USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 771 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 12 TYR OH : rot 165:sc= -0.412 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -2.75! C(o=-2.8!,f=-4.2!) USER MOD Single : A 19 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.16) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 76:sc= 0.00664 USER MOD Single : A 32 SER OG : rot 28:sc= -0.115! USER MOD Single : A 34 TYR OH : rot 102:sc= 0.218 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 157:sc= -0.047 (180deg=-0.308) USER MOD Single : A 59 TYR OH : rot -92:sc= 1.23 USER MOD Single : A 62 GLN : amide:sc= 1.22 K(o=1.2,f=-1.5!) USER MOD Single : A 64 SER OG : rot 150:sc= -0.536 USER MOD Single : A 65 THR OG1 : rot -77:sc= 0.797 USER MOD Single : A 71 ASN :FLIP amide:sc= -8.38! C(o=-10!,f=-8.4!) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 156:sc= -0.0228 (180deg=-0.312) USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 87 THR OG1 : rot -13:sc= -8.41! USER MOD Single : A 89 TYR OH : rot 180:sc= -1.64 USER MOD Single : B 314 MET CE :methyl -131:sc= -0.274 (180deg=-1.2) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= -0.0837 X(o=-0.084,f=0) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 150:sc= -0.0386 (180deg=-0.402) USER MOD Single : B 335 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.0011) USER MOD Single : B 336 GLN : amide:sc= -0.273 X(o=-0.27,f=-0.34) USER MOD Single : B 337 ASN : amide:sc= -1.01 K(o=-1,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.170 -15.355 -2.516 1.00 0.00 N ATOM 143 CA ALA A 11 0.385 -16.479 -1.770 1.00 0.00 C ATOM 144 C ALA A 11 -0.372 -16.682 -0.461 1.00 0.00 C ATOM 145 O ALA A 11 -0.952 -15.742 0.084 1.00 0.00 O ATOM 146 CB ALA A 11 1.865 -16.229 -1.473 1.00 0.00 C ATOM 0 HA ALA A 11 0.283 -17.378 -2.377 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.272 -17.073 -0.916 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.410 -16.116 -2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.969 -15.320 -0.881 1.00 0.00 H new ATOM 152 N TYR A 12 -0.365 -17.914 0.040 1.00 0.00 N ATOM 153 CA TYR A 12 -1.052 -18.229 1.291 1.00 0.00 C ATOM 154 C TYR A 12 -0.073 -18.803 2.312 1.00 0.00 C ATOM 155 O TYR A 12 0.941 -19.398 1.947 1.00 0.00 O ATOM 156 CB TYR A 12 -2.173 -19.241 1.032 1.00 0.00 C ATOM 157 CG TYR A 12 -3.347 -18.539 0.393 1.00 0.00 C ATOM 158 CD1 TYR A 12 -3.384 -18.356 -0.993 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.399 -18.071 1.191 1.00 0.00 C ATOM 160 CE1 TYR A 12 -4.473 -17.706 -1.584 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.488 -17.421 0.599 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.524 -17.238 -0.788 1.00 0.00 C ATOM 163 OH TYR A 12 -6.598 -16.595 -1.371 1.00 0.00 O ATOM 0 H TYR A 12 0.105 -18.707 -0.397 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.478 -17.308 1.690 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.814 -20.038 0.381 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.480 -19.707 1.968 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -2.572 -18.716 -1.607 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.370 -18.212 2.261 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -4.502 -17.566 -2.654 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.301 -17.061 1.213 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.338 -16.549 -0.731 1.00 0.00 H new ATOM 173 N ILE A 13 -0.385 -18.622 3.593 1.00 0.00 N ATOM 174 CA ILE A 13 0.466 -19.140 4.661 1.00 0.00 C ATOM 175 C ILE A 13 -0.363 -19.928 5.671 1.00 0.00 C ATOM 176 O ILE A 13 -1.530 -19.615 5.911 1.00 0.00 O ATOM 177 CB ILE A 13 1.178 -17.987 5.369 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.163 -16.895 5.709 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.257 -17.412 4.452 1.00 0.00 C ATOM 180 CD1 ILE A 13 0.797 -15.887 6.670 1.00 0.00 C ATOM 0 H ILE A 13 -1.215 -18.124 3.915 1.00 0.00 H new ATOM 0 HA ILE A 13 1.208 -19.805 4.219 1.00 0.00 H new ATOM 0 HB ILE A 13 1.640 -18.354 6.286 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.162 -16.391 4.799 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.724 -17.337 6.163 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.764 -16.590 4.958 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.981 -18.190 4.209 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.797 -17.045 3.534 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.073 -15.109 6.911 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.100 -16.397 7.584 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.671 -15.436 6.200 1.00 0.00 H new ATOM 192 N TYR A 14 0.246 -20.952 6.260 1.00 0.00 N ATOM 193 CA TYR A 14 -0.446 -21.785 7.239 1.00 0.00 C ATOM 194 C TYR A 14 -0.137 -21.314 8.656 1.00 0.00 C ATOM 195 O TYR A 14 1.024 -21.129 9.022 1.00 0.00 O ATOM 196 CB TYR A 14 -0.018 -23.245 7.083 1.00 0.00 C ATOM 197 CG TYR A 14 -0.531 -24.053 8.252 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.833 -24.569 8.229 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.293 -24.282 9.359 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.308 -25.315 9.313 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.183 -25.029 10.444 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.484 -25.545 10.420 1.00 0.00 C ATOM 203 OH TYR A 14 -1.952 -26.281 11.490 1.00 0.00 O ATOM 0 H TYR A 14 1.212 -21.225 6.078 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.518 -21.701 7.063 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.407 -23.651 6.149 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.069 -23.312 7.031 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.470 -24.391 7.375 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.296 -23.883 9.377 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.312 -25.714 9.295 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.453 -25.207 11.298 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.252 -26.347 12.173 1.00 0.00 H new ATOM 213 N ILE A 15 -1.186 -21.119 9.450 1.00 0.00 N ATOM 214 CA ILE A 15 -1.014 -20.691 10.836 1.00 0.00 C ATOM 215 C ILE A 15 -1.655 -21.697 11.787 1.00 0.00 C ATOM 216 O ILE A 15 -2.863 -21.934 11.731 1.00 0.00 O ATOM 217 CB ILE A 15 -1.646 -19.314 11.039 1.00 0.00 C ATOM 218 CG1 ILE A 15 -0.988 -18.308 10.092 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.434 -18.864 12.485 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.798 -17.010 10.083 1.00 0.00 C ATOM 0 H ILE A 15 -2.156 -21.249 9.162 1.00 0.00 H new ATOM 0 HA ILE A 15 0.053 -20.633 11.052 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.714 -19.369 10.828 1.00 0.00 H new ATOM 0 HG12 ILE A 15 0.035 -18.108 10.410 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.934 -18.722 9.085 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.884 -17.882 12.630 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.900 -19.581 13.161 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.366 -18.808 12.696 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.329 -16.293 9.409 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.813 -17.217 9.744 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.829 -16.594 11.090 1.00 0.00 H new ATOM 232 N GLY A 16 -0.841 -22.284 12.658 1.00 0.00 N ATOM 233 CA GLY A 16 -1.338 -23.276 13.606 1.00 0.00 C ATOM 234 C GLY A 16 -0.578 -23.198 14.927 1.00 0.00 C ATOM 235 O GLY A 16 0.295 -22.349 15.101 1.00 0.00 O ATOM 0 H GLY A 16 0.158 -22.092 12.728 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.401 -23.114 13.784 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.234 -24.274 13.181 1.00 0.00 H new ATOM 239 N ASN A 17 -0.916 -24.092 15.852 1.00 0.00 N ATOM 240 CA ASN A 17 -0.255 -24.119 17.150 1.00 0.00 C ATOM 241 C ASN A 17 -0.569 -22.851 17.941 1.00 0.00 C ATOM 242 O ASN A 17 0.183 -22.465 18.835 1.00 0.00 O ATOM 243 CB ASN A 17 1.260 -24.244 16.962 1.00 0.00 C ATOM 244 CG ASN A 17 1.902 -24.784 18.236 1.00 0.00 C ATOM 245 OD1 ASN A 17 1.200 -25.216 19.152 1.00 0.00 O ATOM 246 ND2 ASN A 17 3.201 -24.785 18.350 1.00 0.00 N ATOM 0 H ASN A 17 -1.638 -24.801 15.727 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.625 -24.980 17.706 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.477 -24.909 16.126 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.685 -23.271 16.715 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.638 -25.144 19.199 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.780 -24.427 17.590 1.00 0.00 H new ATOM 253 N LEU A 18 -1.682 -22.210 17.603 1.00 0.00 N ATOM 254 CA LEU A 18 -2.095 -20.992 18.297 1.00 0.00 C ATOM 255 C LEU A 18 -3.262 -21.282 19.238 1.00 0.00 C ATOM 256 O LEU A 18 -3.964 -22.280 19.081 1.00 0.00 O ATOM 257 CB LEU A 18 -2.508 -19.922 17.277 1.00 0.00 C ATOM 258 CG LEU A 18 -3.915 -20.224 16.748 1.00 0.00 C ATOM 259 CD1 LEU A 18 -4.352 -19.119 15.783 1.00 0.00 C ATOM 260 CD2 LEU A 18 -3.907 -21.567 16.012 1.00 0.00 C ATOM 0 H LEU A 18 -2.312 -22.509 16.858 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.253 -20.626 18.884 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.488 -18.936 17.742 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.796 -19.899 16.452 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.612 -20.270 17.585 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.352 -19.337 15.409 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.360 -18.162 16.305 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.655 -19.070 14.947 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.907 -21.782 15.636 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.208 -21.520 15.177 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.600 -22.356 16.698 1.00 0.00 H new ATOM 272 N ASN A 19 -3.463 -20.399 20.212 1.00 0.00 N ATOM 273 CA ASN A 19 -4.558 -20.564 21.162 1.00 0.00 C ATOM 274 C ASN A 19 -5.900 -20.331 20.475 1.00 0.00 C ATOM 275 O ASN A 19 -6.100 -19.316 19.808 1.00 0.00 O ATOM 276 CB ASN A 19 -4.393 -19.578 22.321 1.00 0.00 C ATOM 277 CG ASN A 19 -3.438 -20.150 23.364 1.00 0.00 C ATOM 278 OD1 ASN A 19 -2.413 -19.540 23.669 1.00 0.00 O ATOM 279 ND2 ASN A 19 -3.714 -21.292 23.931 1.00 0.00 N ATOM 0 H ASN A 19 -2.888 -19.570 20.363 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.534 -21.583 21.548 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -4.010 -18.628 21.949 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.362 -19.375 22.777 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -3.080 -21.681 24.629 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.564 -21.795 23.677 1.00 0.00 H new ATOM 286 N ARG A 20 -6.818 -21.278 20.645 1.00 0.00 N ATOM 287 CA ARG A 20 -8.138 -21.167 20.033 1.00 0.00 C ATOM 288 C ARG A 20 -8.890 -19.962 20.592 1.00 0.00 C ATOM 289 O ARG A 20 -9.845 -19.479 19.986 1.00 0.00 O ATOM 290 CB ARG A 20 -8.943 -22.442 20.295 