USER MOD reduce.3.24.130724 H: found=0, std=0, add=686, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 704 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 Single : A 9 MET CE :methyl 159:sc= -0.16 (180deg=-1.12) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.366 K(o=-0.37,f=-1.6) USER MOD Single : A 22 LYS NZ :NH3+ -162:sc= -0.0321 (180deg=-0.364) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 30 GLN : amide:sc= -7.01! C(o=-7!,f=-12!) USER MOD Single : A 32 ASN : amide:sc= -5.75! C(o=-5.7!,f=-7.3!) USER MOD Single : A 45 GLN : amide:sc= -0.267 X(o=-0.27,f=-0.35) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 MET CE :methyl -127:sc= -0.0921 (180deg=-1.93) USER MOD Single : B 217 SER OG : rot 180:sc= 0 USER MOD Single : B 218 ASN :FLIP amide:sc= -0.12 F(o=-2.1,f=-0.12) USER MOD Single : B 222 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 223 GLN : amide:sc= -0.221 K(o=-0.22,f=-3.6!) USER MOD Single : B 230 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : B 232 ASN :FLIP amide:sc= -0.1 F(o=-2.3!,f=-0.1) USER MOD Single : B 245 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : B 246 TYR OH : rot 90:sc= 0.134 USER MOD Single : B 249 ASN : amide:sc= -0.696 K(o=-0.7,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 111 N MET A 9 -14.449 -14.101 6.362 1.00 1.00 N ATOM 112 CA MET A 9 -13.450 -13.105 5.994 1.00 1.00 C ATOM 113 C MET A 9 -12.354 -13.755 5.152 1.00 1.00 C ATOM 114 O MET A 9 -11.762 -14.756 5.557 1.00 1.00 O ATOM 115 CB MET A 9 -12.828 -12.507 7.257 1.00 1.00 C ATOM 116 CG MET A 9 -13.941 -11.991 8.172 1.00 1.00 C ATOM 117 SD MET A 9 -13.214 -11.164 9.608 1.00 1.00 S ATOM 118 CE MET A 9 -13.081 -9.517 8.868 1.00 1.00 C ATOM 0 HA MET A 9 -13.932 -12.317 5.416 1.00 1.00 H new ATOM 0 HB2 MET A 9 -12.235 -13.260 7.776 1.00 1.00 H new ATOM 0 HB3 MET A 9 -12.152 -11.694 6.993 1.00 1.00 H new ATOM 0 HG2 MET A 9 -14.582 -11.298 7.627 1.00 1.00 H new ATOM 0 HG3 MET A 9 -14.571 -12.819 8.497 1.00 1.00 H new ATOM 0 HE1 MET A 9 -13.012 -8.768 9.657 1.00 1.00 H new ATOM 0 HE2 MET A 9 -12.189 -9.470 8.243 1.00 1.00 H new ATOM 0 HE3 MET A 9 -13.962 -9.320 8.257 1.00 1.00 H new ATOM 128 N GLY A 10 -12.091 -13.185 3.982 1.00 1.00 N ATOM 129 CA GLY A 10 -11.070 -13.725 3.094 1.00 1.00 C ATOM 130 C GLY A 10 -9.676 -13.414 3.619 1.00 1.00 C ATOM 131 O GLY A 10 -9.411 -12.312 4.098 1.00 1.00 O ATOM 0 H GLY A 10 -12.567 -12.355 3.628 1.00 1.00 H new ATOM 0 HA2 GLY A 10 -11.196 -14.804 3.001 1.00 1.00 H new ATOM 0 HA3 GLY A 10 -11.190 -13.303 2.096 1.00 1.00 H new ATOM 135 N ARG A 11 -8.785 -14.394 3.513 1.00 1.00 N ATOM 136 CA ARG A 11 -7.406 -14.220 3.970 1.00 1.00 C ATOM 137 C ARG A 11 -6.564 -13.563 2.885 1.00 1.00 C ATOM 138 O ARG A 11 -6.687 -13.887 1.706 1.00 1.00 O ATOM 139 CB ARG A 11 -6.787 -15.566 4.341 1.00 1.00 C ATOM 140 CG ARG A 11 -7.422 -16.084 5.628 1.00 1.00 C ATOM 141 CD ARG A 11 -6.745 -17.393 6.032 1.00 1.00 C ATOM 142 NE ARG A 11 -7.325 -17.895 7.276 1.00 1.00 N ATOM 143 CZ ARG A 11 -6.906 -19.031 7.825 1.00 1.00 C ATOM 144 NH1 ARG A 11 -5.960 -19.724 7.251 1.00 1.00 N ATOM 145 NH2 ARG A 11 -7.439 -19.456 8.940 1.00 1.00 N ATOM 0 H ARG A 11 -8.988 -15.312 3.118 1.00 1.00 H new ATOM 0 HA ARG A 11 -7.424 -13.579 4.851 1.00 1.00 H new ATOM 0 HB2 ARG A 11 -6.940 -16.283 3.534 1.00 1.00 H new ATOM 0 HB3 ARG A 11 -5.710 -15.459 4.472 1.00 1.00 H new ATOM 0 HG2 ARG A 11 -7.316 -15.346 6.423 1.00 1.00 H new ATOM 0 HG3 ARG A 11 -8.490 -16.243 5.482 1.00 1.00 H new ATOM 0 HD2 ARG A 11 -6.865 -18.133 5.241 1.00 1.00 H new ATOM 0 HD3 ARG A 11 -5.674 -17.234 6.159 1.00 1.00 H new ATOM 0 HE ARG A 11 -8.066 -17.363 7.732 1.00 1.00 H new ATOM 0 HH11 ARG A 11 -5.542 -19.394 6.381 1.00 1.00 H new ATOM 0 HH12 ARG A 11 -5.639 -20.596 7.673 1.00 1.00 H new ATOM 0 HH21 ARG A 11 -8.178 -18.916 9.390 1.00 1.00 H new ATOM 0 HH22 ARG A 11 -7.116 -20.328 9.360 1.00 1.00 H new ATOM 159 N ILE A 12 -5.705 -12.636 3.301 1.00 1.00 N ATOM 160 CA ILE A 12 -4.829 -11.923 2.372 1.00 1.00 C ATOM 161 C ILE A 12 -3.421 -11.858 2.937 1.00 1.00 C ATOM 162 O ILE A 12 -3.224 -11.559 4.115 1.00 1.00 O ATOM 163 CB ILE A 12 -5.340 -10.504 2.144 1.00 1.00 C ATOM 164 CG1 ILE A 12 -6.789 -10.558 1.648 1.00 1.00 C ATOM 165 CG2 ILE A 12 -4.473 -9.812 1.090 1.00 1.00 C ATOM 166 CD1 ILE A 12 -7.369 -9.144 1.586 1.00 1.00 C ATOM 0 H ILE A 12 -5.596 -12.360 4.277 1.00 1.00 H new ATOM 0 HA ILE A 12 -4.822 -12.460 1.423 1.00 1.00 H new ATOM 0 HB ILE A 12 -5.292 -9.947 3.080 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -6.828 -11.021 0.662 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -7.388 -11.178 2.315 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -4.838 -8.798 0.927 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -3.440 -9.774 1.436 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -4.522 -10.370 0.155 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -8.399 -9.188 1.233 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -7.345 -8.697 2.580 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -6.776 -8.537 0.901 1.00 1.00 H new ATOM 178 N LEU A 13 -2.448 -12.137 2.089 1.00 1.00 N ATOM 179 CA LEU A 13 -1.047 -12.112 2.495 1.00 1.00 C ATOM 180 C LEU A 13 -0.425 -10.771 2.164 1.00 1.00 C ATOM 181 O LEU A 13 -0.403 -10.349 1.008 1.00 1.00 O ATOM 182 CB LEU A 13 -0.282 -13.223 1.767 1.00 1.00 C ATOM 183 CG LEU A 13 -0.497 -14.569 2.478 1.00 1.00 C ATOM 184 CD1 LEU A 13 -0.324 -15.709 1.480 1.00 1.00 C ATOM 185 CD2 LEU A 13 0.531 -14.742 3.607 1.00 1.00 C ATOM 0 H LEU A 13 -2.599 -12.385 1.111 1.00 1.00 H new ATOM 0 HA LEU A 13 -0.991 -12.271 3.572 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -0.621 -13.291 0.733 1.00 1.00 H new ATOM 0 HB3 LEU A 13 0.781 -12.984 1.738 1.00 1.00 H new ATOM 0 HG LEU A 13 -1.504 -14.586 2.895 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -0.477 -16.662 1.986 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -1.054 -15.604 0.677 1.00 1.00 H new ATOM 0 HD13 LEU A 13 0.682 -15.677 1.062 1.00 1.00 H new ATOM 0 HD21 LEU A 13 0.369 -15.699 4.103 1.00 1.00 H new ATOM 0 HD22 LEU A 13 1.538 -14.716 3.190 1.00 1.00 H new ATOM 0 HD23 LEU A 13 0.417 -13.934 4.330 1.00 1.00 H new ATOM 197 N LEU A 14 0.091 -10.109 3.188 1.00 1.00 N ATOM 198 CA LEU A 14 0.728 -8.808 3.004 1.00 1.00 C ATOM 199 C LEU A 14 2.240 -8.966 3.013 1.00 1.00 C ATOM 200 O LEU A 14 2.804 -9.465 3.983 1.00 1.00 O ATOM 201 CB LEU A 14 0.316 -7.851 4.136 1.00 1.00 C ATOM 202 CG LEU A 14 0.990 -6.480 3.946 1.00 1.00 C ATOM 203 CD1 LEU A 14 0.643 -5.887 2.570 1.00 1.00 C ATOM 204 CD2 LEU A 14 0.520 -5.527 5.055 1.00 1.00 C ATOM 0 H LEU A 14 0.083 -10.446 4.151 1.00 1.00 H new ATOM 0 HA LEU A 14 0.408 -8.397 2.047 1.00 1.00 H new ATOM 0 HB2 LEU A 14 -0.768 -7.733 4.146 1.00 1.00 H new ATOM 0 HB3 LEU A 14 0.600 -8.273 5.100 1.00 1.00 H new ATOM 0 HG LEU A 14 2.071 -6.609 4.001 1.00 1.00 H new ATOM 0 HD11 LEU A 14 1.130 -4.918 2.458 1.00 1.00 H new ATOM 0 HD12 LEU A 14 0.989 -6.560 1.786 1.00 1.00 H new ATOM 0 HD13 LEU A 14 -0.437 -5.762 2.490 1.00 1.00 H new ATOM 0 HD21 LEU A 14 0.995 -4.555 4.925 1.00 1.00 H new ATOM 0 HD22 LEU A 14 -0.563 -5.412 5.001 1.00 1.00 H new ATOM 0 HD23 LEU A 14 0.794 -5.937 6.027 1.00 1.00 H new ATOM 216 N ASP A 15 2.886 -8.544 1.928 1.00 1.00 N ATOM 217 CA ASP A 15 4.345 -8.638 1.805 1.00 1.00 C ATOM 218 C ASP A 15 5.011 -7.296 2.111 1.00 1.00 C ATOM 219 O ASP A 15 4.761 -6.296 1.436 1.00 1.00 O ATOM 220 CB ASP A 15 4.714 -9.079 0.391 1.00 1.00 C ATOM 221 CG ASP A 15 4.137 -8.107 -0.632 1.00 1.00 C ATOM 222 OD1 ASP A 15 4.450 -8.256 -1.801 1.00 1.00 O ATOM 223 OD2 ASP A 15 3.386 -7.232 -0.233 1.00 1.00 O ATOM 0 H ASP A 15 2.423 -8.132 1.118 1.00 1.00 H new ATOM 0 HA ASP A 15 4.702 -9.372 2.527 1.00 1.00 H new ATOM 0 HB2 ASP A 15 5.798 -9.125 0.288 1.00 1.00 H new ATOM 0 HB3 ASP A 15 4.333 -10.083 0.204 1.00 1.00 H new ATOM 229 N LEU A 16 5.859 -7.284 3.140 1.00 1.00 N ATOM 230 CA LEU A 16 6.558 -6.065 3.544 1.00 1.00 C ATOM 231 C LEU A 16 7.897 -6.407 4.186 1.00 1.00 C ATOM 232 O LEU A 16 8.066 -7.447 4.818 1.00 1.00 O ATOM 233 CB LEU A 16 5.695 -5.252 4.528 1.00 1.00 C ATOM 234 CG LEU A 16 4.847 -6.202 5.371 1.00 1.00 C ATOM 235 CD1 LEU A 16 5.739 -7.127 6.219 1.00 1.00 C ATOM 236 CD2 LEU A 16 3.935 -5.379 6.275 1.00 1.00 C ATOM 0 H LEU A 16 6.078 -8.103 3.707 1.00 1.00 H new ATOM 0 HA LEU A 16 6.739 -5.462 2.654 1.00 1.00 H new ATOM 0 HB2 LEU A 16 6.333 -4.648 5.173 1.00 1.00 H new ATOM 0 HB3 LEU A 16 5.052 -4.563 3.980 1.00 1.00 H new ATOM 0 HG LEU A 16 4.248 -6.828 4.710 1.00 1.00 H new ATOM 0 HD11 LEU A 16 5.112 -7.794 6.811 1.00 1.00 H new ATOM 0 HD12 LEU A 16 6.379 -7.717 5.563 1.00 1.00 H new ATOM 0 HD13 LEU A 16 6.358 -6.525 6.885 1.00 1.00 H new ATOM 0 HD21 LEU A 16 3.325 -6.048 6.882 1.00 1.00 H new ATOM 0 HD22 LEU A 16 4.541 -4.749 6.927 1.00 1.00 H new ATOM 0 HD23 LEU A 16 3.287 -4.751 5.663 1.00 1.00 H new ATOM 248 N SER A 17 8.847 -5.524 3.990 1.00 1.00 N ATOM 249 CA SER A 17 10.182 -5.720 4.530 1.00 1.00 C ATOM 250 C SER A 17 10.112 -5.826 6.050 1.00 1.00 C ATOM 251 O SER A 17 9.167 -5.342 6.672 1.00 1.00 O ATOM 252 CB SER A 17 11.081 -4.551 4.132 1.00 1.00 C ATOM 253 OG SER A 17 11.521 -4.726 2.791 1.00 1.00 O ATOM 0 H SER A 17 8.726 -4.660 3.461 1.00 1.00 H new ATOM 0 HA SER A 17 10.599 -6.642 4.125 1.00 1.00 H new ATOM 0 HB2 SER A 17 10.537 -3.611 4.228 1.00 1.00 H new ATOM 0 HB3 SER A 17 11.938 -4.493 4.803 1.00 1.00 H new ATOM 0 HG SER A 17 12.096 -3.975 2.535 1.00 1.00 H new ATOM 259 N ASN A 18 11.117 -6.462 6.637 1.00 1.00 N ATOM 260 CA ASN A 18 11.162 -6.629 8.084 1.00 1.00 C ATOM 261 C ASN A 18 11.381 -5.288 8.776 1.00 