USER MOD Single : A 123 THR OG1 : rot -175:sc= -0.969 USER MOD Single : A 124 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 130 TYR OH : rot -166:sc= 0.27 USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 153 N LEU A 11 14.607 -3.186 -7.571 1.00 0.00 N ATOM 154 CA LEU A 11 13.643 -2.103 -7.640 1.00 0.00 C ATOM 155 C LEU A 11 12.274 -2.635 -8.041 1.00 0.00 C ATOM 156 O LEU A 11 12.018 -2.898 -9.216 1.00 0.00 O ATOM 157 CB LEU A 11 14.104 -1.029 -8.629 1.00 0.00 C ATOM 158 CG LEU A 11 13.288 0.265 -8.601 1.00 0.00 C ATOM 159 CD1 LEU A 11 13.436 0.957 -7.257 1.00 0.00 C ATOM 160 CD2 LEU A 11 13.717 1.192 -9.728 1.00 0.00 C ATOM 0 HA LEU A 11 13.567 -1.651 -6.651 1.00 0.00 H new ATOM 0 HB2 LEU A 11 15.147 -0.788 -8.422 1.00 0.00 H new ATOM 0 HB3 LEU A 11 14.067 -1.443 -9.636 1.00 0.00 H new ATOM 0 HG LEU A 11 12.238 0.013 -8.746 1.00 0.00 H new ATOM 0 HD11 LEU A 11 12.849 1.876 -7.254 1.00 0.00 H new ATOM 0 HD12 LEU A 11 13.080 0.296 -6.466 1.00 0.00 H new ATOM 0 HD13 LEU A 11 14.485 1.196 -7.085 1.00 0.00 H new ATOM 0 HD21 LEU A 11 13.126 2.107 -9.692 1.00 0.00 H new ATOM 0 HD22 LEU A 11 14.773 1.438 -9.615 1.00 0.00 H new ATOM 0 HD23 LEU A 11 13.560 0.697 -10.686 1.00 0.00 H new ATOM 172 N ASN A 12 11.410 -2.815 -7.053 1.00 0.00 N ATOM 173 CA ASN A 12 10.049 -3.275 -7.300 1.00 0.00 C ATOM 174 C ASN A 12 9.252 -2.192 -8.010 1.00 0.00 C ATOM 175 O ASN A 12 8.902 -1.171 -7.417 1.00 0.00 O ATOM 176 CB ASN A 12 9.369 -3.669 -5.987 1.00 0.00 C ATOM 177 CG ASN A 12 9.953 -4.937 -5.394 1.00 0.00 C ATOM 178 OD1 ASN A 12 10.377 -5.837 -6.117 1.00 0.00 O ATOM 179 ND2 ASN A 12 10.001 -5.009 -4.075 1.00 0.00 N ATOM 0 H ASN A 12 11.627 -2.649 -6.070 1.00 0.00 H new ATOM 0 HA ASN A 12 10.089 -4.156 -7.941 1.00 0.00 H new ATOM 0 HB2 ASN A 12 9.470 -2.855 -5.269 1.00 0.00 H new ATOM 0 HB3 ASN A 12 8.302 -3.810 -6.161 1.00 0.00 H new ATOM 0 HD21 ASN A 12 10.400 -5.832 -3.623 1.00 0.00 H new ATOM 0 HD22 ASN A 12 9.639 -4.242 -3.509 1.00 0.00 H new ATOM 186 N THR A 13 8.993 -2.405 -9.288 1.00 0.00 N ATOM 187 CA THR A 13 8.323 -1.409 -10.103 1.00 0.00 C ATOM 188 C THR A 13 7.203 -2.038 -10.927 1.00 0.00 C ATOM 189 O THR A 13 7.370 -3.114 -11.506 1.00 0.00 O ATOM 190 CB THR A 13 9.326 -0.721 -11.050 1.00 0.00 C ATOM 191 OG1 THR A 13 10.489 -0.321 -10.312 1.00 0.00 O ATOM 192 CG2 THR A 13 8.708 0.498 -11.719 1.00 0.00 C ATOM 0 H THR A 13 9.238 -3.262 -9.784 1.00 0.00 H new ATOM 0 HA THR A 13 7.893 -0.668 -9.430 1.00 0.00 H new ATOM 0 HB THR A 13 9.603 -1.435 -11.826 1.00 0.00 H new ATOM 0 HG1 THR A 13 11.021 -1.112 -10.086 1.00 0.00 H new ATOM 0 HG21 THR A 13 9.441 0.961 -12.380 1.00 0.00 H new ATOM 0 HG22 THR A 13 7.837 0.192 -12.299 1.00 0.00 H new ATOM 0 HG23 THR A 13 8.403 1.215 -10.957 1.00 0.00 H new ATOM 200 N VAL A 14 6.057 -1.370 -10.957 1.00 0.00 N ATOM 201 CA VAL A 14 4.948 -1.792 -11.797 1.00 0.00 C ATOM 202 C VAL A 14 5.269 -1.485 -13.254 1.00 0.00 C ATOM 203 O VAL A 14 5.490 -0.329 -13.616 1.00 0.00 O ATOM 204 CB VAL A 14 3.633 -1.080 -11.406 1.00 0.00 C ATOM 205 CG1 VAL A 14 2.470 -1.577 -12.253 1.00 0.00 C ATOM 206 CG2 VAL A 14 3.336 -1.273 -9.925 1.00 0.00 C ATOM 0 H VAL A 14 5.873 -0.531 -10.407 1.00 0.00 H new ATOM 0 HA VAL A 14 4.810 -2.864 -11.655 1.00 0.00 H new ATOM 0 HB VAL A 14 3.759 -0.014 -11.596 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.557 -1.060 -11.957 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.675 -1.378 -13.305 1.00 0.00 H new ATOM 0 HG13 VAL A 14 2.344 -2.649 -12.104 1.00 0.00 H new ATOM 0 HG21 VAL A 14 2.406 -0.764 -9.671 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.238 -2.337 -9.709 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.151 -0.857 -9.333 1.00 0.00 H new ATOM 216 N THR A 15 5.321 -2.518 -14.075 1.00 0.00 N ATOM 217 CA THR A 15 5.646 -2.355 -15.479 1.00 0.00 C ATOM 218 C THR A 15 4.380 -2.199 -16.316 1.00 0.00 C ATOM 219 O THR A 15 4.039 -1.094 -16.739 1.00 0.00 O ATOM 220 CB THR A 15 6.486 -3.543 -15.989 1.00 0.00 C ATOM 221 OG1 THR A 15 5.979 -4.771 -15.448 1.00 0.00 O ATOM 222 CG2 THR A 15 7.948 -3.378 -15.601 1.00 0.00 C ATOM 0 H THR A 15 5.142 -3.481 -13.792 1.00 0.00 H new ATOM 0 HA THR A 15 6.239 -1.446 -15.582 1.00 0.00 H new ATOM 0 HB THR A 15 6.415 -3.569 -17.076 1.00 0.00 H new ATOM 0 HG1 THR A 15 5.676 -5.350 -16.178 1.00 0.00 H new ATOM 0 HG21 THR A 15 8.521 -4.228 -15.972 1.00 0.00 H new ATOM 0 HG22 THR A 15 8.339 -2.459 -16.038 1.00 0.00 H new ATOM 0 HG23 THR A 15 8.033 -3.329 -14.515 1.00 0.00 H new ATOM 230 N ALA A 16 3.671 -3.298 -16.534 1.00 0.00 N ATOM 231 CA ALA A 16 2.425 -3.253 -17.279 1.00 0.00 C ATOM 232 C ALA A 16 1.244 -3.055 -16.339 1.00 0.00 C ATOM 233 O ALA A 16 0.771 -4.000 -15.702 1.00 0.00 O ATOM 234 CB ALA A 16 2.243 -4.516 -18.109 1.00 0.00 C ATOM 0 H ALA A 16 3.937 -4.227 -16.206 1.00 0.00 H new ATOM 0 HA ALA A 16 2.469 -2.403 -17.960 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.303 -4.458 -18.658 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.069 -4.611 -18.814 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.226 -5.385 -17.451 1.00 0.00 H new ATOM 240 N TYR A 17 0.795 -1.815 -16.224 1.00 0.00 N ATOM 241 CA TYR A 17 -0.373 -1.504 -15.418 1.00 0.00 C ATOM 242 C TYR A 17 -1.641 -1.682 -16.240 1.00 0.00 C ATOM 243 O TYR A 17 -1.865 -0.971 -17.223 1.00 0.00 O ATOM 244 CB TYR A 17 -0.291 -0.075 -14.868 1.00 0.00 C ATOM 245 CG TYR A 17 -1.554 0.382 -14.166 1.00 0.00 C ATOM 246 CD1 TYR A 17 -1.880 -0.088 -12.898 1.00 0.00 C ATOM 247 CD2 TYR A 17 -2.427 1.276 -14.777 1.00 0.00 C ATOM 248 CE1 TYR A 17 -3.037 0.322 -12.262 1.00 0.00 C ATOM 249 CE2 TYR A 17 -3.585 1.689 -14.146 1.00 0.00 C ATOM 250 CZ TYR A 17 -3.885 1.210 -12.889 1.00 0.00 C ATOM 251 OH TYR A 17 -5.038 1.617 -12.260 1.00 0.00 O ATOM 0 H TYR A 17 1.222 -1.008 -16.679 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.401 -2.193 -14.574 1.00 0.00 H new ATOM 0 HB2 TYR A 17 0.545 -0.011 -14.171 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.075 0.609 -15.689 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.219 -0.784 -12.403 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -2.196 1.654 -15.762 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -3.276 -0.052 -11.277 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -4.252 2.384 -14.635 1.00 0.00 H new ATOM 0 HH TYR A 17 -4.902 1.608 -11.290 1.00 0.00 H new ATOM 261 N GLY A 18 -2.457 -2.643 -15.843 1.00 0.00 N ATOM 262 CA GLY A 18 -3.710 -2.878 -16.519 1.00 0.00 C ATOM 263 C GLY A 18 -4.867 -2.879 -15.548 1.00 0.00 C ATOM 264 O GLY A 18 -4.664 -2.902 -14.335 1.00 0.00 O ATOM 0 H GLY A 18 -2.271 -3.268 -15.059 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.868 -2.108 -17.275 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.670 -3.834 -17.041 1.00 0.00 H new ATOM 268 N ASP A 19 -6.078 -2.850 -16.077 1.00 0.00 N ATOM 269 CA ASP A 19 -7.270 -2.867 -15.254 1.00 0.00 C ATOM 270 C ASP A 19 -7.605 -4.294 -14.847 1.00 0.00 C ATOM 271 O ASP A 19 -8.317 -4.527 -13.867 1.00 0.00 O ATOM 272 CB ASP A 19 -8.441 -2.256 -16.021 1.00 0.00 C ATOM 273 CG ASP A 19 -8.219 -0.802 -16.385 1.00 0.00 C ATOM 274 OD1 ASP A 19 -7.572 -0.539 -17.422 1.00 0.00 O ATOM 275 OD2 ASP A 19 -8.706 0.084 -15.652 1.00 0.00 O ATOM 0 H ASP A 19 -6.260 -2.814 -17.080 1.00 0.00 H new ATOM 0 HA ASP A 19 -7.086 -2.278 -14.355 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.610 -2.831 -16.932 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -9.345 -2.340 -15.418 1.00 0.00 H new ATOM 280 N GLY A 20 -7.093 -5.248 -15.614 1.00 0.00 N ATOM 281 CA GLY A 20 -7.341 -6.646 -15.328 1.00 0.00 C ATOM 282 C GLY A 20 -6.280 -7.256 -14.436 1.00 0.00 C ATOM 283 O GLY A 20 -6.590 -8.060 -13.555 1.00 0.00 O ATOM 0 H GLY A 20 -6.508 -5.077 -16.432 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -8.315 -6.748 -14.849 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.386 -7.202 -16.264 1.00 0.00 H new ATOM 287 N TYR A 21 -5.030 -6.868 -14.648 1.00 0.00 N ATOM 288 CA TYR A 21 -3.919 -7.435 -13.896 1.00 0.00 C ATOM 289 C TYR A 21 -2.899 -6.360 -13.544 1.00 0.00 C ATOM 290 O TYR A 21 -2.803 -5.335 -14.222 1.00 0.00 O ATOM 291 CB TYR A 21 -3.238 -8.557 -14.696 1.00 0.00 C ATOM 292 CG TYR A 21 -2.631 -8.108 -16.012 1.00 0.00 C ATOM 293 CD1 TYR A 21 -1.339 -7.595 -16.067 1.00 0.00 C ATOM 294 CD2 TYR A 21 -3.349 -8.199 -17.197 1.00 0.00 C ATOM 295 CE1 TYR A 21 -0.782 -7.190 -17.265 1.00 0.00 C ATOM 296 CE2 TYR A 21 -2.798 -7.798 -18.399 1.00 0.00 C ATOM 297 CZ TYR A 21 -1.516 -7.292 -18.427 1.00 0.00 C ATOM 298 OH TYR A 21 -0.965 -6.890 -19.623 1.00 0.00 O ATOM 0 H TYR A 21 -4.760 -6.163 -15.334 1.00 0.00 H new ATOM 0 HA TYR A 21 -4.320 -7.853 -12.973 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -2.455 -9.001 -14.081 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.970 -9.340 -14.896 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.762 -7.512 -15.158 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.356 -8.590 -17.179 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.223 -6.796 -17.291 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -3.369 -7.881 -19.312 1.00 0.00 H new ATOM 0 HH TYR A 21 -1.613 -7.029 -20.345 1.00 0.00 H new ATOM 308 N ILE A 22 -2.142 -6.603 -12.488 1.00 0.00 N ATOM 309 CA ILE A 22 -1.077 -5.701 -12.084 1.00 0.00 C ATOM 310 C ILE A 22 0.269 -6.398 -12.237 1.00 0.00 C ATOM 311 O ILE A 22 0.544 -7.390 -11.556 1.00 0.00 O ATOM 312 CB ILE A 22 -1.259 -5.230 -10.623 1.00 0.00 C ATOM 313 CG1 ILE A 22 -2.628 -4.564 -10.450 1.00 0.00 C ATOM 314 CG2 ILE A 22 -0.141 -4.270 -10.230 1.00 0.00 C ATOM 315 CD1 ILE A 22 -2.946 -4.178 -9.021 1.00 0.00 C ATOM 0 H ILE A 22 -2.246 -7.423 -11.891 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.114 -4.822 -12.728 1.00 0.00 H new ATOM 0 HB ILE A 22 -1.210 -6.098 -9.966 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -2.669 -3.672 -11.075 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -3.400 -5.243 -10.813 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -0.284 -3.948 -9.199 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.821 -4.774 -10.323 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.160 -3.401 -10.888 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.931 -3.713 -8.980 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -2.939 -5.069 -8.393 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -2.197 -3.474 -8.659 1.00 0.00 H new ATOM 327 N GLU A 23 1.091 -5.904 -13.150 1.00 0.00 N ATOM 328 CA GLU A 23 2.387 -6.509 -13.407 1.00 0.00 C ATOM 329 C GLU A 23 3.496 -5.745 -12.692 1.00 0.00 C ATOM 330 O GLU A 23 3.745 -4.574 -12.978 1.00 0.00 O ATOM 331 CB GLU A 23 2.667 -6.559 -14.908 1.00 0.00 C ATOM 332 CG GLU A 23 3.964 -7.267 -15.251 1.00 0.00 C ATOM 333 CD GLU A 23 4.263 -7.275 -16.734 1.00 0.00 C ATOM 334 OE1 GLU A 23 4.792 -6.268 -17.239 1.00 0.00 O ATOM 335 OE2 GLU A 23 3.985 -8.298 -17.394 1.00 0.00 O ATOM 0 H GLU A 23 0.883 -5.087 -13.724 1.00 0.00 H new ATOM 0 HA GLU A 23 2.365 -7.528 -13.019 1.00 0.00 H new ATOM 0 HB2 GLU A 23 1.841 -7.065 -15.408 1.00 0.00 H new ATOM 0 HB3 GLU A 23 2.701 -5.542 -15.299 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.786 -6.782 -14.724 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.916 -8.295 -14.891 1.00 0.00 H new ATOM 342 N VAL A 24 4.151 -6.413 -11.758 1.00 0.00 N ATOM 343 CA VAL A 24 5.266 -5.830 -11.032 1.00 0.00 C ATOM 344 C VAL A 24 6.539 -6.605 -11.339 1.00 0.00 C ATOM 345 O VAL A 24 6.593 -7.815 -11.127 1.00 0.00 O ATOM 346 CB VAL A 24 5.016 -5.834 -9.509 1.00 0.00 C ATOM 347 CG1 VAL A 24 6.175 -5.186 -8.767 1.00 0.00 C ATOM 348 CG2 VAL A 24 3.709 -5.127 -9.184 1.00 0.00 C ATOM 0 H VAL A 24 3.927 -7.369 -11.483 1.00 0.00 H new ATOM 0 HA VAL A 24 5.371 -4.794 -11.355 1.00 0.00 H new ATOM 0 HB VAL A 24 4.941 -6.870 -9.178 1.00 0.00 H new ATOM 0 HG11 VAL A 24 5.975 -5.201 -7.696 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.092 -5.737 -8.973 1.00 0.00 H new ATOM 0 HG13 VAL A 24 6.289 -4.155 -9.100 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.547 -5.139 -8.106 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.757 -4.095 -9.533 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.885 -5.640 -9.680 1.00 0.00 H new ATOM 358 N ASN A 25 7.547 -5.907 -11.859 1.00 0.00 N ATOM 359 CA ASN A 25 8.813 -6.531 -12.256 1.00 0.00 C ATOM 360 C ASN A 25 8.574 -7.589 -13.330 1.00 0.00 C ATOM 361 O ASN A 25 9.304 -8.577 -13.417 1.00 0.00 O ATOM 362 CB ASN A 25 9.522 -7.173 -11.054 1.00 0.00 C ATOM 363 CG ASN A 25 