1.00 0.00 C ATOM 291 CG ARG A 20 -9.285 -22.534 21.784 1.00 0.00 C ATOM 292 CD ARG A 20 -9.833 -23.927 22.097 1.00 0.00 C ATOM 293 NE ARG A 20 -8.786 -24.928 21.940 1.00 0.00 N ATOM 294 CZ ARG A 20 -9.076 -26.223 21.864 1.00 0.00 C ATOM 295 NH1 ARG A 20 -10.320 -26.616 21.929 1.00 0.00 N ATOM 296 NH2 ARG A 20 -8.122 -27.100 21.723 1.00 0.00 N ATOM 0 H ARG A 20 -6.674 -22.124 21.197 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.010 -21.033 18.959 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -9.857 -22.436 19.701 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.369 -23.316 19.988 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.397 -22.338 22.385 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.022 -21.775 22.046 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.221 -23.953 23.115 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.667 -24.155 21.433 1.00 0.00 H new ATOM 0 HE ARG A 20 -7.812 -24.629 21.887 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -11.067 -25.930 22.038 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.545 -27.609 21.871 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -7.151 -26.793 21.671 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -8.347 -28.093 21.665 1.00 0.00 H new ATOM 310 N GLU A 21 -8.451 -19.484 21.753 1.00 0.00 N ATOM 311 CA GLU A 21 -9.092 -18.338 22.386 1.00 0.00 C ATOM 312 C GLU A 21 -8.953 -17.095 21.513 1.00 0.00 C ATOM 313 O GLU A 21 -9.808 -16.209 21.539 1.00 0.00 O ATOM 314 CB GLU A 21 -8.459 -18.077 23.754 1.00 0.00 C ATOM 315 CG GLU A 21 -8.848 -19.199 24.720 1.00 0.00 C ATOM 316 CD GLU A 21 -8.053 -19.070 26.015 1.00 0.00 C ATOM 317 OE1 GLU A 21 -7.141 -18.262 26.049 1.00 0.00 O ATOM 318 OE2 GLU A 21 -8.369 -19.781 26.954 1.00 0.00 O ATOM 0 H GLU A 21 -7.661 -19.869 22.270 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.151 -18.562 22.512 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.374 -18.023 23.660 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.793 -17.115 24.144 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.916 -19.153 24.933 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.656 -20.169 24.261 1.00 0.00 H new ATOM 325 N LEU A 22 -7.873 -17.037 20.743 1.00 0.00 N ATOM 326 CA LEU A 22 -7.630 -15.896 19.869 1.00 0.00 C ATOM 327 C LEU A 22 -8.613 -15.898 18.701 1.00 0.00 C ATOM 328 O LEU A 22 -8.697 -16.868 17.949 1.00 0.00 O ATOM 329 CB LEU A 22 -6.198 -15.942 19.333 1.00 0.00 C ATOM 330 CG LEU A 22 -5.240 -15.362 20.379 1.00 0.00 C ATOM 331 CD1 LEU A 22 -5.479 -16.046 21.727 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.795 -15.602 19.935 1.00 0.00 C ATOM 0 H LEU A 22 -7.156 -17.761 20.706 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.771 -14.983 20.448 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.919 -16.969 19.099 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.127 -15.374 18.405 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.417 -14.291 20.479 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -4.797 -15.633 22.470 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.508 -15.876 22.044 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.302 -17.117 21.628 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.113 -15.190 20.678 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.618 -16.673 19.835 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.624 -15.114 18.975 1.00 0.00 H new ATOM 344 N THR A 23 -9.354 -14.804 18.555 1.00 0.00 N ATOM 345 CA THR A 23 -10.326 -14.687 17.472 1.00 0.00 C ATOM 346 C THR A 23 -9.684 -14.049 16.246 1.00 0.00 C ATOM 347 O THR A 23 -8.478 -13.806 16.219 1.00 0.00 O ATOM 348 CB THR A 23 -11.518 -13.841 17.927 1.00 0.00 C ATOM 349 OG1 THR A 23 -11.092 -12.502 18.134 1.00 0.00 O ATOM 350 CG2 THR A 23 -12.081 -14.408 19.230 1.00 0.00 C ATOM 0 H THR A 23 -9.301 -13.991 19.168 1.00 0.00 H new ATOM 0 HA THR A 23 -10.672 -15.687 17.209 1.00 0.00 H new ATOM 0 HB THR A 23 -12.294 -13.862 17.161 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.854 -11.958 18.424 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.930 -13.805 19.553 1.00 0.00 H new ATOM 0 HG22 THR A 23 -12.407 -15.436 19.069 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.309 -14.389 19.999 1.00 0.00 H new ATOM 358 N GLU A 24 -10.498 -13.781 15.230 1.00 0.00 N ATOM 359 CA GLU A 24 -9.997 -13.174 14.002 1.00 0.00 C ATOM 360 C GLU A 24 -9.376 -11.811 14.293 1.00 0.00 C ATOM 361 O GLU A 24 -8.346 -11.455 13.723 1.00 0.00 O ATOM 362 CB GLU A 24 -11.139 -13.011 12.998 1.00 0.00 C ATOM 363 CG GLU A 24 -11.568 -14.387 12.486 1.00 0.00 C ATOM 364 CD GLU A 24 -12.717 -14.239 11.494 1.00 0.00 C ATOM 365 OE1 GLU A 24 -12.651 -13.343 10.669 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.648 -15.024 11.573 1.00 0.00 O ATOM 0 H GLU A 24 -11.500 -13.973 15.232 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.233 -13.827 13.581 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.983 -12.507 13.469 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.819 -12.385 12.165 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.725 -14.885 12.007 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.877 -15.015 13.322 1.00 0.00 H new ATOM 373 N GLY A 25 -10.010 -11.055 15.183 1.00 0.00 N ATOM 374 CA GLY A 25 -9.514 -9.730 15.535 1.00 0.00 C ATOM 375 C GLY A 25 -8.117 -9.813 16.143 1.00 0.00 C ATOM 376 O GLY A 25 -7.234 -9.026 15.803 1.00 0.00 O ATOM 0 H GLY A 25 -10.862 -11.334 15.670 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.491 -9.099 14.647 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.195 -9.259 16.243 1.00 0.00 H new ATOM 380 N ASP A 26 -7.926 -10.771 17.043 1.00 0.00 N ATOM 381 CA ASP A 26 -6.635 -10.941 17.700 1.00 0.00 C ATOM 382 C ASP A 26 -5.555 -11.295 16.680 1.00 0.00 C ATOM 383 O ASP A 26 -4.435 -10.789 16.748 1.00 0.00 O ATOM 384 CB ASP A 26 -6.728 -12.047 18.752 1.00 0.00 C ATOM 385 CG ASP A 26 -7.551 -11.568 19.942 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.820 -10.379 20.011 1.00 0.00 O ATOM 387 OD2 ASP A 26 -7.904 -12.395 20.767 1.00 0.00 O ATOM 0 H ASP A 26 -8.642 -11.437 17.333 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.367 -10.001 18.183 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.185 -12.936 18.317 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.729 -12.331 19.082 1.00 0.00 H new ATOM 392 N ILE A 27 -5.900 -12.165 15.735 1.00 0.00 N ATOM 393 CA ILE A 27 -4.951 -12.577 14.705 1.00 0.00 C ATOM 394 C ILE A 27 -4.544 -11.384 13.844 1.00 0.00 C ATOM 395 O ILE A 27 -3.374 -11.227 13.498 1.00 0.00 O ATOM 396 CB ILE A 27 -5.577 -13.657 13.819 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.777 -14.933 14.639 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.650 -13.952 12.637 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.594 -15.941 13.826 1.00 0.00 C ATOM 0 H ILE A 27 -6.822 -12.595 15.661 1.00 0.00 H new ATOM 0 HA ILE A 27 -4.064 -12.978 15.195 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.540 -13.307 13.446 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.811 -15.362 14.905 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.290 -14.701 15.572 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.097 -14.721 12.007 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.505 -13.043 12.053 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.687 -14.302 13.008 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.736 -16.850 14.411 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.565 -15.510 13.583 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.063 -16.181 12.905 1.00 0.00 H new ATOM 411 N LEU A 28 -5.517 -10.545 13.503 1.00 0.00 N ATOM 412 CA LEU A 28 -5.245 -9.373 12.677 1.00 0.00 C ATOM 413 C LEU A 28 -4.212 -8.474 13.345 1.00 0.00 C ATOM 414 O LEU A 28 -3.247 -8.049 12.715 1.00 0.00 O ATOM 415 CB LEU A 28 -6.540 -8.585 12.450 1.00 0.00 C ATOM 416 CG LEU A 28 -7.447 -9.356 11.484 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.832 -8.704 11.452 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.839 -9.328 10.077 1.00 0.00 C ATOM 0 H LEU A 28 -6.492 -10.652 13.782 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.850 -9.710 11.719 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.053 -8.427 13.399 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.312 -7.600 12.043 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.538 -10.389 11.821 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.477 -9.252 10.765 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.267 -8.724 12.451 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.740 -7.671 11.117 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.484 -9.876 9.391 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.747 -8.295 9.741 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.853 -9.793 10.097 1.00 0.00 H new ATOM 430 N THR A 29 -4.422 -8.190 14.625 1.00 0.00 N ATOM 431 CA THR A 29 -3.507 -7.327 15.365 1.00 0.00 C ATOM 432 C THR A 29 -2.113 -7.946 15.426 1.00 0.00 C ATOM 433 O THR A 29 -1.106 -7.248 15.301 1.00 0.00 O ATOM 434 CB THR A 29 -4.033 -7.106 16.785 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.308 -6.482 16.723 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.062 -6.211 17.557 1.00 0.00 C ATOM 0 H THR A 29 -5.210 -8.541 15.169 1.00 0.00 H new ATOM 0 HA THR A 29 -3.442 -6.370 14.848 1.00 0.00 H new ATOM 0 HB THR A 29 -4.122 -8.066 17.294 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.984 -7.144 16.470 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.437 -6.054 18.568 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.084 -6.690 17.603 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.972 -5.250 17.050 1.00 0.00 H new ATOM 444 N VAL A 30 -2.061 -9.258 15.621 1.00 0.00 N ATOM 445 CA VAL A 30 -0.782 -9.956 15.716 1.00 0.00 C ATOM 446 C VAL A 30 0.002 -9.839 14.408 1.00 0.00 C ATOM 447 O VAL A 30 1.173 -9.464 14.408 1.00 0.00 O ATOM 448 CB VAL A 30 -1.022 -11.434 16.039 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.294 -12.206 15.905 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.545 -11.565 17.471 1.00 0.00 C ATOM 0 H VAL A 30 -2.881 -9.857 15.716 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.198 -9.495 16.513 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.756 -11.843 15.345 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.124 -13.258 16.135 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.668 -12.113 14.885 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.028 -11.797 16.599 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.716 -12.617 17.701 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.811 -11.156 18.165 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.481 -11.016 17.568 1.00 0.00 H new ATOM 460 N PHE A 31 -0.651 -10.161 13.296 1.00 0.00 