1.00 C ATOM 262 O ASN A 18 10.942 -5.082 9.907 1.00 1.00 O ATOM 263 CB ASN A 18 12.278 -7.600 8.468 1.00 1.00 C ATOM 264 CG ASN A 18 11.946 -8.996 7.953 1.00 1.00 C ATOM 265 OD1 ASN A 18 10.938 -9.581 8.346 1.00 1.00 O ATOM 266 ND2 ASN A 18 12.737 -9.564 7.085 1.00 1.00 N ATOM 0 H ASN A 18 11.908 -6.869 6.137 1.00 1.00 H new ATOM 0 HA ASN A 18 10.205 -7.036 8.411 1.00 1.00 H new ATOM 0 HB2 ASN A 18 13.226 -7.263 8.049 1.00 1.00 H new ATOM 0 HB3 ASN A 18 12.398 -7.621 9.551 1.00 1.00 H new ATOM 0 HD21 ASN A 18 12.520 -10.496 6.731 1.00 1.00 H new ATOM 0 HD22 ASN A 18 13.572 -9.077 6.761 1.00 1.00 H new ATOM 273 N GLU A 19 12.078 -4.384 8.096 1.00 1.00 N ATOM 274 CA GLU A 19 12.366 -3.069 8.660 1.00 1.00 C ATOM 275 C GLU A 19 11.073 -2.332 9.003 1.00 1.00 C ATOM 276 O GLU A 19 11.016 -1.589 9.980 1.00 1.00 O ATOM 277 CB GLU A 19 13.178 -2.240 7.660 1.00 1.00 C ATOM 278 CG GLU A 19 13.816 -1.049 8.378 1.00 1.00 C ATOM 279 CD GLU A 19 14.961 -1.534 9.261 1.00 1.00 C ATOM 280 OE1 GLU A 19 15.305 -2.700 9.163 1.00 1.00 O ATOM 281 OE2 GLU A 19 15.474 -0.733 10.025 1.00 1.00 O ATOM 0 H GLU A 19 12.452 -4.535 7.159 1.00 1.00 H new ATOM 0 HA GLU A 19 12.943 -3.207 9.575 1.00 1.00 H new ATOM 0 HB2 GLU A 19 13.951 -2.858 7.203 1.00 1.00 H new ATOM 0 HB3 GLU A 19 12.533 -1.889 6.855 1.00 1.00 H new ATOM 0 HG2 GLU A 19 14.186 -0.328 7.649 1.00 1.00 H new ATOM 0 HG3 GLU A 19 13.070 -0.535 8.984 1.00 1.00 H new ATOM 289 N VAL A 20 10.038 -2.557 8.206 1.00 1.00 N ATOM 290 CA VAL A 20 8.742 -1.922 8.444 1.00 1.00 C ATOM 291 C VAL A 20 8.093 -2.479 9.707 1.00 1.00 C ATOM 292 O VAL A 20 7.565 -1.727 10.523 1.00 1.00 O ATOM 293 CB VAL A 20 7.821 -2.167 7.240 1.00 1.00 C ATOM 294 CG1 VAL A 20 6.382 -1.754 7.585 1.00 1.00 C ATOM 295 CG2 VAL A 20 8.315 -1.353 6.041 1.00 1.00 C ATOM 0 H VAL A 20 10.066 -3.171 7.392 1.00 1.00 H new ATOM 0 HA VAL A 20 8.897 -0.851 8.577 1.00 1.00 H new ATOM 0 HB VAL A 20 7.837 -3.228 6.991 1.00 1.00 H new ATOM 0 HG11 VAL A 20 5.736 -1.931 6.725 1.00 1.00 H new ATOM 0 HG12 VAL A 20 6.028 -2.342 8.432 1.00 1.00 H new ATOM 0 HG13 VAL A 20 6.359 -0.695 7.843 1.00 1.00 H new ATOM 0 HG21 VAL A 20 7.660 -1.528 5.188 1.00 1.00 H new ATOM 0 HG22 VAL A 20 8.307 -0.293 6.293 1.00 1.00 H new ATOM 0 HG23 VAL A 20 9.330 -1.658 5.788 1.00 1.00 H new ATOM 305 N ILE A 21 8.122 -3.797 9.859 1.00 1.00 N ATOM 306 CA ILE A 21 7.517 -4.418 11.029 1.00 1.00 C ATOM 307 C ILE A 21 8.063 -3.769 12.288 1.00 1.00 C ATOM 308 O ILE A 21 7.339 -3.571 13.257 1.00 1.00 O ATOM 309 CB ILE A 21 7.807 -5.925 11.040 1.00 1.00 C ATOM 310 CG1 ILE A 21 7.251 -6.556 9.758 1.00 1.00 C ATOM 311 CG2 ILE A 21 7.151 -6.570 12.266 1.00 1.00 C ATOM 312 CD1 ILE A 21 7.629 -8.037 9.702 1.00 1.00 C ATOM 0 H ILE A 21 8.550 -4.447 9.199 1.00 1.00 H new ATOM 0 HA ILE A 21 6.437 -4.275 10.992 1.00 1.00 H new ATOM 0 HB ILE A 21 8.883 -6.089 11.088 1.00 1.00 H new ATOM 0 HG12 ILE A 21 6.167 -6.447 9.729 1.00 1.00 H new ATOM 0 HG13 ILE A 21 7.647 -6.037 8.885 1.00 1.00 H new ATOM 0 HG21 ILE A 21 7.360 -7.640 12.270 1.00 1.00 H new ATOM 0 HG22 ILE A 21 7.553 -6.119 13.173 1.00 1.00 H new ATOM 0 HG23 ILE A 21 6.073 -6.411 12.228 1.00 1.00 H new ATOM 0 HD11 ILE A 21 7.231 -8.480 8.789 1.00 1.00 H new ATOM 0 HD12 ILE A 21 8.714 -8.136 9.710 1.00 1.00 H new ATOM 0 HD13 ILE A 21 7.211 -8.552 10.567 1.00 1.00 H new ATOM 324 N LYS A 22 9.337 -3.416 12.264 1.00 1.00 N ATOM 325 CA LYS A 22 9.940 -2.766 13.412 1.00 1.00 C ATOM 326 C LYS A 22 9.269 -1.422 13.654 1.00 1.00 C ATOM 327 O LYS A 22 8.946 -1.069 14.788 1.00 1.00 O ATOM 328 CB LYS A 22 11.444 -2.576 13.175 1.00 1.00 C ATOM 329 CG LYS A 22 12.101 -1.977 14.419 1.00 1.00 C ATOM 330 CD LYS A 22 13.613 -1.872 14.198 1.00 1.00 C ATOM 331 CE LYS A 22 14.271 -1.290 15.450 1.00 1.00 C ATOM 332 NZ LYS A 22 13.839 0.127 15.621 1.00 1.00 N ATOM 0 H LYS A 22 9.965 -3.566 11.474 1.00 1.00 H new ATOM 0 HA LYS A 22 9.802 -3.392 14.293 1.00 1.00 H new ATOM 0 HB2 LYS A 22 11.906 -3.534 12.936 1.00 1.00 H new ATOM 0 HB3 LYS A 22 11.605 -1.922 12.318 1.00 1.00 H new ATOM 0 HG2 LYS A 22 11.684 -0.991 14.625 1.00 1.00 H new ATOM 0 HG3 LYS A 22 11.892 -2.600 15.289 1.00 1.00 H new ATOM 0 HD2 LYS A 22 14.029 -2.856 13.979 1.00 1.00 H new ATOM 0 HD3 LYS A 22 13.822 -1.239 13.336 1.00 1.00 H new ATOM 0 HE2 LYS A 22 13.993 -1.875 16.326 1.00 1.00 H new ATOM 0 HE3 LYS A 22 15.356 -1.343 15.363 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 14.494 0.614 16.265 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 13.843 0.605 14.697 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 12.879 0.151 16.020 1.00 1.00 H new ATOM 346 N GLN A 23 9.054 -0.679 12.575 1.00 1.00 N ATOM 347 CA GLN A 23 8.410 0.615 12.677 1.00 1.00 C ATOM 348 C GLN A 23 6.954 0.438 13.094 1.00 1.00 C ATOM 349 O GLN A 23 6.471 1.118 13.999 1.00 1.00 O ATOM 350 CB GLN A 23 8.488 1.333 11.323 1.00 1.00 C ATOM 351 CG GLN A 23 9.946 1.446 10.887 1.00 1.00 C ATOM 352 CD GLN A 23 10.040 2.056 9.495 1.00 1.00 C ATOM 353 OE1 GLN A 23 9.156 1.847 8.665 1.00 1.00 O ATOM 354 NE2 GLN A 23 11.069 2.800 9.185 1.00 1.00 N ATOM 0 H GLN A 23 9.316 -0.952 11.628 1.00 1.00 H new ATOM 0 HA GLN A 23 8.920 1.215 13.430 1.00 1.00 H new ATOM 0 HB2 GLN A 23 7.916 0.784 10.575 1.00 1.00 H new ATOM 0 HB3 GLN A 23 8.043 2.325 11.400 1.00 1.00 H new ATOM 0 HG2 GLN A 23 10.498 2.061 11.598 1.00 1.00 H new ATOM 0 HG3 GLN A 23 10.410 0.460 10.891 1.00 1.00 H new ATOM 0 HE21 GLN A 23 11.800 2.972 9.875 1.00 1.00 H new ATOM 0 HE22 GLN A 23 11.141 3.209 8.253 1.00 1.00 H new ATOM 363 N LEU A 24 6.262 -0.489 12.435 1.00 1.00 N ATOM 364 CA LEU A 24 4.883 -0.759 12.743 1.00 1.00 C ATOM 365 C LEU A 24 4.775 -1.324 14.156 1.00 1.00 C ATOM 366 O LEU A 24 3.977 -0.873 14.974 1.00 1.00 O ATOM 367 CB LEU A 24 4.356 -1.772 11.688 1.00 1.00 C ATOM 368 CG LEU A 24 3.249 -2.651 12.279 1.00 1.00 C ATOM 369 CD1 LEU A 24 2.092 -1.785 12.847 1.00 1.00 C ATOM 370 CD2 LEU A 24 2.707 -3.642 11.231 1.00 1.00 C ATOM 0 H LEU A 24 6.647 -1.061 11.683 1.00 1.00 H new ATOM 0 HA LEU A 24 4.284 0.151 12.706 1.00 1.00 H new ATOM 0 HB2 LEU A 24 3.974 -1.234 10.820 1.00 1.00 H new ATOM 0 HB3 LEU A 24 5.176 -2.399 11.339 1.00 1.00 H new ATOM 0 HG LEU A 24 3.687 -3.222 13.098 1.00 1.00 H new ATOM 0 HD11 LEU A 24 1.320 -2.435 13.260 1.00 1.00 H new ATOM 0 HD12 LEU A 24 2.476 -1.134 13.632 1.00 1.00 H new ATOM 0 HD13 LEU A 24 1.666 -1.178 12.048 1.00 1.00 H new ATOM 0 HD21 LEU A 24 1.923 -4.252 11.679 1.00 1.00 H new ATOM 0 HD22 LEU A 24 2.298 -3.089 10.385 1.00 1.00 H new ATOM 0 HD23 LEU A 24 3.516 -4.286 10.887 1.00 1.00 H new ATOM 382 N ASP A 25 5.570 -2.343 14.412 1.00 1.00 N ATOM 383 CA ASP A 25 5.537 -3.008 15.708 1.00 1.00 C ATOM 384 C ASP A 25 5.670 -1.991 16.823 1.00 1.00 C ATOM 385 O ASP A 25 4.919 -2.022 17.798 1.00 1.00 O ATOM 386 CB ASP A 25 6.662 -4.040 15.814 1.00 1.00 C ATOM 387 CG ASP A 25 6.661 -4.670 17.205 1.00 1.00 C ATOM 388 OD1 ASP A 25 5.589 -4.998 17.686 1.00 1.00 O ATOM 389 OD2 ASP A 25 7.734 -4.814 17.769 1.00 1.00 O ATOM 0 H ASP A 25 6.243 -2.729 13.750 1.00 1.00 H new ATOM 0 HA ASP A 25 4.580 -3.521 15.803 1.00 1.00 H new ATOM 0 HB2 ASP A 25 6.532 -4.812 15.056 1.00 1.00 H new ATOM 0 HB3 ASP A 25 7.623 -3.564 15.622 1.00 1.00 H new ATOM 395 N ASP A 26 6.617 -1.089 16.668 1.00 1.00 N ATOM 396 CA ASP A 26 6.837 -0.056 17.666 1.00 1.00 C ATOM 397 C ASP A 26 5.588 0.807 17.824 1.00 1.00 C ATOM 398 O ASP A 26 5.243 1.213 18.932 1.00 1.00 O ATOM 399 CB ASP A 26 8.015 0.823 17.247 1.00 1.00 C ATOM 400 CG ASP A 26 8.461 1.692 18.419 1.00 1.00 C ATOM 401 OD1 ASP A 26 8.773 1.137 19.459 1.00 1.00 O ATOM 402 OD2 ASP A 26 8.482 2.902 18.258 1.00 1.00 O ATOM 0 H ASP A 26 7.245 -1.048 15.866 1.00 1.00 H new ATOM 0 HA ASP A 26 7.058 -0.534 18.620 1.00 1.00 H new ATOM 0 HB2 ASP A 26 8.843 0.199 16.910 1.00 1.00 H new ATOM 0 HB3 ASP A 26 7.728 1.453 16.405 1.00 1.00 H new ATOM 408 N LEU A 27 4.901 1.068 16.715 1.00 1.00 N ATOM 409 CA LEU A 27 3.699 1.860 16.746 1.00 1.00 C ATOM 410 C LEU A 27 2.601 1.118 17.503 1.00 1.00 C ATOM 411 O LEU A 27 1.795 1.730 18.203 1.00 1.00 O ATOM 412 CB LEU A 27 3.254 2.172 15.306 1.00 1.00 C ATOM 413 CG LEU A 27 1.897 2.859 15.328 1.00 1.00 C ATOM 414 CD1 LEU A 27 1.973 4.150 16.156 1.00 1.00 C ATOM 415 CD2 LEU A 27 1.453 3.183 13.898 1.00 1.00 C ATOM 0 H LEU A 27 5.166 0.737 15.787 1.00 1.00 H new ATOM 0 HA LEU A 27 3.895 2.798 17.265 1.00 1.00 H new ATOM 0 HB2 LEU A 27 3.989 2.812 14.818 1.00 1.00 H new ATOM 0 HB3 LEU A 27 3.197 1.252 14.725 1.00 1.00 H new ATOM 0 HG LEU A 27 1.169 2.188 15.784 1.00 1.00 H new ATOM 0 HD11 LEU A 27 0.996 4.634 16.165 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.269 3.910 17.177 1.00 1.00 H new ATOM 0 HD13 LEU A 27 2.707 4.823 15.714 1.00 1.00 H new ATOM 0 HD21 LEU A 27 0.481 3.675 13.922 1.00 1.00 H new ATOM 0 HD22 LEU A 27 2.183 3.845 13.431 1.00 1.00 H new ATOM 0 HD23 LEU A 27 1.379 2.261 13.322 1.00 1.00 H new ATOM 427 N GLU A 28 2.560 -0.199 17.339 1.00 1.00 N ATOM 428 CA GLU A 28 1.537 -1.003 17.991 1.00 1.00 C ATOM 429 C GLU A 28 1.657 -0.910 19.505 1.00 1.00 C ATOM 430 O GLU A 28 0.652 -0.866 20.215 1.00 1.00 O ATOM 431 CB GLU A 28 1.671 -2.462 17.554 1.00 1.00 C ATOM 432 CG GLU A 28 0.416 -3.237 17.958 1.00 1.00 C ATOM 433 CD GLU A 28 0.578 -4.714 17.612 1.00 1.00 C ATOM 434 OE1 GLU A 28 1.688 -5.111 17.298 1.00 1.00 O ATOM 435 OE2 GLU A 28 -0.411 -5.426 17.671 1.00 1.00 O ATOM 0 H GLU A 28 3.217 -0.728 16.765 1.00 1.00 H new ATOM 0 HA GLU A 28 0.560 -0.620 17.697 1.00 1.00 H new ATOM 0 HB2 GLU A 28 1.813 -2.517 16.475 1.00 1.00 H new ATOM 0 HB3 GLU A 28 2.551 -2.910 18.014 1.00 1.00 H new ATOM 0 HG2 GLU A 28 0.237 -3.123 19.027 