9.798 -6.198 -9.924 1.00 0.00 C ATOM 364 OD1 ASN A 25 9.943 -4.993 -10.139 1.00 0.00 O ATOM 365 ND2 ASN A 25 9.884 -6.720 -8.712 1.00 0.00 N ATOM 0 H ASN A 25 7.513 -4.900 -12.017 1.00 0.00 H new ATOM 0 HA ASN A 25 9.453 -5.745 -12.657 1.00 0.00 H new ATOM 0 HB2 ASN A 25 8.910 -7.992 -10.676 1.00 0.00 H new ATOM 0 HB3 ASN A 25 10.465 -7.607 -11.387 1.00 0.00 H new ATOM 0 HD21 ASN A 25 10.077 -6.119 -7.911 1.00 0.00 H new ATOM 0 HD22 ASN A 25 9.757 -7.723 -8.579 1.00 0.00 H new ATOM 372 N GLN A 26 7.546 -7.358 -14.151 1.00 0.00 N ATOM 373 CA GLN A 26 7.139 -8.289 -15.209 1.00 0.00 C ATOM 374 C GLN A 26 6.494 -9.550 -14.631 1.00 0.00 C ATOM 375 O GLN A 26 6.313 -10.546 -15.332 1.00 0.00 O ATOM 376 CB GLN A 26 8.316 -8.645 -16.122 1.00 0.00 C ATOM 377 CG GLN A 26 8.864 -7.450 -16.881 1.00 0.00 C ATOM 378 CD GLN A 26 10.015 -7.807 -17.798 1.00 0.00 C ATOM 379 OE1 GLN A 26 10.777 -8.741 -17.534 1.00 0.00 O ATOM 380 NE2 GLN A 26 10.142 -7.068 -18.886 1.00 0.00 N ATOM 0 H GLN A 26 6.970 -6.518 -14.101 1.00 0.00 H new ATOM 0 HA GLN A 26 6.388 -7.781 -15.814 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.113 -9.084 -15.522 1.00 0.00 H new ATOM 0 HB3 GLN A 26 7.998 -9.406 -16.835 1.00 0.00 H new ATOM 0 HG2 GLN A 26 8.063 -7.003 -17.470 1.00 0.00 H new ATOM 0 HG3 GLN A 26 9.196 -6.695 -16.168 1.00 0.00 H new ATOM 0 HE21 GLN A 26 9.488 -6.305 -19.064 1.00 0.00 H new ATOM 0 HE22 GLN A 26 10.894 -7.260 -19.548 1.00 0.00 H new ATOM 389 N VAL A 27 6.130 -9.496 -13.356 1.00 0.00 N ATOM 390 CA VAL A 27 5.364 -10.562 -12.730 1.00 0.00 C ATOM 391 C VAL A 27 3.919 -10.104 -12.563 1.00 0.00 C ATOM 392 O VAL A 27 3.644 -9.136 -11.855 1.00 0.00 O ATOM 393 CB VAL A 27 5.943 -10.959 -11.354 1.00 0.00 C ATOM 394 CG1 VAL A 27 5.202 -12.159 -10.784 1.00 0.00 C ATOM 395 CG2 VAL A 27 7.435 -11.247 -11.461 1.00 0.00 C ATOM 0 H VAL A 27 6.355 -8.720 -12.734 1.00 0.00 H new ATOM 0 HA VAL A 27 5.416 -11.440 -13.374 1.00 0.00 H new ATOM 0 HB VAL A 27 5.806 -10.120 -10.672 1.00 0.00 H new ATOM 0 HG11 VAL A 27 5.626 -12.422 -9.815 1.00 0.00 H new ATOM 0 HG12 VAL A 27 4.147 -11.912 -10.664 1.00 0.00 H new ATOM 0 HG13 VAL A 27 5.301 -13.005 -11.465 1.00 0.00 H new ATOM 0 HG21 VAL A 27 7.823 -11.525 -10.481 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.598 -12.066 -12.161 1.00 0.00 H new ATOM 0 HG23 VAL A 27 7.953 -10.356 -11.817 1.00 0.00 H new ATOM 405 N ARG A 28 3.001 -10.786 -13.229 1.00 0.00 N ATOM 406 CA ARG A 28 1.605 -10.367 -13.248 1.00 0.00 C ATOM 407 C ARG A 28 0.806 -11.056 -12.154 1.00 0.00 C ATOM 408 O ARG A 28 0.665 -12.278 -12.150 1.00 0.00 O ATOM 409 CB ARG A 28 0.988 -10.656 -14.618 1.00 0.00 C ATOM 410 CG ARG A 28 1.703 -9.938 -15.745 1.00 0.00 C ATOM 411 CD ARG A 28 1.107 -10.250 -17.104 1.00 0.00 C ATOM 412 NE ARG A 28 1.824 -9.543 -18.162 1.00 0.00 N ATOM 413 CZ ARG A 28 1.515 -9.601 -19.453 1.00 0.00 C ATOM 414 NH1 ARG A 28 0.495 -10.342 -19.864 1.00 0.00 N ATOM 415 NH2 ARG A 28 2.236 -8.916 -20.332 1.00 0.00 N ATOM 0 H ARG A 28 3.195 -11.632 -13.764 1.00 0.00 H new ATOM 0 HA ARG A 28 1.572 -9.294 -13.060 1.00 0.00 H new ATOM 0 HB2 ARG A 28 1.012 -11.730 -14.804 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.060 -10.358 -14.610 1.00 0.00 H new ATOM 0 HG2 ARG A 28 1.660 -8.863 -15.571 1.00 0.00 H new ATOM 0 HG3 ARG A 28 2.756 -10.220 -15.740 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.148 -11.324 -17.286 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.055 -9.965 -17.119 1.00 0.00 H new ATOM 0 HE ARG A 28 2.618 -8.964 -17.891 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.056 -10.871 -19.188 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.262 -10.383 -20.856 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.022 -8.349 -20.015 1.00 0.00 H new ATOM 0 HH22 ARG A 28 2.004 -8.957 -21.324 1.00 0.00 H new ATOM 429 N PHE A 29 0.295 -10.263 -11.225 1.00 0.00 N ATOM 430 CA PHE A 29 -0.522 -10.783 -10.141 1.00 0.00 C ATOM 431 C PHE A 29 -1.996 -10.521 -10.417 1.00 0.00 C ATOM 432 O PHE A 29 -2.361 -9.480 -10.970 1.00 0.00 O ATOM 433 CB PHE A 29 -0.122 -10.144 -8.809 1.00 0.00 C ATOM 434 CG PHE A 29 1.272 -10.483 -8.363 1.00 0.00 C ATOM 435 CD1 PHE A 29 1.521 -11.646 -7.652 1.00 0.00 C ATOM 436 CD2 PHE A 29 2.331 -9.636 -8.645 1.00 0.00 C ATOM 437 CE1 PHE A 29 2.799 -11.960 -7.234 1.00 0.00 C ATOM 438 CE2 PHE A 29 3.613 -9.943 -8.228 1.00 0.00 C ATOM 439 CZ PHE A 29 3.846 -11.107 -7.521 1.00 0.00 C ATOM 0 H PHE A 29 0.433 -9.253 -11.201 1.00 0.00 H new ATOM 0 HA PHE A 29 -0.358 -11.859 -10.077 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -0.211 -9.061 -8.896 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.826 -10.461 -8.040 1.00 0.00 H new ATOM 0 HD1 PHE A 29 0.705 -12.315 -7.422 1.00 0.00 H new ATOM 0 HD2 PHE A 29 2.153 -8.725 -9.197 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.979 -12.871 -6.683 1.00 0.00 H new ATOM 0 HE2 PHE A 29 4.430 -9.274 -8.454 1.00 0.00 H new ATOM 0 HZ PHE A 29 4.846 -11.349 -7.193 1.00 0.00 H new ATOM 449 N SER A 30 -2.837 -11.472 -10.040 1.00 0.00 N ATOM 450 CA SER A 30 -4.272 -11.332 -10.210 1.00 0.00 C ATOM 451 C SER A 30 -4.947 -11.065 -8.867 1.00 0.00 C ATOM 452 O SER A 30 -6.170 -10.930 -8.787 1.00 0.00 O ATOM 453 CB SER A 30 -4.850 -12.589 -10.868 1.00 0.00 C ATOM 454 OG SER A 30 -4.455 -13.768 -10.178 1.00 0.00 O ATOM 0 H SER A 30 -2.547 -12.352 -9.613 1.00 0.00 H new ATOM 0 HA SER A 30 -4.466 -10.480 -10.861 1.00 0.00 H new ATOM 0 HB2 SER A 30 -5.938 -12.524 -10.886 1.00 0.00 H new ATOM 0 HB3 SER A 30 -4.517 -12.644 -11.904 1.00 0.00 H new ATOM 0 HG SER A 30 -4.841 -14.552 -10.622 1.00 0.00 H new ATOM 460 N HIS A 31 -4.140 -10.981 -7.814 1.00 0.00 N ATOM 461 CA HIS A 31 -4.658 -10.703 -6.481 1.00 0.00 C ATOM 462 C HIS A 31 -3.885 -9.548 -5.849 1.00 0.00 C ATOM 463 O HIS A 31 -2.868 -9.110 -6.391 1.00 0.00 O ATOM 464 CB HIS A 31 -4.605 -11.961 -5.591 1.00 0.00 C ATOM 465 CG HIS A 31 -3.234 -12.356 -5.118 1.00 0.00 C ATOM 466 ND1 HIS A 31 -2.334 -13.057 -5.892 1.00 0.00 N ATOM 467 CD2 HIS A 31 -2.624 -12.160 -3.926 1.00 0.00 C ATOM 468 CE1 HIS A 31 -1.233 -13.273 -5.195 1.00 0.00 C ATOM 469 NE2 HIS A 31 -1.382 -12.740 -3.999 1.00 0.00 N ATOM 0 H HIS A 31 -3.128 -11.101 -7.858 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.704 -10.411 -6.570 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -5.239 -11.796 -4.719 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -5.035 -12.796 -6.144 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -3.038 -11.642 -3.074 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -0.357 -13.798 -5.546 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -0.689 -12.756 -3.251 1.00 0.00 H new ATOM 478 N ALA A 32 -4.377 -9.066 -4.716 1.00 0.00 N ATOM 479 CA ALA A 32 -3.806 -7.904 -4.042 1.00 0.00 C ATOM 480 C ALA A 32 -2.353 -8.125 -3.636 1.00 0.00 C ATOM 481 O ALA A 32 -1.962 -9.222 -3.230 1.00 0.00 O ATOM 482 CB ALA A 32 -4.641 -7.548 -2.825 1.00 0.00 C ATOM 0 H ALA A 32 -5.183 -9.468 -4.237 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.820 -7.077 -4.752 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -4.208 -6.680 -2.328 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.659 -7.317 -3.137 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.656 -8.391 -2.135 1.00 0.00 H new ATOM 488 N ILE A 33 -1.563 -7.069 -3.745 1.00 0.00 N ATOM 489 CA ILE A 33 -0.146 -7.122 -3.408 1.00 0.00 C ATOM 490 C ILE A 33 0.300 -5.823 -2.752 1.00 0.00 C ATOM 491 O ILE A 33 -0.188 -4.743 -3.091 1.00 0.00 O ATOM 492 CB ILE A 33 0.731 -7.378 -4.655 1.00 0.00 C ATOM 493 CG1 ILE A 33 0.324 -6.439 -5.797 1.00 0.00 C ATOM 494 CG2 ILE A 33 0.641 -8.836 -5.089 1.00 0.00 C ATOM 495 CD1 ILE A 33 1.167 -6.593 -7.043 1.00 0.00 C ATOM 0 H ILE A 33 -1.882 -6.155 -4.067 1.00 0.00 H new ATOM 0 HA ILE A 33 -0.018 -7.952 -2.713 1.00 0.00 H new ATOM 0 HB ILE A 33 1.769 -7.170 -4.396 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.720 -6.622 -6.051 1.00 0.00 H new ATOM 0 HG13 ILE A 33 0.391 -5.408 -5.449 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.266 -8.993 -5.968 1.00 0.00 H new ATOM 0 HG22 ILE A 33 0.986 -9.479 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.393 -9.080 -5.331 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.819 -5.896 -7.806 1.00 0.00 H new ATOM 0 HD12 ILE A 33 2.209 -6.381 -6.806 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.081 -7.613 -7.417 1.00 0.00 H new ATOM 507 N ALA A 34 1.211 -5.940 -1.801 1.00 0.00 N ATOM 508 CA ALA A 34 1.797 -4.784 -1.144 1.00 0.00 C ATOM 509 C ALA A 34 3.312 -4.890 -1.189 1.00 0.00 C ATOM 510 O ALA A 34 3.884 -5.850 -0.681 1.00 0.00 O ATOM 511 CB ALA A 34 1.309 -4.687 0.293 1.00 0.00 C ATOM 0 H ALA A 34 1.564 -6.835 -1.463 1.00 0.00 H new ATOM 0 HA ALA A 34 1.489 -3.879 -1.667 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.757 -3.816 0.771 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.224 -4.588 0.303 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.596 -5.587 0.836 1.00 0.00 H new ATOM 517 N PHE A 35 3.966 -3.922 -1.805 1.00 0.00 N ATOM 518 CA PHE A 35 5.405 -4.004 -2.001 1.00 0.00 C ATOM 519 C PHE A 35 6.069 -2.641 -1.873 1.00 0.00 C ATOM 520 O PHE A 35 5.411 -1.601 -1.945 1.00 0.00 O ATOM 521 CB PHE A 35 5.724 -4.626 -3.368 1.00 0.00 C ATOM 522 CG PHE A 35 5.125 -3.891 -4.538 1.00 0.00 C ATOM 523 CD1 PHE A 35 3.811 -4.121 -4.920 1.00 0.00 C ATOM 524 CD2 PHE A 35 5.875 -2.974 -5.255 1.00 0.00 C ATOM 525 CE1 PHE A 35 3.259 -3.449 -5.993 1.00 0.00 C ATOM 526 CE2 PHE A 35 5.328 -2.299 -6.331 1.00 0.00 C ATOM 527 CZ PHE A 35 4.019 -2.537 -6.699 1.00 0.00 C ATOM 0 H PHE A 35 3.531 -3.077 -2.175 1.00 0.00 H new ATOM 0 HA PHE A 35 5.808 -4.644 -1.216 1.00 0.00 H new ATOM 0 HB2 PHE A 35 6.806 -4.664 -3.493 1.00 0.00 H new ATOM 0 HB3 PHE A 35 5.366 -5.655 -3.378 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.213 -4.834 -4.372 1.00 0.00 H new ATOM 0 HD2 PHE A 35 6.899 -2.784 -4.971 1.00 0.00 H new ATOM 0 HE1 PHE A 35 2.235 -3.636 -6.280 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.924 -1.587 -6.882 1.00 0.00 H new ATOM 0 HZ PHE A 35 3.589 -2.010 -7.538 1.00 0.00 H new ATOM 537 N ALA A 36 7.377 -2.669 -1.670 1.00 0.00 N ATOM 538 CA ALA A 36 8.179 -1.463 -1.572 1.00 0.00 C ATOM 539 C ALA A 36 9.477 -1.658 -2.344 1.00 0.00 C ATOM 540 O ALA A 36 9.949 -2.787 -2.474 1.00 0.00 O ATOM 541 CB ALA A 36 8.465 -1.138 -0.114 1.00 0.00 C ATOM 0 H ALA A 36 7.912 -3.532 -1.569 1.00 0.00 H new ATOM 0 HA ALA A 36 7.631 -0.626 -2.004 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.067 -0.231 -0.055 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.525 -0.984 0.416 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.008 -1.965 0.343 1.00 0.00 H new ATOM 547 N PRO A 37 10.074 -0.572 -2.866 1.00 0.00 N ATOM 548 CA PRO A 37 11.302 -0.649 -3.666 1.00 0.00 C ATOM 549 C PRO A 37 12.450 -1.316 -2.914 1.00 0.00 C ATOM 550 O PRO A 37 13.139 -2.180 -3.451 1.00 0.00 O ATOM 551 CB PRO A 37 11.642 0.817 -3.965 1.00 0.00 C ATOM 552 CG PRO A 37 10.837 1.617 -2.998 1.00 0.00 C ATOM 553 CD PRO A 37 9.600 0.813 -2.727 1.00 0.00 C ATOM 0 HA PRO A 37 11.156 -1.255 -4.560 1.00 0.00 H new ATOM 0 HB2 PRO A 37 12.708 1.006 -3.839 1.00 0.00 H new ATOM 0 HB3 PRO A 37 11.391 1.076 -4.994 1.00 0.00 H new ATOM 0 HG2 PRO A 37 11.395 1.796 -2.079 1.00 0.00 H new ATOM 0 HG3 PRO A 37 10.585 2.593 -3.413 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.202 1.006 -1.731 1.00 0.00 H new ATOM 0 HD3 PRO A 37 8.805 1.042 -3.437 1.00 0.00 H new ATOM 561 N GLU A 38 12.631 -0.925 -1.661 1.00 0.00 N ATOM 562 CA GLU A 38 13.721 -1.440 -0.841 1.00 0.00 C ATOM 563 C GLU A 38 13.235 -2.576 0.057 1.00 0.00 C ATOM 564 O GLU A 38 13.839 -2.869 1.088 1.00 0.00 O ATOM 565 CB GLU A 38 14.306 -0.312 0.008 1.00 0.00 C ATOM 566 CG GLU A 38 14.864 0.837 -0.816 1.00 0.00 C ATOM 567 CD GLU A 38 15.282 2.016 0.036 1.00 0.00 C ATOM 568 OE1 GLU A 38 16.444 2.049 0.494 1.00 0.00 O ATOM 569 OE2 GLU A 38 14.450 2.917 0.250 1.00 0.00 O ATOM 0 H GLU A 38 12.033 -0.248 -1.186 1.00 0.00 H new ATOM 0 HA GLU A 38 14.495 -1.834 -1.500 1.00 0.00 H new ATOM 0 HB2 GLU A 38 13.532 0.070 0.674 1.00 0.00 H new ATOM 0 HB3 GLU A 38 15.098 -0.715 0.639 1.00 0.00 H new ATOM 0 HG2 GLU A 38 15.722 0.485 -1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 38 14.112 1.162 -1.535 1.00 0.00 H new ATOM 576 N GLY A 39 12.149 -3.221 -0.347 1.00 0.00 N ATOM 577 CA GLY A 39 11.591 -4.296 0.446 1.00 0.00 C ATOM 578 C GLY A 39 11.133 -5.461 -0.409 1.00 0.00 C ATOM 579 O GLY A 39 11.422 -5.502 -1.607 1.00 0.00 O ATOM 0 H GLY A 39 11.645 -3.018 -1.210 1.00 0.00 H new ATOM 0 HA2 GLY A 39 12.337 -4.643 1.160 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.748 -3.919 1.024 1.00 0.00 H new ATOM 583 N PRO A 40 10.431 -6.434 0.184 1.00 0.00 N ATOM 584 CA PRO A 40 9.897 -7.578 -0.541 1.00 0.00 C ATOM 585 C PRO A 40 8.488 -7.321 -1.074 1.00 0.00 C ATOM 586 O PRO A 40 8.007 -6.184 -1.070 1.00 0.00 O ATOM 587 CB PRO A 40 9.875 -8.657 0.536 1.00 0.00 C ATOM 588 CG PRO A 40 9.598 -7.921 1.808 1.00 0.00 C ATOM 589 CD PRO A 40 10.111 -6.509 1.621 1.00 0.00 C ATOM 0 HA PRO A 40 10.484 -7.832 -1.423 1.00 0.00 H new ATOM 0 HB2 PRO A 40 9.105 -9.402 0.334 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.826 -9.187 0.585 1.00 0.00 H new ATOM 0 HG2 PRO A 40 8.530 -7.918 2.027 1.00 0.00 H new ATOM 0 HG3 PRO A 40 10.095 -8.404 2.649 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.360 -5.771 1.902 1.00 0.00 H new ATOM 0 HD3 PRO A 40 10.990 -6.319 2.236 1.00 0.00 H new ATOM 597 N VAL A 41 7.837 -8.380 -1.534 1.00 0.00 N ATOM 598 CA VAL A 41 6.461 -8.292 -1.998 1.00 0.00 C ATOM 599 C VAL A 41 5.557 -9.103 -1.078 1.00 0.00 C ATOM 600 O VAL A 41 5.714 -10.318 -0.952 1.00 0.00 O ATOM 601 CB VAL A 41 6.309 -8.809 -3.447 1.00 0.00 C ATOM 602 CG1 VAL A 41 4.872 -8.654 -3.926 1.00 0.00 C ATOM 603 CG2 VAL A 41 7.266 -8.085 -4.383 1.00 0.00 C ATOM 0 H VAL A 41 8.242 -9.314 -1.596 1.00 0.00 H new ATOM 0 HA VAL A 41 6.173 -7.241 -1.982 1.00 0.00 H new ATOM 0 HB VAL A 41 6.561 -9.869 -3.456 1.00 0.00 H new ATOM 0 HG11 VAL A 41 4.787 -9.024 -4.948 1.00 0.00 H new ATOM 0 HG12 VAL A 41 4.208 -9.226 -3.277 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.590 -7.601 -3.897 1.00 0.00 H new ATOM 0 HG21 VAL A 41 7.141 -8.465 -5.397 1.00 0.00 H new ATOM 0 HG22 VAL A 41 7.051 -7.016 -4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 41 8.292 -8.254 -4.056 1.00 0.00 H new ATOM 613 N ALA A 42 4.623 -8.428 -0.428 1.00 0.00 N ATOM 614 CA ALA A 42 3.710 -9.079 0.491 1.00 0.00 C ATOM 615 C ALA A 42 2.445 -9.501 -0.236 1.00 0.00 C ATOM 616 O ALA A 42 1.772 -8.678 -0.865 1.00 0.00 O ATOM 617 CB ALA A 42 3.376 -8.158 1.657 1.00 0.00 C ATOM 0 H ALA A 42 4.479 -7.423 -0.522 1.00 0.00 H new ATOM 0 HA ALA A 42 4.195 -9.970 0.889 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.690 -8.664 2.336 1.00 0.00 H new ATOM 0 HB2 ALA A 42 4.291 -7.901 2.191 1.00 0.00 H new ATOM 0 HB3 ALA A 42 2.908 -7.249 1.280 1.00 0.00 H new ATOM 623 N SER A 43 2.141 -10.785 -0.169 1.00 0.00 N ATOM 624 CA SER A 43 0.954 -11.321 -0.804 1.00 0.00 C ATOM 625 C SER A 43 -0.274 -10.993 0.040 1.00 0.00 C ATOM 626 O SER A 43 -0.417 -11.478 1.162 1.00 0.00 O ATOM 627 CB SER A 43 1.097 -12.833 -0.988 1.00 0.00 C ATOM 628 OG SER A 43 0.085 -13.350 -1.833 1.00 0.00 O ATOM 0 H SER A 43 2.705 -11.478 0.323 1.00 0.00 H new ATOM 0 HA SER A 43 0.832 -10.866 -1.787 1.00 0.00 H new ATOM 0 HB2 SER A 43 2.076 -13.058 -1.411 1.00 0.00 H new ATOM 0 HB3 SER A 43 1.048 -13.325 -0.017 1.00 0.00 H new ATOM 0 HG SER A 43 -0.795 -13.154 -1.448 1.00 0.00 H new ATOM 634 N TRP A 44 -1.144 -10.151 -0.497 1.00 0.00 N ATOM 635 CA TRP A 44 -2.331 -9.724 0.221 1.00 0.00 C ATOM 636 C TRP A 44 -3.549 -10.533 -0.206 1.00 0.00 C ATOM 637 O TRP A 44 -3.957 -10.500 -1.365 1.00 0.00 O ATOM 638 CB TRP A 44 -2.586 -8.232 -0.011 1.00 0.00 C ATOM 639 CG TRP A 44 -2.145 -7.359 1.125 1.00 0.00 C ATOM 640 CD1 TRP A 44 -1.136 -7.603 2.011 1.00 0.00 C ATOM 641 CD2 TRP A 44 -2.706 -6.093 1.493 1.00 0.00 C ATOM 642 NE1 TRP A 44 -1.045 -6.572 2.916 1.00 0.00 N ATOM 643 CE2 TRP A 44 -1.995 -5.631 2.615 1.00 0.00 C ATOM 644 CE3 TRP A 44 -3.742 -5.305 0.981 1.00 0.00 C ATOM 645 CZ2 TRP A 44 -2.290 -4.420 3.236 1.00 0.00 C ATOM 646 CZ3 TRP A 44 -4.032 -4.103 1.597 1.00 0.00 C ATOM 647 CH2 TRP A 44 -3.307 -3.669 2.714 1.00 0.00 C ATOM 0 H TRP A 44 -1.048 -9.750 -1.430 1.00 0.00 H new ATOM 0 HA TRP A 44 -2.161 -9.895 1.284 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -2.068 -7.921 -0.918 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -3.651 -8.077 -0.183 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -0.502 -8.477 2.002 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -0.379 -6.516 3.686 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.305 -5.631 0.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.735 -4.085 4.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -4.831 -3.488 1.211 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -3.556 -2.723 3.172 1.00 0.00 H new ATOM 658 N PRO A 45 -4.151 -11.272 0.735 1.00 0.00 N ATOM 659 CA PRO A 45 -5.374 -12.031 0.486 1.00 0.00 C ATOM 660 C PRO A 45 -6.616 -11.151 0.606 1.00 0.00 C ATOM 661 O PRO A 45 -7.719 -11.632 0.876 1.00 0.00 O ATOM 662 CB PRO A 45 -5.346 -13.081 1.594 1.00 0.00 C ATOM 663 CG PRO A 45 -4.658 -12.406 2.731 1.00 0.00 C ATOM 664 CD PRO A 45 -3.676 -11.434 2.124 1.00 0.00 C ATOM 0 HA PRO A 45 -5.417 -12.452 -0.519 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.353 -13.394 1.869 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.808 -13.976 1.280 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -5.376 -11.886 3.365 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -4.145 -13.133 3.360 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -3.672 -10.484 2.658 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.658 -11.822 2.156 1.00 0.00 H new ATOM 672 N VAL A 46 -6.425 -9.860 0.382 1.00 0.00 N ATOM 673 CA VAL A 46 -7.489 -8.881 0.525 1.00 0.00 C ATOM 674 C VAL A 46 -8.290 -8.780 -0.766 1.00 0.00 C ATOM 675 O VAL A 46 -7.740 -8.506 -1.831 1.00 0.00 O ATOM 676 CB VAL A 46 -6.914 -7.495 0.889 1.00 0.00 C ATOM 677 CG1 VAL A 46 -8.017 -6.458 1.017 1.00 0.00 C ATOM 678 CG2 VAL A 46 -6.113 -7.582 2.178 1.00 0.00 C ATOM 0 H VAL A 46 -5.530 -9.463 0.097 1.00 0.00 H new ATOM 0 HA VAL A 46 -8.145 -9.210 1.331 1.00 0.00 H new ATOM 0 HB VAL A 46 -6.252 -7.180 0.082 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.581 -5.493 1.274 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -8.550 -6.375 0.070 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -8.713 -6.761 1.799 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -5.712 -6.599 2.425 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.760 -7.923 2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.291 -8.286 2.049 1.00 0.00 H new ATOM 688 N GLN A 47 -9.586 -9.019 -0.663 1.00 0.00 N ATOM 689 CA GLN A 47 -10.455 -9.018 -1.826 1.00 0.00 C ATOM 690 C GLN A 47 -11.071 -7.643 -2.034 1.00 0.00 C ATOM 691 O GLN A 47 -11.199 -7.172 -3.164 1.00 0.00 O ATOM 692 CB GLN A 47 -11.547 -10.071 -1.653 1.00 0.00 C ATOM 693 CG GLN A 47 -10.988 -11.465 -1.443 1.00 0.00 C ATOM 694 CD GLN A 47 -12.048 -12.475 -1.063 1.00 0.00 C ATOM 695 OE1 GLN A 47 -13.054 -12.142 -0.435 1.00 0.00 O ATOM 696 NE2 GLN A 47 -11.825 -13.722 -1.434 1.00 0.00 N ATOM 0 H GLN A 47 -10.061 -9.217 0.218 1.00 0.00 H new ATOM 0 HA GLN A 47 -9.863 -9.260 -2.709 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -12.173 -9.803 -0.802 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -12.189 -10.070 -2.534 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -10.492 -11.793 -2.356 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -10.228 -11.432 -0.662 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -10.979 -13.956 -1.953 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -12.499 -14.452 -1.202 1.00 0.00 H new ATOM 705 N ARG A 48 -11.451 -7.008 -0.935 1.00 0.00 N ATOM 706 CA ARG A 48 -12.035 -5.677 -0.983 1.00 0.00 C ATOM 707 C ARG A 48 -11.495 -4.830 0.164 1.00 0.00 C ATOM 708 O ARG A 48 -11.039 -5.370 1.171 1.00 0.00 O ATOM 709 CB ARG A 48 -13.565 -5.760 -0.922 1.00 0.00 C ATOM 710 CG ARG A 48 -14.184 -6.367 -2.172 1.00 0.00 C ATOM 711 CD ARG A 48 -15.696 -6.440 -2.077 1.00 0.00 C ATOM 712 NE ARG A 48 -16.287 -7.004 -3.290 1.00 0.00 N ATOM 713 CZ ARG A 48 -17.485 -7.581 -3.334 1.00 0.00 C ATOM 714 NH1 ARG A 48 -18.224 -7.663 -2.238 1.00 0.00 N ATOM 715 NH2 ARG A 48 -17.949 -8.069 -4.478 1.00 0.00 N ATOM 0 H ARG A 48 -11.365 -7.396 0.004 1.00 0.00 H new ATOM 0 HA ARG A 48 -11.759 -5.204 -1.925 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -13.856 -6.354 -0.056 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -13.971 -4.759 -0.773 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -13.903 -5.772 -3.041 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -13.781 -7.368 -2.327 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -15.978 -7.049 -1.218 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -16.099 -5.442 -1.906 1.00 0.00 H new ATOM 0 HE ARG A 48 -15.748 -6.952 -4.155 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -17.875 -7.283 -1.358 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -19.142 -8.106 -2.274 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -17.387 -8.002 -5.326 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -18.868 -8.511 -4.509 1.00 0.00 H new ATOM 729 N PRO A 49 -11.541 -3.492 0.027 1.00 0.00 N ATOM 730 CA PRO A 49 -11.014 -2.558 1.038 1.00 0.00 C ATOM 731 C PRO A 49 -11.663 -2.723 2.415 1.00 0.00 C ATOM 732 O PRO A 49 -11.182 -2.172 3.404 1.00 0.00 O ATOM 733 CB PRO A 49 -11.335 -1.172 0.462 1.00 0.00 C ATOM 734 CG PRO A 49 -12.363 -1.410 -0.591 1.00 0.00 C ATOM 735 CD PRO A 49 -12.087 -2.778 -1.136 1.00 0.00 C ATOM 0 HA PRO A 49 -9.952 -2.731 1.212 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -11.712 -0.503 1.235 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -10.444 -0.705 0.043 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.369 -1.351 -0.175 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.299 -0.657 -1.376 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.993 -3.253 -1.513 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.376 -2.748 -1.962 1.00 0.00 H new ATOM 743 N ALA A 50 -12.749 -3.482 2.474 1.00 0.00 N ATOM 744 CA ALA A 50 -13.433 -3.745 3.733 1.00 0.00 C ATOM 745 C ALA A 50 -12.636 -4.719 4.599 1.00 0.00 C ATOM 746 O ALA A 50 -12.801 -4.761 5.818 1.00 0.00 O ATOM 747 CB ALA A 50 -14.828 -4.293 3.465 1.00 0.00 C ATOM 0 H ALA A 50 -13.176 -3.928 1.662 1.00 0.00 H new ATOM 0 HA ALA A 50 -13.519 -2.805 4.278 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -15.331 -4.486 4.412 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -15.401 -3.564 2.892 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -14.752 -5.221 2.899 1.00 0.00 H new ATOM 753 N ASP A 51 -11.757 -5.488 3.963 1.00 0.00 N ATOM 754 CA ASP A 51 -10.965 -6.495 4.666 1.00 0.00 C ATOM 755 C ASP A 51 -9.696 -5.889 5.247 1.00 0.00 C ATOM 756 O ASP A 51 -8.943 -6.561 5.951 1.00 0.00 O ATOM 757 CB ASP A 51 -10.580 -7.646 3.729 1.00 0.00 C ATOM 758 CG ASP A 51 -11.770 -8.385 3.158 1.00 0.00 C ATOM 759 OD1 ASP A 51 -12.598 -8.891 3.943 1.00 0.00 O ATOM 760 OD2 ASP A 51 -11.866 -8.496 1.914 1.00 0.00 O ATOM 0 H ASP A 51 -11.574 -5.434 2.961 1.00 0.00 H new ATOM 0 HA ASP A 51 -11.585 -6.879 5.476 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -9.980 -7.251 2.909 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -9.951 -8.351 4.273 1.00 0.00 H new ATOM 765 N ILE A 52 -9.458 -4.620 4.947 1.00 0.00 N ATOM 766 CA ILE A 52 -8.235 -3.953 5.372 1.00 0.00 C ATOM 767 C ILE A 52 -8.275 -3.634 6.865 1.00 0.00 C ATOM 768 O ILE A 52 -9.210 -2.999 7.352 1.00 0.00 O ATOM 769 CB ILE A 52 -7.993 -2.654 4.569 1.00 0.00 C ATOM 770 CG1 ILE A 52 -7.852 -2.976 3.078 1.00 0.00 C ATOM 771 CG2 ILE A 52 -6.754 -1.927 5.079 1.00 0.00 C ATOM 772 CD1 ILE A 52 -7.656 -1.752 2.209 1.00 0.00 C ATOM 0 H ILE A 52 -10.096 -4.031 4.411 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.411 -4.640 5.179 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.851 -1.996 4.706 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -7.006 -3.649 2.939 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.742 -3.509 2.744 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.603 -1.016 4.500 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.889 -1.671 6.130 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.883 -2.574 4.972 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.564 -2.057 1.167 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.513 -1.087 2.318 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.750 -1.229 2.516 1.00 0.00 H new ATOM 784 N THR A 53 -7.259 -4.091 7.582 1.00 0.00 N ATOM 785 CA THR A 53 -7.147 -3.828 9.005 1.00 0.00 C ATOM 786 C THR A 53 -5.685 -3.562 9.376 1.00 0.00 C ATOM 787 O THR A 53 -4.791 -3.691 8.533 1.00 0.00 O ATOM 788 CB THR A 53 -7.712 -5.000 9.843 1.00 0.00 C ATOM 789 OG1 THR A 53 -7.800 -4.626 11.224 1.00 0.00 O ATOM 790 CG2 THR A 53 -6.845 -6.246 9.704 1.00 0.00 C ATOM 0 H THR A 53 -6.497 -4.649 7.197 1.00 0.00 H new ATOM 0 HA THR A 53 -7.740 -2.942 9.233 1.00 0.00 H new ATOM 0 HB THR A 53 -8.708 -5.229 9.465 1.00 0.00 H new ATOM 0 HG1 THR A 53 -8.160 -5.375 11.743 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.267 -7.052 10.304 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.812 -6.551 8.658 1.00 0.00 H new ATOM 0 HG23 THR A 53 -5.835 -6.027 10.050 1.00 0.00 H new ATOM 798 N ALA A 54 -5.452 -3.211 10.638 1.00 0.00 N ATOM 799 CA ALA A 54 -4.131 -2.802 11.113 1.00 0.00 C ATOM 800 C ALA A 54 -3.067 -3.871 10.878 1.00 0.00 C ATOM 801 O ALA A 54 -1.969 -3.566 10.416 1.00 0.00 O ATOM 802 CB ALA A 54 -4.198 -2.456 12.590 1.00 0.00 C ATOM 0 H ALA A 54 -6.172 -3.202 11.360 1.00 0.00 H new ATOM 0 HA ALA A 54 -3.839 -1.924 10.537 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -3.211 -2.152 12.938 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -4.903 -1.639 12.741 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -4.528 -3.329 13.153 1.00 0.00 H new ATOM 808 N SER A 55 -3.399 -5.114 11.204 1.00 0.00 N ATOM 809 CA SER A 55 -2.460 -6.224 11.085 1.00 0.00 C ATOM 810 C SER A 55 -1.918 -6.347 9.660 1.00 0.00 C ATOM 811 O SER A 55 -0.714 -6.512 9.452 1.00 0.00 O ATOM 812 CB SER A 55 -3.156 -7.520 11.501 1.00 0.00 C ATOM 813 OG SER A 55 -3.831 -7.350 12.737 1.00 0.00 O ATOM 0 H SER A 55 -4.319 -5.381 11.556 1.00 0.00 H new ATOM 0 HA SER A 55 -1.612 -6.034 11.743 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.866 -7.821 10.731 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.422 -8.321 11.588 1.00 0.00 H new ATOM 0 HG SER A 55 -4.272 -8.189 12.987 1.00 0.00 H new ATOM 819 N LEU A 56 -2.812 -6.236 8.684 1.00 0.00 N ATOM 820 CA LEU A 56 -2.432 -6.348 7.281 1.00 0.00 C ATOM 821 C LEU A 56 -1.563 -5.169 6.861 1.00 0.00 C ATOM 822 O LEU A 56 -0.598 -5.332 6.116 1.00 0.00 O ATOM 823 CB LEU A 56 -3.681 -6.418 6.399 1.00 0.00 C ATOM 824 CG LEU A 56 -4.584 -7.628 6.643 1.00 0.00 C ATOM 825 CD1 LEU A 56 -5.846 -7.524 5.807 1.00 0.00 C ATOM 826 CD2 LEU A 56 -3.845 -8.919 6.328 1.00 0.00 C ATOM 0 H LEU A 56 -3.806 -6.068 8.839 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.855 -7.264 7.155 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.266 -5.511 6.553 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.369 -6.423 5.355 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.865 -7.640 7.696 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.478 -8.393 5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.388 -6.617 6.077 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -5.581 -7.487 4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.504 -9.769 6.508 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.535 -8.915 5.283 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.966 -9.000 6.967 1.00 0.00 H new ATOM 838 N LEU A 57 -1.905 -3.988 7.360 1.00 0.00 N ATOM 839 CA LEU A 57 -1.173 -2.774 7.028 1.00 0.00 C ATOM 840 C LEU A 57 0.248 -2.820 7.579 1.00 0.00 C ATOM 841 O LEU A 57 1.194 -2.401 6.913 1.00 0.00 O ATOM 842 CB LEU A 57 -1.906 -1.548 7.569 1.00 0.00 C ATOM 843 CG LEU A 57 -3.287 -1.297 6.961 1.00 0.00 C ATOM 844 CD1 LEU A 57 -3.977 -0.140 7.665 1.00 0.00 C ATOM 845 CD2 LEU A 57 -3.169 -1.018 5.470 1.00 0.00 C ATOM 0 H LEU A 57 -2.688 -3.846 7.998 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.115 -2.703 5.942 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.015 -1.656 8.648 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.286 -0.668 7.398 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.892 -2.193 7.098 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.958 0.024 7.219 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.094 -0.375 8.723 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.375 0.762 7.558 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.161 -0.842 5.053 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.547 -0.137 5.313 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.714 -1.876 4.974 1.00 0.00 H new ATOM 857 N GLN A 58 0.394 -3.337 8.794 1.00 0.00 N ATOM 858 CA GLN A 58 1.709 -3.488 9.403 1.00 0.00 C ATOM 859 C GLN A 58 2.578 -4.421 8.569 1.00 0.00 C ATOM 860 O GLN A 58 3.733 -4.113 8.275 1.00 0.00 O ATOM 861 CB GLN A 58 1.590 -4.025 10.830 1.00 0.00 C ATOM 862 CG GLN A 58 1.059 -3.008 11.825 1.00 0.00 C ATOM 863 CD GLN A 58 0.943 -3.574 13.226 1.00 0.00 C ATOM 864 OE1 GLN A 58 0.684 -4.763 13.412 1.00 0.00 O ATOM 865 NE2 GLN A 58 1.154 -2.731 14.224 1.00 0.00 N ATOM 0 H GLN A 58 -0.381 -3.658 9.375 1.00 0.00 H new ATOM 0 HA GLN A 58 2.178 -2.505 9.440 1.00 0.00 H new ATOM 0 HB2 GLN A 58 0.933 -4.894 10.827 1.00 0.00 H new ATOM 0 HB3 GLN A 58 2.570 -4.367 11.162 1.00 0.00 H new ATOM 0 HG2 GLN A 58 1.719 -2.141 11.840 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.081 -2.658 11.495 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.366 -1.753 14.029 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.105 -3.060 15.188 1.00 0.00 H new ATOM 874 N GLN A 59 2.009 -5.554 8.179 1.00 0.00 N ATOM 875 CA GLN A 59 2.721 -6.524 7.359 1.00 0.00 C ATOM 876 C GLN A 59 3.079 -5.930 6.000 1.00 0.00 C ATOM 877 O GLN A 59 4.153 -6.199 5.461 1.00 0.00 O ATOM 878 CB GLN A 59 1.884 -7.788 7.176 1.00 0.00 C ATOM 879 CG GLN A 59 1.686 -8.575 8.461 1.00 0.00 C ATOM 880 CD GLN A 59 0.860 -9.825 8.252 1.00 0.00 C ATOM 881 OE1 GLN A 59 -0.015 -9.868 7.386 1.00 0.00 O ATOM 882 NE2 GLN A 59 1.129 -10.852 9.040 1.00 0.00 N ATOM 0 H GLN A 59 1.055 -5.824 8.418 1.00 0.00 H new ATOM 0 HA GLN A 59 3.645 -6.786 7.874 1.00 0.00 H new ATOM 0 HB2 GLN A 59 0.909 -7.513 6.773 1.00 0.00 H new ATOM 0 HB3 GLN A 59 2.365 -8.429 6.437 1.00 0.00 H new ATOM 0 HG2 GLN A 59 2.659 -8.850 8.869 1.00 0.00 H new ATOM 0 HG3 GLN A 59 1.198 -7.940 9.201 1.00 0.00 H new ATOM 0 HE21 GLN A 59 1.862 -10.776 9.745 1.00 0.00 H new ATOM 0 HE22 GLN A 59 0.604 -11.721 8.943 1.00 0.00 H new ATOM 891 N ALA A 60 2.179 -5.110 5.465 1.00 0.00 N ATOM 892 CA ALA A 60 2.397 -4.451 4.182 1.00 0.00 C ATOM 893 C ALA A 60 3.584 -3.498 4.251 1.00 0.00 C ATOM 894 O ALA A 60 4.307 -3.321 3.276 1.00 0.00 O ATOM 895 CB ALA A 60 1.146 -3.698 3.755 1.00 0.00 C ATOM 0 H ALA A 60 1.286 -4.885 5.904 1.00 0.00 H new ATOM 0 HA ALA A 60 2.619 -5.220 3.442 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.324 -3.211 2.796 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.315 -4.397 3.659 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.901 -2.945 4.504 1.00 0.00 H new ATOM 901 N ALA A 61 3.788 -2.903 5.423 1.00 0.00 N ATOM 902 CA ALA A 61 4.877 -1.954 5.628 1.00 0.00 C ATOM 903 C ALA A 61 6.216 -2.671 5.800 1.00 0.00 C ATOM 904 O ALA A 61 7.236 -2.045 6.089 1.00 0.00 O ATOM 905 CB ALA A 61 4.587 -1.070 6.834 1.00 0.00 C ATOM 0 H ALA A 61 3.210 -3.063 6.248 1.00 0.00 H new ATOM 0 HA ALA A 61 4.948 -1.327 4.739 1.00 0.00 H new ATOM 0 HB1 ALA A 61 5.408 -0.367 6.975 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.662 -0.519 6.667 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.484 -1.691 7.724 1.00 0.00 H new ATOM 911 N GLY A 62 6.206 -3.986 5.623 1.00 0.00 N ATOM 912 CA GLY A 62 7.430 -4.757 5.708 1.00 0.00 C ATOM 913 C GLY A 62 7.560 -5.489 7.024 1.00 0.00 C ATOM 914 O GLY A 62 8.447 -6.323 7.193 1.00 0.00 O ATOM 0 H GLY A 62 5.369 -4.533 5.422 1.00 0.00 H new ATOM 0 HA2 GLY A 62 7.460 -5.477 4.890 1.00 0.00 H new ATOM 0 HA3 GLY A 62 8.284 -4.093 5.579 1.00 0.00 H new ATOM 918 N LEU A 63 6.652 -5.208 7.949 1.00 0.00 N ATOM 919 CA LEU A 63 6.708 -5.794 9.286 1.00 0.00 C ATOM 920 C LEU A 63 6.097 -7.196 9.300 1.00 0.00 C ATOM 921 O LEU A 63 5.631 -7.675 10.335 1.00 0.00 O ATOM 922 CB LEU A 63 5.974 -4.892 10.281 1.00 0.00 C ATOM 923 CG LEU A 63 6.494 -3.453 10.357 1.00 0.00 C ATOM 924 CD1 LEU A 63 5.615 -2.615 11.269 1.00 0.00 C ATOM 925 CD2 LEU A 63 7.936 -3.430 10.839 1.00 0.00 C ATOM 0 H LEU A 63 5.865 -4.576 7.800 1.00 0.00 H new ATOM 0 HA LEU A 63 7.755 -5.878 9.578 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.917 -4.867 10.014 1.00 0.00 H new ATOM 0 HB3 LEU A 63 6.042 -5.340 11.273 1.00 0.00 H new ATOM 0 HG LEU A 63 6.459 -3.023 9.356 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.000 -1.596 11.310 1.00 0.00 H new ATOM 0 HD12 LEU A 63 4.596 -2.602 10.881 1.00 0.00 H new ATOM 0 HD13 LEU A 63 5.617 -3.044 12.271 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.287 -2.399 10.886 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.996 -3.880 11.830 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.560 -3.995 10.146 1.00 0.00 H new ATOM 1274 N ALA A 88 11.573 1.582 9.515 1.00 0.00 N ATOM 1275 CA ALA A 88 10.334 1.454 8.764 1.00 0.00 C ATOM 1276 C ALA A 88 10.219 2.552 7.714 1.00 0.00 C ATOM 1277 O ALA A 88 10.698 3.670 7.923 1.00 0.00 O ATOM 1278 CB ALA A 88 9.143 1.492 9.711 1.00 0.00 C ATOM 0 HA ALA A 88 10.341 0.495 8.247 1.00 0.00 H new ATOM 0 HB1 ALA A 88 8.220 1.395 9.139 1.00 0.00 H new ATOM 0 HB2 ALA A 88 9.217 0.669 10.422 1.00 0.00 H new ATOM 0 HB3 ALA A 88 9.138 2.439 10.251 1.00 0.00 H new ATOM 1284 N PRO A 89 9.589 2.242 6.567 1.00 0.00 N ATOM 1285 CA PRO A 89 9.398 3.203 5.471 1.00 0.00 C ATOM 1286 C PRO A 89 8.672 4.470 5.917 1.00 0.00 C ATOM 1287 O PRO A 89 8.016 4.491 6.959 1.00 0.00 O ATOM 1288 CB PRO A 89 8.549 2.431 4.458 1.00 0.00 C ATOM 1289 CG PRO A 89 8.818 0.997 4.755 1.00 0.00 C ATOM 1290 CD PRO A 89 9.018 0.922 6.241 1.00 0.00 C ATOM 0 HA PRO A 89 10.351 3.551 5.073 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.490 2.666 4.567 1.00 0.00 H new ATOM 0 HB3 PRO A 89 8.827 2.683 3.435 1.00 0.00 H new ATOM 0 HG2 PRO A 89 7.985 0.369 4.440 1.00 0.00 H new ATOM 0 HG3 PRO A 89 9.702 0.646 4.222 1.00 0.00 H new ATOM 0 HD2 PRO A 89 8.079 0.748 6.766 1.00 0.00 H new ATOM 0 HD3 PRO A 89 9.692 0.111 6.517 1.00 0.00 H new ATOM 1298 N GLU A 90 8.778 5.514 5.108 1.00 0.00 N ATOM 1299 CA GLU A 90 8.221 6.811 5.454 1.00 0.00 C ATOM 1300 C GLU A 90 6.701 6.789 5.347 1.00 0.00 C ATOM 1301 O GLU A 90 5.997 7.199 6.270 1.00 0.00 O ATOM 1302 CB GLU A 90 8.782 7.896 4.530 1.00 0.00 C ATOM 1303 CG GLU A 90 10.294 7.848 4.367 1.00 0.00 C ATOM 1304 CD GLU A 90 11.044 8.025 5.672 1.00 0.00 C ATOM 1305 OE1 GLU A 90 11.236 9.183 6.102 1.00 0.00 O ATOM 1306 OE2 GLU A 90 11.460 7.011 6.267 1.00 0.00 O ATOM 0 H GLU A 90 9.248 5.486 4.203 1.00 0.00 H new ATOM 0 HA GLU A 90 8.501 7.035 6.483 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.318 7.799 3.549 1.00 0.00 H new ATOM 0 HB3 GLU A 90 8.500 8.874 4.921 1.00 0.00 H new ATOM 0 HG2 GLU A 90 10.574 6.893 3.922 1.00 0.00 H new ATOM 0 HG3 GLU A 90 10.602 8.628 3.670 1.00 0.00 H new ATOM 1313 N VAL A 91 6.199 6.298 4.219 1.00 0.00 N ATOM 1314 CA VAL A 91 4.762 6.295 3.975 1.00 0.00 C ATOM 1315 C VAL A 91 4.348 5.096 3.123 1.00 0.00 C ATOM 1316 O VAL A 91 5.106 4.643 2.265 1.00 0.00 O ATOM 1317 CB VAL A 91 4.309 7.613 3.289 1.00 0.00 C ATOM 1318 CG1 VAL A 91 4.957 7.778 1.921 1.00 0.00 C ATOM 1319 CG2 VAL A 91 2.791 7.683 3.173 1.00 0.00 C ATOM 0 H VAL A 91 6.760 5.900 3.466 1.00 0.00 H new ATOM 0 HA VAL A 91 4.269 6.218 4.944 1.00 0.00 H new ATOM 0 HB VAL A 91 4.640 8.437 3.921 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.619 8.710 1.468 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.041 7.801 2.032 1.00 0.00 H new ATOM 0 HG13 VAL A 91 4.676 6.941 1.282 1.00 0.00 H new ATOM 0 HG21 VAL A 91 2.506 8.617 2.689 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.432 6.842 2.579 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.348 7.640 4.168 1.00 0.00 H new ATOM 1329 N LEU A 92 3.161 4.564 3.387 1.00 0.00 N ATOM 1330 CA LEU A 92 2.597 3.515 2.552 1.00 0.00 C ATOM 1331 C LEU A 92 1.280 3.984 1.938 1.00 0.00 C ATOM 1332 O LEU A 92 0.419 4.540 2.624 1.00 0.00 O ATOM 1333 CB LEU A 92 2.389 2.199 3.327 1.00 0.00 C ATOM 1334 CG LEU A 92 1.297 2.199 4.407 1.00 0.00 C ATOM 1335 CD1 LEU A 92 0.822 0.778 4.669 1.00 0.00 C ATOM 1336 CD2 LEU A 92 1.809 2.816 5.699 1.00 0.00 C ATOM 0 H LEU A 92 2.572 4.842 4.172 1.00 0.00 H new ATOM 0 HA LEU A 92 3.315 3.310 1.758 1.00 0.00 H new ATOM 0 HB2 LEU A 92 2.156 1.414 2.608 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.334 1.929 3.799 1.00 0.00 H new ATOM 0 HG LEU A 92 0.462 2.799 4.045 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.048 0.789 5.436 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.416 