N ATOM 461 CA PHE A 31 0.006 -10.128 11.989 1.00 0.00 C ATOM 462 C PHE A 31 -0.091 -8.735 11.366 1.00 0.00 C ATOM 463 O PHE A 31 0.607 -8.423 10.401 1.00 0.00 O ATOM 464 CB PHE A 31 -0.641 -11.153 11.054 1.00 0.00 C ATOM 465 CG PHE A 31 -0.227 -12.546 11.468 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.794 -13.143 12.600 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.729 -13.245 10.718 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.411 -14.433 12.984 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.114 -14.537 11.103 1.00 0.00 C ATOM 470 CZ PHE A 31 0.544 -15.130 12.235 1.00 0.00 C ATOM 0 H PHE A 31 -1.630 -10.447 13.271 1.00 0.00 H new ATOM 0 HA PHE A 31 1.058 -10.374 12.130 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.726 -11.059 11.090 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.338 -10.963 10.024 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.530 -12.606 13.179 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.169 -12.788 9.844 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.852 -14.890 13.857 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.851 -15.075 10.525 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.841 -16.125 12.531 1.00 0.00 H new ATOM 480 N SER A 32 -0.961 -7.902 11.922 1.00 0.00 N ATOM 481 CA SER A 32 -1.169 -6.560 11.385 1.00 0.00 C ATOM 482 C SER A 32 0.164 -5.870 11.099 1.00 0.00 C ATOM 483 O SER A 32 0.456 -5.505 9.958 1.00 0.00 O ATOM 484 CB SER A 32 -1.971 -5.722 12.381 1.00 0.00 C ATOM 485 OG SER A 32 -3.360 -5.887 12.124 1.00 0.00 O ATOM 0 H SER A 32 -1.531 -8.127 12.738 1.00 0.00 H new ATOM 0 HA SER A 32 -1.720 -6.651 10.449 1.00 0.00 H new ATOM 0 HB2 SER A 32 -1.739 -6.029 13.401 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.696 -4.671 12.294 1.00 0.00 H new ATOM 0 HG SER A 32 -3.516 -6.766 11.719 1.00 0.00 H new ATOM 491 N GLU A 33 0.973 -5.699 12.139 1.00 0.00 N ATOM 492 CA GLU A 33 2.254 -5.013 11.997 1.00 0.00 C ATOM 493 C GLU A 33 3.204 -5.818 11.111 1.00 0.00 C ATOM 494 O GLU A 33 4.245 -5.319 10.684 1.00 0.00 O ATOM 495 CB GLU A 33 2.889 -4.806 13.374 1.00 0.00 C ATOM 496 CG GLU A 33 3.337 -6.155 13.941 1.00 0.00 C ATOM 497 CD GLU A 33 3.738 -6.000 15.403 1.00 0.00 C ATOM 498 OE1 GLU A 33 2.859 -6.054 16.247 1.00 0.00 O ATOM 499 OE2 GLU A 33 4.918 -5.830 15.659 1.00 0.00 O ATOM 0 H GLU A 33 0.767 -6.023 13.084 1.00 0.00 H new ATOM 0 HA GLU A 33 2.075 -4.045 11.528 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.742 -4.132 13.295 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.173 -4.336 14.049 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.530 -6.882 13.852 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.178 -6.540 13.364 1.00 0.00 H new ATOM 506 N TYR A 34 2.838 -7.065 10.840 1.00 0.00 N ATOM 507 CA TYR A 34 3.674 -7.940 10.020 1.00 0.00 C ATOM 508 C TYR A 34 2.991 -8.245 8.690 1.00 0.00 C ATOM 509 O TYR A 34 3.125 -9.344 8.152 1.00 0.00 O ATOM 510 CB TYR A 34 3.955 -9.245 10.768 1.00 0.00 C ATOM 511 CG TYR A 34 4.715 -8.944 12.041 1.00 0.00 C ATOM 512 CD1 TYR A 34 5.978 -8.341 11.978 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.163 -9.270 13.283 1.00 0.00 C ATOM 514 CE1 TYR A 34 6.681 -8.062 13.157 1.00 0.00 C ATOM 515 CE2 TYR A 34 4.863 -8.992 14.461 1.00 0.00 C ATOM 516 CZ TYR A 34 6.124 -8.387 14.400 1.00 0.00 C ATOM 517 OH TYR A 34 6.815 -8.113 15.560 1.00 0.00 O ATOM 0 H TYR A 34 1.974 -7.493 11.173 1.00 0.00 H new ATOM 0 HA TYR A 34 4.615 -7.429 9.819 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.018 -9.751 11.002 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.533 -9.920 10.138 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.410 -8.091 11.020 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.191 -9.739 13.333 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.654 -7.596 13.107 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.431 -9.244 15.418 1.00 0.00 H new ATOM 0 HH TYR A 34 6.449 -7.304 15.975 1.00 0.00 H new ATOM 527 N GLY A 35 2.256 -7.266 8.164 1.00 0.00 N ATOM 528 CA GLY A 35 1.556 -7.450 6.895 1.00 0.00 C ATOM 529 C GLY A 35 0.084 -7.768 7.123 1.00 0.00 C ATOM 530 O GLY A 35 -0.357 -8.897 6.910 1.00 0.00 O ATOM 0 H GLY A 35 2.131 -6.348 8.591 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.647 -6.547 6.291 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.023 -8.258 6.332 1.00 0.00 H new ATOM 534 N VAL A 36 -0.670 -6.765 7.560 1.00 0.00 N ATOM 535 CA VAL A 36 -2.089 -6.956 7.832 1.00 0.00 C ATOM 536 C VAL A 36 -2.805 -7.511 6.597 1.00 0.00 C ATOM 537 O VAL A 36 -2.795 -6.895 5.532 1.00 0.00 O ATOM 538 CB VAL A 36 -2.726 -5.622 8.238 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.884 -4.730 7.003 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.101 -5.884 8.857 1.00 0.00 C ATOM 0 H VAL A 36 -0.326 -5.820 7.732 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.191 -7.672 8.648 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.087 -5.121 8.965 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.337 -3.782 7.294 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.905 -4.544 6.561 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.522 -5.228 6.274 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.556 -4.937 9.147 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.738 -6.385 8.129 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.989 -6.517 9.737 1.00 0.00 H new ATOM 550 N PRO A 37 -3.414 -8.663 6.729 1.00 0.00 N ATOM 551 CA PRO A 37 -4.133 -9.339 5.604 1.00 0.00 C ATOM 552 C PRO A 37 -5.486 -8.696 5.315 1.00 0.00 C ATOM 553 O PRO A 37 -6.063 -8.031 6.173 1.00 0.00 O ATOM 554 CB PRO A 37 -4.308 -10.786 6.089 1.00 0.00 C ATOM 555 CG PRO A 37 -4.359 -10.705 7.576 1.00 0.00 C ATOM 556 CD PRO A 37 -3.510 -9.470 7.966 1.00 0.00 C ATOM 0 HA PRO A 37 -3.579 -9.266 4.668 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.221 -11.226 5.689 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.480 -11.413 5.758 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.386 -10.599 7.926 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.960 -11.612 8.030 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.982 -8.905 8.770 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.523 -9.766 8.321 1.00 0.00 H new ATOM 564 N VAL A 38 -5.984 -8.900 4.100 1.00 0.00 N ATOM 565 CA VAL A 38 -7.276 -8.346 3.713 1.00 0.00 C ATOM 566 C VAL A 38 -8.390 -9.351 3.985 1.00 0.00 C ATOM 567 O VAL A 38 -9.569 -8.997 3.989 1.00 0.00 O ATOM 568 CB VAL A 38 -7.265 -7.984 2.226 1.00 0.00 C ATOM 569 CG1 VAL A 38 -6.113 -7.019 1.943 1.00 0.00 C ATOM 570 CG2 VAL A 38 -7.082 -9.256 1.394 1.00 0.00 C ATOM 0 H VAL A 38 -5.517 -9.440 3.372 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.458 -7.448 4.304 1.00 0.00 H new ATOM 0 HB VAL A 38 -8.209 -7.508 1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -6.106 -6.762 0.884 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.243 -6.113 2.536 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.168 -7.493 2.208 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -7.074 -9.000 0.335 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -6.138 -9.732 1.659 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.904 -9.943 1.595 1.00 0.00 H new ATOM 580 N ASP A 39 -8.008 -10.603 4.213 1.00 0.00 N ATOM 581 CA ASP A 39 -8.983 -11.649 4.494 1.00 0.00 C ATOM 582 C ASP A 39 -8.320 -12.821 5.211 1.00 0.00 C ATOM 583 O ASP A 39 -7.154 -13.131 4.968 1.00 0.00 O ATOM 584 CB ASP A 39 -9.616 -12.138 3.189 1.00 0.00 C ATOM 585 CG ASP A 39 -10.894 -12.915 3.489 1.00 0.00 C ATOM 586 OD1 ASP A 39 -11.186 -13.108 4.658 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.560 -13.307 2.545 1.00 0.00 O ATOM 0 H ASP A 39 -7.037 -10.916 4.209 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.757 -11.234 5.139 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.840 -11.289 2.543 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.913 -12.772 2.649 1.00 0.00 H new ATOM 592 N VAL A 40 -9.070 -13.467 6.095 1.00 0.00 N ATOM 593 CA VAL A 40 -8.544 -14.605 6.843 1.00 0.00 C ATOM 594 C VAL A 40 -9.551 -15.750 6.847 1.00 0.00 C ATOM 595 O VAL A 40 -10.721 -15.560 7.178 1.00 0.00 O ATOM 596 CB VAL A 40 -8.234 -14.186 8.283 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.493 -15.318 8.996 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.356 -12.932 8.270 1.00 0.00 C ATOM 0 H VAL A 40 -10.037 -13.226 6.311 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.627 -14.944 6.361 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.165 -13.974 8.808 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.272 -15.020 10.021 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.116 -16.212 9.005 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.561 -15.530 8.471 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.134 -12.632 9.294 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.425 -13.145 7.745 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.883 -12.124 7.762 1.00 0.00 H new ATOM 608 N ILE A 41 -9.087 -16.942 6.479 1.00 0.00 N ATOM 609 CA ILE A 41 -9.959 -18.109 6.433 1.00 0.00 C ATOM 610 C ILE A 41 -9.891 -18.880 7.747 1.00 0.00 C ATOM 611 O ILE A 41 -8.865 -19.477 8.076 1.00 0.00 O ATOM 612 CB ILE A 41 -9.546 -19.026 5.281 1.00 0.00 C ATOM 613 CG1 ILE A 41 -9.595 -18.244 3.965 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.506 -20.214 5.201 1.00 0.00 C ATOM 615 CD1 ILE A 41 -8.958 -19.078 2.851 1.00 0.00 C ATOM 0 H ILE A 41 -8.120 -17.123 6.211 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.982 -17.768 6.276 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.533 -19.389 5.453 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.627 -18.005 3.710 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.066 -17.297 4.073 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.210 -20.866 4.379 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.473 -20.772 6.137 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.520 -19.852 5.030 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.993 -18.521 1.914 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -7.921 -19.294 3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.506 -20.013 2.738 1.00 0.00 H new ATOM 627 N LEU A 42 -10.991 -18.865 8.494 1.00 0.00 N ATOM 628 CA LEU A 42 -11.048 -19.573 9.769 1.00 0.00 C ATOM 629 C LEU A 42 -11.826 -20.876 9.620 1.00 0.00 C ATOM 630 O LEU A 42 -13.057 -20.877 9.608 1.00 0.00 O ATOM 631 CB LEU A 42 -11.715 -18.687 10.830 1.00 0.00 C ATOM 632 CG LEU A 42 -10.645 -17.871 11.570 1.00 0.00 C ATOM 633 CD1 LEU A 42 -9.802 -18.805 12.450 1.00 0.00 C ATOM 634 CD2 LEU A 42 -9.739 -17.172 10.550 1.00 0.00 C ATOM 0 H LEU A 42 -11.849 -18.374 8.241 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.031 -19.806 10.083 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.435 -18.018 10.359 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.269 -19.304 11.537 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.130 -17.123 12.198 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.043 -18.224 12.974 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.446 -19.300 13.177 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.317 -19.555 11.825 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.979 -16.593 11.075 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.255 -17.919 9.921 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.337 -16.506 9.928 1.00 0.00 H new ATOM 646 N SER A 43 -11.100 -21.982 9.507 1.00 0.00 N ATOM 647 CA SER A 43 -11.733 -23.285 9.350 1.00 0.00 C ATOM 648 C SER A 43 -12.098 -23.871 10.710 1.00 0.00 C ATOM 649 O SER A 43 -11.388 -23.669 11.694 1.00 0.00 O ATOM 650 CB SER A 43 -10.789 -24.240 8.619 1.00 0.00 C ATOM 651 OG SER A 43 -10.495 -23.714 7.332 1.00 0.00 O ATOM 0 H SER A 43 -10.080 -22.003 9.521 1.00 0.00 H new ATOM 0 HA SER A 43 -12.644 -23.157 8.766 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.870 -24.370 9.190 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.248 -25.224 8.526 1.00 0.00 H new ATOM 0 HG SER A 43 -9.889 -24.323 6.861 1.00 0.00 H new ATOM 657 N ARG A 44 -13.211 -24.598 10.757 1.00 0.00 N ATOM 658 CA ARG A 44 -13.660 -25.212 12.002 1.00 0.00 C ATOM 659 C ARG A 44 -14.057 -26.665 11.769 1.00 0.00 C ATOM 660 O ARG A 44 -14.434 -27.047 10.660 1.00 0.00 O ATOM 661 CB ARG A 44 -14.852 -24.437 12.567 1.00 0.00 C ATOM 662 CG ARG A 44 -14.373 -23.093 13.119 1.00 0.00 C ATOM 663 CD ARG A 44 -15.584 -22.233 13.487 1.00 0.00 C ATOM 664 NE ARG A 44 -15.154 -21.043 14.212 1.00 0.00 N ATOM 665 CZ ARG A 44 -16.027 -20.113 14.586 1.00 0.00 C ATOM 666 NH1 ARG A 44 -17.293 -20.257 14.305 1.00 0.00 N ATOM 667 NH2 ARG A 44 -15.618 -19.058 15.235 1.00 0.00 N ATOM 0 H ARG A 44 -13.814 -24.775 9.954 1.00 0.00 H new ATOM 0 HA ARG A 44 -12.838 -25.183 12.717 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.597 -24.277 11.788 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -15.334 -25.015 13.356 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -13.745 -23.251 13.996 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -13.761 -22.580 12.377 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -16.122 -21.943 12.584 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -16.277 -22.810 14.099 1.00 0.00 H new ATOM 0 HE ARG A 44 -14.166 -20.922 14.436 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -17.612 -21.083 13.799 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -17.963 -19.544 14.592 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -14.628 -18.947 15.455 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -16.288 -18.344 15.522 1.00 0.00 H new ATOM 786 N GLY A 53 -7.525 -24.632 15.439 1.00 0.00 N ATOM 787 CA GLY A 53 -6.078 -24.671 15.627 1.00 0.00 C ATOM 788 C GLY A 53 -5.351 -24.572 14.291 1.00 0.00 C ATOM 789 O GLY A 53 -4.135 -24.748 14.222 1.00 0.00 O ATOM 0 HA2 GLY A 53 -5.770 -23.850 16.275 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.798 -25.597 16.130 1.00 0.00 H new ATOM 793 N PHE A 54 -6.103 -24.291 13.230 1.00 0.00 N ATOM 794 CA PHE A 54 -5.517 -24.169 11.898 1.00 0.00 C ATOM 795 C PHE A 54 -6.289 -23.151 11.063 1.00 0.00 C ATOM 796 O PHE A 54 -7.520 -23.158 11.040 1.00 0.00 O ATOM 797 CB PHE A 54 -5.535 -25.530 11.196 1.00 0.00 C ATOM 798 CG PHE A 54 -6.861 -26.208 11.443 1.00 0.00 C ATOM 799 CD1 PHE A 54 -7.934 -25.989 10.571 1.00 0.00 C ATOM 800 CD2 PHE A 54 -7.018 -27.058 12.545 1.00 0.00 C ATOM 801 CE1 PHE A 54 -9.163 -26.619 10.801 1.00 0.00 C ATOM 802 CE2 PHE A 54 -8.247 -27.686 12.776 1.00 0.00 C ATOM 803 CZ PHE A 54 -9.320 -27.467 11.904 1.00 0.00 C ATOM 0 H PHE A 54 -7.112 -24.144 13.265 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.487 -23.827 12.003 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -5.375 -25.401 10.126 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.721 -26.153 11.567 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.814 -25.334 9.721 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.190 -27.229 13.217 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.990 -26.451 10.127 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.368 -28.340 13.627 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.268 -27.952 12.082 1.00 0.00 H new ATOM 813 N ALA A 55 -5.557 -22.278 10.377 1.00 0.00 N ATOM 814 CA ALA A 55 -6.184 -21.254 9.547 1.00 0.00 C ATOM 815 C ALA A 55 -5.213 -20.763 8.477 1.00 0.00 C ATOM 816 O ALA A 55 -4.004 -20.969 8.579 1.00 0.00 O ATOM 817 CB ALA A 55 -6.626 -20.076 10.417 1.00 0.00 C ATOM 0 H ALA A 55 -4.537 -22.258 10.379 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.055 -21.691 9.058 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.093 -19.316 9.790 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.342 -20.422 11.162 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.758 -19.649 10.919 1.00 0.00 H new ATOM 823 N TYR A 56 -5.751 -20.110 7.447 1.00 0.00 N ATOM 824 CA TYR A 56 -4.921 -19.594 6.361 1.00 0.00 C ATOM 825 C TYR A 56 -5.002 -18.071 6.305 1.00 0.00 C ATOM 826 O TYR A 56 -6.044 -17.484 6.594 1.00 0.00 O ATOM 827 CB TYR A 56 -5.381 -20.181 5.027 1.00 0.00 C ATOM 828 CG TYR A 56 -5.361 -21.690 5.106 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.146 -22.380 5.015 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.557 -22.397 5.272 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.129 -23.777 5.089 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.540 -23.795 5.346 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.324 -24.485 5.254 1.00 0.00 C ATOM 834 OH TYR A 56 -5.307 -25.863 5.328 1.00 0.00 O ATOM 0 H TYR A 56 -6.749 -19.927 7.343 1.00 0.00 H new ATOM 0 HA TYR A 56 -3.888 -19.886 6.547 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.386 -19.832 4.791 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -4.729 -19.840 4.223 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.223 -21.834 4.888 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.494 -21.864 5.343 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.192 -24.309 5.019 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.463 -24.341 5.474 1.00 0.00 H new ATOM 0 HH TYR A 56 -6.221 -26.196 5.444 1.00 0.00 H new ATOM 844 N LEU A 57 -3.895 -17.436 5.929 1.00 0.00 N ATOM 845 CA LEU A 57 -3.850 -15.978 5.846 1.00 0.00 C ATOM 846 C LEU A 57 -3.818 -15.523 4.388 1.00 0.00 C ATOM 847 O LEU A 57 -3.153 -16.135 3.553 1.00 0.00 O ATOM 848 CB LEU A 57 -2.609 -15.449 6.577 1.00 0.00 C ATOM 849 CG LEU A 57 -2.949 -14.135 7.286 1.00 0.00 C ATOM 850 CD1 LEU A 57 -3.622 -14.434 8.629 1.00 0.00 C ATOM 851 CD2 LEU A 57 -1.665 -13.336 7.526 1.00 0.00 C ATOM 0 H LEU A 57 -3.023 -17.903 5.679 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.747 -15.579 6.319 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.261 -16.185 7.302 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.797 -15.291 5.867 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.628 -13.554 6.662 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.863 -13.497 9.132 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.538 -15.001 8.459 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.945 -15.017 9.253 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.907 -12.401 8.031 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.985 -13.918 8.148 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.187 -13.119 6.571 1.00 0.00 H new ATOM 863 N LYS A 58 -4.541 -14.443 4.090 1.00 0.00 N ATOM 864 CA LYS A 58 -4.580 -13.910 2.730 1.00 0.00 C ATOM 865 C LYS A 58 -4.233 -12.423 2.727 1.00 0.00 C ATOM 866 O LYS A 58 -5.064 -11.581 3.068 1.00 0.00 O ATOM 867 CB LYS A 58 -5.973 -14.110 2.130 1.00 0.00 C ATOM 868 CG LYS A 58 -5.899 -13.972 0.606 1.00 0.00 C ATOM 869 CD LYS A 58 -7.317 -13.949 0.024 1.00 0.00 C ATOM 870 CE LYS A 58 -7.822 -12.506 -0.037 1.00 0.00 C ATOM 871 NZ LYS A 58 -7.137 -11.786 -1.148 1.00 0.00 N ATOM 0 H LYS A 58 -5.102 -13.925 4.766 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.845 -14.446 2.129 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.358 -15.094 2.398 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.666 -13.374 2.539 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.370 -13.057 0.339 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.334 -14.802 0.182 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.319 -14.388 -0.974 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.984 -14.553 0.640 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -8.901 -12.493 -0.192 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -7.630 -12.002 0.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.718 -10.977 -1.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.211 -11.445 -0.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.004 -12.433 -1.951 1.00 0.00 H new ATOM 885 N TYR A 59 -3.000 -12.107 2.339 1.00 0.00 N ATOM 886 CA TYR A 59 -2.553 -10.717 2.288 1.00 0.00 C ATOM 887 C TYR A 59 -2.099 -10.350 0.877 1.00 0.00 C ATOM 888 O TYR A 59 -1.537 -11.178 0.161 1.00 0.00 O ATOM 889 CB TYR A 59 -1.402 -10.494 3.277 1.00 0.00 C ATOM 890 CG TYR A 59 -0.991 -9.032 3.266 1.00 0.00 C ATOM 891 CD1 TYR A 59 -1.935 -8.032 2.972 1.00 0.00 C ATOM 892 CD2 TYR A 59 0.327 -8.666 3.558 1.00 0.00 C ATOM 893 CE1 TYR A 59 -1.557 -6.684 2.962 1.00 0.00 C ATOM 894 CE2 TYR A 59 0.708 -7.318 3.547 1.00 0.00 C ATOM 895 CZ TYR A 59 -0.235 -6.327 3.248 1.00 0.00 C ATOM 896 OH TYR A 59 0.138 -4.999 3.237 1.00 0.00 O ATOM 0 H TYR A 59 -2.296 -12.789 2.057 1.00 0.00 H new ATOM 0 HA TYR A 59 -3.391 -10.078 2.564 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -1.711 -10.787 4.280 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -0.553 -11.122 3.008 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.957 -8.305 2.753 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.056 -9.428 3.793 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -2.286 -5.920 2.734 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.729 -7.043 3.769 1.00 0.00 H new ATOM 0 HH TYR A 59 0.473 -4.761 2.347 1.00 0.00 H new ATOM 906 N GLU A 60 -2.346 -9.104 0.482 1.00 0.00 N ATOM 907 CA GLU A 60 -1.989 -8.650 -0.857 1.00 0.00 C ATOM 908 C GLU A 60 -0.493 -8.825 -1.106 1.00 0.00 C ATOM 909 O GLU A 60 -0.085 -9.381 -2.126 1.00 0.00 O ATOM 910 CB GLU A 60 -2.365 -7.175 -1.028 1.00 0.00 C ATOM 911 CG GLU A 60 -2.082 -6.736 -2.466 1.00 0.00 C ATOM 912 CD GLU A 60 -2.964 -7.519 -3.433 1.00 0.00 C ATOM 913 OE1 GLU A 60 -3.984 -8.025 -2.995 1.00 0.00 O ATOM 914 OE2 GLU A 60 -2.605 -7.600 -4.597 1.00 0.00 O ATOM 0 H GLU A 60 -2.789 -8.395 1.067 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.539 -9.253 -1.580 