1.00 1.00 H new ATOM 0 HG3 GLU A 28 -0.454 -2.828 17.444 1.00 1.00 H new ATOM 443 N VAL A 29 2.888 -0.883 19.993 1.00 1.00 N ATOM 444 CA VAL A 29 3.126 -0.799 21.425 1.00 1.00 C ATOM 445 C VAL A 29 2.558 0.499 21.992 1.00 1.00 C ATOM 446 O VAL A 29 1.916 0.496 23.043 1.00 1.00 O ATOM 447 CB VAL A 29 4.627 -0.864 21.711 1.00 1.00 C ATOM 448 CG1 VAL A 29 4.874 -0.703 23.213 1.00 1.00 C ATOM 449 CG2 VAL A 29 5.178 -2.215 21.246 1.00 1.00 C ATOM 0 H VAL A 29 3.733 -0.918 19.422 1.00 1.00 H new ATOM 0 HA VAL A 29 2.626 -1.641 21.903 1.00 1.00 H new ATOM 0 HB VAL A 29 5.131 -0.060 21.174 1.00 1.00 H new ATOM 0 HG11 VAL A 29 5.945 -0.750 23.413 1.00 1.00 H new ATOM 0 HG12 VAL A 29 4.485 0.260 23.545 1.00 1.00 H new ATOM 0 HG13 VAL A 29 4.369 -1.504 23.753 1.00 1.00 H new ATOM 0 HG21 VAL A 29 6.248 -2.261 21.450 1.00 1.00 H new ATOM 0 HG22 VAL A 29 4.672 -3.018 21.781 1.00 1.00 H new ATOM 0 HG23 VAL A 29 5.007 -2.329 20.175 1.00 1.00 H new ATOM 459 N GLN A 30 2.798 1.607 21.298 1.00 1.00 N ATOM 460 CA GLN A 30 2.311 2.902 21.749 1.00 1.00 C ATOM 461 C GLN A 30 0.786 2.939 21.738 1.00 1.00 C ATOM 462 O GLN A 30 0.162 3.486 22.648 1.00 1.00 O ATOM 463 CB GLN A 30 2.860 4.000 20.831 1.00 1.00 C ATOM 464 CG GLN A 30 4.302 4.332 21.223 1.00 1.00 C ATOM 465 CD GLN A 30 5.160 3.071 21.249 1.00 1.00 C ATOM 466 OE1 GLN A 30 4.971 2.205 22.104 1.00 1.00 O ATOM 467 NE2 GLN A 30 6.108 2.924 20.367 1.00 1.00 N ATOM 0 H GLN A 30 3.325 1.633 20.425 1.00 1.00 H new ATOM 0 HA GLN A 30 2.653 3.069 22.770 1.00 1.00 H new ATOM 0 HB2 GLN A 30 2.823 3.671 19.793 1.00 1.00 H new ATOM 0 HB3 GLN A 30 2.239 4.893 20.905 1.00 1.00 H new ATOM 0 HG2 GLN A 30 4.721 5.048 20.515 1.00 1.00 H new ATOM 0 HG3 GLN A 30 4.317 4.808 22.204 1.00 1.00 H new ATOM 0 HE21 GLN A 30 6.263 3.643 19.660 1.00 1.00 H new ATOM 0 HE22 GLN A 30 6.695 2.090 20.384 1.00 1.00 H new ATOM 476 N ARG A 31 0.194 2.363 20.703 1.00 1.00 N ATOM 477 CA ARG A 31 -1.258 2.349 20.579 1.00 1.00 C ATOM 478 C ARG A 31 -1.863 1.291 21.490 1.00 1.00 C ATOM 479 O ARG A 31 -3.081 1.234 21.658 1.00 1.00 O ATOM 480 CB ARG A 31 -1.654 2.079 19.116 1.00 1.00 C ATOM 481 CG ARG A 31 -1.614 3.388 18.307 1.00 1.00 C ATOM 482 CD ARG A 31 -2.938 4.147 18.464 1.00 1.00 C ATOM 483 NE ARG A 31 -2.925 5.352 17.645 1.00 1.00 N ATOM 484 CZ ARG A 31 -3.275 5.318 16.365 1.00 1.00 C ATOM 485 NH1 ARG A 31 -3.632 4.189 15.816 1.00 1.00 N ATOM 486 NH2 ARG A 31 -3.258 6.413 15.659 1.00 1.00 N ATOM 0 H ARG A 31 0.691 1.902 19.941 1.00 1.00 H new ATOM 0 HA ARG A 31 -1.644 3.323 20.880 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -0.974 1.349 18.676 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.654 1.648 19.075 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -0.787 4.010 18.648 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -1.435 3.169 17.255 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -3.770 3.507 18.170 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -3.093 4.411 19.510 1.00 1.00 H new ATOM 0 HE ARG A 31 -2.642 6.238 18.063 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -3.642 3.333 16.371 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -3.901 4.163 14.832 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -2.976 7.293 16.090 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -3.526 6.390 14.675 1.00 1.00 H new ATOM 500 N ASN A 32 -1.009 0.456 22.069 1.00 1.00 N ATOM 501 CA ASN A 32 -1.473 -0.593 22.963 1.00 1.00 C ATOM 502 C ASN A 32 -2.687 -1.290 22.375 1.00 1.00 C ATOM 503 O ASN A 32 -3.657 -1.565 23.082 1.00 1.00 O ATOM 504 CB ASN A 32 -1.829 -0.001 24.330 1.00 1.00 C ATOM 505 CG ASN A 32 -3.064 0.890 24.219 1.00 1.00 C ATOM 506 OD1 ASN A 32 -2.952 2.065 23.869 1.00 1.00 O ATOM 507 ND2 ASN A 32 -4.242 0.398 24.494 1.00 1.00 N ATOM 0 H ASN A 32 0.002 0.485 21.936 1.00 1.00 H new ATOM 0 HA ASN A 32 -0.672 -1.322 23.086 1.00 1.00 H new ATOM 0 HB2 ASN A 32 -2.015 -0.804 25.044 1.00 1.00 H new ATOM 0 HB3 ASN A 32 -0.988 0.578 24.713 1.00 1.00 H new ATOM 0 HD21 ASN A 32 -5.071 0.987 24.419 1.00 1.00 H new ATOM 0 HD22 ASN A 32 -4.333 -0.576 24.784 1.00 1.00 H new ATOM 514 N LEU A 33 -2.642 -1.565 21.073 1.00 1.00 N ATOM 515 CA LEU A 33 -3.766 -2.221 20.404 1.00 1.00 C ATOM 516 C LEU A 33 -3.265 -3.299 19.444 1.00 1.00 C ATOM 517 O LEU A 33 -2.139 -3.228 18.956 1.00 1.00 O ATOM 518 CB LEU A 33 -4.579 -1.166 19.632 1.00 1.00 C ATOM 519 CG LEU A 33 -5.519 -0.413 20.597 1.00 1.00 C ATOM 520 CD1 LEU A 33 -5.892 0.943 19.994 1.00 1.00 C ATOM 521 CD2 LEU A 33 -6.806 -1.218 20.854 1.00 1.00 C ATOM 0 H LEU A 33 -1.851 -1.348 20.466 1.00 1.00 H new ATOM 0 HA LEU A 33 -4.398 -2.698 21.153 1.00 1.00 H new ATOM 0 HB2 LEU A 33 -3.905 -0.462 19.144 1.00 1.00 H new ATOM 0 HB3 LEU A 33 -5.161 -1.647 18.846 1.00 1.00 H new ATOM 0 HG LEU A 33 -4.996 -0.275 21.544 1.00 1.00 H new ATOM 0 HD11 LEU A 33 -6.556 1.474 20.676 1.00 1.00 H new ATOM 0 HD12 LEU A 33 -4.988 1.532 19.835 1.00 1.00 H new ATOM 0 HD13 LEU A 33 -6.398 0.790 19.041 1.00 1.00 H new ATOM 0 HD21 LEU A 33 -7.451 -0.665 21.537 1.00 1.00 H new ATOM 0 HD22 LEU A 33 -7.329 -1.379 19.911 1.00 1.00 H new ATOM 0 HD23 LEU A 33 -6.551 -2.181 21.296 1.00 1.00 H new ATOM 533 N PRO A 34 -4.079 -4.290 19.162 1.00 1.00 N ATOM 534 CA PRO A 34 -3.702 -5.395 18.229 1.00 1.00 C ATOM 535 C PRO A 34 -3.347 -4.871 16.838 1.00 1.00 C ATOM 536 O PRO A 34 -3.941 -3.908 16.353 1.00 1.00 O ATOM 537 CB PRO A 34 -4.959 -6.295 18.186 1.00 1.00 C ATOM 538 CG PRO A 34 -6.073 -5.441 18.703 1.00 1.00 C ATOM 539 CD PRO A 34 -5.439 -4.487 19.703 1.00 1.00 C ATOM 0 HA PRO A 34 -2.813 -5.929 18.564 1.00 1.00 H new ATOM 0 HB2 PRO A 34 -5.164 -6.637 17.171 1.00 1.00 H new ATOM 0 HB3 PRO A 34 -4.827 -7.185 18.802 1.00 1.00 H new ATOM 0 HG2 PRO A 34 -6.554 -4.894 17.892 1.00 1.00 H new ATOM 0 HG3 PRO A 34 -6.843 -6.049 19.178 1.00 1.00 H new ATOM 0 HD2 PRO A 34 -5.987 -3.547 19.767 1.00 1.00 H new ATOM 0 HD3 PRO A 34 -5.416 -4.912 20.707 1.00 1.00 H new ATOM 547 N ARG A 35 -2.373 -5.515 16.206 1.00 1.00 N ATOM 548 CA ARG A 35 -1.945 -5.114 14.873 1.00 1.00 C ATOM 549 C ARG A 35 -3.091 -5.244 13.879 1.00 1.00 C ATOM 550 O ARG A 35 -3.315 -4.354 13.058 1.00 1.00 O ATOM 551 CB ARG A 35 -0.786 -5.995 14.416 1.00 1.00 C ATOM 552 CG ARG A 35 -0.293 -5.529 13.044 1.00 1.00 C ATOM 553 CD ARG A 35 0.942 -6.339 12.642 1.00 1.00 C ATOM 554 NE ARG A 35 0.754 -7.745 12.973 1.00 1.00 N ATOM 555 CZ ARG A 35 -0.036 -8.527 12.247 1.00 1.00 C ATOM 556 NH1 ARG A 35 -0.663 -8.040 11.213 1.00 1.00 N ATOM 557 NH2 ARG A 35 -0.184 -9.781 12.568 1.00 1.00 N ATOM 0 H ARG A 35 -1.868 -6.312 16.593 1.00 1.00 H new ATOM 0 HA ARG A 35 -1.626 -4.072 14.914 1.00 1.00 H new ATOM 0 HB2 ARG A 35 0.027 -5.948 15.141 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -1.106 -7.036 14.364 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -1.081 -5.654 12.301 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -0.050 -4.467 13.075 1.00 1.00 H new ATOM 0 HD2 ARG A 35 1.124 -6.231 11.573 1.00 1.00 H new ATOM 0 HD3 ARG A 35 1.822 -5.952 13.155 1.00 1.00 H new ATOM 0 HE ARG A 35 1.240 -8.137 13.780 1.00 1.00 H new ATOM 0 HH11 ARG A 35 -0.547 -7.058 10.962 1.00 1.00 H new ATOM 0 HH12 ARG A 35 -1.270 -8.641 10.655 1.00 1.00 H new ATOM 0 HH21 ARG A 35 0.307 -10.162 13.377 1.00 1.00 H new ATOM 0 HH22 ARG A 35 -0.791 -10.382 12.010 1.00 1.00 H new ATOM 571 N ALA A 36 -3.800 -6.367 13.938 1.00 1.00 N ATOM 572 CA ALA A 36 -4.907 -6.602 13.015 1.00 1.00 C ATOM 573 C ALA A 36 -5.830 -5.395 12.981 1.00 1.00 C ATOM 574 O ALA A 36 -6.306 -4.999 11.917 1.00 1.00 O ATOM 575 CB ALA A 36 -5.694 -7.839 13.450 1.00 1.00 C ATOM 0 H ALA A 36 -3.632 -7.120 14.605 1.00 1.00 H new ATOM 0 HA ALA A 36 -4.501 -6.765 12.017 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -6.518 -8.008 12.757 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -5.036 -8.708 13.450 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -6.090 -7.684 14.454 1.00 1.00 H new ATOM 581 N ASP A 37 -6.077 -4.805 14.144 1.00 1.00 N ATOM 582 CA ASP A 37 -6.937 -3.633 14.215 1.00 1.00 C ATOM 583 C ASP A 37 -6.293 -2.443 13.506 1.00 1.00 C ATOM 584 O ASP A 37 -6.971 -1.669 12.831 1.00 1.00 O ATOM 585 CB ASP A 37 -7.208 -3.284 15.678 1.00 1.00 C ATOM 586 CG ASP A 37 -8.006 -1.990 15.773 1.00 1.00 C ATOM 587 OD1 ASP A 37 -8.114 -1.464 16.868 1.00 1.00 O ATOM 588 OD2 ASP A 37 -8.498 -1.544 14.749 1.00 1.00 O ATOM 0 H ASP A 37 -5.699 -5.114 15.039 1.00 1.00 H new ATOM 0 HA ASP A 37 -7.878 -3.861 13.714 1.00 1.00 H new ATOM 0 HB2 ASP A 37 -7.758 -4.094 16.157 1.00 1.00 H new ATOM 0 HB3 ASP A 37 -6.265 -3.178 16.215 1.00 1.00 H new ATOM 594 N LEU A 38 -4.980 -2.303 13.662 1.00 1.00 N ATOM 595 CA LEU A 38 -4.260 -1.204 13.025 1.00 1.00 C ATOM 596 C LEU A 38 -4.295 -1.334 11.510 1.00 1.00 C ATOM 597 O LEU A 38 -4.508 -0.354 10.796 1.00 1.00 O ATOM 598 CB LEU A 38 -2.807 -1.181 13.518 1.00 1.00 C ATOM 599 CG LEU A 38 -2.741 -0.544 14.916 1.00 1.00 C ATOM 600 CD1 LEU A 38 -1.353 -0.775 15.514 1.00 1.00 C ATOM 601 CD2 LEU A 38 -3.030 0.977 14.851 1.00 1.00 C ATOM 0 H LEU A 38 -4.397 -2.929 14.218 1.00 1.00 H new ATOM 0 HA LEU A 38 -4.749 -0.269 13.296 1.00 1.00 H new ATOM 0 HB2 LEU A 38 -2.409 -2.195 13.551 1.00 1.00 H new ATOM 0 HB3 LEU A 38 -2.186 -0.617 12.822 1.00 1.00 H new ATOM 0 HG LEU A 38 -3.501 -1.010 15.543 1.00 1.00 H new ATOM 0 HD11 LEU A 38 -1.304 -0.324 16.505 1.00 1.00 H new ATOM 0 HD12 LEU A 38 -1.164 -1.846 15.593 1.00 1.00 H new ATOM 0 HD13 LEU A 38 -0.599 -0.320 14.871 1.00 1.00 H new ATOM 0 HD21 LEU A 38 -2.977 1.401 15.854 1.00 1.00 H new ATOM 0 HD22 LEU A 38 -2.291 1.461 14.213 1.00 1.00 H new ATOM 0 HD23 LEU A 38 -4.026 