0.355 3.750 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.661 0.171 5.009 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.016 2.804 6.447 1.00 0.00 H new ATOM 0 HD22 LEU A 92 2.661 2.242 6.064 1.00 0.00 H new ATOM 0 HD23 LEU A 92 2.117 3.845 5.514 1.00 0.00 H new ATOM 1348 N LEU A 93 1.148 3.778 0.640 1.00 0.00 N ATOM 1349 CA LEU A 93 -0.040 4.177 -0.093 1.00 0.00 C ATOM 1350 C LEU A 93 -0.975 2.989 -0.260 1.00 0.00 C ATOM 1351 O LEU A 93 -0.582 1.945 -0.787 1.00 0.00 O ATOM 1352 CB LEU A 93 0.349 4.726 -1.469 1.00 0.00 C ATOM 1353 CG LEU A 93 1.332 5.897 -1.450 1.00 0.00 C ATOM 1354 CD1 LEU A 93 1.708 6.292 -2.868 1.00 0.00 C ATOM 1355 CD2 LEU A 93 0.739 7.085 -0.705 1.00 0.00 C ATOM 0 H LEU A 93 1.861 3.330 0.065 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.552 4.957 0.470 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.784 3.917 -2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.557 5.042 -1.986 1.00 0.00 H new ATOM 0 HG LEU A 93 2.234 5.582 -0.925 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.408 7.127 -2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.174 5.444 -3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.812 6.589 -3.413 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.455 7.907 -0.703 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.179 7.404 -1.200 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.516 6.796 0.322 1.00 0.00 H new ATOM 1367 N VAL A 94 -2.202 3.144 0.202 1.00 0.00 N ATOM 1368 CA VAL A 94 -3.188 2.084 0.103 1.00 0.00 C ATOM 1369 C VAL A 94 -4.149 2.355 -1.046 1.00 0.00 C ATOM 1370 O VAL A 94 -4.964 3.277 -0.981 1.00 0.00 O ATOM 1371 CB VAL A 94 -3.989 1.929 1.414 1.00 0.00 C ATOM 1372 CG1 VAL A 94 -4.958 0.759 1.318 1.00 0.00 C ATOM 1373 CG2 VAL A 94 -3.051 1.754 2.600 1.00 0.00 C ATOM 0 H VAL A 94 -2.540 3.996 0.650 1.00 0.00 H new ATOM 0 HA VAL A 94 -2.648 1.156 -0.084 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.568 2.839 1.569 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -5.512 0.668 2.252 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -5.655 0.930 0.498 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -4.402 -0.160 1.135 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.636 1.647 3.514 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.441 0.863 2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.404 2.627 2.684 1.00 0.00 H new ATOM 1383 N GLY A 95 -4.027 1.562 -2.100 1.00 0.00 N ATOM 1384 CA GLY A 95 -4.932 1.662 -3.222 1.00 0.00 C ATOM 1385 C GLY A 95 -6.182 0.847 -2.983 1.00 0.00 C ATOM 1386 O GLY A 95 -6.139 -0.383 -3.004 1.00 0.00 O ATOM 0 H GLY A 95 -3.309 0.844 -2.197 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -5.200 2.706 -3.386 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -4.434 1.315 -4.127 1.00 0.00 H new ATOM 1390 N THR A 96 -7.290 1.531 -2.755 1.00 0.00 N ATOM 1391 CA THR A 96 -8.534 0.884 -2.364 1.00 0.00 C ATOM 1392 C THR A 96 -9.152 0.049 -3.490 1.00 0.00 C ATOM 1393 O THR A 96 -10.089 -0.720 -3.256 1.00 0.00 O ATOM 1394 CB THR A 96 -9.535 1.934 -1.870 1.00 0.00 C ATOM 1395 OG1 THR A 96 -9.415 3.124 -2.661 1.00 0.00 O ATOM 1396 CG2 THR A 96 -9.294 2.264 -0.405 1.00 0.00 C ATOM 0 H THR A 96 -7.355 2.546 -2.835 1.00 0.00 H new ATOM 0 HA THR A 96 -8.295 0.191 -1.557 1.00 0.00 H new ATOM 0 HB THR A 96 -10.541 1.527 -1.970 1.00 0.00 H new ATOM 0 HG1 THR A 96 -8.882 3.787 -2.175 1.00 0.00 H new ATOM 0 HG21 THR A 96 -10.016 3.011 -0.077 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.408 1.361 0.195 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.285 2.656 -0.282 1.00 0.00 H new ATOM 1404 N GLY A 97 -8.642 0.216 -4.705 1.00 0.00 N ATOM 1405 CA GLY A 97 -9.024 -0.648 -5.809 1.00 0.00 C ATOM 1406 C GLY A 97 -10.413 -0.376 -6.353 1.00 0.00 C ATOM 1407 O GLY A 97 -10.571 0.374 -7.316 1.00 0.00 O ATOM 0 H GLY A 97 -7.966 0.940 -4.947 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -8.300 -0.532 -6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -8.971 -1.686 -5.480 1.00 0.00 H new ATOM 1411 N ARG A 98 -11.418 -0.984 -5.726 1.00 0.00 N ATOM 1412 CA ARG A 98 -12.796 -0.925 -6.215 1.00 0.00 C ATOM 1413 C ARG A 98 -13.306 0.515 -6.235 1.00 0.00 C ATOM 1414 O ARG A 98 -13.998 0.926 -7.168 1.00 0.00 O ATOM 1415 CB ARG A 98 -13.695 -1.812 -5.348 1.00 0.00 C ATOM 1416 CG ARG A 98 -13.201 -3.250 -5.245 1.00 0.00 C ATOM 1417 CD ARG A 98 -13.233 -3.960 -6.592 1.00 0.00 C ATOM 1418 NE ARG A 98 -14.447 -4.758 -6.771 1.00 0.00 N ATOM 1419 CZ ARG A 98 -15.462 -4.418 -7.566 1.00 0.00 C ATOM 1420 NH1 ARG A 98 -15.413 -3.300 -8.276 1.00 0.00 N ATOM 1421 NH2 ARG A 98 -16.515 -5.218 -7.676 1.00 0.00 N ATOM 0 H ARG A 98 -11.303 -1.528 -4.871 1.00 0.00 H new ATOM 0 HA ARG A 98 -12.820 -1.298 -7.239 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -13.760 -1.384 -4.347 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -14.704 -1.810 -5.761 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -12.183 -3.257 -4.855 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -13.819 -3.796 -4.532 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -13.165 -3.222 -7.391 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -12.360 -4.606 -6.680 1.00 0.00 H new ATOM 0 HE ARG A 98 -14.522 -5.633 -6.253 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -14.595 -2.693 -8.216 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -16.193 -3.046 -8.882 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -16.548 -6.093 -7.152 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -17.292 -4.958 -8.284 1.00 0.00 H new ATOM 1435 N ARG A 99 -12.969 1.263 -5.191 1.00 0.00 N ATOM 1436 CA ARG A 99 -13.185 2.706 -5.154 1.00 0.00 C ATOM 1437 C ARG A 99 -12.522 3.269 -3.907 1.00 0.00 C ATOM 1438 O ARG A 99 -12.270 2.526 -2.953 1.00 0.00 O ATOM 1439 CB ARG A 99 -14.674 3.081 -5.178 1.00 0.00 C ATOM 1440 CG ARG A 99 -15.379 2.974 -3.835 1.00 0.00 C ATOM 1441 CD ARG A 99 -16.718 3.696 -3.870 1.00 0.00 C ATOM 1442 NE ARG A 99 -17.342 3.773 -2.550 1.00 0.00 N ATOM 1443 CZ ARG A 99 -17.293 4.855 -1.770 1.00 0.00 C ATOM 1444 NH1 ARG A 99 -16.606 5.924 -2.158 1.00 0.00 N ATOM 1445 NH2 ARG A 99 -17.928 4.869 -0.604 1.00 0.00 N ATOM 0 H ARG A 99 -12.538 0.887 -4.346 1.00 0.00 H new ATOM 0 HA ARG A 99 -12.741 3.137 -6.051 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -14.771 4.103 -5.543 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -15.185 2.437 -5.893 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -15.533 1.925 -3.582 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -14.750 3.401 -3.054 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -16.575 4.703 -4.261 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -17.389 3.180 -4.557 1.00 0.00 H new ATOM 0 HE ARG A 99 -17.843 2.954 -2.206 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -16.116 5.918 -3.052 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -16.569 6.751 -1.561 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -18.456 4.051 -0.301 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -17.888 5.698 -0.011 1.00 0.00 H new ATOM 1459 N GLN A 100 -12.235 4.564 -3.917 1.00 0.00 N ATOM 1460 CA GLN A 100 -11.547 5.205 -2.804 1.00 0.00 C ATOM 1461 C GLN A 100 -12.364 5.130 -1.516 1.00 0.00 C ATOM 1462 O GLN A 100 -13.582 5.313 -1.519 1.00 0.00 O ATOM 1463 CB GLN A 100 -11.226 6.665 -3.132 1.00 0.00 C ATOM 1464 CG GLN A 100 -10.466 7.379 -2.024 1.00 0.00 C ATOM 1465 CD GLN A 100 -10.176 8.828 -2.346 1.00 0.00 C ATOM 1466 OE1 GLN A 100 -10.005 9.200 -3.507 1.00 0.00 O ATOM 1467 NE2 GLN A 100 -10.125 9.658 -1.317 1.00 0.00 N ATOM 0 H GLN A 100 -12.469 5.193 -4.686 1.00 0.00 H new ATOM 0 HA GLN A 100 -10.615 4.662 -2.647 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -10.638 6.703 -4.049 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -12.156 7.199 -3.327 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -11.044 7.326 -1.102 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -9.526 6.858 -1.841 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -10.273 9.307 -0.371 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.938 10.649 -1.470 1.00 0.00 H new ATOM 1476 N HIS A 101 -11.676 4.839 -0.422 1.00 0.00 N ATOM 1477 CA HIS A 101 -12.282 4.821 0.901 1.00 0.00 C ATOM 1478 C HIS A 101 -11.361 5.512 1.889 1.00 0.00 C ATOM 1479 O HIS A 101 -10.183 5.715 1.603 1.00 0.00 O ATOM 1480 CB HIS A 101 -12.550 3.389 1.375 1.00 0.00 C ATOM 1481 CG HIS A 101 -13.677 2.713 0.664 1.00 0.00 C ATOM 1482 ND1 HIS A 101 -13.485 1.711 -0.255 1.00 0.00 N ATOM 1483 CD2 HIS A 101 -15.014 2.882 0.761 1.00 0.00 C ATOM 1484 CE1 HIS A 101 -14.657 1.290 -0.693 1.00 0.00 C ATOM 1485 NE2 HIS A 101 -15.605 1.984 -0.091 1.00 0.00 N ATOM 0 H HIS A 101 -10.682 4.609 -0.426 1.00 0.00 H new ATOM 0 HA HIS A 101 -13.236 5.346 0.843 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -11.644 2.798 1.242 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -12.766 3.406 2.443 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -15.524 3.594 1.393 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -14.814 0.509 -1.422 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -16.608 1.871 -0.235 1.00 0.00 H new ATOM 1494 N LEU A 102 -11.892 5.865 3.045 1.00 0.00 N ATOM 1495 CA LEU A 102 -11.099 6.517 4.069 1.00 0.00 C ATOM 1496 C LEU A 102 -10.820 5.557 5.216 1.00 0.00 C ATOM 1497 O LEU A 102 -11.726 5.181 5.960 1.00 0.00 O ATOM 1498 CB LEU A 102 -11.808 7.766 4.597 1.00 0.00 C ATOM 1499 CG LEU A 102 -11.027 8.554 5.653 1.00 0.00 C ATOM 1500 CD1 LEU A 102 -9.745 9.120 5.061 1.00 0.00 C ATOM 1501 CD2 LEU A 102 -11.886 9.666 6.233 1.00 0.00 C ATOM 0 H LEU A 102 -12.868 5.711 3.298 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.153 6.819 3.620 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -12.022 8.427 3.757 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -12.767 7.469 5.022 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.758 7.872 6.460 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -9.205 9.676 5.827 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.121 8.304 4.697 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -9.989 9.786 4.234 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -11.314 10.215 6.981 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.188 10.346 5.436 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -12.773 9.236 6.698 1.00 0.00 H new ATOM 1513 N LEU A 103 -9.568 5.147 5.337 1.00 0.00 N ATOM 1514 CA LEU A 103 -9.147 4.324 6.456 1.00 0.00 C ATOM 1515 C LEU A 103 -8.998 5.216 7.682 1.00 0.00 C ATOM 1516 O LEU A 103 -8.369 6.274 7.609 1.00 0.00 O ATOM 1517 CB LEU A 103 -7.833 3.609 6.131 1.00 0.00 C ATOM 1518 CG LEU A 103 -7.805 2.868 4.786 1.00 0.00 C ATOM 1519 CD1 LEU A 103 -6.484 2.138 4.613 1.00 0.00 C ATOM 1520 CD2 LEU A 103 -8.974 1.896 4.665 1.00 0.00 C ATOM 0 H LEU A 103 -8.826 5.371 4.674 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.894 3.556 6.656 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.027 4.343 6.140 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -7.621 2.894 6.926 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.904 3.608 3.991 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -6.479 1.617 3.655 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -5.665 2.857 4.640 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -6.359 1.415 5.419 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -8.926 1.387 3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.920 1.160 5.467 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -9.913 2.445 4.739 1.00 0.00 H new ATOM 1532 N GLY A 104 -9.566 4.793 8.801 1.00 0.00 N ATOM 1533 CA GLY A 104 -9.702 5.689 9.930 1.00 0.00 C ATOM 1534 C GLY A 104 -8.750 5.397 11.072 1.00 0.00 C ATOM 1535 O GLY A 104 -7.924 4.481 10.991 1.00 0.00 O ATOM 0 H GLY A 104 -9.933 3.853 8.947 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -9.540 6.712 9.589 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -10.725 5.635 10.302 1.00 0.00 H new ATOM 1539 N PRO A 105 -8.878 6.157 12.175 1.00 0.00 N ATOM 1540 CA PRO A 105 -7.955 6.100 13.319 1.00 0.00 C ATOM 1541 C PRO A 105 -8.100 4.830 14.155 1.00 0.00 C ATOM 1542 O PRO A 105 -7.465 4.691 15.202 1.00 0.00 O ATOM 1543 CB PRO A 105 -8.348 7.323 14.148 1.00 0.00 C ATOM 1544 CG PRO A 105 -9.782 7.552 13.825 1.00 0.00 C ATOM 1545 CD PRO A 105 -9.950 7.151 12.387 1.00 0.00 C ATOM 0 HA PRO A 105 -6.916 6.092 12.988 