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -3.419 -7.029 -0.793 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.795 -6.561 -0.331 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.270 -5.668 -2.573 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -1.031 -6.900 -2.705 1.00 0.00 H new ATOM 921 N ASP A 61 0.320 -8.348 -0.168 1.00 0.00 N ATOM 922 CA ASP A 61 1.770 -8.446 -0.303 1.00 0.00 C ATOM 923 C ASP A 61 2.263 -9.808 0.174 1.00 0.00 C ATOM 924 O ASP A 61 1.972 -10.226 1.295 1.00 0.00 O ATOM 925 CB ASP A 61 2.447 -7.343 0.512 1.00 0.00 C ATOM 926 CG ASP A 61 1.841 -5.989 0.160 1.00 0.00 C ATOM 927 OD1 ASP A 61 1.812 -5.662 -1.014 1.00 0.00 O ATOM 928 OD2 ASP A 61 1.414 -5.299 1.072 1.00 0.00 O ATOM 0 H ASP A 61 0.003 -7.893 0.688 1.00 0.00 H new ATOM 0 HA ASP A 61 2.025 -8.328 -1.356 1.00 0.00 H new ATOM 0 HB2 ASP A 61 2.325 -7.539 1.577 1.00 0.00 H new ATOM 0 HB3 ASP A 61 3.518 -7.335 0.310 1.00 0.00 H new ATOM 933 N GLN A 62 3.010 -10.496 -0.684 1.00 0.00 N ATOM 934 CA GLN A 62 3.540 -11.810 -0.337 1.00 0.00 C ATOM 935 C GLN A 62 4.862 -11.673 0.413 1.00 0.00 C ATOM 936 O GLN A 62 5.135 -12.424 1.348 1.00 0.00 O ATOM 937 CB GLN A 62 3.754 -12.636 -1.607 1.00 0.00 C ATOM 938 CG GLN A 62 2.424 -12.790 -2.348 1.00 0.00 C ATOM 939 CD GLN A 62 2.660 -13.416 -3.718 1.00 0.00 C ATOM 940 OE1 GLN A 62 3.722 -13.230 -4.312 1.00 0.00 O ATOM 941 NE2 GLN A 62 1.726 -14.151 -4.258 1.00 0.00 N ATOM 0 H GLN A 62 3.260 -10.169 -1.617 1.00 0.00 H new ATOM 0 HA GLN A 62 2.821 -12.314 0.308 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.486 -12.149 -2.251 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.156 -13.617 -1.352 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.744 -13.413 -1.767 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.946 -11.817 -2.461 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.847 -14.303 -3.763 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.875 -14.573 -5.175 1.00 0.00 H new ATOM 950 N ARG A 63 5.678 -10.712 -0.005 1.00 0.00 N ATOM 951 CA ARG A 63 6.977 -10.497 0.624 1.00 0.00 C ATOM 952 C ARG A 63 6.807 -10.114 2.091 1.00 0.00 C ATOM 953 O ARG A 63 7.680 -10.378 2.917 1.00 0.00 O ATOM 954 CB ARG A 63 7.737 -9.391 -0.110 1.00 0.00 C ATOM 955 CG ARG A 63 7.024 -8.053 0.103 1.00 0.00 C ATOM 956 CD ARG A 63 7.627 -7.000 -0.828 1.00 0.00 C ATOM 957 NE ARG A 63 6.942 -5.722 -0.655 1.00 0.00 N ATOM 958 CZ ARG A 63 7.279 -4.889 0.323 1.00 0.00 C ATOM 959 NH1 ARG A 63 8.237 -5.208 1.149 1.00 0.00 N ATOM 960 NH2 ARG A 63 6.653 -3.752 0.456 1.00 0.00 N ATOM 0 H ARG A 63 5.466 -10.073 -0.771 1.00 0.00 H new ATOM 0 HA ARG A 63 7.544 -11.426 0.567 1.00 0.00 H new ATOM 0 HB2 ARG A 63 8.761 -9.332 0.259 1.00 0.00 H new ATOM 0 HB3 ARG A 63 7.794 -9.619 -1.174 1.00 0.00 H new ATOM 0 HG2 ARG A 63 5.958 -8.161 -0.095 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.125 -7.736 1.141 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.690 -6.883 -0.616 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.543 -7.329 -1.864 1.00 0.00 H new ATOM 0 HE ARG A 63 6.192 -5.465 -1.296 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.727 -6.097 1.043 1.00 0.00 H new ATOM 0 HH12 ARG A 63 8.496 -4.569 1.900 1.00 0.00 H new ATOM 0 HH21 ARG A 63 5.905 -3.503 -0.191 1.00 0.00 H new ATOM 0 HH22 ARG A 63 6.912 -3.112 1.207 1.00 0.00 H new ATOM 974 N SER A 64 5.678 -9.487 2.406 1.00 0.00 N ATOM 975 CA SER A 64 5.409 -9.062 3.775 1.00 0.00 C ATOM 976 C SER A 64 5.286 -10.270 4.697 1.00 0.00 C ATOM 977 O SER A 64 5.702 -10.225 5.856 1.00 0.00 O ATOM 978 CB SER A 64 4.116 -8.250 3.824 1.00 0.00 C ATOM 979 OG SER A 64 3.956 -7.699 5.125 1.00 0.00 O ATOM 0 H SER A 64 4.940 -9.263 1.738 1.00 0.00 H new ATOM 0 HA SER A 64 6.241 -8.444 4.113 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.145 -7.454 3.080 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.265 -8.885 3.578 1.00 0.00 H new ATOM 0 HG SER A 64 3.466 -6.852 5.064 1.00 0.00 H new ATOM 985 N THR A 65 4.711 -11.349 4.178 1.00 0.00 N ATOM 986 CA THR A 65 4.517 -12.557 4.973 1.00 0.00 C ATOM 987 C THR A 65 5.849 -13.049 5.534 1.00 0.00 C ATOM 988 O THR A 65 5.886 -13.765 6.536 1.00 0.00 O ATOM 989 CB THR A 65 3.889 -13.652 4.111 1.00 0.00 C ATOM 990 OG1 THR A 65 4.782 -13.998 3.061 1.00 0.00 O ATOM 991 CG2 THR A 65 2.574 -13.147 3.519 1.00 0.00 C ATOM 0 H THR A 65 4.373 -11.413 3.218 1.00 0.00 H new ATOM 0 HA THR A 65 3.851 -12.321 5.803 1.00 0.00 H new ATOM 0 HB THR A 65 3.694 -14.531 4.726 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.751 -13.309 2.365 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.128 -13.929 2.905 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.889 -12.884 4.325 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.766 -12.268 2.904 1.00 0.00 H new ATOM 999 N ILE A 66 6.938 -12.662 4.884 1.00 0.00 N ATOM 1000 CA ILE A 66 8.265 -13.072 5.325 1.00 0.00 C ATOM 1001 C ILE A 66 8.519 -12.611 6.756 1.00 0.00 C ATOM 1002 O ILE A 66 9.069 -13.356 7.569 1.00 0.00 O ATOM 1003 CB ILE A 66 9.330 -12.479 4.399 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.174 -13.074 2.997 1.00 0.00 C ATOM 1005 CG2 ILE A 66 10.723 -12.811 4.939 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.049 -12.296 2.013 1.00 0.00 C ATOM 0 H ILE A 66 6.930 -12.068 4.055 1.00 0.00 H new ATOM 0 HA ILE A 66 8.319 -14.160 5.290 1.00 0.00 H new ATOM 0 HB ILE A 66 9.207 -11.397 4.353 1.00 0.00 H new ATOM 0 HG12 ILE A 66 9.461 -14.126 3.003 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.130 -13.030 2.686 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.480 -12.388 4.278 1.00 0.00 H new ATOM 0 HG22 ILE A 66 10.836 -12.389 5.938 1.00 0.00 H new ATOM 0 HG23 ILE A 66 10.847 -13.893 4.986 1.00 0.00 H new ATOM 0 HD11 ILE A 66 9.938 -12.719 1.015 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.741 -11.251 2.000 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.092 -12.363 2.322 1.00 0.00 H new ATOM 1018 N LEU A 67 8.118 -11.380 7.057 1.00 0.00 N ATOM 1019 CA LEU A 67 8.328 -10.822 8.390 1.00 0.00 C ATOM 1020 C LEU A 67 7.562 -11.625 9.435 1.00 0.00 C ATOM 1021 O LEU A 67 8.110 -11.979 10.478 1.00 0.00 O ATOM 1022 CB LEU A 67 7.864 -9.364 8.425 1.00 0.00 C ATOM 1023 CG LEU A 67 8.843 -8.490 7.631 1.00 0.00 C ATOM 1024 CD1 LEU A 67 8.422 -8.458 6.159 1.00 0.00 C ATOM 1025 CD2 LEU A 67 8.832 -7.064 8.193 1.00 0.00 C ATOM 0 H LEU A 67 7.649 -10.753 6.403 1.00 0.00 H new ATOM 0 HA LEU A 67 9.393 -10.871 8.619 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.863 -9.281 8.003 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.805 -9.016 9.456 1.00 0.00 H new ATOM 0 HG LEU A 67 9.847 -8.906 7.715 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.118 -7.837 5.595 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.431 -9.471 5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.417 -8.044 6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.528 -6.445 7.628 1.00 0.00 H new ATOM 0 HD22 LEU A 67 7.828 -6.648 8.111 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.132 -7.083 9.241 1.00 0.00 H new ATOM 1037 N ALA A 68 6.298 -11.910 9.148 1.00 0.00 N ATOM 1038 CA ALA A 68 5.457 -12.644 10.089 1.00 0.00 C ATOM 1039 C ALA A 68 6.116 -13.960 10.482 1.00 0.00 C ATOM 1040 O ALA A 68 6.044 -14.382 11.636 1.00 0.00 O ATOM 1041 CB ALA A 68 4.092 -12.922 9.463 1.00 0.00 C ATOM 0 H ALA A 68 5.834 -11.647 8.278 1.00 0.00 H new ATOM 0 HA ALA A 68 5.328 -12.034 10.983 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.471 -13.470 10.172 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.608 -11.978 9.211 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.221 -13.517 8.559 1.00 0.00 H new ATOM 1047 N VAL A 69 6.757 -14.601 9.517 1.00 0.00 N ATOM 1048 CA VAL A 69 7.419 -15.871 9.774 1.00 0.00 C ATOM 1049 C VAL A 69 8.579 -15.688 10.750 1.00 0.00 C ATOM 1050 O VAL A 69 8.517 -16.137 11.893 1.00 0.00 O ATOM 1051 CB VAL A 69 7.942 -16.458 8.461 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.763 -17.715 8.754 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.761 -16.821 7.560 1.00 0.00 C ATOM 0 H VAL A 69 6.833 -14.267 8.556 1.00 0.00 H new ATOM 0 HA VAL A 69 6.694 -16.554 10.217 1.00 0.00 H new ATOM 0 HB VAL A 69 8.571 -15.722 7.960 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.135 -18.133 7.819 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.605 -17.458 9.397 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.135 -18.451 9.255 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.132 -17.239 6.624 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.133 -17.557 8.062 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.175 -15.926 7.350 1.00 0.00 H new ATOM 1063 N ASP A 70 9.633 -15.025 10.293 1.00 0.00 N ATOM 1064 CA ASP A 70 10.825 -14.839 11.115 1.00 0.00 C ATOM 1065 C ASP A 70 10.486 -14.088 12.403 1.00 0.00 C ATOM 1066 O ASP A 70 11.267 -14.084 13.356 1.00 0.00 O ATOM 1067 CB ASP A 70 11.881 -14.059 10.332 1.00 0.00 C ATOM 1068 CG ASP A 70 13.220 -14.119 11.059 1.00 0.00 C ATOM 1069 OD1 ASP A 70 13.243 -14.606 12.177 1.00 0.00 O ATOM 1070 OD2 ASP A 70 14.203 -13.676 10.488 1.00 0.00 O ATOM 0 H ASP A 70 9.689 -14.609 9.364 1.00 0.00 H new ATOM 0 HA ASP A 70 11.216 -15.822 11.377 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.983 -14.475 9.330 1.00 0.00 H new ATOM 0 HB3 ASP A 70 11.567 -13.022 10.216 1.00 0.00 H new ATOM 1075 N ASN A 71 9.320 -13.451 12.426 1.00 0.00 N ATOM 1076 CA ASN A 71 8.908 -12.663 13.586 1.00 0.00 C ATOM 1077 C ASN A 71 8.149 -13.525 14.592 1.00 0.00 C ATOM 1078 O ASN A 71 8.465 -13.531 15.782 1.00 0.00 O ATOM 1079 CB ASN A 71 8.014 -11.504 13.138 1.00 0.00 C ATOM 1080 CG ASN A 71 8.839 -10.478 12.366 1.00 0.00 C ATOM 1081 OD1 ASN A 71 10.139 -10.588 12.338 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 8.283 -9.555 11.772 1.00 0.00 N flip ATOM 0 H ASN A 71 8.646 -13.463 11.661 1.00 0.00 H new ATOM 0 HA ASN A 71 9.806 -12.274 14.066 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.205 -11.879 12.511 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.552 -11.033 14.006 1.00 0.00 H new ATOM 0 HD21 ASN A 71 7.267 -9.472 11.796 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.838 -8.873 11.256 1.00 0.00 H new ATOM 1089 N LEU A 72 7.149 -14.254 14.108 1.00 0.00 N ATOM 1090 CA LEU A 72 6.314 -15.071 14.985 1.00 0.00 C ATOM 1091 C LEU A 72 6.637 -16.554 14.816 1.00 0.00 C ATOM 1092 O LEU A 72 5.831 -17.418 15.164 1.00 0.00 O ATOM 1093 CB LEU A 72 4.836 -14.824 14.670 1.00 0.00 C ATOM 1094 CG LEU A 72 4.560 -13.318 14.659 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.075 -13.075 14.382 1.00 0.00 C ATOM 1096 CD2 LEU A 72 4.929 -12.719 16.020 1.00 0.00 C ATOM 0 H LEU A 72 6.897 -14.297 13.121 1.00 0.00 H new ATOM 0 HA LEU A 72 6.519 -14.789 16.018 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.582 -15.258 13.703 