1.141 14.441 1.00 1.00 H new ATOM 613 N LEU A 39 -4.085 -2.547 11.023 1.00 1.00 N ATOM 614 CA LEU A 39 -4.094 -2.787 9.591 1.00 1.00 C ATOM 615 C LEU A 39 -5.467 -2.492 9.008 1.00 1.00 C ATOM 616 O LEU A 39 -5.584 -1.879 7.947 1.00 1.00 O ATOM 617 CB LEU A 39 -3.708 -4.241 9.312 1.00 1.00 C ATOM 618 CG LEU A 39 -2.215 -4.456 9.610 1.00 1.00 C ATOM 619 CD1 LEU A 39 -1.908 -5.957 9.563 1.00 1.00 C ATOM 620 CD2 LEU A 39 -1.332 -3.712 8.578 1.00 1.00 C ATOM 0 H LEU A 39 -3.908 -3.374 11.594 1.00 1.00 H new ATOM 0 HA LEU A 39 -3.370 -2.123 9.119 1.00 1.00 H new ATOM 0 HB2 LEU A 39 -4.310 -4.910 9.927 1.00 1.00 H new ATOM 0 HB3 LEU A 39 -3.919 -4.489 8.272 1.00 1.00 H new ATOM 0 HG LEU A 39 -1.992 -4.057 10.600 1.00 1.00 H new ATOM 0 HD11 LEU A 39 -0.851 -6.119 9.773 1.00 1.00 H new ATOM 0 HD12 LEU A 39 -2.510 -6.475 10.310 1.00 1.00 H new ATOM 0 HD13 LEU A 39 -2.145 -6.346 8.573 1.00 1.00 H new ATOM 0 HD21 LEU A 39 -0.280 -3.880 8.811 1.00 1.00 H new ATOM 0 HD22 LEU A 39 -1.547 -4.088 7.578 1.00 1.00 H new ATOM 0 HD23 LEU A 39 -1.547 -2.644 8.618 1.00 1.00 H new ATOM 632 N ARG A 40 -6.502 -2.940 9.701 1.00 1.00 N ATOM 633 CA ARG A 40 -7.860 -2.727 9.230 1.00 1.00 C ATOM 634 C ARG A 40 -8.166 -1.231 9.152 1.00 1.00 C ATOM 635 O ARG A 40 -8.757 -0.763 8.179 1.00 1.00 O ATOM 636 CB ARG A 40 -8.847 -3.417 10.173 1.00 1.00 C ATOM 637 CG ARG A 40 -10.257 -3.337 9.589 1.00 1.00 C ATOM 638 CD ARG A 40 -11.251 -3.958 10.572 1.00 1.00 C ATOM 639 NE ARG A 40 -10.892 -5.347 10.834 1.00 1.00 N ATOM 640 CZ ARG A 40 -11.040 -6.287 9.908 1.00 1.00 C ATOM 641 NH1 ARG A 40 -11.516 -5.980 8.733 1.00 1.00 N ATOM 642 NH2 ARG A 40 -10.703 -7.518 10.176 1.00 1.00 N ATOM 0 H ARG A 40 -6.429 -3.448 10.582 1.00 1.00 H new ATOM 0 HA ARG A 40 -7.960 -3.154 8.232 1.00 1.00 H new ATOM 0 HB2 ARG A 40 -8.561 -4.459 10.316 1.00 1.00 H new ATOM 0 HB3 ARG A 40 -8.821 -2.942 11.154 1.00 1.00 H new ATOM 0 HG2 ARG A 40 -10.523 -2.298 9.394 1.00 1.00 H new ATOM 0 HG3 ARG A 40 -10.297 -3.861 8.634 1.00 1.00 H new ATOM 0 HD2 ARG A 40 -11.255 -3.393 11.504 1.00 1.00 H new ATOM 0 HD3 ARG A 40 -12.260 -3.905 10.163 1.00 1.00 H new ATOM 0 HE ARG A 40 -10.519 -5.602 11.749 1.00 1.00 H new ATOM 0 HH11 ARG A 40 -11.775 -5.016 8.524 1.00 1.00 H new ATOM 0 HH12 ARG A 40 -11.629 -6.704 8.023 1.00 1.00 H new ATOM 0 HH21 ARG A 40 -10.327 -7.756 11.094 1.00 1.00 H new ATOM 0 HH22 ARG A 40 -10.815 -8.243 9.468 1.00 1.00 H new ATOM 656 N GLU A 41 -7.763 -0.483 10.180 1.00 1.00 N ATOM 657 CA GLU A 41 -7.998 0.940 10.216 1.00 1.00 C ATOM 658 C GLU A 41 -7.199 1.639 9.119 1.00 1.00 C ATOM 659 O GLU A 41 -7.704 2.532 8.443 1.00 1.00 O ATOM 660 CB GLU A 41 -7.579 1.475 11.583 1.00 1.00 C ATOM 661 CG GLU A 41 -8.034 2.915 11.695 1.00 1.00 C ATOM 662 CD GLU A 41 -7.645 3.497 13.052 1.00 1.00 C ATOM 663 OE1 GLU A 41 -6.852 2.873 13.739 1.00 1.00 O ATOM 664 OE2 GLU A 41 -8.147 4.558 13.383 1.00 1.00 O ATOM 0 H GLU A 41 -7.272 -0.851 10.995 1.00 1.00 H new ATOM 0 HA GLU A 41 -9.057 1.136 10.049 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -8.023 0.875 12.377 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -6.497 1.409 11.700 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -7.585 3.507 10.897 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -9.115 2.972 11.565 1.00 1.00 H new ATOM 672 N ALA A 42 -5.949 1.226 8.944 1.00 1.00 N ATOM 673 CA ALA A 42 -5.099 1.828 7.924 1.00 1.00 C ATOM 674 C ALA A 42 -5.750 1.702 6.551 1.00 1.00 C ATOM 675 O ALA A 42 -5.739 2.646 5.762 1.00 1.00 O ATOM 676 CB ALA A 42 -3.730 1.141 7.912 1.00 1.00 C ATOM 0 H ALA A 42 -5.506 0.486 9.488 1.00 1.00 H new ATOM 0 HA ALA A 42 -4.969 2.885 8.158 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -3.101 1.597 7.147 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -3.257 1.256 8.887 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -3.857 0.081 7.693 1.00 1.00 H new ATOM 682 N VAL A 43 -6.323 0.536 6.270 1.00 1.00 N ATOM 683 CA VAL A 43 -6.981 0.320 4.988 1.00 1.00 C ATOM 684 C VAL A 43 -8.237 1.183 4.883 1.00 1.00 C ATOM 685 O VAL A 43 -8.433 1.900 3.901 1.00 1.00 O ATOM 686 CB VAL A 43 -7.355 -1.155 4.842 1.00 1.00 C ATOM 687 CG1 VAL A 43 -8.141 -1.362 3.547 1.00 1.00 C ATOM 688 CG2 VAL A 43 -6.079 -1.998 4.804 1.00 1.00 C ATOM 0 H VAL A 43 -6.345 -0.263 6.903 1.00 1.00 H new ATOM 0 HA VAL A 43 -6.294 0.601 4.189 1.00 1.00 H new ATOM 0 HB VAL A 43 -7.971 -1.459 5.689 1.00 1.00 H new ATOM 0 HG11 VAL A 43 -8.406 -2.415 3.446 1.00 1.00 H new ATOM 0 HG12 VAL A 43 -9.049 -0.760 3.573 1.00 1.00 H new ATOM 0 HG13 VAL A 43 -7.529 -1.059 2.697 1.00 1.00 H new ATOM 0 HG21 VAL A 43 -6.341 -3.051 4.700 1.00 1.00 H new ATOM 0 HG22 VAL A 43 -5.466 -1.691 3.957 1.00 1.00 H new ATOM 0 HG23 VAL A 43 -5.520 -1.853 5.728 1.00 1.00 H new ATOM 698 N ASP A 44 -9.088 1.098 5.901 1.00 1.00 N ATOM 699 CA ASP A 44 -10.330 1.864 5.911 1.00 1.00 C ATOM 700 C ASP A 44 -10.034 3.341 5.705 1.00 1.00 C ATOM 701 O ASP A 44 -10.677 4.006 4.892 1.00 1.00 O ATOM 702 CB ASP A 44 -11.061 1.664 7.241 1.00 1.00 C ATOM 703 CG ASP A 44 -12.505 2.144 7.125 1.00 1.00 C ATOM 704 OD1 ASP A 44 -13.143 1.812 6.139 1.00 1.00 O ATOM 705 OD2 ASP A 44 -12.953 2.835 8.025 1.00 1.00 O ATOM 0 H ASP A 44 -8.943 0.512 6.723 1.00 1.00 H new ATOM 0 HA ASP A 44 -10.965 1.511 5.099 1.00 1.00 H new ATOM 0 HB2 ASP A 44 -11.041 0.611 7.520 1.00 1.00 H new ATOM 0 HB3 ASP A 44 -10.550 2.213 8.032 1.00 1.00 H new ATOM 711 N GLN A 45 -9.050 3.848 6.436 1.00 1.00 N ATOM 712 CA GLN A 45 -8.670 5.245 6.321 1.00 1.00 C ATOM 713 C GLN A 45 -8.287 5.577 4.882 1.00 1.00 C ATOM 714 O GLN A 45 -8.664 6.624 4.354 1.00 1.00 O ATOM 715 CB GLN A 45 -7.488 5.525 7.248 1.00 1.00 C ATOM 716 CG GLN A 45 -7.966 5.538 8.704 1.00 1.00 C ATOM 717 CD GLN A 45 -8.855 6.749 8.963 1.00 1.00 C ATOM 718 OE1 GLN A 45 -8.456 7.883 8.700 1.00 1.00 O ATOM 719 NE2 GLN A 45 -10.044 6.573 9.469 1.00 1.00 N ATOM 0 H GLN A 45 -8.504 3.313 7.112 1.00 1.00 H new ATOM 0 HA GLN A 45 -9.517 5.868 6.607 1.00 1.00 H new ATOM 0 HB2 GLN A 45 -6.720 4.763 7.114 1.00 1.00 H new ATOM 0 HB3 GLN A 45 -7.034 6.483 6.995 1.00 1.00 H new ATOM 0 HG2 GLN A 45 -8.516 4.622 8.920 1.00 1.00 H new ATOM 0 HG3 GLN A 45 -7.107 5.560 9.375 1.00 1.00 H new ATOM 0 HE21 GLN A 45 -10.372 5.632 9.686 1.00 1.00 H new ATOM 0 HE22 GLN A 45 -10.646 7.377 9.648 1.00 1.00 H new ATOM 728 N TYR A 46 -7.540 4.677 4.253 1.00 1.00 N ATOM 729 CA TYR A 46 -7.113 4.880 2.873 1.00 1.00 C ATOM 730 C TYR A 46 -8.321 4.932 1.943 1.00 1.00 C ATOM 731 O TYR A 46 -8.383 5.757 1.031 1.00 1.00 O ATOM 732 CB TYR A 46 -6.179 3.749 2.444 1.00 1.00 C ATOM 733 CG TYR A 46 -5.678 4.013 1.041 1.00 1.00 C ATOM 734 CD1 TYR A 46 -4.805 5.081 0.802 1.00 1.00 C ATOM 735 CD2 TYR A 46 -6.086 3.194 -0.021 1.00 1.00 C ATOM 736 CE1 TYR A 46 -4.339 5.331 -0.494 1.00 1.00 C ATOM 737 CE2 TYR A 46 -5.620 3.444 -1.318 1.00 1.00 C ATOM 738 CZ TYR A 46 -4.747 4.512 -1.555 1.00 1.00 C ATOM 739 OH TYR A 46 -4.288 4.759 -2.833 1.00 1.00 O ATOM 0 H TYR A 46 -7.219 3.805 4.673 1.00 1.00 H new ATOM 0 HA TYR A 46 -6.581 5.829 2.811 1.00 1.00 H new ATOM 0 HB2 TYR A 46 -5.338 3.676 3.134 1.00 1.00 H new ATOM 0 HB3 TYR A 46 -6.705 2.795 2.480 1.00 1.00 H new ATOM 0 HD1 TYR A 46 -4.490 5.713 1.619 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -6.760 2.370 0.161 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -3.665 6.155 -0.676 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -5.934 2.812 -2.136 1.00 1.00 H new ATOM 0 HH TYR A 46 -4.666 4.098 -3.450 1.00 1.00 H new ATOM 749 N LEU A 47 -9.275 4.042 2.184 1.00 1.00 N ATOM 750 CA LEU A 47 -10.483 3.984 1.363 1.00 1.00 C ATOM 751 C LEU A 47 -11.266 5.287 1.465 1.00 1.00 C ATOM 752 O LEU A 47 -11.800 5.781 0.472 1.00 1.00 O ATOM 753 CB LEU A 47 -11.372 2.819 1.809 1.00 1.00 C ATOM 754 CG LEU A 47 -10.700 1.481 1.460 1.00 1.00 C ATOM 755 CD1 LEU A 47 -11.514 0.330 2.068 1.00 1.00 C ATOM 756 CD2 LEU A 47 -10.606 1.303 -0.073 1.00 1.00 C ATOM 0 H LEU A 47 -9.239 3.353 2.936 1.00 1.00 H new ATOM 0 HA LEU A 47 -10.181 3.833 0.327 1.00 1.00 H new ATOM 0 HB2 LEU A 47 -11.550 2.877 2.883 1.00 1.00 H new ATOM 0 HB3 LEU A 47 -12.344 2.885 1.321 1.00 1.00 H new ATOM 0 HG LEU A 47 -9.690 1.475 1.870 1.00 1.00 H new ATOM 0 HD11 LEU A 47 -11.040 -0.620 1.822 1.00 1.00 H new ATOM 0 HD12 LEU A 47 -11.555 0.446 3.151 1.00 1.00 H new ATOM 0 HD13 LEU A 47 -12.526 0.346 1.663 1.00 1.00 H new ATOM 0 HD21 LEU A 47 -10.128 0.350 -0.300 1.00 1.00 H new ATOM 0 HD22 LEU A 47 -11.607 1.318 -0.503 1.00 1.00 H new ATOM 0 HD23 LEU A 47 -10.017 2.115 -0.498 1.00 1.00 H new ATOM 768 N ILE A 48 -11.338 5.836 2.668 1.00 1.00 N ATOM 769 CA ILE A 48 -12.065 7.080 2.876 1.00 1.00 C ATOM 770 C ILE A 48 -11.440 8.198 2.046 1.00 1.00 C ATOM 771 O ILE A 48 -12.145 8.974 1.402 1.00 1.00 O ATOM 772 CB ILE A 48 -12.037 7.455 4.364 1.00 1.00 C ATOM 773 CG1 ILE A 48 -12.879 6.451 5.162 1.00 1.00 C ATOM 774 CG2 ILE A 48 -12.597 8.869 4.557 1.00 1.00 C ATOM 775 CD1 ILE A 48 -12.675 6.680 6.663 1.00 1.00 C ATOM 0 H ILE A 48 -10.908 5.446 3.506 1.00 1.00 H new ATOM 0 HA ILE A 48 -13.099 6.944 2.560 1.00 1.00 H new ATOM 0 HB ILE A 48 -11.008 7.429 4.721 1.00 1.00 H new ATOM 0 HG12 ILE A 48 -13.933 6.563 4.908 1.00 1.00 H new ATOM 0 HG13 ILE A 48 -12.594 5.433 4.898 1.00 1.00 H new ATOM 0 HG21 ILE A 48 -12.574 9.128 5.616 1.00 1.00 H new ATOM 0 HG22 ILE A 48 -11.991 9.580 3.996 1.00 1.00 H new ATOM 0 HG23 ILE A 48 -13.625 8.905 4.197 1.00 1.00 H new ATOM 0 HD11 ILE A 48 -13.275 5.964 7.225 1.00 1.00 H new ATOM 0 HD12 ILE A 48 -11.622 6.545 6.912 1.00 1.00 H new ATOM 0 HD13 ILE A 48 -12.982 7.693 6.922 1.00 1.00 H new ATOM 1413 N MET B 209 11.920 -11.331 