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -8.206 7.142 15.213 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -7.740 8.190 13.888 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -10.428 6.960 14.473 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -10.054 8.597 13.973 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -10.935 6.723 12.203 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -9.843 8.005 11.718 1.00 0.00 H new ATOM 1553 N GLU A 106 -8.958 3.927 13.716 1.00 0.00 N ATOM 1554 CA GLU A 106 -9.084 2.633 14.358 1.00 0.00 C ATOM 1555 C GLU A 106 -8.248 1.608 13.596 1.00 0.00 C ATOM 1556 O GLU A 106 -7.782 0.619 14.156 1.00 0.00 O ATOM 1557 CB GLU A 106 -10.553 2.202 14.403 1.00 0.00 C ATOM 1558 CG GLU A 106 -10.805 0.963 15.248 1.00 0.00 C ATOM 1559 CD GLU A 106 -10.399 1.155 16.694 1.00 0.00 C ATOM 1560 OE1 GLU A 106 -11.133 1.833 17.436 1.00 0.00 O ATOM 1561 OE2 GLU A 106 -9.345 0.623 17.098 1.00 0.00 O ATOM 0 H GLU A 106 -9.577 4.067 12.918 1.00 0.00 H new ATOM 0 HA GLU A 106 -8.719 2.701 15.383 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -11.151 3.025 14.794 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -10.898 2.013 13.386 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -11.863 0.705 15.202 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -10.253 0.122 14.828 1.00 0.00 H new ATOM 1568 N GLN A 107 -8.053 1.871 12.312 1.00 0.00 N ATOM 1569 CA GLN A 107 -7.355 0.946 11.430 1.00 0.00 C ATOM 1570 C GLN A 107 -5.881 1.310 11.292 1.00 0.00 C ATOM 1571 O GLN A 107 -5.004 0.472 11.484 1.00 0.00 O ATOM 1572 CB GLN A 107 -8.030 0.938 10.059 1.00 0.00 C ATOM 1573 CG GLN A 107 -9.468 0.444 10.098 1.00 0.00 C ATOM 1574 CD GLN A 107 -10.222 0.726 8.814 1.00 0.00 C ATOM 1575 OE1 GLN A 107 -9.960 1.716 8.131 1.00 0.00 O ATOM 1576 NE2 GLN A 107 -11.167 -0.139 8.480 1.00 0.00 N ATOM 0 H GLN A 107 -8.371 2.725 11.854 1.00 0.00 H new ATOM 0 HA GLN A 107 -7.408 -0.051 11.868 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.011 1.947 9.647 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -7.455 0.306 9.382 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -9.473 -0.629 10.289 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -9.988 0.918 10.931 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -11.352 -0.947 9.075 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -11.710 0.002 7.628 1.00 0.00 H new ATOM 1585 N VAL A 108 -5.611 2.569 10.977 1.00 0.00 N ATOM 1586 CA VAL A 108 -4.245 3.004 10.694 1.00 0.00 C ATOM 1587 C VAL A 108 -3.533 3.513 11.944 1.00 0.00 C ATOM 1588 O VAL A 108 -2.402 3.997 11.870 1.00 0.00 O ATOM 1589 CB VAL A 108 -4.219 4.105 9.612 1.00 0.00 C ATOM 1590 CG1 VAL A 108 -4.819 3.591 8.314 1.00 0.00 C ATOM 1591 CG2 VAL A 108 -4.952 5.352 10.088 1.00 0.00 C ATOM 0 H VAL A 108 -6.313 3.306 10.910 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.715 2.125 10.328 1.00 0.00 H new ATOM 0 HB VAL A 108 -3.180 4.376 9.427 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -4.792 4.381 7.563 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -4.244 2.735 7.961 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -5.852 3.288 8.485 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.920 6.113 9.308 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.990 5.102 10.308 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.472 5.735 10.989 1.00 0.00 H new ATOM 1601 N ARG A 109 -4.185 3.381 13.092 1.00 0.00 N ATOM 1602 CA ARG A 109 -3.645 3.898 14.348 1.00 0.00 C ATOM 1603 C ARG A 109 -2.287 3.273 14.703 1.00 0.00 C ATOM 1604 O ARG A 109 -1.335 4.004 14.966 1.00 0.00 O ATOM 1605 CB ARG A 109 -4.636 3.691 15.493 1.00 0.00 C ATOM 1606 CG ARG A 109 -4.220 4.369 16.788 1.00 0.00 C ATOM 1607 CD ARG A 109 -5.289 4.224 17.857 1.00 0.00 C ATOM 1608 NE ARG A 109 -5.469 2.836 18.277 1.00 0.00 N ATOM 1609 CZ ARG A 109 -6.587 2.139 18.081 1.00 0.00 C ATOM 1610 NH1 ARG A 109 -7.593 2.671 17.405 1.00 0.00 N ATOM 1611 NH2 ARG A 109 -6.698 0.905 18.549 1.00 0.00 N ATOM 0 H ARG A 109 -5.090 2.920 13.182 1.00 0.00 H new ATOM 0 HA ARG A 109 -3.485 4.967 14.204 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.612 4.071 15.191 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.752 2.622 15.673 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -3.286 3.935 17.144 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -4.030 5.426 16.602 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -5.020 4.831 18.722 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.234 4.612 17.477 1.00 0.00 H new ATOM 0 HE ARG A 109 -4.692 2.373 18.749 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -7.513 3.617 17.033 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -8.448 2.135 17.257 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -5.925 0.483 19.063 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -7.557 0.377 18.395 1.00 0.00 H new ATOM 1625 N PRO A 110 -2.162 1.924 14.722 1.00 0.00 N ATOM 1626 CA PRO A 110 -0.888 1.259 15.045 1.00 0.00 C ATOM 1627 C PRO A 110 0.271 1.723 14.162 1.00 0.00 C ATOM 1628 O PRO A 110 1.421 1.735 14.595 1.00 0.00 O ATOM 1629 CB PRO A 110 -1.190 -0.221 14.805 1.00 0.00 C ATOM 1630 CG PRO A 110 -2.653 -0.333 15.027 1.00 0.00 C ATOM 1631 CD PRO A 110 -3.233 0.935 14.475 1.00 0.00 C ATOM 0 HA PRO A 110 -0.564 1.486 16.061 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.916 -0.525 13.795 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.633 -0.858 15.492 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.062 -1.207 14.520 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.883 -0.443 16.087 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.463 0.845 13.413 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.160 1.209 14.980 1.00 0.00 H new ATOM 1639 N LEU A 111 -0.036 2.117 12.930 1.00 0.00 N ATOM 1640 CA LEU A 111 0.983 2.634 12.022 1.00 0.00 C ATOM 1641 C LEU A 111 1.457 3.998 12.500 1.00 0.00 C ATOM 1642 O LEU A 111 2.659 4.249 12.625 1.00 0.00 O ATOM 1643 CB LEU A 111 0.432 2.756 10.601 1.00 0.00 C ATOM 1644 CG LEU A 111 -0.181 1.485 10.019 1.00 0.00 C ATOM 1645 CD1 LEU A 111 -0.807 1.781 8.668 1.00 0.00 C ATOM 1646 CD2 LEU A 111 0.869 0.391 9.891 1.00 0.00 C ATOM 0 H LEU A 111 -0.977 2.089 12.538 1.00 0.00 H new ATOM 0 HA LEU A 111 1.820 1.936 12.014 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -0.325 3.541 10.590 1.00 0.00 H new ATOM 0 HB3 LEU A 111 1.239 3.082 9.945 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.958 1.132 10.697 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -1.242 0.868 8.261 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.587 2.533 8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.042 2.154 7.987 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.411 -0.506 9.474 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.669 0.730 9.232 1.00 0.00 H new ATOM 0 HD23 LEU A 111 1.280 0.165 10.875 1.00 0.00 H new ATOM 1658 N LEU A 112 0.494 4.864 12.792 1.00 0.00 N ATOM 1659 CA LEU A 112 0.776 6.213 13.267 1.00 0.00 C ATOM 1660 C LEU A 112 1.476 6.166 14.622 1.00 0.00 C ATOM 1661 O LEU A 112 2.310 7.015 14.937 1.00 0.00 O ATOM 1662 CB LEU A 112 -0.527 7.010 13.377 1.00 0.00 C ATOM 1663 CG LEU A 112 -1.377 7.049 12.103 1.00 0.00 C ATOM 1664 CD1 LEU A 112 -2.689 7.777 12.358 1.00 0.00 C ATOM 1665 CD2 LEU A 112 -0.614 7.708 10.963 1.00 0.00 C ATOM 0 H LEU A 112 -0.500 4.652 12.707 1.00 0.00 H new ATOM 0 HA LEU A 112 1.436 6.704 12.552 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -1.127 6.586 14.182 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -0.285 8.033 13.665 1.00 0.00 H new ATOM 0 HG LEU A 112 -1.602 6.023 11.813 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.279 7.795 11.442 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -3.246 7.260 13.139 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -2.482 8.799 12.676 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -1.238 7.724 10.069 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.353 8.729 11.242 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.296 7.144 10.760 1.00 0.00 H new ATOM 1677 N ALA A 113 1.133 5.155 15.413 1.00 0.00 N ATOM 1678 CA ALA A 113 1.733 4.956 16.725 1.00 0.00 C ATOM 1679 C ALA A 113 3.208 4.584 16.611 1.00 0.00 C ATOM 1680 O ALA A 113 3.995 4.846 17.519 1.00 0.00 O ATOM 1681 CB ALA A 113 0.975 3.883 17.490 1.00 0.00 C ATOM 0 H ALA A 113 0.435 4.454 15.164 1.00 0.00 H new ATOM 0 HA ALA A 113 1.668 5.897 17.272 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.432 3.743 18.469 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -0.063 4.190 17.615 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.012 2.946 16.935 1.00 0.00 H new ATOM 1687 N MET A 114 3.579 3.974 15.493 1.00 0.00 N ATOM 1688 CA MET A 114 4.967 3.593 15.264 1.00 0.00 C ATOM 1689 C MET A 114 5.742 4.741 14.631 1.00 0.00 C ATOM 1690 O MET A 114 6.930 4.924 14.898 1.00 0.00 O ATOM 1691 CB MET A 114 5.054 2.352 14.375 1.00 0.00 C ATOM 1692 CG MET A 114 4.478 1.100 15.016 1.00 0.00 C ATOM 1693 SD MET A 114 4.588 -0.345 13.941 1.00 0.00 S ATOM 1694 CE MET A 114 3.655 0.216 12.520 1.00 0.00 C ATOM 0 H MET A 114 2.942 3.733 14.734 1.00 0.00 H new ATOM 0 HA MET A 114 5.412 3.359 16.231 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.527 2.547 13.441 1.00 0.00 H new ATOM 0 HB3 MET A 114 6.098 2.171 14.120 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.007 0.897 15.947 1.00 0.00 H new ATOM 0 HG3 MET A 114 3.434 1.277 15.275 1.00 0.00 H new ATOM 0 HE1 MET A 114 3.633 -0.570 11.766 1.00 0.00 H new ATOM 0 HE2 MET A 114 2.636 0.455 12.825 1.00 0.00 H new ATOM 0 HE3 MET A 114 4.127 1.106 12.103 1.00 0.00 H new ATOM 1704 N GLY A 115 5.063 5.522 13.801 1.00 0.00 N ATOM 1705 CA GLY A 115 5.707 6.648 13.150 1.00 0.00 C ATOM 1706 C GLY A 115 5.644 6.555 11.640 1.00 0.00 C ATOM 1707 O GLY A 115 6.206 7.392 10.933 1.00 0.00 O ATOM 0 H GLY A 115 4.078 5.397 13.566 1.00 0.00 H new ATOM 0 HA2 GLY A 115 5.230 7.573 13.475 1.00 0.00 H new ATOM 0 HA3 GLY A 115 6.749 6.699 13.465 1.00 0.00 H new ATOM 1711 N VAL A 116 4.954 5.538 11.145 1.00 0.00 N ATOM 1712 CA VAL A 116 4.828 5.326 9.713 1.00 0.00 C ATOM 1713 C VAL A 116 3.631 6.098 9.173 1.00 0.00 C ATOM 1714 O VAL A 116 2.538 6.038 9.743 1.00 0.00 O ATOM 1715 CB VAL A 116 4.666 3.827 9.376 1.00 0.00 C ATOM 1716 CG1 VAL A 116 4.701 3.602 7.870 1.00 0.00 C ATOM 1717 CG2 VAL A 116 5.741 3.003 10.068 1.00 0.00 C ATOM 0 H VAL A 116 4.472 4.845 11.717 1.00 0.00 H new ATOM 0 HA VAL A 116 5.743 5.687 9.243 1.00 0.00 H new ATOM 0 HB VAL A 116 3.694 3.500 9.744 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.585 2.539 7.658 1.00 0.00 H new ATOM 0 HG12 VAL A 116 3.889 4.156 7.400 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.655 3.949 7.472 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.610 1.950 9.818 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.724 3.335 9.735 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.660 3.133 11.147 1.00 0.00 H new ATOM 1727 N GLY A 117 3.844 6.837 8.095 1.00 0.00 N ATOM 1728 CA GLY A 117 2.764 7.581 7.485 1.00 0.00 C ATOM 1729 C GLY A 117 1.931 6.711 6.571 1.00 0.00 C ATOM 1730 O GLY A 117 2.463 5.857 5.864 1.00 0.00 O ATOM 0 H GLY A 117 4.747 6.934 7.632 1.00 0.00 H new ATOM 0 HA2 GLY A 117 2.129 8.004 8.263 1.00 0.00 H new ATOM 0 HA3 GLY A 117 3.173 8.417 6.918 1.00 0.00 H new ATOM 1734 N VAL A 118 0.628 6.916 6.582 1.00 0.00 N ATOM 1735 CA VAL A 118 -0.270 6.130 5.753 1.00 0.00 C ATOM 1736 C VAL A 118 -1.161 7.049 4.922 1.00 0.00 C ATOM 1737 O VAL A 118 -1.522 8.144 5.364 1.00 0.00 O ATOM 1738 CB VAL A 118 -1.137 5.179 6.614 1.00 0.00 C ATOM 1739 CG1 VAL A 118 -2.018 5.965 7.575 1.00 0.00 C ATOM 1740 CG2 VAL A 118 -1.975 4.256 5.739 1.00 0.00 C ATOM 0 H VAL A 118 0.166 7.621 7.156 1.00 0.00 H new ATOM 0 HA VAL A 118 0.336 5.521 5.082 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.464 4.558 7.205 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -2.617 5.274 8.168 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -1.391 6.562 8.237 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -2.678 6.623 7.009 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.573 3.600 6.371 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.634 4.852 5.108 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.318 3.655 5.111 1.00 0.00 H new ATOM 1750 N GLU A 119 -1.486 6.623 3.711 1.00 0.00 N ATOM 1751 CA GLU A 119 -2.354 7.404 2.850 1.00 0.00 C ATOM 1752 C GLU A 119 -3.260 6.493 