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.208 -15.314 15.414 1.00 0.00 H new ATOM 0 HG LEU A 72 5.159 -12.845 13.880 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.877 -12.003 14.374 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.811 -13.500 13.414 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.477 -13.548 15.161 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.732 -11.647 16.011 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.331 -13.191 16.800 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.987 -12.892 16.219 1.00 0.00 H new ATOM 1108 N ASN A 73 7.818 -16.841 14.279 1.00 0.00 N ATOM 1109 CA ASN A 73 8.250 -18.225 14.101 1.00 0.00 C ATOM 1110 C ASN A 73 8.822 -18.777 15.402 1.00 0.00 C ATOM 1111 O ASN A 73 9.927 -18.413 15.808 1.00 0.00 O ATOM 1112 CB ASN A 73 9.311 -18.306 12.998 1.00 0.00 C ATOM 1113 CG ASN A 73 10.079 -19.621 13.102 1.00 0.00 C ATOM 1114 OD1 ASN A 73 11.185 -19.654 13.642 1.00 0.00 O ATOM 1115 ND2 ASN A 73 9.555 -20.713 12.616 1.00 0.00 N ATOM 0 H ASN A 73 8.489 -16.141 13.961 1.00 0.00 H new ATOM 0 HA ASN A 73 7.384 -18.822 13.814 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.836 -18.230 12.020 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.000 -17.466 13.084 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.062 -21.596 12.683 1.00 0.00 H new ATOM 0 HD22 ASN A 73 8.639 -20.684 12.169 1.00 0.00 H new ATOM 1122 N GLY A 74 8.065 -19.654 16.051 1.00 0.00 N ATOM 1123 CA GLY A 74 8.513 -20.256 17.300 1.00 0.00 C ATOM 1124 C GLY A 74 8.266 -19.317 18.476 1.00 0.00 C ATOM 1125 O GLY A 74 8.561 -19.653 19.623 1.00 0.00 O ATOM 0 H GLY A 74 7.145 -19.962 15.736 1.00 0.00 H new ATOM 0 HA2 GLY A 74 7.987 -21.197 17.464 1.00 0.00 H new ATOM 0 HA3 GLY A 74 9.575 -20.492 17.234 1.00 0.00 H new ATOM 1129 N PHE A 75 7.722 -18.138 18.185 1.00 0.00 N ATOM 1130 CA PHE A 75 7.437 -17.158 19.229 1.00 0.00 C ATOM 1131 C PHE A 75 6.338 -17.672 20.154 1.00 0.00 C ATOM 1132 O PHE A 75 5.273 -18.087 19.700 1.00 0.00 O ATOM 1133 CB PHE A 75 7.003 -15.833 18.598 1.00 0.00 C ATOM 1134 CG PHE A 75 6.848 -14.787 19.678 1.00 0.00 C ATOM 1135 CD1 PHE A 75 7.958 -14.400 20.448 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.600 -14.202 19.911 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.812 -13.432 21.448 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.456 -13.233 20.913 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.561 -12.848 21.680 1.00 0.00 C ATOM 0 H PHE A 75 7.471 -17.840 17.242 1.00 0.00 H new ATOM 0 HA PHE A 75 8.343 -16.998 19.813 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.742 -15.508 17.865 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.061 -15.963 18.065 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.923 -14.849 20.268 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.746 -14.497 19.319 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.665 -13.135 22.041 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.491 -12.783 21.093 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.449 -12.100 22.451 1.00 0.00 H new ATOM 1149 N LYS A 76 6.605 -17.640 21.457 1.00 0.00 N ATOM 1150 CA LYS A 76 5.646 -18.140 22.437 1.00 0.00 C ATOM 1151 C LYS A 76 4.574 -17.092 22.731 1.00 0.00 C ATOM 1152 O LYS A 76 4.886 -15.940 23.033 1.00 0.00 O ATOM 1153 CB LYS A 76 6.371 -18.509 23.733 1.00 0.00 C ATOM 1154 CG LYS A 76 7.401 -19.611 23.450 1.00 0.00 C ATOM 1155 CD LYS A 76 6.705 -20.978 23.439 1.00 0.00 C ATOM 1156 CE LYS A 76 6.352 -21.390 24.871 1.00 0.00 C ATOM 1157 NZ LYS A 76 6.284 -22.877 24.961 1.00 0.00 N ATOM 0 H LYS A 76 7.470 -17.276 21.856 1.00 0.00 H new ATOM 0 HA LYS A 76 5.163 -19.025 22.023 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.867 -17.631 24.147 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.653 -18.851 24.479 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.886 -19.431 22.491 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.182 -19.596 24.210 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.802 -20.932 22.831 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.357 -21.725 22.986 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.100 -21.007 25.565 1.00 0.00 H new ATOM 0 HE3 LYS A 76 5.396 -20.954 25.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 6.044 -23.155 25.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 5.555 -23.231 24.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.206 -23.283 24.702 1.00 0.00 H new ATOM 1171 N ILE A 77 3.311 -17.500 22.640 1.00 0.00 N ATOM 1172 CA ILE A 77 2.199 -16.596 22.927 1.00 0.00 C ATOM 1173 C ILE A 77 1.065 -17.346 23.619 1.00 0.00 C ATOM 1174 O ILE A 77 0.388 -18.169 23.003 1.00 0.00 O ATOM 1175 CB ILE A 77 1.683 -15.965 21.627 1.00 0.00 C ATOM 1176 CG1 ILE A 77 2.578 -14.784 21.242 1.00 0.00 C ATOM 1177 CG2 ILE A 77 0.247 -15.470 21.828 1.00 0.00 C ATOM 1178 CD1 ILE A 77 2.202 -14.291 19.843 1.00 0.00 C ATOM 0 H ILE A 77 3.032 -18.444 22.372 1.00 0.00 H new ATOM 0 HA ILE A 77 2.558 -15.809 23.591 1.00 0.00 H new ATOM 0 HB ILE A 77 1.701 -16.711 20.833 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.464 -13.977 21.966 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.625 -15.086 21.263 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.116 -15.022 20.903 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.392 -16.310 22.101 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.227 -14.725 22.624 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.840 -13.450 19.570 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.338 -15.099 19.124 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.160 -13.972 19.837 1.00 0.00 H new ATOM 1190 N GLY A 78 0.863 -17.054 24.899 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.192 -17.708 25.662 1.00 0.00 C ATOM 1192 C GLY A 78 0.249 -19.091 26.124 1.00 0.00 C ATOM 1193 O GLY A 78 -0.574 -19.918 26.516 1.00 0.00 O ATOM 0 H GLY A 78 1.411 -16.374 25.426 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.453 -17.097 26.526 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.090 -17.794 25.050 1.00 0.00 H new ATOM 1197 N GLY A 79 1.556 -19.338 26.075 1.00 0.00 N ATOM 1198 CA GLY A 79 2.097 -20.621 26.505 1.00 0.00 C ATOM 1199 C GLY A 79 2.312 -21.549 25.312 1.00 0.00 C ATOM 1200 O GLY A 79 2.840 -22.652 25.461 1.00 0.00 O ATOM 0 H GLY A 79 2.254 -18.671 25.744 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.042 -20.466 27.025 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.415 -21.088 27.216 1.00 0.00 H new ATOM 1204 N ARG A 80 1.903 -21.096 24.130 1.00 0.00 N ATOM 1205 CA ARG A 80 2.054 -21.896 22.917 1.00 0.00 C ATOM 1206 C ARG A 80 2.855 -21.134 21.866 1.00 0.00 C ATOM 1207 O ARG A 80 2.794 -19.907 21.795 1.00 0.00 O ATOM 1208 CB ARG A 80 0.678 -22.253 22.352 1.00 0.00 C ATOM 1209 CG ARG A 80 -0.064 -23.146 23.345 1.00 0.00 C ATOM 1210 CD ARG A 80 -1.355 -23.656 22.706 1.00 0.00 C ATOM 1211 NE ARG A 80 -2.104 -24.468 23.657 1.00 0.00 N ATOM 1212 CZ ARG A 80 -3.216 -25.100 23.296 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -3.656 -25.000 22.072 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -3.868 -25.821 24.166 1.00 0.00 N ATOM 0 H ARG A 80 1.467 -20.185 23.986 1.00 0.00 H new ATOM 0 HA ARG A 80 2.590 -22.810 23.173 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.104 -21.346 22.163 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.787 -22.766 21.396 1.00 0.00 H new ATOM 0 HG2 ARG A 80 0.567 -23.986 23.636 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.291 -22.588 24.253 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.964 -22.814 22.378 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.122 -24.245 21.819 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.769 -24.553 24.617 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -3.147 -24.437 21.391 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -4.509 -25.485 21.796 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -3.524 -25.900 25.123 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -4.721 -26.306 23.889 1.00 0.00 H new ATOM 1228 N ALA A 81 3.606 -21.869 21.052 1.00 0.00 N ATOM 1229 CA ALA A 81 4.420 -21.250 20.008 1.00 0.00 C ATOM 1230 C ALA A 81 3.686 -21.274 18.671 1.00 0.00 C ATOM 1231 O ALA A 81 3.102 -22.289 18.293 1.00 0.00 O ATOM 1232 CB ALA A 81 5.751 -21.991 19.878 1.00 0.00 C ATOM 0 H ALA A 81 3.669 -22.886 21.093 1.00 0.00 H new ATOM 0 HA ALA A 81 4.608 -20.213 20.285 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.353 -21.524 19.098 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.287 -21.945 20.826 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.564 -23.033 19.617 1.00 0.00 H new ATOM 1238 N LEU A 82 3.723 -20.152 17.958 1.00 0.00 N ATOM 1239 CA LEU A 82 3.050 -20.053 16.667 1.00 0.00 C ATOM 1240 C LEU A 82 3.822 -20.822 15.599 1.00 0.00 C ATOM 1241 O LEU A 82 5.051 -20.900 15.643 1.00 0.00 O ATOM 1242 CB LEU A 82 2.927 -18.583 16.248 1.00 0.00 C ATOM 1243 CG LEU A 82 1.653 -17.985 16.848 1.00 0.00 C ATOM 1244 CD1 LEU A 82 1.834 -17.807 18.355 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.377 -16.624 16.204 1.00 0.00 C ATOM 0 H LEU A 82 4.209 -19.304 18.250 1.00 0.00 H new ATOM 0 HA LEU A 82 2.055 -20.487 16.766 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.799 -18.023 16.587 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.901 -18.505 15.161 1.00 0.00 H new ATOM 0 HG LEU A 82 0.814 -18.654 16.659 1.00 0.00 H new ATOM 0 HD11 LEU A 82 0.926 -17.381 18.783 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.032 -18.775 18.815 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.673 -17.138 18.544 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.469 -16.197 16.631 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.217 -15.955 16.393 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.248 -16.750 15.129 1.00 0.00 H new ATOM 1257 N LYS A 83 3.092 -21.389 14.641 1.00 0.00 N ATOM 1258 CA LYS A 83 3.721 -22.130 13.554 1.00 0.00 C ATOM 1259 C LYS A 83 3.377 -21.499 12.209 1.00 0.00 C ATOM 1260 O LYS A 83 2.286 -21.704 11.676 1.00 0.00 O ATOM 1261 CB LYS A 83 3.251 -23.587 13.573 1.00 0.00 C ATOM 1262 CG LYS A 83 4.142 -24.425 12.645 1.00 0.00 C ATOM 1263 CD LYS A 83 5.349 -24.955 13.430 1.00 0.00 C ATOM 1264 CE LYS A 83 4.969 -26.258 14.136 1.00 0.00 C ATOM 1265 NZ LYS A 83 4.883 -27.359 13.134 1.00 0.00 N ATOM 0 H LYS A 83 2.074 -21.350 14.596 1.00 0.00 H new ATOM 0 HA LYS A 83 4.802 -22.097 13.693 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.294 -23.981 14.589 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.212 -23.649 13.250 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.572 -25.256 12.230 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.480 -23.819 11.804 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.188 -25.126 12.755 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.674 -24.215 14.161 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.710 -26.501 14.897 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.014 -26.142 14.