3.505 1.00 1.00 N ATOM 1414 CA MET B 209 10.874 -10.408 3.935 1.00 1.00 C ATOM 1415 C MET B 209 10.177 -10.951 5.177 1.00 1.00 C ATOM 1416 O MET B 209 10.537 -12.009 5.693 1.00 1.00 O ATOM 1417 CB MET B 209 9.848 -10.205 2.818 1.00 1.00 C ATOM 1418 CG MET B 209 10.520 -9.500 1.638 1.00 1.00 C ATOM 1419 SD MET B 209 9.304 -9.217 0.325 1.00 1.00 S ATOM 1420 CE MET B 209 8.734 -7.591 0.887 1.00 1.00 C ATOM 0 HA MET B 209 11.335 -9.449 4.170 1.00 1.00 H new ATOM 0 HB2 MET B 209 9.444 -11.166 2.500 1.00 1.00 H new ATOM 0 HB3 MET B 209 9.009 -9.611 3.182 1.00 1.00 H new ATOM 0 HG2 MET B 209 10.946 -8.551 1.963 1.00 1.00 H new ATOM 0 HG3 MET B 209 11.343 -10.106 1.260 1.00 1.00 H new ATOM 0 HE1 MET B 209 7.648 -7.599 0.981 1.00 1.00 H new ATOM 0 HE2 MET B 209 9.181 -7.363 1.855 1.00 1.00 H new ATOM 0 HE3 MET B 209 9.030 -6.832 0.163 1.00 1.00 H new ATOM 1430 N GLY B 210 9.193 -10.203 5.662 1.00 1.00 N ATOM 1431 CA GLY B 210 8.447 -10.577 6.862 1.00 1.00 C ATOM 1432 C GLY B 210 6.951 -10.561 6.603 1.00 1.00 C ATOM 1433 O GLY B 210 6.170 -10.103 7.436 1.00 1.00 O ATOM 0 H GLY B 210 8.890 -9.326 5.239 1.00 1.00 H new ATOM 0 HA2 GLY B 210 8.752 -11.571 7.188 1.00 1.00 H new ATOM 0 HA3 GLY B 210 8.686 -9.888 7.672 1.00 1.00 H new ATOM 1437 N ARG B 211 6.559 -11.039 5.432 1.00 1.00 N ATOM 1438 CA ARG B 211 5.148 -11.049 5.053 1.00 1.00 C ATOM 1439 C ARG B 211 4.272 -11.449 6.237 1.00 1.00 C ATOM 1440 O ARG B 211 4.728 -12.126 7.157 1.00 1.00 O ATOM 1441 CB ARG B 211 4.919 -12.035 3.901 1.00 1.00 C ATOM 1442 CG ARG B 211 5.284 -13.453 4.358 1.00 1.00 C ATOM 1443 CD ARG B 211 5.119 -14.429 3.194 1.00 1.00 C ATOM 1444 NE ARG B 211 5.428 -15.785 3.633 1.00 1.00 N ATOM 1445 CZ ARG B 211 5.697 -16.746 2.756 1.00 1.00 C ATOM 1446 NH1 ARG B 211 5.690 -16.482 1.479 1.00 1.00 N ATOM 1447 NH2 ARG B 211 5.967 -17.953 3.172 1.00 1.00 N ATOM 0 H ARG B 211 7.191 -11.423 4.729 1.00 1.00 H new ATOM 0 HA ARG B 211 4.876 -10.043 4.735 1.00 1.00 H new ATOM 0 HB2 ARG B 211 3.877 -12.002 3.582 1.00 1.00 H new ATOM 0 HB3 ARG B 211 5.525 -11.752 3.041 1.00 1.00 H new ATOM 0 HG2 ARG B 211 6.312 -13.475 4.721 1.00 1.00 H new ATOM 0 HG3 ARG B 211 4.646 -13.753 5.189 1.00 1.00 H new ATOM 0 HD2 ARG B 211 4.099 -14.385 2.813 1.00 1.00 H new ATOM 0 HD3 ARG B 211 5.778 -14.144 2.374 1.00 1.00 H new ATOM 0 HE ARG B 211 5.438 -15.999 4.630 1.00 1.00 H new ATOM 0 HH11 ARG B 211 5.478 -15.539 1.154 1.00 1.00 H new ATOM 0 HH12 ARG B 211 5.896 -17.219 0.805 1.00 1.00 H new ATOM 0 HH21 ARG B 211 5.972 -18.159 4.171 1.00 1.00 H new ATOM 0 HH22 ARG B 211 6.173 -18.690 2.498 1.00 1.00 H new ATOM 1461 N ILE B 212 3.015 -11.003 6.216 1.00 1.00 N ATOM 1462 CA ILE B 212 2.080 -11.296 7.304 1.00 1.00 C ATOM 1463 C ILE B 212 0.705 -11.638 6.744 1.00 1.00 C ATOM 1464 O ILE B 212 0.354 -11.228 5.638 1.00 1.00 O ATOM 1465 CB ILE B 212 1.957 -10.080 8.225 1.00 1.00 C ATOM 1466 CG1 ILE B 212 3.358 -9.628 8.661 1.00 1.00 C ATOM 1467 CG2 ILE B 212 1.137 -10.468 9.463 1.00 1.00 C ATOM 1468 CD1 ILE B 212 3.258 -8.361 9.512 1.00 1.00 C ATOM 0 H ILE B 212 2.622 -10.440 5.462 1.00 1.00 H new ATOM 0 HA ILE B 212 2.461 -12.148 7.867 1.00 1.00 H new ATOM 0 HB ILE B 212 1.461 -9.266 7.696 1.00 1.00 H new ATOM 0 HG12 ILE B 212 3.844 -10.421 9.230 1.00 1.00 H new ATOM 0 HG13 ILE B 212 3.977 -9.439 7.784 1.00 1.00 H new ATOM 0 HG21 ILE B 212 1.046 -9.606 10.124 1.00 1.00 H new ATOM 0 HG22 ILE B 212 0.144 -10.795 9.154 1.00 1.00 H new ATOM 0 HG23 ILE B 212 1.638 -11.279 9.992 1.00 1.00 H new ATOM 0 HD11 ILE B 212 4.257 -8.048 9.817 1.00 1.00 H new ATOM 0 HD12 ILE B 212 2.791 -7.567 8.929 1.00 1.00 H new ATOM 0 HD13 ILE B 212 2.655 -8.564 10.397 1.00 1.00 H new ATOM 1480 N LEU B 213 -0.075 -12.383 7.522 1.00 1.00 N ATOM 1481 CA LEU B 213 -1.418 -12.771 7.111 1.00 1.00 C ATOM 1482 C LEU B 213 -2.435 -11.757 7.603 1.00 1.00 C ATOM 1483 O LEU B 213 -2.355 -11.274 8.733 1.00 1.00 O ATOM 1484 CB LEU B 213 -1.749 -14.161 7.680 1.00 1.00 C ATOM 1485 CG LEU B 213 -1.237 -15.261 6.736 1.00 1.00 C ATOM 1486 CD1 LEU B 213 -0.965 -16.543 7.525 1.00 1.00 C ATOM 1487 CD2 LEU B 213 -2.286 -15.550 5.651 1.00 1.00 C ATOM 0 H LEU B 213 0.201 -12.730 8.441 1.00 1.00 H new ATOM 0 HA LEU B 213 -1.459 -12.805 6.022 1.00 1.00 H new ATOM 0 HB2 LEU B 213 -1.294 -14.276 8.664 1.00 1.00 H new ATOM 0 HB3 LEU B 213 -2.826 -14.260 7.813 1.00 1.00 H new ATOM 0 HG LEU B 213 -0.314 -14.919 6.269 1.00 1.00 H new ATOM 0 HD11 LEU B 213 -0.603 -17.317 6.848 1.00 1.00 H new ATOM 0 HD12 LEU B 213 -0.212 -16.347 8.289 1.00 1.00 H new ATOM 0 HD13 LEU B 213 -1.886 -16.880 8.001 1.00 1.00 H new ATOM 0 HD21 LEU B 213 -1.916 -16.330 4.986 1.00 1.00 H new ATOM 0 HD22 LEU B 213 -3.212 -15.882 6.120 1.00 1.00 H new ATOM 0 HD23 LEU B 213 -2.475 -14.643 5.077 1.00 1.00 H new ATOM 1499 N LEU B 214 -3.397 -11.440 6.746 1.00 1.00 N ATOM 1500 CA LEU B 214 -4.438 -10.482 7.100 1.00 1.00 C ATOM 1501 C LEU B 214 -5.793 -10.966 6.593 1.00 1.00 C ATOM 1502 O LEU B 214 -5.889 -11.539 5.511 1.00 1.00 O ATOM 1503 CB LEU B 214 -4.117 -9.114 6.494 1.00 1.00 C ATOM 1504 CG LEU B 214 -5.095 -8.061 7.033 1.00 1.00 C ATOM 1505 CD1 LEU B 214 -4.949 -7.913 8.566 1.00 1.00 C ATOM 1506 CD2 LEU B 214 -4.806 -6.717 6.351 1.00 1.00 C ATOM 0 H LEU B 214 -3.479 -11.829 5.807 1.00 1.00 H new ATOM 0 HA LEU B 214 -4.478 -10.392 8.186 1.00 1.00 H new ATOM 0 HB2 LEU B 214 -3.093 -8.830 6.737 1.00 1.00 H new ATOM 0 HB3 LEU B 214 -4.185 -9.163 5.407 1.00 1.00 H new ATOM 0 HG LEU B 214 -6.115 -8.378 6.816 1.00 1.00 H new ATOM 0 HD11 LEU B 214 -5.651 -7.162 8.928 1.00 1.00 H new ATOM 0 HD12 LEU B 214 -5.161 -8.869 9.046 1.00 1.00 H new ATOM 0 HD13 LEU B 214 -3.932 -7.604 8.806 1.00 1.00 H new ATOM 0 HD21 LEU B 214 -5.496 -5.962 6.728 1.00 1.00 H new ATOM 0 HD22 LEU B 214 -3.782 -6.412 6.567 1.00 1.00 H new ATOM 0 HD23 LEU B 214 -4.934 -6.821 5.274 1.00 1.00 H new ATOM 1518 N ASP B 215 -6.840 -10.729 7.381 1.00 1.00 N ATOM 1519 CA ASP B 215 -8.194 -11.138 7.008 1.00 1.00 C ATOM 1520 C ASP B 215 -9.096 -9.921 6.837 1.00 1.00 C ATOM 1521 O ASP B 215 -9.219 -9.094 7.742 1.00 1.00 O ATOM 1522 CB ASP B 215 -8.772 -12.037 8.094 1.00 1.00 C ATOM 1523 CG ASP B 215 -7.808 -13.178 8.388 1.00 1.00 C ATOM 1524 OD1 ASP B 215 -8.231 -14.319 8.311 1.00 1.00 O ATOM 1525 OD2 ASP B 215 -6.659 -12.895 8.685 1.00 1.00 O ATOM 0 H ASP B 215 -6.777 -10.256 8.282 1.00 1.00 H new ATOM 0 HA ASP B 215 -8.144 -11.677 6.062 1.00 1.00 H new ATOM 0 HB2 ASP B 215 -8.952 -11.458 9.000 1.00 1.00 H new ATOM 0 HB3 ASP B 215 -9.735 -12.436 7.774 1.00 1.00 H new ATOM 1531 N LEU B 216 -9.734 -9.827 5.674 1.00 1.00 N ATOM 1532 CA LEU B 216 -10.645 -8.721 5.370 1.00 1.00 C ATOM 1533 C LEU B 216 -12.040 -9.252 5.098 1.00 1.00 C ATOM 1534 O LEU B 216 -12.199 -10.343 4.548 1.00 1.00 O ATOM 1535 CB LEU B 216 -10.149 -7.937 4.131 1.00 1.00 C ATOM 1536 CG LEU B 216 -9.224 -6.790 4.555 1.00 1.00 C ATOM 1537 CD1 LEU B 216 -7.976 -7.349 5.241 1.00 1.00 C ATOM 1538 CD2 LEU B 216 -8.824 -5.967 3.321 1.00 1.00 C ATOM 0 H LEU B 216 -9.638 -10.507 4.920 1.00 1.00 H new ATOM 0 HA LEU B 216 -10.671 -8.053 6.231 1.00 1.00 H new ATOM 0 HB2 LEU B 216 -9.619 -8.609 3.457 1.00 1.00 H new ATOM 0 HB3 LEU B 216 -11.001 -7.540 3.580 1.00 1.00 H new ATOM 0 HG LEU B 216 -9.751 -6.146 5.259 1.00 1.00 H new ATOM 0 HD11 LEU B 216 -7.325 -6.527 5.538 1.00 1.00 H new ATOM 0 HD12 LEU B 216 -8.270 -7.917 6.124 1.00 1.00 H new ATOM 0 HD13 LEU B 216 -7.443 -8.002 4.550 1.00 1.00 H new ATOM 0 HD21 LEU B 216 -8.167 -5.152 3.625 1.00 1.00 H new ATOM 0 HD22 LEU B 216 -8.303 -6.608 2.610 1.00 1.00 H new ATOM 0 HD23 LEU B 216 -9.718 -5.556 2.852 1.00 1.00 H new ATOM 1550 N SER B 217 -13.034 -8.472 5.515 1.00 1.00 N ATOM 1551 CA SER B 217 -14.432 -8.837 5.333 1.00 1.00 C ATOM 1552 C SER B 217 -14.679 -9.258 3.883 1.00 1.00 C ATOM 1553 O SER B 217 -13.770 -9.681 3.177 1.00 1.00 O ATOM 1554 CB SER B 217 -15.342 -7.651 5.709 1.00 1.00 C ATOM 1555 OG SER B 217 -16.500 -8.142 6.372 1.00 1.00 O ATOM 0 H SER B 217 -12.893 -7.577 5.984 1.00 1.00 H new ATOM 0 HA SER B 217 -14.667 -9.677 5.986 1.00 1.00 H new ATOM 0 HB2 SER B 217 -14.806 -6.956 6.355 1.00 1.00 H new ATOM 0 HB3 SER B 217 -15.628 -7.098 4.814 1.00 1.00 H new ATOM 0 HG SER B 217 -17.081 -7.391 6.615 1.00 1.00 H new ATOM 1561 N ASN B 218 -15.914 -9.114 3.430 1.00 1.00 N ATOM 1562 CA ASN B 218 -16.263 -9.468 2.054 1.00 1.00 C ATOM 1563 C ASN B 218 -16.612 -8.218 1.253 1.00 1.00 C ATOM 1564 O ASN B 218 -16.239 -8.094 0.086 1.00 1.00 O ATOM 1565 CB ASN B 218 -17.451 -10.424 2.069 1.00 1.00 C ATOM 1566 CG ASN B 218 -17.113 -11.651 2.910 1.00 1.00 C ATOM 1567 OD1 ASN B 218 -15.862 -11.938 3.163 1.00 1.00 O flip ATOM 1568 ND2 ASN B 218 -18.010 -12.364 3.355 1.00 1.00 N flip ATOM 0 H ASN B 218 -16.691 -8.757 3.987 1.00 1.00 H new ATOM 0 HA ASN B 218 -15.408 -9.951 1.581 1.00 1.00 H new ATOM 0 HB2 ASN B 218 -18.329 -9.922 2.477 1.00 1.00 H new ATOM 0 HB3 ASN B 218 -17.700 -10.726 1.052 1.00 1.00 H new ATOM 0 HD21 ASN B 218 -18.985 -12.140 3.157 1.00 1.00 H new ATOM 0 HD22 ASN B 218 -17.779 -13.180 3.922 1.00 1.00 H new ATOM 1575 N GLU B 219 -17.329 -7.294 1.880 1.00 1.00 N ATOM 1576 CA GLU B 219 -17.720 -6.059 1.208 1.00 1.00 C ATOM 1577 C GLU B 219 -16.505 -5.173 0.948 1.00 1.00 C ATOM 1578 O GLU B 219 -16.453 -4.455 -0.048 1.00 1.00 O ATOM 1579 CB GLU B 219 -18.743 -5.300 2.057 1.00 1.00 C ATOM 1580 CG GLU B 219 -20.033 -6.119 2.168 1.00 1.00 C ATOM 1581 CD GLU B 219 -20.701 -6.238 0.802 1.00 1.00 C ATOM 1582 OE1 GLU B 219 -21.497 -7.147 0.630 1.00 1.00 O ATOM 1583 OE2 GLU B 219 -20.409 -5.417 -0.052 1.00 1.00 O ATOM 0 H GLU B 219 -17.650 -7.374 2.845 1.00 1.00 H new ATOM 0 HA GLU B 219 -18.169 -6.320 