2.033 1.00 0.00 C ATOM 1753 O GLU A 119 -2.818 5.471 1.508 1.00 0.00 O ATOM 1754 CB GLU A 119 -1.524 8.292 1.923 1.00 0.00 C ATOM 1755 CG GLU A 119 -2.352 9.318 1.171 1.00 0.00 C ATOM 1756 CD GLU A 119 -3.171 10.188 2.105 1.00 0.00 C ATOM 1757 OE1 GLU A 119 -4.311 9.801 2.442 1.00 0.00 O ATOM 1758 OE2 GLU A 119 -2.673 11.255 2.517 1.00 0.00 O ATOM 0 H GLU A 119 -1.162 5.745 3.306 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.978 8.039 3.478 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.765 8.809 2.510 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.998 7.663 1.205 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.692 9.948 0.575 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.018 8.806 0.476 1.00 0.00 H new ATOM 1765 N ALA A 120 -4.526 6.865 1.939 1.00 0.00 N ATOM 1766 CA ALA A 120 -5.489 6.120 1.143 1.00 0.00 C ATOM 1767 C ALA A 120 -5.701 6.816 -0.194 1.00 0.00 C ATOM 1768 O ALA A 120 -5.993 8.013 -0.240 1.00 0.00 O ATOM 1769 CB ALA A 120 -6.806 5.983 1.892 1.00 0.00 C ATOM 0 H ALA A 120 -4.913 7.684 2.407 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.099 5.119 0.960 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -7.515 5.423 1.282 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.638 5.454 2.830 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -7.210 6.973 2.101 1.00 0.00 H new ATOM 1775 N MET A 121 -5.556 6.072 -1.277 1.00 0.00 N ATOM 1776 CA MET A 121 -5.616 6.657 -2.606 1.00 0.00 C ATOM 1777 C MET A 121 -6.220 5.659 -3.591 1.00 0.00 C ATOM 1778 O MET A 121 -6.285 4.463 -3.306 1.00 0.00 O ATOM 1779 CB MET A 121 -4.203 7.061 -3.040 1.00 0.00 C ATOM 1780 CG MET A 121 -4.158 8.090 -4.158 1.00 0.00 C ATOM 1781 SD MET A 121 -2.476 8.641 -4.515 1.00 0.00 S ATOM 1782 CE MET A 121 -1.966 9.240 -2.904 1.00 0.00 C ATOM 0 H MET A 121 -5.396 5.065 -1.263 1.00 0.00 H new ATOM 0 HA MET A 121 -6.251 7.543 -2.590 1.00 0.00 H new ATOM 0 HB2 MET A 121 -3.671 7.458 -2.176 1.00 0.00 H new ATOM 0 HB3 MET A 121 -3.666 6.169 -3.362 1.00 0.00 H new ATOM 0 HG2 MET A 121 -4.597 7.663 -5.060 1.00 0.00 H new ATOM 0 HG3 MET A 121 -4.769 8.950 -3.882 1.00 0.00 H new ATOM 0 HE1 MET A 121 -1.038 9.804 -3.002 1.00 0.00 H new ATOM 0 HE2 MET A 121 -2.742 9.887 -2.494 1.00 0.00 H new ATOM 0 HE3 MET A 121 -1.808 8.394 -2.235 1.00 0.00 H new ATOM 1792 N ASP A 122 -6.682 6.151 -4.733 1.00 0.00 N ATOM 1793 CA ASP A 122 -7.239 5.278 -5.760 1.00 0.00 C ATOM 1794 C ASP A 122 -6.109 4.536 -6.476 1.00 0.00 C ATOM 1795 O ASP A 122 -4.960 4.970 -6.430 1.00 0.00 O ATOM 1796 CB ASP A 122 -8.080 6.087 -6.751 1.00 0.00 C ATOM 1797 CG ASP A 122 -8.943 5.208 -7.638 1.00 0.00 C ATOM 1798 OD1 ASP A 122 -9.886 4.578 -7.119 1.00 0.00 O ATOM 1799 OD2 ASP A 122 -8.694 5.160 -8.859 1.00 0.00 O ATOM 0 H ASP A 122 -6.683 7.143 -4.971 1.00 0.00 H new ATOM 0 HA ASP A 122 -7.893 4.543 -5.290 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -8.718 6.779 -6.201 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -7.420 6.690 -7.375 1.00 0.00 H new ATOM 1804 N THR A 123 -6.448 3.430 -7.130 1.00 0.00 N ATOM 1805 CA THR A 123 -5.462 2.508 -7.697 1.00 0.00 C ATOM 1806 C THR A 123 -4.408 3.213 -8.565 1.00 0.00 C ATOM 1807 O THR A 123 -3.217 3.205 -8.242 1.00 0.00 O ATOM 1808 CB THR A 123 -6.174 1.435 -8.539 1.00 0.00 C ATOM 1809 OG1 THR A 123 -7.395 1.051 -7.891 1.00 0.00 O ATOM 1810 CG2 THR A 123 -5.287 0.212 -8.723 1.00 0.00 C ATOM 0 H THR A 123 -7.415 3.144 -7.284 1.00 0.00 H new ATOM 0 HA THR A 123 -4.939 2.054 -6.855 1.00 0.00 H new ATOM 0 HB THR A 123 -6.392 1.853 -9.522 1.00 0.00 H new ATOM 0 HG1 THR A 123 -7.810 0.313 -8.385 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.813 -0.532 -9.321 1.00 0.00 H new ATOM 0 HG22 THR A 123 -4.367 0.503 -9.231 1.00 0.00 H new ATOM 0 HG23 THR A 123 -5.045 -0.212 -7.748 1.00 0.00 H new ATOM 1818 N GLN A 124 -4.854 3.820 -9.657 1.00 0.00 N ATOM 1819 CA GLN A 124 -3.955 4.458 -10.615 1.00 0.00 C ATOM 1820 C GLN A 124 -3.197 5.629 -9.987 1.00 0.00 C ATOM 1821 O GLN A 124 -1.987 5.774 -10.186 1.00 0.00 O ATOM 1822 CB GLN A 124 -4.755 4.919 -11.834 1.00 0.00 C ATOM 1823 CG GLN A 124 -3.945 5.682 -12.868 1.00 0.00 C ATOM 1824 CD GLN A 124 -4.732 5.923 -14.140 1.00 0.00 C ATOM 1825 OE1 GLN A 124 -5.962 5.987 -14.119 1.00 0.00 O ATOM 1826 NE2 GLN A 124 -4.032 6.075 -15.251 1.00 0.00 N ATOM 0 H GLN A 124 -5.841 3.885 -9.904 1.00 0.00 H new ATOM 0 HA GLN A 124 -3.209 3.727 -10.927 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -5.200 4.046 -12.312 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -5.576 5.551 -11.496 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -3.631 6.638 -12.449 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -3.039 5.124 -13.103 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.014 6.015 -15.225 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -4.510 6.253 -16.134 1.00 0.00 H new ATOM 1835 N ALA A 125 -3.908 6.455 -9.231 1.00 0.00 N ATOM 1836 CA ALA A 125 -3.302 7.606 -8.570 1.00 0.00 C ATOM 1837 C ALA A 125 -2.216 7.171 -7.588 1.00 0.00 C ATOM 1838 O ALA A 125 -1.166 7.815 -7.482 1.00 0.00 O ATOM 1839 CB ALA A 125 -4.366 8.428 -7.859 1.00 0.00 C ATOM 0 H ALA A 125 -4.908 6.350 -9.059 1.00 0.00 H new ATOM 0 HA ALA A 125 -2.833 8.226 -9.334 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -3.899 9.283 -7.371 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -5.099 8.780 -8.585 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -4.864 7.810 -7.111 1.00 0.00 H new ATOM 1845 N ALA A 126 -2.465 6.078 -6.875 1.00 0.00 N ATOM 1846 CA ALA A 126 -1.492 5.543 -5.930 1.00 0.00 C ATOM 1847 C ALA A 126 -0.234 5.092 -6.656 1.00 0.00 C ATOM 1848 O ALA A 126 0.880 5.377 -6.216 1.00 0.00 O ATOM 1849 CB ALA A 126 -2.089 4.393 -5.134 1.00 0.00 C ATOM 0 H ALA A 126 -3.333 5.545 -6.934 1.00 0.00 H new ATOM 0 HA ALA A 126 -1.223 6.337 -5.233 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.345 4.009 -4.435 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -2.959 4.747 -4.580 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.391 3.597 -5.815 1.00 0.00 H new ATOM 1855 N ALA A 127 -0.420 4.404 -7.779 1.00 0.00 N ATOM 1856 CA ALA A 127 0.699 3.946 -8.595 1.00 0.00 C ATOM 1857 C ALA A 127 1.525 5.129 -9.088 1.00 0.00 C ATOM 1858 O ALA A 127 2.756 5.072 -9.117 1.00 0.00 O ATOM 1859 CB ALA A 127 0.197 3.120 -9.770 1.00 0.00 C ATOM 0 H ALA A 127 -1.338 4.151 -8.145 1.00 0.00 H new ATOM 0 HA ALA A 127 1.339 3.316 -7.977 1.00 0.00 H new ATOM 0 HB1 ALA A 127 1.045 2.786 -10.369 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -0.349 2.253 -9.398 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -0.465 3.729 -10.386 1.00 0.00 H new ATOM 1865 N ARG A 128 0.836 6.203 -9.463 1.00 0.00 N ATOM 1866 CA ARG A 128 1.494 7.427 -9.903 1.00 0.00 C ATOM 1867 C ARG A 128 2.377 7.982 -8.791 1.00 0.00 C ATOM 1868 O ARG A 128 3.577 8.182 -8.976 1.00 0.00 O ATOM 1869 CB ARG A 128 0.454 8.479 -10.296 1.00 0.00 C ATOM 1870 CG ARG A 128 1.060 9.763 -10.840 1.00 0.00 C ATOM 1871 CD ARG A 128 0.030 10.877 -10.919 1.00 0.00 C ATOM 1872 NE ARG A 128 -0.342 11.382 -9.595 1.00 0.00 N ATOM 1873 CZ ARG A 128 -1.508 11.965 -9.317 1.00 0.00 C ATOM 1874 NH1 ARG A 128 -2.457 12.057 -10.243 1.00 0.00 N ATOM 1875 NH2 ARG A 128 -1.726 12.448 -8.103 1.00 0.00 N ATOM 0 H ARG A 128 -0.183 6.249 -9.470 1.00 0.00 H new ATOM 0 HA ARG A 128 2.111 7.190 -10.770 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -0.213 8.055 -11.047 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -0.157 8.716 -9.425 1.00 0.00 H new ATOM 0 HG2 ARG A 128 1.886 10.075 -10.201 1.00 0.00 H new ATOM 0 HG3 ARG A 128 1.475 9.579 -11.831 1.00 0.00 H new ATOM 0 HD2 ARG A 128 0.428 11.695 -11.519 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -0.861 10.511 -11.430 1.00 0.00 H new ATOM 0 HE ARG A 128 0.334 11.281 -8.838 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -2.297 11.679 -11.177 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -3.346 12.505 -10.020 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -1.004 12.373 -7.387 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -2.616 12.895 -7.884 1.00 0.00 H new ATOM 1889 N THR A 129 1.767 8.212 -7.635 1.00 0.00 N ATOM 1890 CA THR A 129 2.461 8.788 -6.492 1.00 0.00 C ATOM 1891 C THR A 129 3.623 7.896 -6.048 1.00 0.00 C ATOM 1892 O THR A 129 4.691 8.389 -5.678 1.00 0.00 O ATOM 1893 CB THR A 129 1.483 8.998 -5.318 1.00 0.00 C ATOM 1894 OG1 THR A 129 0.296 9.658 -5.791 1.00 0.00 O ATOM 1895 CG2 THR A 129 2.120 9.833 -4.215 1.00 0.00 C ATOM 0 H THR A 129 0.783 8.006 -7.465 1.00 0.00 H new ATOM 0 HA THR A 129 2.864 9.754 -6.797 1.00 0.00 H new ATOM 0 HB THR A 129 1.228 8.021 -4.908 1.00 0.00 H new ATOM 0 HG1 THR A 129 -0.490 9.277 -5.346 1.00 0.00 H new ATOM 0 HG21 THR A 129 1.407 9.965 -3.401 1.00 0.00 H new ATOM 0 HG22 THR A 129 3.009 9.325 -3.841 1.00 0.00 H new ATOM 0 HG23 THR A 129 2.400 10.808 -4.613 1.00 0.00 H new ATOM 1903 N TYR A 130 3.410 6.584 -6.109 1.00 0.00 N ATOM 1904 CA TYR A 130 4.439 5.615 -5.750 1.00 0.00 C ATOM 1905 C TYR A 130 5.668 5.770 -6.637 1.00 0.00 C ATOM 1906 O TYR A 130 6.790 5.858 -6.140 1.00 0.00 O ATOM 1907 CB TYR A 130 3.882 4.192 -5.862 1.00 0.00 C ATOM 1908 CG TYR A 130 4.919 3.101 -5.684 1.00 0.00 C ATOM 1909 CD1 TYR A 130 5.536 2.890 -4.456 1.00 0.00 C ATOM 1910 CD2 TYR A 130 5.274 2.277 -6.746 1.00 0.00 C ATOM 1911 CE1 TYR A 130 6.475 1.889 -4.294 1.00 0.00 C ATOM 1912 CE2 TYR A 130 6.212 1.275 -6.591 1.00 0.00 C ATOM 1913 CZ TYR A 130 6.811 1.086 -5.364 1.00 0.00 C ATOM 1914 OH TYR A 130 7.740 0.083 -5.205 1.00 0.00 O ATOM 0 H TYR A 130 2.528 6.167 -6.406 1.00 0.00 H new ATOM 0 HA TYR A 130 4.739 5.801 -4.719 1.00 0.00 H new ATOM 0 HB2 TYR A 130 3.101 4.060 -5.114 1.00 0.00 H new ATOM 0 HB3 TYR A 130 3.411 4.074 -6.838 1.00 0.00 H new ATOM 0 HD1 TYR A 130 5.278 3.518 -3.616 1.00 0.00 H new ATOM 0 HD2 TYR A 130 4.808 2.423 -7.709 1.00 0.00 H new ATOM 0 HE1 TYR A 130 6.944 1.736 -3.333 1.00 0.00 H new ATOM 0 HE2 TYR A 130 6.475 0.643 -7.427 1.00 0.00 H new ATOM 0 HH TYR A 130 8.027 -0.240 -6.085 1.00 0.00 H new ATOM 1924 N ASN A 131 5.452 5.818 -7.949 1.00 0.00 N ATOM 1925 CA ASN A 131 6.553 5.935 -8.901 1.00 0.00 C ATOM 1926 C ASN A 131 7.327 7.229 -8.671 1.00 0.00 C ATOM 1927 O ASN A 131 8.559 7.243 -8.714 1.00 0.00 O ATOM 1928 CB ASN A 131 6.030 5.876 -10.341 1.00 0.00 C ATOM 1929 CG ASN A 131 7.148 5.841 -11.372 1.00 0.00 C ATOM 1930 OD1 ASN A 131 7.678 4.777 -11.692 1.00 0.00 O ATOM 1931 ND2 ASN A 131 7.495 6.996 -11.921 1.00 0.00 N ATOM 0 H ASN A 131 4.527 5.778 -8.376 1.00 0.00 H new ATOM 0 HA ASN A 131 7.230 5.095 -8.744 1.00 0.00 H new ATOM 0 HB2 ASN A 131 5.404 4.991 -10.460 1.00 0.00 H new ATOM 0 HB3 ASN A 131 5.396 6.742 -10.528 1.00 0.00 H new ATOM 0 HD21 ASN A 131 8.224 7.023 -12.634 1.00 0.00 H new ATOM 0 HD22 ASN A 131 7.033 7.858 -11.630 1.00 0.00 H new ATOM 1938 N ILE A 132 6.596 8.308 -8.402 1.00 0.00 N ATOM 1939 CA ILE A 132 7.209 9.603 -8.133 1.00 0.00 C ATOM 1940 C ILE A 132 8.117 9.528 -6.907 1.00 0.00 C ATOM 1941 O ILE A 132 9.307 9.824 -6.990 1.00 0.00 O ATOM 1942 CB ILE A 132 6.143 10.701 -7.911 1.00 0.00 C ATOM 1943 CG1 ILE A 132 5.261 10.848 -9.154 1.00 0.00 C ATOM 1944 CG2 ILE A 132 6.807 12.030 -7.569 1.00 0.00 C ATOM 1945 CD1 ILE A 132 4.118 11.827 -8.979 1.00 0.00 C ATOM 0 H ILE A 132 5.577 8.309 -8.365 1.00 0.00 H new ATOM 0 HA ILE A 132 7.802 9.865 -9.009 1.00 0.00 H new ATOM 0 HB ILE A 132 5.513 10.405 -7.072 1.00 0.00 H new ATOM 0 HG12 ILE A 132 5.880 11.172 -9.991 1.00 0.00 H new ATOM 0 HG13 ILE A 132 4.854 9.872 -9.417 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.041 12.791 -7.416 1.00 0.00 H new ATOM 0 HG22 ILE A 132 7.395 11.919 -6.658 1.00 0.00 H new ATOM 0 HG23 ILE A 132 7.460 12.332 -8.388 1.00 0.00 H new ATOM 0 HD11 ILE A 132 3.538 11.878 -9.901 1.00 0.00 H new ATOM 0 HD12 ILE A 132 3.476 11.494 -8.164 1.00 0.00 H new ATOM 0 HD13 ILE A 132 4.517 12.814 -8.747 1.00 0.00 H new ATOM 1957 N LEU A 133 7.554 9.102 -5.779 1.00 0.00 N ATOM 1958 CA LEU A 133 8.297 9.046 -4.521 1.00 0.00 C ATOM 1959 C LEU A 133 9.455 8.055 -4.602 1.00 0.00 C ATOM 1960 O LEU A 133 10.495 8.247 -3.965 1.00 0.00 O ATOM 1961 CB LEU A 133 7.367 8.669 -3.364 1.00 0.00 C ATOM 1962 CG LEU A 133 6.252 9.676 -3.070 1.00 0.00 C ATOM 1963 CD1 LEU A 133 5.386 9.190 -1.920 1.00 0.00 C ATOM 1964 CD2 LEU A 133 6.840 11.044 -2.753 1.00 0.00 C ATOM 0 H LEU A 133 6.585 8.790 -5.709 1.00 0.00 H new ATOM 0 HA LEU A 133 8.710 10.038 -4.338 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.913 