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.031 -28.273 13.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.944 -27.349 12.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.614 -27.224 12.406 1.00 0.00 H new ATOM 1279 N ILE A 84 4.316 -20.731 11.661 1.00 0.00 N ATOM 1280 CA ILE A 84 4.104 -20.081 10.370 1.00 0.00 C ATOM 1281 C ILE A 84 4.763 -20.886 9.255 1.00 0.00 C ATOM 1282 O ILE A 84 5.890 -21.359 9.400 1.00 0.00 O ATOM 1283 CB ILE A 84 4.687 -18.662 10.396 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.470 -18.044 11.786 1.00 0.00 C ATOM 1285 CG2 ILE A 84 3.983 -17.802 9.342 1.00 0.00 C ATOM 1286 CD1 ILE A 84 2.971 -17.944 12.080 1.00 0.00 C ATOM 0 H ILE A 84 5.224 -20.544 12.087 1.00 0.00 H new ATOM 0 HA ILE A 84 3.032 -20.027 10.180 1.00 0.00 H new ATOM 0 HB ILE A 84 5.754 -18.704 10.179 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.959 -18.654 12.546 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.925 -17.055 11.829 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.397 -16.794 9.360 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.135 -18.239 8.355 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.916 -17.760 9.560 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.822 -17.505 13.067 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.494 -17.316 11.328 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.528 -18.940 12.055 1.00 0.00 H new ATOM 1298 N ASP A 85 4.052 -21.034 8.140 1.00 0.00 N ATOM 1299 CA ASP A 85 4.581 -21.781 7.002 1.00 0.00 C ATOM 1300 C ASP A 85 3.893 -21.348 5.711 1.00 0.00 C ATOM 1301 O ASP A 85 2.782 -20.822 5.734 1.00 0.00 O ATOM 1302 CB ASP A 85 4.369 -23.280 7.217 1.00 0.00 C ATOM 1303 CG ASP A 85 5.252 -24.076 6.263 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.014 -23.457 5.538 1.00 0.00 O ATOM 1305 OD2 ASP A 85 5.153 -25.292 6.270 1.00 0.00 O ATOM 0 H ASP A 85 3.117 -20.651 8.000 1.00 0.00 H new ATOM 0 HA ASP A 85 5.648 -21.574 6.919 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.604 -23.544 8.248 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.322 -23.534 7.053 1.00 0.00 H new ATOM 1310 N HIS A 86 4.562 -21.576 4.584 1.00 0.00 N ATOM 1311 CA HIS A 86 4.002 -21.211 3.288 1.00 0.00 C ATOM 1312 C HIS A 86 3.028 -22.282 2.803 1.00 0.00 C ATOM 1313 O HIS A 86 3.162 -23.457 3.147 1.00 0.00 O ATOM 1314 CB HIS A 86 5.125 -21.039 2.265 1.00 0.00 C ATOM 1315 CG HIS A 86 6.057 -19.948 2.719 1.00 0.00 C ATOM 1316 ND1 HIS A 86 5.760 -18.605 2.547 1.00 0.00 N ATOM 1317 CD2 HIS A 86 7.280 -19.986 3.341 1.00 0.00 C ATOM 1318 CE1 HIS A 86 6.785 -17.895 3.055 1.00 0.00 C ATOM 1319 NE2 HIS A 86 7.738 -18.689 3.552 1.00 0.00 N ATOM 0 H HIS A 86 5.485 -22.008 4.542 1.00 0.00 H new ATOM 0 HA HIS A 86 3.463 -20.270 3.398 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.672 -21.975 2.150 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.707 -20.792 1.289 1.00 0.00 H new ATOM 0 HD2 HIS A 86 7.807 -20.886 3.624 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.831 -16.816 3.060 1.00 0.00 H new ATOM 0 HE2 HIS A 86 8.613 -18.405 3.992 1.00 0.00 H new ATOM 1328 N THR A 87 2.045 -21.870 2.003 1.00 0.00 N ATOM 1329 CA THR A 87 1.048 -22.803 1.482 1.00 0.00 C ATOM 1330 C THR A 87 0.920 -22.665 -0.033 1.00 0.00 C ATOM 1331 O THR A 87 0.992 -23.655 -0.764 1.00 0.00 O ATOM 1332 CB THR A 87 -0.309 -22.534 2.133 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.676 -21.179 1.918 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.220 -22.808 3.635 1.00 0.00 C ATOM 0 H THR A 87 1.918 -20.903 1.704 1.00 0.00 H new ATOM 0 HA THR A 87 1.372 -23.817 1.717 1.00 0.00 H new ATOM 0 HB THR A 87 -1.060 -23.188 1.691 1.00 0.00 H new ATOM 0 HG1 THR A 87 0.100 -20.678 1.592 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.188 -22.616 4.098 1.00 0.00 H new ATOM 0 HG22 THR A 87 0.061 -23.848 3.799 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.531 -22.155 4.080 1.00 0.00 H new ATOM 1342 N PHE A 88 0.729 -21.434 -0.499 1.00 0.00 N ATOM 1343 CA PHE A 88 0.571 -21.183 -1.928 1.00 0.00 C ATOM 1344 C PHE A 88 -0.573 -22.020 -2.494 1.00 0.00 C ATOM 1345 O PHE A 88 -0.600 -22.323 -3.687 1.00 0.00 O ATOM 1346 CB PHE A 88 1.869 -21.521 -2.667 1.00 0.00 C ATOM 1347 CG PHE A 88 2.849 -20.382 -2.513 1.00 0.00 C ATOM 1348 CD1 PHE A 88 3.550 -20.221 -1.315 1.00 0.00 C ATOM 1349 CD2 PHE A 88 3.054 -19.485 -3.572 1.00 0.00 C ATOM 1350 CE1 PHE A 88 4.458 -19.164 -1.171 1.00 0.00 C ATOM 1351 CE2 PHE A 88 3.962 -18.431 -3.428 1.00 0.00 C ATOM 1352 CZ PHE A 88 4.664 -18.269 -2.228 1.00 0.00 C ATOM 0 H PHE A 88 0.680 -20.601 0.087 1.00 0.00 H new ATOM 0 HA PHE A 88 0.340 -20.127 -2.069 1.00 0.00 H new ATOM 0 HB2 PHE A 88 2.298 -22.440 -2.268 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.663 -21.697 -3.723 1.00 0.00 H new ATOM 0 HD1 PHE A 88 3.392 -20.912 -0.500 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.511 -19.608 -4.498 1.00 0.00 H new ATOM 0 HE1 PHE A 88 4.999 -19.039 -0.245 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.122 -17.741 -4.244 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.364 -17.454 -2.117 1.00 0.00 H new ATOM 1362 N TYR A 89 -1.515 -22.388 -1.631 1.00 0.00 N ATOM 1363 CA TYR A 89 -2.654 -23.194 -2.056 1.00 0.00 C ATOM 1364 C TYR A 89 -3.763 -22.306 -2.614 1.00 0.00 C ATOM 1365 O TYR A 89 -4.130 -21.300 -2.006 1.00 0.00 O ATOM 1366 CB TYR A 89 -3.192 -24.005 -0.871 1.00 0.00 C ATOM 1367 CG TYR A 89 -4.247 -23.203 -0.144 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -3.871 -22.168 0.721 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -5.604 -23.491 -0.337 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -4.847 -21.424 1.392 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -6.581 -22.746 0.334 1.00 0.00 C ATOM 1372 CZ TYR A 89 -6.202 -21.712 1.200 1.00 0.00 C ATOM 1373 OH TYR A 89 -7.165 -20.979 1.861 1.00 0.00 O ATOM 0 H TYR A 89 -1.513 -22.143 -0.641 1.00 0.00 H new ATOM 0 HA TYR A 89 -2.321 -23.874 -2.840 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -3.615 -24.946 -1.223 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -2.379 -24.256 -0.190 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -2.825 -21.944 0.870 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.897 -24.288 -1.004 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -4.554 -20.627 2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -7.627 -22.968 0.184 1.00 0.00 H new ATOM 0 HH TYR A 89 -8.054 -21.309 1.614 1.00 0.00 H new ATOM 2031 N PHE B 311 12.699 -4.283 6.507 1.00 0.00 N ATOM 2032 CA PHE B 311 11.772 -3.911 5.441 1.00 0.00 C ATOM 2033 C PHE B 311 11.311 -2.466 5.609 1.00 0.00 C ATOM 2034 O PHE B 311 11.492 -1.868 6.670 1.00 0.00 O ATOM 2035 CB PHE B 311 10.558 -4.837 5.455 1.00 0.00 C ATOM 2036 CG PHE B 311 11.016 -6.268 5.320 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.339 -7.003 6.458 1.00 0.00 C ATOM 2038 CD2 PHE B 311 11.115 -6.856 4.053 1.00 0.00 C ATOM 2039 CE1 PHE B 311 11.766 -8.331 6.336 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.539 -8.183 3.928 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.866 -8.921 5.072 1.00 0.00 C ATOM 0 HA PHE B 311 12.291 -4.007 4.488 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.000 -4.708 6.382 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.883 -4.581 4.638 1.00 0.00 H new ATOM 0 HD1 PHE B 311 11.260 -6.549 7.435 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.864 -6.284 3.172 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.018 -8.900 7.219 1.00 0.00 H new ATOM 0 HE2 PHE B 311 11.614 -8.637 2.951 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.195 -9.945 4.978 1.00 0.00 H new ATOM 2051 N ALA B 312 10.714 -1.913 4.559 1.00 0.00 N ATOM 2052 CA ALA B 312 10.216 -0.543 4.607 1.00 0.00 C ATOM 2053 C ALA B 312 8.744 -0.522 5.015 1.00 0.00 C ATOM 2054 O ALA B 312 8.111 0.533 5.037 1.00 0.00 O ATOM 2055 CB ALA B 312 10.377 0.122 3.239 1.00 0.00 C ATOM 0 H ALA B 312 10.564 -2.389 3.669 1.00 0.00 H new ATOM 0 HA ALA B 312 10.796 0.008 5.348 1.00 0.00 H new ATOM 0 HB1 ALA B 312 10.002 1.145 3.285 1.00 0.00 H new ATOM 0 HB2 ALA B 312 11.431 0.134 2.962 1.00 0.00 H new ATOM 0 HB3 ALA B 312 9.812 -0.438 2.494 1.00 0.00 H new ATOM 2061 N ILE B 313 8.207 -1.694 5.336 1.00 0.00 N ATOM 2062 CA ILE B 313 6.807 -1.800 5.733 1.00 0.00 C ATOM 2063 C ILE B 313 6.609 -1.268 7.149 1.00 0.00 C ATOM 2064 O ILE B 313 7.174 -1.798 8.105 1.00 0.00 O ATOM 2065 CB ILE B 313 6.354 -3.259 5.666 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.508 -3.775 4.234 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.885 -3.359 6.087 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.312 -5.291 4.213 1.00 0.00 C ATOM 0 H ILE B 313 8.715 -2.578 5.330 1.00 0.00 H new ATOM 0 HA ILE B 313 6.208 -1.202 5.046 1.00 0.00 H new ATOM 0 HB ILE B 313 6.967 -3.860 6.338 1.00 0.00 H new ATOM 0 HG12 ILE B 313 5.778 -3.294 3.583 1.00 0.00 H new ATOM 0 HG13 ILE B 313 7.495 -3.520 3.849 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.563 -4.399 6.039 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.773 -2.991 7.107 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.272 -2.758 5.415 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.422 -5.658 3.193 1.00 0.00 H new ATOM 0 HD12 ILE B 313 7.059 -5.763 4.851 1.00 0.00 H new ATOM 0 HD13 ILE B 313 5.315 -5.534 4.581 1.00 0.00 H new ATOM 2080 N MET B 314 5.805 -0.217 7.276 1.00 0.00 N ATOM 2081 CA MET B 314 5.540 0.381 8.580 1.00 0.00 C ATOM 2082 C MET B 314 4.247 -0.174 9.180 1.00 0.00 C ATOM 2083 O MET B 314 3.361 -0.628 8.454 1.00 0.00 O ATOM 2084 CB MET B 314 5.432 1.904 8.445 1.00 0.00 C ATOM 2085 CG MET B 314 4.662 2.252 7.169 1.00 0.00 C ATOM 2086 SD MET B 314 5.755 2.073 5.735 1.00 0.00 S ATOM 2087 CE MET B 314 6.805 3.510 6.067 1.00 0.00 C ATOM 0 H MET B 314 5.328 0.236 6.497 1.00 0.00 H new ATOM 0 HA MET B 314 6.367 0.132 9.245 1.00 0.00 H new ATOM 0 HB2 MET B 314 4.923 2.321 9.314 1.00 0.00 H new ATOM 0 HB3 MET B 314 6.427 2.348 8.414 1.00 0.00 H new ATOM 0 HG2 MET B 314 3.797 1.598 7.064 1.00 0.00 H new ATOM 0 HG3 MET B 314 4.284 3.273 7.227 1.00 0.00 H new ATOM 0 HE1 MET B 314 6.899 4.109 5.161 1.00 0.00 H new ATOM 0 HE2 MET B 314 6.357 4.114 6.856 1.00 0.00 H new ATOM 0 HE3 MET B 314 7.792 3.174 6.384 1.00 0.00 H new ATOM 2097 N PRO B 315 4.128 -0.142 10.485 1.00 0.00 N ATOM 2098 CA PRO B 315 2.916 -0.643 11.207 1.00 0.00 C ATOM 2099 C PRO B 315 1.635 0.022 10.705 1.00 0.00 C ATOM 2100 O PRO B 315 1.621 1.215 10.400 1.00 0.00 O ATOM 2101 CB PRO B 315 3.181 -0.279 12.677 1.00 0.00 C ATOM 2102 CG PRO B 315 4.662 -0.136 12.795 1.00 0.00 C ATOM 2103 CD PRO B 315 5.138 0.374 11.442 