0.250 1.00 1.00 H new ATOM 0 HB2 GLU B 219 -18.336 -5.109 3.050 1.00 1.00 H new ATOM 0 HB3 GLU B 219 -18.955 -4.330 1.607 1.00 1.00 H new ATOM 0 HG2 GLU B 219 -19.810 -7.112 2.559 1.00 1.00 H new ATOM 0 HG3 GLU B 219 -20.714 -5.644 2.874 1.00 1.00 H new ATOM 1591 N VAL B 220 -15.526 -5.243 1.841 1.00 1.00 N ATOM 1592 CA VAL B 220 -14.305 -4.452 1.692 1.00 1.00 C ATOM 1593 C VAL B 220 -13.458 -4.968 0.530 1.00 1.00 C ATOM 1594 O VAL B 220 -12.924 -4.186 -0.257 1.00 1.00 O ATOM 1595 CB VAL B 220 -13.495 -4.511 2.988 1.00 1.00 C ATOM 1596 CG1 VAL B 220 -12.193 -3.731 2.815 1.00 1.00 C ATOM 1597 CG2 VAL B 220 -14.313 -3.902 4.128 1.00 1.00 C ATOM 0 H VAL B 220 -15.550 -5.834 2.672 1.00 1.00 H new ATOM 0 HA VAL B 220 -14.585 -3.420 1.480 1.00 1.00 H new ATOM 0 HB VAL B 220 -13.263 -5.549 3.224 1.00 1.00 H new ATOM 0 HG11 VAL B 220 -11.617 -3.774 3.740 1.00 1.00 H new ATOM 0 HG12 VAL B 220 -11.611 -4.170 2.004 1.00 1.00 H new ATOM 0 HG13 VAL B 220 -12.420 -2.692 2.577 1.00 1.00 H new ATOM 0 HG21 VAL B 220 -13.736 -3.944 5.052 1.00 1.00 H new ATOM 0 HG22 VAL B 220 -14.548 -2.864 3.893 1.00 1.00 H new ATOM 0 HG23 VAL B 220 -15.239 -4.464 4.252 1.00 1.00 H new ATOM 1607 N ILE B 221 -13.335 -6.288 0.425 1.00 1.00 N ATOM 1608 CA ILE B 221 -12.544 -6.888 -0.645 1.00 1.00 C ATOM 1609 C ILE B 221 -13.034 -6.381 -1.996 1.00 1.00 C ATOM 1610 O ILE B 221 -12.243 -6.157 -2.913 1.00 1.00 O ATOM 1611 CB ILE B 221 -12.656 -8.421 -0.584 1.00 1.00 C ATOM 1612 CG1 ILE B 221 -11.979 -8.929 0.696 1.00 1.00 C ATOM 1613 CG2 ILE B 221 -11.970 -9.042 -1.807 1.00 1.00 C ATOM 1614 CD1 ILE B 221 -12.262 -10.423 0.883 1.00 1.00 C ATOM 0 H ILE B 221 -13.768 -6.957 1.061 1.00 1.00 H new ATOM 0 HA ILE B 221 -11.499 -6.606 -0.518 1.00 1.00 H new ATOM 0 HB ILE B 221 -13.708 -8.706 -0.581 1.00 1.00 H new ATOM 0 HG12 ILE B 221 -10.904 -8.759 0.640 1.00 1.00 H new ATOM 0 HG13 ILE B 221 -12.346 -8.371 1.557 1.00 1.00 H new ATOM 0 HG21 ILE B 221 -12.053 -10.128 -1.758 1.00 1.00 H new ATOM 0 HG22 ILE B 221 -12.452 -8.682 -2.716 1.00 1.00 H new ATOM 0 HG23 ILE B 221 -10.918 -8.758 -1.817 1.00 1.00 H new ATOM 0 HD11 ILE B 221 -11.777 -10.774 1.794 1.00 1.00 H new ATOM 0 HD12 ILE B 221 -13.338 -10.583 0.960 1.00 1.00 H new ATOM 0 HD13 ILE B 221 -11.873 -10.977 0.029 1.00 1.00 H new ATOM 1626 N LYS B 222 -14.340 -6.186 -2.106 1.00 1.00 N ATOM 1627 CA LYS B 222 -14.924 -5.685 -3.341 1.00 1.00 C ATOM 1628 C LYS B 222 -14.461 -4.257 -3.605 1.00 1.00 C ATOM 1629 O LYS B 222 -14.154 -3.891 -4.739 1.00 1.00 O ATOM 1630 CB LYS B 222 -16.453 -5.738 -3.252 1.00 1.00 C ATOM 1631 CG LYS B 222 -16.922 -7.189 -3.065 1.00 1.00 C ATOM 1632 CD LYS B 222 -16.896 -7.945 -4.401 1.00 1.00 C ATOM 1633 CE LYS B 222 -17.419 -9.365 -4.193 1.00 1.00 C ATOM 1634 NZ LYS B 222 -17.478 -10.057 -5.509 1.00 1.00 N ATOM 0 H LYS B 222 -15.012 -6.366 -1.360 1.00 1.00 H new ATOM 0 HA LYS B 222 -14.594 -6.314 -4.168 1.00 1.00 H new ATOM 0 HB2 LYS B 222 -16.798 -5.126 -2.418 1.00 1.00 H new ATOM 0 HB3 LYS B 222 -16.892 -5.320 -4.158 1.00 1.00 H new ATOM 0 HG2 LYS B 222 -16.280 -7.694 -2.343 1.00 1.00 H new ATOM 0 HG3 LYS B 222 -17.932 -7.200 -2.655 1.00 1.00 H new ATOM 0 HD2 LYS B 222 -17.508 -7.425 -5.137 1.00 1.00 H new ATOM 0 HD3 LYS B 222 -15.880 -7.974 -4.795 1.00 1.00 H new ATOM 0 HE2 LYS B 222 -16.767 -9.910 -3.510 1.00 1.00 H new ATOM 0 HE3 LYS B 222 -18.409 -9.339 -3.737 1.00 1.00 H new ATOM 0 HZ1 LYS B 222 -17.833 -11.025 -5.376 1.00 1.00 H new ATOM 0 HZ2 LYS B 222 -18.116 -9.538 -6.146 1.00 1.00 H new ATOM 0 HZ3 LYS B 222 -16.526 -10.092 -5.926 1.00 1.00 H new ATOM 1648 N GLN B 223 -14.414 -3.455 -2.547 1.00 1.00 N ATOM 1649 CA GLN B 223 -13.987 -2.073 -2.673 1.00 1.00 C ATOM 1650 C GLN B 223 -12.546 -2.018 -3.167 1.00 1.00 C ATOM 1651 O GLN B 223 -12.214 -1.251 -4.070 1.00 1.00 O ATOM 1652 CB GLN B 223 -14.100 -1.375 -1.312 1.00 1.00 C ATOM 1653 CG GLN B 223 -15.561 -1.309 -0.889 1.00 1.00 C ATOM 1654 CD GLN B 223 -15.693 -0.596 0.452 1.00 1.00 C ATOM 1655 OE1 GLN B 223 -15.206 -1.086 1.470 1.00 1.00 O ATOM 1656 NE2 GLN B 223 -16.327 0.545 0.512 1.00 1.00 N ATOM 0 H GLN B 223 -14.665 -3.739 -1.600 1.00 1.00 H new ATOM 0 HA GLN B 223 -14.627 -1.563 -3.393 1.00 1.00 H new ATOM 0 HB2 GLN B 223 -13.519 -1.917 -0.565 1.00 1.00 H new ATOM 0 HB3 GLN B 223 -13.683 -0.370 -1.372 1.00 1.00 H new ATOM 0 HG2 GLN B 223 -16.142 -0.783 -1.647 1.00 1.00 H new ATOM 0 HG3 GLN B 223 -15.971 -2.316 -0.815 1.00 1.00 H new ATOM 0 HE21 GLN B 223 -16.730 0.950 -0.333 1.00 1.00 H new ATOM 0 HE22 GLN B 223 -16.419 1.031 1.404 1.00 1.00 H new ATOM 1665 N LEU B 224 -11.699 -2.845 -2.568 1.00 1.00 N ATOM 1666 CA LEU B 224 -10.291 -2.899 -2.946 1.00 1.00 C ATOM 1667 C LEU B 224 -10.145 -3.366 -4.388 1.00 1.00 C ATOM 1668 O LEU B 224 -9.332 -2.834 -5.144 1.00 1.00 O ATOM 1669 CB LEU B 224 -9.543 -3.856 -2.013 1.00 1.00 C ATOM 1670 CG LEU B 224 -9.452 -3.253 -0.602 1.00 1.00 C ATOM 1671 CD1 LEU B 224 -8.987 -4.334 0.379 1.00 1.00 C ATOM 1672 CD2 LEU B 224 -8.456 -2.072 -0.571 1.00 1.00 C ATOM 0 H LEU B 224 -11.961 -3.487 -1.820 1.00 1.00 H new ATOM 0 HA LEU B 224 -9.865 -1.899 -2.858 1.00 1.00 H new ATOM 0 HB2 LEU B 224 -10.058 -4.816 -1.974 1.00 1.00 H new ATOM 0 HB3 LEU B 224 -8.542 -4.047 -2.401 1.00 1.00 H new ATOM 0 HG LEU B 224 -10.437 -2.883 -0.317 1.00 1.00 H new ATOM 0 HD11 LEU B 224 -8.921 -3.911 1.382 1.00 1.00 H new ATOM 0 HD12 LEU B 224 -9.701 -5.157 0.379 1.00 1.00 H new ATOM 0 HD13 LEU B 224 -8.007 -4.704 0.076 1.00 1.00 H new ATOM 0 HD21 LEU B 224 -8.409 -1.662 0.438 1.00 1.00 H new ATOM 0 HD22 LEU B 224 -7.467 -2.422 -0.867 1.00 1.00 H new ATOM 0 HD23 LEU B 224 -8.788 -1.297 -1.262 1.00 1.00 H new ATOM 1684 N ASP B 225 -10.936 -4.362 -4.764 1.00 1.00 N ATOM 1685 CA ASP B 225 -10.883 -4.891 -6.117 1.00 1.00 C ATOM 1686 C ASP B 225 -11.189 -3.793 -7.130 1.00 1.00 C ATOM 1687 O ASP B 225 -10.483 -3.641 -8.125 1.00 1.00 O ATOM 1688 CB ASP B 225 -11.898 -6.023 -6.269 1.00 1.00 C ATOM 1689 CG ASP B 225 -11.833 -6.598 -7.679 1.00 1.00 C ATOM 1690 OD1 ASP B 225 -12.500 -7.589 -7.925 1.00 1.00 O ATOM 1691 OD2 ASP B 225 -11.115 -6.039 -8.493 1.00 1.00 O ATOM 0 H ASP B 225 -11.617 -4.816 -4.155 1.00 1.00 H new ATOM 0 HA ASP B 225 -9.879 -5.273 -6.303 1.00 1.00 H new ATOM 0 HB2 ASP B 225 -11.693 -6.806 -5.539 1.00 1.00 H new ATOM 0 HB3 ASP B 225 -12.902 -5.651 -6.065 1.00 1.00 H new ATOM 1697 N ASP B 226 -12.247 -3.034 -6.872 1.00 1.00 N ATOM 1698 CA ASP B 226 -12.639 -1.955 -7.775 1.00 1.00 C ATOM 1699 C ASP B 226 -11.524 -0.919 -7.903 1.00 1.00 C ATOM 1700 O ASP B 226 -11.180 -0.492 -9.006 1.00 1.00 O ATOM 1701 CB ASP B 226 -13.910 -1.279 -7.255 1.00 1.00 C ATOM 1702 CG ASP B 226 -14.431 -0.288 -8.291 1.00 1.00 C ATOM 1703 OD1 ASP B 226 -15.591 0.078 -8.202 1.00 1.00 O ATOM 1704 OD2 ASP B 226 -13.661 0.091 -9.159 1.00 1.00 O ATOM 0 H ASP B 226 -12.845 -3.143 -6.053 1.00 1.00 H new ATOM 0 HA ASP B 226 -12.828 -2.384 -8.759 1.00 1.00 H new ATOM 0 HB2 ASP B 226 -14.671 -2.030 -7.042 1.00 1.00 H new ATOM 0 HB3 ASP B 226 -13.701 -0.763 -6.318 1.00 1.00 H new ATOM 1710 N LEU B 227 -10.954 -0.531 -6.768 1.00 1.00 N ATOM 1711 CA LEU B 227 -9.884 0.426 -6.746 1.00 1.00 C ATOM 1712 C LEU B 227 -8.638 -0.141 -7.418 1.00 1.00 C ATOM 1713 O LEU B 227 -7.892 0.583 -8.078 1.00 1.00 O ATOM 1714 CB LEU B 227 -9.568 0.806 -5.293 1.00 1.00 C ATOM 1715 CG LEU B 227 -8.775 2.120 -5.280 1.00 1.00 C ATOM 1716 CD1 LEU B 227 -9.723 3.327 -5.250 1.00 1.00 C ATOM 1717 CD2 LEU B 227 -7.847 2.180 -4.060 1.00 1.00 C ATOM 0 H LEU B 227 -11.228 -0.876 -5.848 1.00 1.00 H new ATOM 0 HA LEU B 227 -10.196 1.313 -7.297 1.00 1.00 H new ATOM 0 HB2 LEU B 227 -10.491 0.918 -4.724 1.00 1.00 H new ATOM 0 HB3 LEU B 227 -8.992 0.014 -4.814 1.00 1.00 H new ATOM 0 HG LEU B 227 -8.177 2.155 -6.191 1.00 1.00 H new ATOM 0 HD11 LEU B 227 -9.140 4.248 -5.241 1.00 1.00 H new ATOM 0 HD12 LEU B 227 -10.361 3.310 -6.133 1.00 1.00 H new ATOM 0 HD13 LEU B 227 -10.342 3.281 -4.354 1.00 1.00 H new ATOM 0 HD21 LEU B 227 -7.294 3.119 -4.069 1.00 1.00 H new ATOM 0 HD22 LEU B 227 -8.441 2.118 -3.148 1.00 1.00 H new ATOM 0 HD23 LEU B 227 -7.146 1.346 -4.095 1.00 1.00 H new ATOM 1729 N GLU B 228 -8.409 -1.437 -7.233 1.00 1.00 N ATOM 1730 CA GLU B 228 -7.241 -2.088 -7.814 1.00 1.00 C ATOM 1731 C GLU B 228 -7.348 -2.134 -9.335 1.00 1.00 C ATOM 1732 O GLU B 228 -6.360 -1.935 -10.041 1.00 1.00 O ATOM 1733 CB GLU B 228 -7.124 -3.513 -7.267 1.00 1.00 C ATOM 1734 CG GLU B 228 -5.741 -4.073 -7.594 1.00 1.00 C ATOM 1735 CD GLU B 228 -5.648 -5.529 -7.154 1.00 1.00 C ATOM 1736 OE1 GLU B 228 -4.551 -6.061 -7.161 1.00 1.00 O ATOM 1737 OE2 GLU B 228 -6.677 -6.092 -6.815 1.00 1.00 O ATOM 0 H GLU B 228 -9.013 -2.054 -6.689 1.00 1.00 H new ATOM 0 HA GLU B 228 -6.354 -1.514 -7.545 1.00 1.00 H new ATOM 0 HB2 GLU B 228 -7.283 -3.514 -6.189 1.00 1.00 H new ATOM 0 HB3 GLU B 228 -7.897 -4.146 -7.703 1.00 1.00 H new ATOM 0 HG2 GLU B 228 -5.553 -3.996 -8.665 1.00 1.00 H new ATOM 0 HG3 GLU B 228 -4.974 -3.484 -7.092 1.00 1.00 H new ATOM 1745 N VAL B 229 -8.550 -2.406 -9.835 1.00 1.00 N ATOM 1746 CA VAL B 229 -8.767 -2.481 -11.278 1.00 1.00 C ATOM 1747 C VAL B 229 -8.520 -1.125 -11.934 1.00 1.00 C ATOM 1748 O VAL B 229 -7.871 -1.040 -12.976 1.00 1.00 O ATOM 1749 CB VAL B 229 -10.205 -2.937 -11.569 1.00 1.00 C ATOM 1750 CG1 VAL B 229 -10.505 -2.796 -13.067 1.00 1.00 C ATOM 1751 CG2 VAL B 229 -10.373 -4.403 -11.151 1.00 1.00 C ATOM 0 H VAL B 229 -9.382 -2.577 -9.270 1.00 1.00 H new ATOM 0 HA VAL B 229 -8.064 -3.204 -11.692 1.00 1.00 H new ATOM 0 HB VAL B 229 -10.898 -2.314 -11.004 1.00 1.00 H new ATOM 0 HG11 VAL B 229 -11.526 -3.121 -13.266 1.00 1.00 H new ATOM 0 HG12 VAL B 229 -10.392 -1.753 -13.364 1.00 1.00 H new ATOM 0 HG13 VAL B 229 -9.810 -3.413 -13.637 1.00 1.00 H new ATOM 0 HG21 VAL B 229 -11.393 -4.726 -11.358 1.00 1.00 H new ATOM 0 HG22 VAL B 229 -9.675 -5.024 -11.713 1.00 1.00 H new ATOM 0 HG23 VAL B 229 -10.170 -4.503 -10.085 1.00 1.00 H new ATOM 1761 N GLN B 230 -9.042 -0.071 -11.322 1.00 1.00 N ATOM 1762 CA GLN B 230 -8.875 1.270 -11.865 1.00 1.00 C ATOM 1763 C GLN B 230 -7.411 1.689 -11.827 1.00 1.00 C ATOM 1764 O GLN B 230 -6.903 2.303 -12.765 1.00 1.00 O ATOM 1765 CB GLN B 230 -9.716 2.264 -11.059 1.00 1.00 C ATOM 1766 CG GLN B 230 -11.202 2.028 -11.345 1.00 1.00 C ATOM 1767 CD GLN B 230 -12.053 2.956 -10.483 1.00 1.00 C ATOM 1768 OE1 GLN B 230 -11.698 3.243 -9.340 1.00 1.00 O ATOM 1769 NE2 GLN B 230 -13.163 3.447 -10.967 1.00 1.00 N ATOM 0 H GLN B 230 -9.580 -0.117 -10.457 1.00 1.00 H new ATOM 0 HA GLN B 230 -9.209 1.266 -12.903 1.00 1.00 H new ATOM 0 HB2 GLN B 230 -9.517 2.145 -9.994 1.00 1.00 H new ATOM 0 HB3 GLN B 230 -9.442 3.286 -11.323 1.00 1.00 H new ATOM 0 HG2 GLN B 230 -11.410 2.205 -12.400 1.00 1.00 H new ATOM 0 HG3 GLN B 230 -11.460 0.989 -11.139 1.00 1.00 H new ATOM 0 HE21 GLN B 230 -13.456 3.208 -11.914 1.00 1.00 H new ATOM 0 HE22 GLN B 230 -13.737 4.069 -10.397 1.00 1.00 H new ATOM 1778 N ARG B 231 -6.738 1.353 -10.736 1.00 1.00 N ATOM 1779 CA ARG B 231 -5.334 1.701 -10.576 1.00 1.00 C ATOM 1780 C ARG B 231 -4.469 0.908 -11.547 1.00 1.00 C ATOM 1781 O ARG B 231 -3.483 1.421 -12.072 1.00 1.00 O ATOM 1782 CB ARG B 231 -4.898 1.435 -9.134 1.00 1.00 C ATOM 1783 CG ARG B 231 -5.580 2.431 -8.180 1.00 1.00 C ATOM 1784 CD ARG B 231 -4.749 3.715 -8.082 1.00 1.00 C ATOM 1785 NE ARG B 231 -3.603 3.504 -7.206 1.00 1.00 N ATOM 1786 CZ ARG B 231 -2.678 4.443 -7.051 1.00 1.00 C ATOM 1787 NH1 ARG B 231 -2.783 5.574 -7.692 1.00 1.00 N ATOM 1788 NH2 ARG B 231 -1.663 4.233 -6.258 1.00 1.00 N ATOM 0 H ARG B 231 -7.140 0.841 -9.951 1.00 1.00 H new ATOM 0 HA ARG B 231 -5.207 2.761 -10.798 1.00 1.00 H new ATOM 0 HB2 ARG B 231 -5.156 0.414 -8.851 1.00 1.00 H new ATOM 0 HB3 ARG B 231 -3.815 1.525 -9.051 1.00 1.00 H new ATOM 0 HG2 ARG B 231 -6.583 2.663 -8.539 1.00 1.00 H new ATOM 0 HG3 ARG B 231 -5.691 1.984 -7.192 1.00 1.00 H new ATOM 0 HD2 ARG B 231 -4.409 4.014 -9.073 1.00 1.00 H new ATOM 0 HD3 ARG B 231 -5.365 4.528 -7.698 1.00 1.00 H new ATOM 0 HE ARG B 231 -3.511 2.621 -6.704 1.00 1.00 H new ATOM 0 HH11 ARG B 231 -3.576 5.737 -8.312 1.00 1.00 H new ATOM 0 HH12 ARG B 231 -2.072 6.296 -7.573 1.00 1.00 H new ATOM 0 HH21 ARG B 231 -1.581 3.348 -5.758 1.00 1.00 H new ATOM 0 HH22 ARG B 231 -0.952 4.954 -6.138 1.00 1.00 H new ATOM 1802 N ASN B 232 -4.857 -0.342 -11.776 1.00 1.00 N ATOM 1803 CA ASN B 232 -4.129 -1.217 -12.689 1.00 1.00 C ATOM 1804 C ASN B 232 -2.822 -1.702 -12.064 1.00 1.00 C ATOM 1805 O ASN B 232 -1.783 -1.727 -12.720 1.00 1.00 O ATOM 1806 CB ASN B 232 -3.831 -0.474 -14.002 1.00 1.00 C ATOM 1807 CG ASN B 232 -3.617 -1.468 -15.138 1.00 1.00 C ATOM 1808 OD1 ASN B 232 -3.239 -2.685 -14.865 1.00 1.00 O flip ATOM 1809 ND2 ASN B 232 -3.797 -1.124 -16.306 1.00 1.00 N flip ATOM 0 H ASN B 232 -5.673 -0.773 -11.341 1.00 1.00 H new ATOM 0 HA ASN B 232 -4.754 -2.086 -12.894 1.00 1.00 H new ATOM 0 HB2 ASN B 232 -4.658 0.194 -14.245 1.00 1.00 H new ATOM 0 HB3 ASN B 232 -2.944 0.148 -13.882 1.00 1.00 H new ATOM 0 HD21 ASN B 232 -4.093 -0.171 -16.517 1.00 1.00 H new ATOM 0 HD22 ASN B 232 -3.650 -1.792 -17.063 1.00 1.00 H new ATOM 1816 N LEU B 233 -2.878 -2.089 -10.791 1.00 1.00 N ATOM 1817 CA LEU B 233 -1.684 -2.575 -10.098 1.00 1.00 C ATOM 1818 C LEU B 233 -2.074 -3.605 -9.038 1.00 1.00 C ATOM 1819 O LEU B 233 -3.220 -3.646 -8.591 1.00 1.00 O ATOM 1820 CB LEU B 233 -0.930 -1.392 -9.449 1.00 1.00 C ATOM 1821 CG LEU B 233 -1.916 -0.304 -9.055 1.00 1.00 C ATOM 1822 CD1 LEU B 233 -2.945 -0.877 -8.065 1.00 1.00 C ATOM 1823 CD2 LEU B 233 -1.143 0.852 -8.406 1.00 1.00 C ATOM 0 H LEU B 233 -3.725 -2.077 -10.223 1.00 1.00 H new ATOM 0 HA LEU B 233 -1.024 -3.054 -10.822 1.00 1.00 H new ATOM 0 HB2 LEU B 233 -0.384 -1.736 -8.570 1.00 1.00 H new ATOM 0 HB3 LEU B 233 -0.193 -0.992 -10.146 1.00 1.00 H new ATOM 0 HG LEU B 233 -2.444 0.061 -9.936 1.00 1.00 H new ATOM 0 HD11 LEU B 233 -3.652 -0.097 -7.783 1.00 1.00 H new ATOM 0 HD12 LEU B 233 -3.482 -1.701 -8.535 1.00 1.00 H new ATOM 0 HD13 LEU B 233 -2.431 -1.240 -7.175 1.00 1.00 H new ATOM 0 HD21 LEU B 233 -1.840 1.640 -8.119 1.00 1.00 H new ATOM 0 HD22 LEU B 233 -0.621 0.489 -7.521 1.00 1.00 H new ATOM 0 HD23 LEU B 233 -0.419 1.250 -9.117 1.00 1.00 H new ATOM 1835 N PRO B 234 -1.149 -4.432 -8.628 1.00 1.00 N ATOM 1836 CA PRO B 234 -1.411 -5.472 -7.586 1.00 1.00 C ATOM 1837 C PRO B 234 -1.864 -4.854 -6.259 1.00 1.00 C ATOM 1838 O PRO B 234 -1.383 -3.795 -5.855 1.00 1.00 O ATOM 1839 CB PRO B 234 -0.054 -6.195 -7.438 1.00 1.00 C ATOM 1840 CG PRO B 234 0.959 -5.252 -8.008 1.00 1.00 C ATOM 1841 CD PRO B 234 0.241 -4.489 -9.113 1.00 1.00 C ATOM 0 HA PRO B 234 -2.220 -6.145 -7.869 1.00 1.00 H new ATOM 0 HB2 PRO B 234 0.161 -6.419 -6.393 1.00 1.00 H new ATOM 0 HB3 PRO B 234 -0.053 -7.144 -7.974 1.00 1.00 H new ATOM 0 HG2 PRO B 234 1.334 -4.572 -7.243 1.00 1.00 H new ATOM 0 HG3 PRO B 234 1.819 -5.794 -8.402 1.00 1.00 H new ATOM 0 HD2 PRO B 234 0.660 -3.493 -9.254 1.00 1.00 H new ATOM 0 HD3 PRO B 234 0.313 -5.003 -10.071 1.00 1.00 H new ATOM 1849 N ARG B 235 -2.791 -5.532 -5.589 1.00 1.00 N ATOM 1850 CA ARG B 235 -3.307 -5.062 -4.312 1.00 1.00 C ATOM 1851 C ARG B 235 -2.183 -4.977 -3.292 1.00 1.00 C ATOM 1852 O ARG B 235 -2.109 -4.033 -2.507 1.00 1.00 O ATOM 1853 CB ARG B 235 -4.387 -6.025 -3.820 1.00 1.00 C ATOM 1854 CG ARG B 235 -3.764 -7.384 -3.488 1.00 1.00 C ATOM 1855 CD ARG B 235 -4.875 -8.408 -3.240 1.00 1.00 C ATOM 1856 NE ARG B 235 -4.298 -9.704 -2.900 1.00 1.00 N ATOM 1857 CZ ARG B 235 -5.021 -10.817 -2.960 1.00 1.00 C ATOM 1858 NH1 ARG B 235 -6.272 -10.764 -3.329 1.00 1.00 N ATOM 1859 NH2 ARG B 235 -4.480 -11.965 -2.653 1.00 1.00 N ATOM 0 H ARG B 235 -3.199 -6.409 -5.911 1.00 1.00 H new ATOM 0 HA ARG B 235 -3.736 -4.068 -4.440 1.00 1.00 H new ATOM 0 HB2 ARG B 235 -4.877 -5.615 -2.937 1.00 1.00 H new ATOM 0 HB3 ARG B 235 -5.155 -6.145 -4.584 1.00 1.00 H new ATOM 0 HG2 ARG B 235 -3.127 -7.714 -4.309 1.00 1.00 H new ATOM 0 HG3 ARG B 235 -3.129 -7.299 -2.606 1.00 1.00 H new ATOM 0 HD2 ARG B 235 -5.521 -8.066 -2.432 1.00 1.00 H new ATOM 0 HD3 ARG B 235 -5.499 -8.501 -4.129 1.00 1.00 H new ATOM 0 HE ARG B 235 -3.321 -9.757 -2.611 1.00 1.00 H new ATOM 0 HH11 ARG B 235 -6.695 -9.868 -3.571 1.00 1.00 H new ATOM 0 HH12 ARG B 235 -6.827 -11.619 -3.375 1.00 1.00 H new ATOM 0 HH21 ARG B 235 -3.502 -12.008 -2.367 1.00 1.00 H new ATOM 0 HH22 ARG B 235 -5.036 -12.819 -2.699 1.00 1.00 H new ATOM 1873 N ALA B 236 -1.309 -5.973 -3.306 1.00 1.00 N ATOM 1874 CA ALA B 236 -0.191 -5.998 -2.371 1.00 1.00 C ATOM 1875 C ALA B 236 0.521 -4.653 -2.374 1.00 1.00 C ATOM 1876 O ALA B 236 0.933 -4.161 -1.325 1.00 1.00 O ATOM 1877 CB ALA B 236 0.798 -7.101 -2.763 1.00 1.00 C ATOM 0 H ALA B 236 -1.350 -6.766 -3.946 1.00 1.00 H new ATOM 0 HA ALA B 236 -0.576 -6.199 -1.371 1.00 1.00 H new ATOM 0 HB1 ALA B 236 1.630 -7.111 -2.058 1.00 1.00 H new ATOM 0 HB2 ALA B 236 0.293 -8.067 -2.742 1.00 1.00 H new ATOM 0 HB3 ALA B 236 1.176 -6.911 -3.767 1.00 1.00 H new ATOM 1883 N ASP B 237 0.653 -4.050 -3.552 1.00 1.00 N ATOM 1884 CA ASP B 237 1.303 -2.751 -3.650 1.00 1.00 C ATOM 1885 C ASP B 237 0.476 -1.679 -2.939 1.00 1.00 C ATOM 1886 O ASP B 237 1.022 -0.786 -2.291 1.00 1.00 O ATOM 1887 CB ASP B 237 1.487 -2.372 -5.122 1.00 1.00 C ATOM 1888 CG ASP B 237 2.187 -1.023 -5.236 1.00 1.00 C ATOM 1889 OD1 ASP B 237 2.400 -0.398 -4.210 1.00 1.00 O ATOM 1890 OD2 ASP B 237 2.499 -0.634 -6.349 1.00 1.00 O ATOM 0 H ASP B 237 0.324 -4.434 -4.438 1.00 1.00 H new ATOM 0 HA ASP B 237 2.278 -2.814 -3.167 1.00 1.00 H new ATOM 0 HB2 ASP B 237 2.072 -3.138 -5.631 1.00 1.00 H new ATOM 0 HB3 ASP B 237 0.517 -2.329 -5.618 1.00 1.00 H new ATOM 1896 N LEU B 238 -0.845 -1.779 -3.065 1.00 1.00 N ATOM 1897 CA LEU B 238 -1.741 -0.816 -2.430 1.00 1.00 C ATOM 1898 C LEU B 238 -1.656 -0.912 -0.912 1.00 1.00 C ATOM 1899 O LEU B 238 -1.634 0.103 -0.215 1.00 1.00 O ATOM 1900 CB LEU B 238 -3.182 -1.068 -2.884 1.00 1.00 C ATOM 1901 CG LEU B 238 -3.328 -0.731 -4.377 1.00 1.00 C ATOM 1902 CD1 LEU B 238 -4.730 -1.134 -4.848 1.00 1.00 C ATOM 1903 CD2 LEU B 238 -3.104 0.781 -4.624 1.00 1.00 C ATOM 0 H LEU B 238 -1.316 -2.511 -3.597 1.00 1.00 H new ATOM 0 HA LEU B 238 -1.434 0.186 -2.730 1.00 1.00 H new ATOM 0 HB2 LEU B 238 -3.450 -2.110 -2.710 1.00 1.00 H new ATOM 0 HB3 LEU B 238 -3.869 -0.459 -2.296 1.00 1.00 H new ATOM 0 HG LEU B 238 -2.575 -1.283 -4.940 1.00 1.00 H new ATOM 0 HD11 LEU B 238 -4.840 -0.898 -5.906 1.00 1.00 H new ATOM 0 HD12 LEU B 238 -4.870 -2.205 -4.699 1.00 1.00 H new ATOM 0 HD13 LEU B 238 -5.478 -0.587 -4.274 1.00 1.00 H new ATOM 0 HD21 LEU B 238 -3.212 0.996 -5.687 1.00 1.00 H new ATOM 0 HD22 LEU B 238 -3.840 1.355 -4.061 1.00 1.00 H new ATOM 0 HD23 LEU B 238 -2.102 1.058 -4.298 1.00 1.00 H new ATOM 1915 N LEU B 239 -1.612 -2.137 -0.407 1.00 1.00 N ATOM 1916 CA LEU B 239 -1.537 -2.353 1.029 1.00 1.00 C ATOM 1917 C LEU B 239 -0.245 -1.769 1.586 1.00 1.00 C ATOM 1918 O LEU B 239 -0.244 -1.128 2.638 1.00 1.00 O ATOM 1919 CB LEU B 239 -1.602 -3.853 1.324 1.00 1.00 C ATOM 1920 CG LEU B 239 -2.992 -4.399 0.965 1.00 1.00 C ATOM 1921 CD1 LEU B 239 -2.973 -5.929 1.077 1.00 1.00 C ATOM 1922 CD2 LEU B 239 -4.069 -3.813 1.909 1.00 1.00 C ATOM 0 H LEU B 239 -1.627 -2.990 -0.966 1.00 1.00 H new ATOM 0 HA LEU B 239 -2.379 -1.853 1.508 1.00 1.00 H new ATOM 0 HB2 LEU B 239 -0.837 -4.378 0.752 1.00 1.00 H new ATOM 0 HB3 LEU B 