7.703 -3.584 1.00 0.00 H new ATOM 0 HB3 LEU A 133 7.967 8.542 -2.463 1.00 0.00 H new ATOM 0 HG LEU A 133 5.626 9.767 -3.958 1.00 0.00 H new ATOM 0 HD11 LEU A 133 4.599 9.918 -1.725 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.937 8.232 -2.182 1.00 0.00 H new ATOM 0 HD13 LEU A 133 6.000 9.071 -1.027 1.00 0.00 H new ATOM 0 HD21 LEU A 133 6.034 11.748 -2.547 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.488 10.968 -1.880 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.420 11.397 -3.606 1.00 0.00 H new ATOM 1976 N MET A 134 9.275 7.001 -5.387 1.00 0.00 N ATOM 1977 CA MET A 134 10.322 6.007 -5.584 1.00 0.00 C ATOM 1978 C MET A 134 11.504 6.626 -6.323 1.00 0.00 C ATOM 1979 O MET A 134 12.661 6.373 -5.987 1.00 0.00 O ATOM 1980 CB MET A 134 9.775 4.809 -6.364 1.00 0.00 C ATOM 1981 CG MET A 134 10.767 3.666 -6.511 1.00 0.00 C ATOM 1982 SD MET A 134 10.079 2.258 -7.404 1.00 0.00 S ATOM 1983 CE MET A 134 9.781 2.988 -9.013 1.00 0.00 C ATOM 0 H MET A 134 8.413 6.812 -5.898 1.00 0.00 H new ATOM 0 HA MET A 134 10.664 5.660 -4.609 1.00 0.00 H new ATOM 0 HB2 MET A 134 8.881 4.439 -5.863 1.00 0.00 H new ATOM 0 HB3 MET A 134 9.470 5.142 -7.356 1.00 0.00 H new ATOM 0 HG2 MET A 134 11.654 4.025 -7.034 1.00 0.00 H new ATOM 0 HG3 MET A 134 11.090 3.341 -5.522 1.00 0.00 H new ATOM 0 HE1 MET A 134 10.097 2.294 -9.792 1.00 0.00 H new ATOM 0 HE2 MET A 134 8.718 3.200 -9.125 1.00 0.00 H new ATOM 0 HE3 MET A 134 10.347 3.915 -9.102 1.00 0.00 H new ATOM 1993 N ALA A 135 11.204 7.453 -7.320 1.00 0.00 N ATOM 1994 CA ALA A 135 12.236 8.152 -8.076 1.00 0.00 C ATOM 1995 C ALA A 135 12.891 9.232 -7.221 1.00 0.00 C ATOM 1996 O ALA A 135 14.093 9.480 -7.326 1.00 0.00 O ATOM 1997 CB ALA A 135 11.646 8.758 -9.341 1.00 0.00 C ATOM 0 H ALA A 135 10.251 7.655 -7.623 1.00 0.00 H new ATOM 0 HA ALA A 135 13.002 7.431 -8.361 1.00 0.00 H new ATOM 0 HB1 ALA A 135 12.428 9.277 -9.895 1.00 0.00 H new ATOM 0 HB2 ALA A 135 11.225 7.967 -9.962 1.00 0.00 H new ATOM 0 HB3 ALA A 135 10.861 9.465 -9.074 1.00 0.00 H new ATOM 2003 N GLU A 136 12.087 9.862 -6.369 1.00 0.00 N ATOM 2004 CA GLU A 136 12.580 10.869 -5.434 1.00 0.00 C ATOM 2005 C GLU A 136 13.595 10.265 -4.470 1.00 0.00 C ATOM 2006 O GLU A 136 14.504 10.948 -3.997 1.00 0.00 O ATOM 2007 CB GLU A 136 11.417 11.463 -4.639 1.00 0.00 C ATOM 2008 CG GLU A 136 10.432 12.246 -5.487 1.00 0.00 C ATOM 2009 CD GLU A 136 11.020 13.533 -6.016 1.00 0.00 C ATOM 2010 OE1 GLU A 136 11.727 13.500 -7.045 1.00 0.00 O ATOM 2011 OE2 GLU A 136 10.769 14.592 -5.407 1.00 0.00 O ATOM 0 H GLU A 136 11.083 9.691 -6.307 1.00 0.00 H new ATOM 0 HA GLU A 136 13.068 11.655 -6.011 1.00 0.00 H new ATOM 0 HB2 GLU A 136 10.886 10.657 -4.133 1.00 0.00 H new ATOM 0 HB3 GLU A 136 11.816 12.118 -3.864 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.106 11.628 -6.324 1.00 0.00 H new ATOM 0 HG3 GLU A 136 9.546 12.472 -4.894 1.00 0.00 H new ATOM 2018 N GLY A 137 13.435 8.982 -4.188 1.00 0.00 N ATOM 2019 CA GLY A 137 14.315 8.313 -3.257 1.00 0.00 C ATOM 2020 C GLY A 137 13.742 8.291 -1.859 1.00 0.00 C ATOM 2021 O GLY A 137 14.477 8.359 -0.874 1.00 0.00 O ATOM 0 H GLY A 137 12.708 8.390 -4.590 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.491 7.291 -3.594 1.00 0.00 H new ATOM 0 HA3 GLY A 137 15.282 8.816 -3.245 1.00 0.00 H new ATOM 2025 N ARG A 138 12.423 8.217 -1.773 1.00 0.00 N ATOM 2026 CA ARG A 138 11.748 8.153 -0.490 1.00 0.00 C ATOM 2027 C ARG A 138 11.205 6.751 -0.256 1.00 0.00 C ATOM 2028 O ARG A 138 10.632 6.143 -1.160 1.00 0.00 O ATOM 2029 CB ARG A 138 10.610 9.174 -0.425 1.00 0.00 C ATOM 2030 CG ARG A 138 9.793 9.087 0.854 1.00 0.00 C ATOM 2031 CD ARG A 138 8.659 10.098 0.876 1.00 0.00 C ATOM 2032 NE ARG A 138 9.140 11.472 1.005 1.00 0.00 N ATOM 2033 CZ ARG A 138 8.682 12.335 1.912 1.00 0.00 C ATOM 2034 NH1 ARG A 138 7.779 11.944 2.805 1.00 0.00 N ATOM 2035 NH2 ARG A 138 9.130 13.581 1.929 1.00 0.00 N ATOM 0 H ARG A 138 11.799 8.200 -2.580 1.00 0.00 H new ATOM 0 HA ARG A 138 12.470 8.392 0.291 1.00 0.00 H new ATOM 0 HB2 ARG A 138 11.027 10.177 -0.514 1.00 0.00 H new ATOM 0 HB3 ARG A 138 9.950 9.026 -1.280 1.00 0.00 H new ATOM 0 HG2 ARG A 138 9.384 8.082 0.955 1.00 0.00 H new ATOM 0 HG3 ARG A 138 10.444 9.254 1.712 1.00 0.00 H new ATOM 0 HD2 ARG A 138 8.075 10.005 -0.040 1.00 0.00 H new ATOM 0 HD3 ARG A 138 7.989 9.871 1.706 1.00 0.00 H new ATOM 0 HE ARG A 138 9.868 11.789 0.364 1.00 0.00 H new ATOM 0 HH11 ARG A 138 7.436 10.983 2.797 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.429 12.604 3.499 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.827 13.882 1.247 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.778 14.240 2.624 1.00 0.00 H new ATOM 2049 N ARG A 139 11.398 6.242 0.954 1.00 0.00 N ATOM 2050 CA ARG A 139 10.898 4.925 1.316 1.00 0.00 C ATOM 2051 C ARG A 139 9.371 4.915 1.357 1.00 0.00 C ATOM 2052 O ARG A 139 8.748 5.333 2.340 1.00 0.00 O ATOM 2053 CB ARG A 139 11.478 4.484 2.661 1.00 0.00 C ATOM 2054 CG ARG A 139 12.986 4.301 2.632 1.00 0.00 C ATOM 2055 CD ARG A 139 13.530 3.862 3.980 1.00 0.00 C ATOM 2056 NE ARG A 139 13.308 4.868 5.018 1.00 0.00 N ATOM 2057 CZ ARG A 139 14.192 5.165 5.968 1.00 0.00 C ATOM 2058 NH1 ARG A 139 15.365 4.546 6.011 1.00 0.00 N ATOM 2059 NH2 ARG A 139 13.899 6.087 6.870 1.00 0.00 N ATOM 0 H ARG A 139 11.898 6.723 1.701 1.00 0.00 H new ATOM 0 HA ARG A 139 11.219 4.216 0.553 1.00 0.00 H new ATOM 0 HB2 ARG A 139 11.223 5.224 3.419 1.00 0.00 H new ATOM 0 HB3 ARG A 139 11.010 3.546 2.961 1.00 0.00 H new ATOM 0 HG2 ARG A 139 13.247 3.560 1.877 1.00 0.00 H new ATOM 0 HG3 ARG A 139 13.460 5.237 2.337 1.00 0.00 H new ATOM 0 HD2 ARG A 139 13.054 2.927 4.275 1.00 0.00 H new ATOM 0 HD3 ARG A 139 14.598 3.663 3.892 1.00 0.00 H new ATOM 0 HE ARG A 139 12.422 5.373 5.014 1.00 0.00 H new ATOM 0 HH11 ARG A 139 15.594 3.838 5.313 1.00 0.00 H new ATOM 0 HH12 ARG A 139 16.038 4.778 6.742 1.00 0.00 H new ATOM 0 HH21 ARG A 139 12.999 6.567 6.836 1.00 0.00 H new ATOM 0 HH22 ARG A 139 14.573 6.318 7.600 1.00 0.00 H new ATOM 2073 N VAL A 140 8.780 4.454 0.269 1.00 0.00 N ATOM 2074 CA VAL A 140 7.336 4.398 0.141 1.00 0.00 C ATOM 2075 C VAL A 140 6.886 2.973 -0.172 1.00 0.00 C ATOM 2076 O VAL A 140 7.539 2.258 -0.930 1.00 0.00 O ATOM 2077 CB VAL A 140 6.834 5.373 -0.955 1.00 0.00 C ATOM 2078 CG1 VAL A 140 7.482 5.070 -2.299 1.00 0.00 C ATOM 2079 CG2 VAL A 140 5.316 5.338 -1.068 1.00 0.00 C ATOM 0 H VAL A 140 9.286 4.109 -0.547 1.00 0.00 H new ATOM 0 HA VAL A 140 6.901 4.705 1.092 1.00 0.00 H new ATOM 0 HB VAL A 140 7.127 6.380 -0.659 1.00 0.00 H new ATOM 0 HG11 VAL A 140 7.111 5.770 -3.048 1.00 0.00 H new ATOM 0 HG12 VAL A 140 8.564 5.171 -2.212 1.00 0.00 H new ATOM 0 HG13 VAL A 140 7.236 4.052 -2.600 1.00 0.00 H new ATOM 0 HG21 VAL A 140 4.993 6.032 -1.844 1.00 0.00 H new ATOM 0 HG22 VAL A 140 4.993 4.329 -1.326 1.00 0.00 H new ATOM 0 HG23 VAL A 140 4.873 5.628 -0.115 1.00 0.00 H new ATOM 2089 N VAL A 141 5.797 2.557 0.451 1.00 0.00 N ATOM 2090 CA VAL A 141 5.210 1.252 0.188 1.00 0.00 C ATOM 2091 C VAL A 141 3.900 1.445 -0.559 1.00 0.00 C ATOM 2092 O VAL A 141 3.245 2.471 -0.398 1.00 0.00 O ATOM 2093 CB VAL A 141 4.936 0.477 1.500 1.00 0.00 C ATOM 2094 CG1 VAL A 141 4.464 -0.940 1.212 1.00 0.00 C ATOM 2095 CG2 VAL A 141 6.170 0.459 2.386 1.00 0.00 C ATOM 0 H VAL A 141 5.297 3.108 1.148 1.00 0.00 H new ATOM 0 HA VAL A 141 5.915 0.671 -0.408 1.00 0.00 H new ATOM 0 HB VAL A 141 4.139 0.997 2.032 1.00 0.00 H new ATOM 0 HG11 VAL A 141 4.279 -1.460 2.152 1.00 0.00 H new ATOM 0 HG12 VAL A 141 3.543 -0.906 0.630 1.00 0.00 H new ATOM 0 HG13 VAL A 141 5.231 -1.471 0.648 1.00 0.00 H new ATOM 0 HG21 VAL A 141 5.953 -0.091 3.302 1.00 0.00 H new ATOM 0 HG22 VAL A 141 6.990 -0.026 1.857 1.00 0.00 H new ATOM 0 HG23 VAL A 141 6.454 1.481 2.636 1.00 0.00 H new ATOM 2105 N VAL A 142 3.520 0.490 -1.386 1.00 0.00 N ATOM 2106 CA VAL A 142 2.253 0.580 -2.086 1.00 0.00 C ATOM 2107 C VAL A 142 1.492 -0.741 -2.012 1.00 0.00 C ATOM 2108 O VAL A 142 2.051 -1.814 -2.244 1.00 0.00 O ATOM 2109 CB VAL A 142 2.444 1.015 -3.559 1.00 0.00 C ATOM 2110 CG1 VAL A 142 3.246 -0.012 -4.341 1.00 0.00 C ATOM 2111 CG2 VAL A 142 1.100 1.276 -4.224 1.00 0.00 C ATOM 0 H VAL A 142 4.064 -0.349 -1.588 1.00 0.00 H new ATOM 0 HA VAL A 142 1.661 1.347 -1.587 1.00 0.00 H new ATOM 0 HB VAL A 142 3.011 1.946 -3.559 1.00 0.00 H new ATOM 0 HG11 VAL A 142 3.362 0.324 -5.371 1.00 0.00 H new ATOM 0 HG12 VAL A 142 4.229 -0.130 -3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 142 2.723 -0.968 -4.328 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.259 1.580 -5.258 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.500 0.366 -4.202 1.00 0.00 H new ATOM 0 HG23 VAL A 142 0.577 2.069 -3.689 1.00 0.00 H new ATOM 2121 N ALA A 143 0.225 -0.650 -1.644 1.00 0.00 N ATOM 2122 CA ALA A 143 -0.657 -1.803 -1.614 1.00 0.00 C ATOM 2123 C ALA A 143 -1.775 -1.604 -2.622 1.00 0.00 C ATOM 2124 O ALA A 143 -2.518 -0.629 -2.539 1.00 0.00 O ATOM 2125 CB ALA A 143 -1.225 -2.008 -0.215 1.00 0.00 C ATOM 0 H ALA A 143 -0.219 0.223 -1.359 1.00 0.00 H new ATOM 0 HA ALA A 143 -0.090 -2.696 -1.878 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -1.883 -2.877 -0.213 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -0.409 -2.170 0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -1.790 -1.124 0.081 1.00 0.00 H new ATOM 2131 N LEU A 144 -1.886 -2.507 -3.579 1.00 0.00 N ATOM 2132 CA LEU A 144 -2.850 -2.346 -4.658 1.00 0.00 C ATOM 2133 C LEU A 144 -3.880 -3.466 -4.659 1.00 0.00 C ATOM 2134 O LEU A 144 -3.530 -4.648 -4.639 1.00 0.00 O ATOM 2135 CB LEU A 144 -2.131 -2.292 -6.008 1.00 0.00 C ATOM 2136 CG LEU A 144 -1.217 -1.080 -6.213 1.00 0.00 C ATOM 2137 CD1 LEU A 144 -0.478 -1.186 -7.539 1.00 0.00 C ATOM 2138 CD2 LEU A 144 -2.022 0.210 -6.156 1.00 0.00 C ATOM 0 H LEU A 144 -1.324 -3.357 -3.634 1.00 0.00 H new ATOM 0 HA LEU A 144 -3.377 -1.406 -4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -1.536 -3.198 -6.121 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -2.879 -2.301 -6.801 1.00 0.00 H new ATOM 0 HG LEU A 144 -0.482 -1.065 -5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 144 0.166 -0.316 -7.667 1.00 0.00 H new ATOM 0 HD12 LEU A 144 0.129 -2.091 -7.546 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -1.199 -1.227 -8.355 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -1.357 1.061 -6.304 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -2.779 0.201 -6.940 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -2.507 0.293 -5.184 1.00 0.00 H new ATOM 2150 N LEU A 145 -5.149 -3.077 -4.663 1.00 0.00 N ATOM 2151 CA LEU A 145 -6.250 -4.023 -4.774 1.00 0.00 C ATOM 2152 C LEU A 145 -6.754 -4.055 -6.216 1.00 0.00 C ATOM 2153 O LEU A 145 -7.235 -3.046 -6.731 1.00 0.00 O ATOM 2154 CB LEU A 145 -7.393 -3.627 -3.832 1.00 0.00 C ATOM 2155 CG LEU A 145 -7.002 -3.451 -2.361 1.00 0.00 C ATOM 2156 CD1 LEU A 145 -8.206 -3.025 -1.537 1.00 0.00 C ATOM 2157 CD2 LEU A 145 -6.408 -4.733 -1.802 1.00 0.00 C ATOM 0 H LEU A 145 -5.442 -2.103 -4.590 1.00 0.00 H new ATOM 0 HA LEU A 145 -5.894 -5.014 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -7.828 -2.693 -4.189 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -8.172 -4.386 -3.895 1.00 0.00 H new ATOM 0 HG LEU A 145 -6.245 -2.669 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -7.910 -2.905 -0.495 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -8.590 -2.078 -1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -8.983 -3.786 -1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -6.138 -4.583 -0.757 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -7.141 -5.536 -1.876 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -5.518 -5.000 -2.372 1.00 0.00 H new ATOM 2169 N PRO A 146 -6.636 -5.204 -6.891 1.00 0.00 N ATOM 2170 CA PRO A 146 -7.038 -5.341 -8.292 1.00 0.00 C ATOM 2171 C PRO A 146 -8.551 -5.477 -8.464 1.00 0.00 C ATOM 2172 O PRO A 146 -9.249 -5.984 -7.583 1.00 0.00 O ATOM 2173 CB PRO A 146 -6.333 -6.624 -8.728 1.00 0.00 C ATOM 2174 CG PRO A 146 -6.240 -7.440 -7.485 1.00 0.00 C ATOM 2175 CD PRO A 146 -6.102 -6.464 -6.344 1.00 0.00 C ATOM 0 HA PRO A 146 -6.771 -4.463 -8.880 1.00 0.00 H new ATOM 0 HB2 PRO A 146 -6.897 -7.143 -9.502 1.00 0.00 H new ATOM 0 HB3 PRO A 146 -5.346 -6.414 -9.140 1.00 0.00 H new ATOM 0 HG2 PRO A 146 -7.128 -8.060 -7.360 1.00 0.00 H new ATOM 0 HG3 PRO A 146 -5.384 -8.113 -7.526 1.00 0.00 H new ATOM 0 HD2 PRO A 146 -6.664 -6.790 -5.469 1.00 0.00 H new ATOM 0 HD3 PRO A 146 -5.063 -6.356 -6.033 1.00 0.00 H new