239 -1.392 -4.034 2.378 1.00 1.00 H new ATOM 0 HG LEU B 239 -3.238 -4.106 -0.056 1.00 1.00 H new ATOM 0 HD11 LEU B 239 -3.957 -6.325 0.824 1.00 1.00 H new ATOM 0 HD12 LEU B 239 -2.231 -6.335 0.390 1.00 1.00 H new ATOM 0 HD13 LEU B 239 -2.718 -6.216 2.097 1.00 1.00 H new ATOM 0 HD21 LEU B 239 -5.046 -4.212 1.638 1.00 1.00 H new ATOM 0 HD22 LEU B 239 -3.838 -4.086 2.939 1.00 1.00 H new ATOM 0 HD23 LEU B 239 -4.082 -2.727 1.816 1.00 1.00 H new ATOM 1934 N ARG B 240 0.855 -1.996 0.881 1.00 1.00 N ATOM 1935 CA ARG B 240 2.146 -1.490 1.324 1.00 1.00 C ATOM 1936 C ARG B 240 2.113 0.033 1.407 1.00 1.00 C ATOM 1937 O ARG B 240 2.603 0.622 2.370 1.00 1.00 O ATOM 1938 CB ARG B 240 3.241 -1.938 0.354 1.00 1.00 C ATOM 1939 CG ARG B 240 4.605 -1.496 0.880 1.00 1.00 C ATOM 1940 CD ARG B 240 5.705 -2.100 0.006 1.00 1.00 C ATOM 1941 NE ARG B 240 5.703 -3.553 0.132 1.00 1.00 N ATOM 1942 CZ ARG B 240 6.453 -4.312 -0.661 1.00 1.00 C ATOM 1943 NH1 ARG B 240 7.210 -3.760 -1.568 1.00 1.00 N ATOM 1944 NH2 ARG B 240 6.429 -5.611 -0.533 1.00 1.00 N ATOM 0 H ARG B 240 0.880 -2.522 0.008 1.00 1.00 H new ATOM 0 HA ARG B 240 2.362 -1.891 2.314 1.00 1.00 H new ATOM 0 HB2 ARG B 240 3.218 -3.022 0.240 1.00 1.00 H new ATOM 0 HB3 ARG B 240 3.064 -1.509 -0.633 1.00 1.00 H new ATOM 0 HG2 ARG B 240 4.675 -0.408 0.873 1.00 1.00 H new ATOM 0 HG3 ARG B 240 4.730 -1.816 1.914 1.00 1.00 H new ATOM 0 HD2 ARG B 240 5.550 -1.817 -1.035 1.00 1.00 H new ATOM 0 HD3 ARG B 240 6.676 -1.703 0.303 1.00 1.00 H new ATOM 0 HE ARG B 240 5.116 -3.994 0.840 1.00 1.00 H new ATOM 0 HH11 ARG B 240 7.227 -2.745 -1.669 1.00 1.00 H new ATOM 0 HH12 ARG B 240 7.785 -4.343 -2.176 1.00 1.00 H new ATOM 0 HH21 ARG B 240 5.835 -6.043 0.175 1.00 1.00 H new ATOM 0 HH22 ARG B 240 7.004 -6.194 -1.141 1.00 1.00 H new ATOM 1958 N GLU B 241 1.522 0.663 0.395 1.00 1.00 N ATOM 1959 CA GLU B 241 1.420 2.117 0.368 1.00 1.00 C ATOM 1960 C GLU B 241 0.482 2.607 1.466 1.00 1.00 C ATOM 1961 O GLU B 241 0.759 3.602 2.135 1.00 1.00 O ATOM 1962 CB GLU B 241 0.897 2.577 -0.994 1.00 1.00 C ATOM 1963 CG GLU B 241 1.948 2.292 -2.068 1.00 1.00 C ATOM 1964 CD GLU B 241 1.400 2.654 -3.445 1.00 1.00 C ATOM 1965 OE1 GLU B 241 2.116 2.466 -4.414 1.00 1.00 O ATOM 1966 OE2 GLU B 241 0.271 3.113 -3.509 1.00 1.00 O ATOM 0 H GLU B 241 1.110 0.193 -0.411 1.00 1.00 H new ATOM 0 HA GLU B 241 2.412 2.537 0.538 1.00 1.00 H new ATOM 0 HB2 GLU B 241 -0.032 2.059 -1.233 1.00 1.00 H new ATOM 0 HB3 GLU B 241 0.669 3.643 -0.967 1.00 1.00 H new ATOM 0 HG2 GLU B 241 2.852 2.866 -1.865 1.00 1.00 H new ATOM 0 HG3 GLU B 241 2.227 1.239 -2.044 1.00 1.00 H new ATOM 1974 N ALA B 242 -0.627 1.898 1.650 1.00 1.00 N ATOM 1975 CA ALA B 242 -1.594 2.271 2.675 1.00 1.00 C ATOM 1976 C ALA B 242 -0.923 2.281 4.043 1.00 1.00 C ATOM 1977 O ALA B 242 -1.093 3.221 4.818 1.00 1.00 O ATOM 1978 CB ALA B 242 -2.765 1.280 2.675 1.00 1.00 C ATOM 0 H ALA B 242 -0.877 1.070 1.109 1.00 1.00 H new ATOM 0 HA ALA B 242 -1.974 3.269 2.458 1.00 1.00 H new ATOM 0 HB1 ALA B 242 -3.483 1.565 3.444 1.00 1.00 H new ATOM 0 HB2 ALA B 242 -3.252 1.293 1.700 1.00 1.00 H new ATOM 0 HB3 ALA B 242 -2.392 0.277 2.881 1.00 1.00 H new ATOM 1984 N VAL B 243 -0.155 1.235 4.331 1.00 1.00 N ATOM 1985 CA VAL B 243 0.541 1.154 5.608 1.00 1.00 C ATOM 1986 C VAL B 243 1.641 2.213 5.683 1.00 1.00 C ATOM 1987 O VAL B 243 1.732 2.963 6.654 1.00 1.00 O ATOM 1988 CB VAL B 243 1.147 -0.241 5.780 1.00 1.00 C ATOM 1989 CG1 VAL B 243 1.929 -0.306 7.093 1.00 1.00 C ATOM 1990 CG2 VAL B 243 0.024 -1.285 5.803 1.00 1.00 C ATOM 0 H VAL B 243 -0.001 0.443 3.707 1.00 1.00 H new ATOM 0 HA VAL B 243 -0.174 1.337 6.410 1.00 1.00 H new ATOM 0 HB VAL B 243 1.821 -0.447 4.948 1.00 1.00 H new ATOM 0 HG11 VAL B 243 2.359 -1.301 7.212 1.00 1.00 H new ATOM 0 HG12 VAL B 243 2.728 0.435 7.078 1.00 1.00 H new ATOM 0 HG13 VAL B 243 1.258 -0.099 7.927 1.00 1.00 H new ATOM 0 HG21 VAL B 243 0.454 -2.279 5.925 1.00 1.00 H new ATOM 0 HG22 VAL B 243 -0.650 -1.076 6.634 1.00 1.00 H new ATOM 0 HG23 VAL B 243 -0.531 -1.243 4.866 1.00 1.00 H new ATOM 2000 N ASP B 244 2.479 2.256 4.650 1.00 1.00 N ATOM 2001 CA ASP B 244 3.576 3.206 4.607 1.00 1.00 C ATOM 2002 C ASP B 244 3.036 4.619 4.802 1.00 1.00 C ATOM 2003 O ASP B 244 3.571 5.398 5.590 1.00 1.00 O ATOM 2004 CB ASP B 244 4.289 3.092 3.250 1.00 1.00 C ATOM 2005 CG ASP B 244 5.297 1.939 3.253 1.00 1.00 C ATOM 2006 OD1 ASP B 244 5.859 1.673 2.203 1.00 1.00 O ATOM 2007 OD2 ASP B 244 5.484 1.332 4.295 1.00 1.00 O ATOM 0 H ASP B 244 2.416 1.644 3.836 1.00 1.00 H new ATOM 0 HA ASP B 244 4.286 2.988 5.405 1.00 1.00 H new ATOM 0 HB2 ASP B 244 3.553 2.934 2.461 1.00 1.00 H new ATOM 0 HB3 ASP B 244 4.802 4.027 3.025 1.00 1.00 H new ATOM 2013 N GLN B 245 1.961 4.938 4.092 1.00 1.00 N ATOM 2014 CA GLN B 245 1.350 6.250 4.207 1.00 1.00 C ATOM 2015 C GLN B 245 0.809 6.466 5.618 1.00 1.00 C ATOM 2016 O GLN B 245 0.924 7.557 6.178 1.00 1.00 O ATOM 2017 CB GLN B 245 0.216 6.377 3.185 1.00 1.00 C ATOM 2018 CG GLN B 245 0.800 6.627 1.792 1.00 1.00 C ATOM 2019 CD GLN B 245 -0.323 6.725 0.766 1.00 1.00 C ATOM 2020 OE1 GLN B 245 -1.531 6.358 1.097 1.00 1.00 O flip ATOM 2021 NE2 GLN B 245 -0.096 7.150 -0.368 1.00 1.00 N flip ATOM 0 H GLN B 245 1.499 4.309 3.435 1.00 1.00 H new ATOM 0 HA GLN B 245 2.105 7.011 4.008 1.00 1.00 H new ATOM 0 HB2 GLN B 245 -0.385 5.468 3.180 1.00 1.00 H new ATOM 0 HB3 GLN B 245 -0.447 7.196 3.464 1.00 1.00 H new ATOM 0 HG2 GLN B 245 1.384 7.547 1.793 1.00 1.00 H new ATOM 0 HG3 GLN B 245 1.480 5.819 1.523 1.00 1.00 H new ATOM 0 HE21 GLN B 245 0.848 7.437 -0.626 1.00 1.00 H new ATOM 0 HE22 GLN B 245 -0.852 7.215 -1.049 1.00 1.00 H new ATOM 2030 N TYR B 246 0.220 5.422 6.182 1.00 1.00 N ATOM 2031 CA TYR B 246 -0.339 5.505 7.525 1.00 1.00 C ATOM 2032 C TYR B 246 0.754 5.825 8.540 1.00 1.00 C ATOM 2033 O TYR B 246 0.561 6.640 9.442 1.00 1.00 O ATOM 2034 CB TYR B 246 -1.010 4.183 7.893 1.00 1.00 C ATOM 2035 CG TYR B 246 -1.780 4.351 9.183 1.00 1.00 C ATOM 2036 CD1 TYR B 246 -3.020 5.003 9.172 1.00 1.00 C ATOM 2037 CD2 TYR B 246 -1.260 3.858 10.385 1.00 1.00 C ATOM 2038 CE1 TYR B 246 -3.739 5.161 10.363 1.00 1.00 C ATOM 2039 CE2 TYR B 246 -1.979 4.017 11.577 1.00 1.00 C ATOM 2040 CZ TYR B 246 -3.218 4.668 11.565 1.00 1.00 C ATOM 2041 OH TYR B 246 -3.926 4.825 12.739 1.00 1.00 O ATOM 0 H TYR B 246 0.116 4.511 5.734 1.00 1.00 H new ATOM 0 HA TYR B 246 -1.080 6.304 7.542 1.00 1.00 H new ATOM 0 HB2 TYR B 246 -1.682 3.869 7.094 1.00 1.00 H new ATOM 0 HB3 TYR B 246 -0.259 3.400 8.004 1.00 1.00 H new ATOM 0 HD1 TYR B 246 -3.421 5.384 8.245 1.00 1.00 H new ATOM 0 HD2 TYR B 246 -0.304 3.355 10.394 1.00 1.00 H new ATOM 0 HE1 TYR B 246 -4.695 5.663 10.354 1.00 1.00 H new ATOM 0 HE2 TYR B 246 -1.577 3.637 12.505 1.00 1.00 H new ATOM 0 HH TYR B 246 -4.518 4.055 12.869 1.00 1.00 H new ATOM 2051 N LEU B 247 1.899 5.171 8.388 1.00 1.00 N ATOM 2052 CA LEU B 247 3.023 5.381 9.296 1.00 1.00 C ATOM 2053 C LEU B 247 3.502 6.826 9.236 1.00 1.00 C ATOM 2054 O LEU B 247 3.837 7.422 10.259 1.00 1.00 O ATOM 2055 CB LEU B 247 4.176 4.448 8.926 1.00 1.00 C ATOM 2056 CG LEU B 247 3.798 2.992 9.241 1.00 1.00 C ATOM 2057 CD1 LEU B 247 4.816 2.052 8.585 1.00 1.00 C ATOM 2058 CD2 LEU B 247 3.777 2.745 10.765 1.00 1.00 C ATOM 0 H LEU B 247 2.075 4.492 7.647 1.00 1.00 H new ATOM 0 HA LEU B 247 2.688 5.163 10.310 1.00 1.00 H new ATOM 0 HB2 LEU B 247 4.411 4.550 7.867 1.00 1.00 H new ATOM 0 HB3 LEU B 247 5.072 4.727 9.480 1.00 1.00 H new ATOM 0 HG LEU B 247 2.800 2.798 8.847 1.00 1.00 H new ATOM 0 HD11 LEU B 247 4.552 1.018 8.806 1.00 1.00 H new ATOM 0 HD12 LEU B 247 4.810 2.205 7.506 1.00 1.00 H new ATOM 0 HD13 LEU B 247 5.811 2.263 8.976 1.00 1.00 H new ATOM 0 HD21 LEU B 247 3.507 1.708 10.962 1.00 1.00 H new ATOM 0 HD22 LEU B 247 4.764 2.948 11.180 1.00 1.00 H new ATOM 0 HD23 LEU B 247 3.045 3.405 11.231 1.00 1.00 H new ATOM 2070 N ILE B 248 3.542 7.383 8.033 1.00 1.00 N ATOM 2071 CA ILE B 248 3.992 8.756 7.865 1.00 1.00 C ATOM 2072 C ILE B 248 3.071 9.705 8.628 1.00 1.00 C ATOM 2073 O ILE B 248 3.533 10.614 9.318 1.00 1.00 O ATOM 2074 CB ILE B 248 3.996 9.123 6.376 1.00 1.00 C ATOM 2075 CG1 ILE B 248 5.082 8.311 5.656 1.00 1.00 C ATOM 2076 CG2 ILE B 248 4.277 10.621 6.210 1.00 1.00 C ATOM 2077 CD1 ILE B 248 4.950 8.489 4.139 1.00 1.00 C ATOM 0 H ILE B 248 3.272 6.912 7.170 1.00 1.00 H new ATOM 0 HA ILE B 248 5.004 8.848 8.260 1.00 1.00 H new ATOM 0 HB ILE B 248 3.022 8.894 5.944 1.00 1.00 H new ATOM 0 HG12 ILE B 248 6.069 8.637 5.984 1.00 1.00 H new ATOM 0 HG13 ILE B 248 4.992 7.256 5.916 1.00 1.00 H new ATOM 0 HG21 ILE B 248 4.279 10.876 5.150 1.00 1.00 H new ATOM 0 HG22 ILE B 248 3.503 11.195 6.720 1.00 1.00 H new ATOM 0 HG23 ILE B 248 5.249 10.859 6.642 1.00 1.00 H new ATOM 0 HD11 ILE B 248 5.724 7.910 3.636 1.00 1.00 H new ATOM 0 HD12 ILE B 248 3.969 8.141 3.816 1.00 1.00 H new ATOM 0 HD13 ILE B 248 5.063 9.543 3.885 1.00 1.00 H new ATOM 2089 N ASN B 249 1.767 9.484 8.507 1.00 1.00 N ATOM 2090 CA ASN B 249 0.796 10.324 9.197 1.00 1.00 C ATOM 2091 C ASN B 249 0.920 10.154 10.708 1.00 1.00 C ATOM 2092 O ASN B 249 0.810 11.119 11.463 1.00 1.00 O ATOM 2093 CB ASN B 249 -0.620 9.964 8.749 1.00 1.00 C ATOM 2094 CG ASN B 249 -1.629 10.891 9.419 1.00 1.00 C ATOM 2095 OD1 ASN B 249 -1.756 10.894 10.643 1.00 1.00 O ATOM 2096 ND2 ASN B 249 -2.356 11.689 8.683 1.00 1.00 N ATOM 0 H ASN B 249 1.361 8.737 7.943 1.00 1.00 H new ATOM 0 HA ASN B 249 0.998 11.365 8.945 1.00 1.00 H new ATOM 0 HB2 ASN B 249 -0.700 10.048 7.665 1.00 1.00 H new ATOM 0 HB3 ASN B 249 -0.839 8.928 9.006 1.00 1.00 H new ATOM 0 HD21 ASN B 249 -3.030 12.316 9.123 1.00 1.00 H new ATOM 0 HD22 ASN B 249 -2.250 11.685 7.669 1.00 1.00 H new