1.00 0.00 C ATOM 0 HA PRO B 315 2.764 -1.711 11.053 1.00 0.00 H new ATOM 0 HB2 PRO B 315 2.675 0.647 12.949 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.808 -1.054 13.346 1.00 0.00 H new ATOM 0 HG2 PRO B 315 4.925 0.561 13.590 1.00 0.00 H new ATOM 0 HG3 PRO B 315 5.129 -1.090 13.040 1.00 0.00 H new ATOM 0 HD2 PRO B 315 5.187 1.463 11.421 1.00 0.00 H new ATOM 0 HD3 PRO B 315 6.136 0.005 11.206 1.00 0.00 H new ATOM 2111 N GLY B 316 0.560 -0.758 10.622 1.00 0.00 N ATOM 2112 CA GLY B 316 -0.724 -0.232 10.167 1.00 0.00 C ATOM 2113 C GLY B 316 -1.605 0.152 11.351 1.00 0.00 C ATOM 2114 O GLY B 316 -1.366 -0.275 12.480 1.00 0.00 O ATOM 0 H GLY B 316 0.552 -1.749 10.862 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -0.560 0.639 9.533 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.232 -0.979 9.558 1.00 0.00 H new ATOM 2118 N SER B 317 -2.628 0.960 11.085 1.00 0.00 N ATOM 2119 CA SER B 317 -3.540 1.392 12.138 1.00 0.00 C ATOM 2120 C SER B 317 -4.274 0.197 12.738 1.00 0.00 C ATOM 2121 O SER B 317 -4.714 0.239 13.886 1.00 0.00 O ATOM 2122 CB SER B 317 -4.557 2.384 11.571 1.00 0.00 C ATOM 2123 OG SER B 317 -5.354 1.731 10.590 1.00 0.00 O ATOM 0 H SER B 317 -2.844 1.326 10.158 1.00 0.00 H new ATOM 0 HA SER B 317 -2.956 1.875 12.922 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.189 2.772 12.370 1.00 0.00 H new ATOM 0 HB3 SER B 317 -4.043 3.237 11.129 1.00 0.00 H new ATOM 0 HG SER B 317 -6.008 2.364 10.226 1.00 0.00 H new ATOM 2129 N ARG B 318 -4.401 -0.868 11.953 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.081 -2.072 12.419 1.00 0.00 C ATOM 2131 C ARG B 318 -4.268 -2.758 13.511 1.00 0.00 C ATOM 2132 O ARG B 318 -4.776 -3.624 14.224 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.292 -3.042 11.251 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.207 -4.193 11.694 1.00 0.00 C ATOM 2135 CD ARG B 318 -7.392 -4.306 10.732 1.00 0.00 C ATOM 2136 NE ARG B 318 -8.141 -3.055 10.706 1.00 0.00 N ATOM 2137 CZ ARG B 318 -9.281 -2.950 10.031 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -9.749 -3.979 9.379 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -9.932 -1.821 10.023 1.00 0.00 N ATOM 0 H ARG B 318 -4.045 -0.923 10.999 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.049 -1.783 12.829 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -5.735 -2.517 10.405 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -4.333 -3.436 10.915 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -5.649 -5.129 11.711 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -6.565 -4.017 12.708 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -7.035 -4.545 9.730 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.044 -5.123 11.041 1.00 0.00 H new ATOM 0 HE ARG B 318 -7.784 -2.246 11.215 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -9.240 -4.863 9.388 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -10.624 -3.899 8.861 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -9.567 -1.018 10.535 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -10.807 -1.740 9.505 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.005 -2.367 13.635 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.127 -2.960 14.636 1.00 0.00 C ATOM 2155 C TRP B 319 -2.640 -2.666 16.043 1.00 0.00 C ATOM 2156 O TRP B 319 -2.165 -3.242 17.021 1.00 0.00 O ATOM 2157 CB TRP B 319 -0.709 -2.409 14.480 1.00 0.00 C ATOM 2158 CG TRP B 319 0.185 -3.031 15.505 1.00 0.00 C ATOM 2159 CD1 TRP B 319 0.012 -4.260 16.046 1.00 0.00 C ATOM 2160 CD2 TRP B 319 1.383 -2.482 16.119 1.00 0.00 C ATOM 2161 NE1 TRP B 319 1.026 -4.497 16.952 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.898 -3.431 17.035 1.00 0.00 C ATOM 2163 CE3 TRP B 319 2.066 -1.261 15.975 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 3.044 -3.180 17.775 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 3.225 -1.005 16.722 1.00 0.00 C ATOM 2166 CH2 TRP B 319 3.714 -1.963 17.622 1.00 0.00 C ATOM 0 H TRP B 319 -2.568 -1.647 13.059 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.114 -4.040 14.486 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.334 -2.620 13.479 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -0.714 -1.325 14.596 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.789 -4.944 15.807 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.119 -5.356 17.494 1.00 0.00 H new ATOM 0 HE3 TRP B 319 1.696 -0.517 15.286 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.417 -3.921 18.466 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 3.744 -0.065 16.604 1.00 0.00 H new ATOM 0 HH2 TRP B 319 4.606 -1.761 18.196 1.00 0.00 H new ATOM 2177 N ASP B 320 -3.613 -1.767 16.139 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.188 -1.410 17.431 1.00 0.00 C ATOM 2179 C ASP B 320 -3.112 -0.867 18.368 1.00 0.00 C ATOM 2180 O ASP B 320 -3.407 -0.419 19.476 1.00 0.00 O ATOM 2181 CB ASP B 320 -4.850 -2.636 18.064 1.00 0.00 C ATOM 2182 CG ASP B 320 -5.660 -2.218 19.287 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -5.984 -1.046 19.385 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -5.944 -3.075 20.105 1.00 0.00 O ATOM 0 H ASP B 320 -4.018 -1.275 15.343 1.00 0.00 H new ATOM 0 HA ASP B 320 -4.937 -0.634 17.272 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.499 -3.125 17.337 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -4.090 -3.362 18.352 1.00 0.00 H new ATOM 2189 N GLY B 321 -1.864 -0.910 17.916 1.00 0.00 N ATOM 2190 CA GLY B 321 -0.754 -0.405 18.715 1.00 0.00 C ATOM 2191 C GLY B 321 -0.355 -1.409 19.792 1.00 0.00 C ATOM 2192 O GLY B 321 0.390 -1.079 20.715 1.00 0.00 O ATOM 0 H GLY B 321 -1.596 -1.287 17.007 1.00 0.00 H new ATOM 0 HA2 GLY B 321 0.100 -0.200 18.069 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.036 0.540 19.180 1.00 0.00 H new ATOM 2196 N VAL B 322 -0.853 -2.635 19.668 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.531 -3.683 20.630 1.00 0.00 C ATOM 2198 C VAL B 322 0.922 -4.125 20.472 1.00 0.00 C ATOM 2199 O VAL B 322 1.361 -4.464 19.374 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.457 -4.885 20.429 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -0.924 -6.084 21.218 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -2.861 -4.534 20.928 1.00 0.00 C ATOM 0 H VAL B 322 -1.477 -2.926 18.916 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.672 -3.283 21.634 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.496 -5.137 19.369 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.585 -6.938 21.073 1.00 0.00 H new ATOM 0 HG12 VAL B 322 0.076 -6.336 20.866 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -0.883 -5.833 22.278 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.522 -5.389 20.786 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -2.818 -4.281 21.987 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.244 -3.682 20.367 1.00 0.00 H new ATOM 2212 N HIS B 323 1.659 -4.117 21.577 1.00 0.00 N ATOM 2213 CA HIS B 323 3.064 -4.507 21.546 1.00 0.00 C ATOM 2214 C HIS B 323 3.202 -6.002 21.274 1.00 0.00 C ATOM 2215 O HIS B 323 2.528 -6.821 21.900 1.00 0.00 O ATOM 2216 CB HIS B 323 3.730 -4.164 22.880 1.00 0.00 C ATOM 2217 CG HIS B 323 5.218 -4.359 22.764 1.00 0.00 C ATOM 2218 ND1 HIS B 323 5.997 -4.764 23.837 1.00 0.00 N ATOM 2219 CD2 HIS B 323 6.086 -4.206 21.710 1.00 0.00 C ATOM 2220 CE1 HIS B 323 7.270 -4.841 23.408 1.00 0.00 C ATOM 2221 NE2 HIS B 323 7.380 -4.510 22.119 1.00 0.00 N ATOM 0 H HIS B 323 1.311 -3.848 22.497 1.00 0.00 H new ATOM 0 HA HIS B 323 3.556 -3.958 20.743 1.00 0.00 H new ATOM 0 HB2 HIS B 323 3.508 -3.133 23.155 1.00 0.00 H new ATOM 0 HB3 HIS B 323 3.330 -4.798 23.672 1.00 0.00 H new ATOM 0 HD2 HIS B 323 5.806 -3.896 20.714 1.00 0.00 H new ATOM 0 HE1 HIS B 323 8.102 -5.135 24.031 1.00 0.00 H new ATOM 0 HE2 HIS B 323 8.230 -4.485 21.556 1.00 0.00 H new ATOM 2230 N ARG B 324 4.080 -6.352 20.338 1.00 0.00 N ATOM 2231 CA ARG B 324 4.314 -7.756 20.005 1.00 0.00 C ATOM 2232 C ARG B 324 5.808 -8.029 19.868 1.00 0.00 C ATOM 2233 O ARG B 324 6.468 -7.490 18.979 1.00 0.00 O ATOM 2234 CB ARG B 324 3.602 -8.112 18.695 1.00 0.00 C ATOM 2235 CG ARG B 324 2.092 -8.209 18.940 1.00 0.00 C ATOM 2236 CD ARG B 324 1.746 -9.604 19.474 1.00 0.00 C ATOM 2237 NE ARG B 324 0.328 -9.682 19.806 1.00 0.00 N ATOM 2238 CZ ARG B 324 -0.112 -9.377 21.023 1.00 0.00 C ATOM 2239 NH1 ARG B 324 0.730 -9.000 21.946 1.00 0.00 N ATOM 2240 NH2 ARG B 324 -1.386 -9.455 21.297 1.00 0.00 N ATOM 0 H ARG B 324 4.638 -5.689 19.800 1.00 0.00 H new ATOM 0 HA ARG B 324 3.915 -8.373 20.810 1.00 0.00 H new ATOM 0 HB2 ARG B 324 3.810 -7.355 17.939 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.980 -9.059 18.310 1.00 0.00 H new ATOM 0 HG2 ARG B 324 1.780 -7.447 19.654 1.00 0.00 H new ATOM 0 HG3 ARG B 324 1.550 -8.018 18.014 1.00 0.00 H new ATOM 0 HD2 ARG B 324 1.994 -10.358 18.727 1.00 0.00 H new ATOM 0 HD3 ARG B 324 2.346 -9.822 20.358 1.00 0.00 H new ATOM 0 HE ARG B 324 -0.338 -9.976 19.092 1.00 0.00 H new ATOM 0 HH11 ARG B 324 1.726 -8.939 21.734 1.00 0.00 H new ATOM 0 HH12 ARG B 324 0.392 -8.766 22.880 1.00 0.00 H new ATOM 0 HH21 ARG B 324 -2.045 -9.750 20.577 1.00 0.00 H new ATOM 0 HH22 ARG B 324 -1.722 -9.221 22.231 1.00 0.00 H new ATOM 2254 N SER B 325 6.334 -8.870 20.752 1.00 0.00 N ATOM 2255 CA SER B 325 7.756 -9.191 20.733 1.00 0.00 C ATOM 2256 C SER B 325 8.017 -10.429 19.880 1.00 0.00 C ATOM 2257 O SER B 325 7.166 -11.312 19.775 1.00 0.00 O ATOM 2258 CB SER B 325 8.253 -9.439 22.157 1.00 0.00 C ATOM 2259 OG SER B 325 9.582 -9.943 22.110 1.00 0.00 O ATOM 0 H SER B 325 5.802 -9.338 21.485 1.00 0.00 H new ATOM 0 HA SER B 325 8.293 -8.347 20.301 1.00 0.00 H new ATOM 0 HB2 SER B 325 8.223 -8.513 22.731 1.00 0.00 H new ATOM 0 HB3 SER B 325 7.600 -10.150 22.664 1.00 0.00 H new ATOM 0 HG SER B 325 9.904 -10.101 23.022 1.00 0.00 H new ATOM 2286 N PHE B 328 14.858 -11.732 19.729 1.00 0.00 N ATOM 2287 CA PHE B 328 15.558 -10.950 20.740 1.00 0.00 C ATOM 2288 C PHE B 328 16.496 -9.941 20.083 1.00 0.00 C ATOM 2289 O PHE B 328 16.713 -8.848 20.606 1.00 0.00 O ATOM 2290 CB PHE B 328 16.361 -11.878 21.654 1.00 0.00 C ATOM 2291 CG PHE B 328 16.706 -11.153 22.934 1.00 0.00 C ATOM 2292 CD1 PHE B 328 15.695 -10.825 23.846 1.00 0.00 C ATOM 2293 CD2 PHE B 328 18.034 -10.808 23.210 1.00 0.00 C ATOM 2294 CE1 PHE B 328 16.013 -10.153 25.032 1.00 0.00 C ATOM 2295 CE2 PHE B 328 18.352 -10.135 24.395 1.00 0.00 C ATOM 2296 CZ PHE B 328 17.342 -9.808 25.307 1.00 0.00 C ATOM 0 HA PHE B 328 14.819 -10.409 21.331 1.00 0.00 H new ATOM 0 HB2 PHE B 328 15.783 -12.775 21.877 1.00 0.00 H new ATOM 0 HB3 PHE B 328 17.272 -12.202 21.151 1.00 0.00 H new ATOM 0 HD1 PHE B 328 14.670 -11.091 23.634 1.00 0.00 H new ATOM 0 HD2 PHE B 328 18.814 -11.061 22.508 1.00 0.00 H new ATOM 0 HE1 PHE B 328 15.233 -9.901 25.735 1.00 0.00 H new ATOM 0 HE2 PHE B 328 19.377 -9.868 24.606 1.00 0.00 H new ATOM 0 HZ PHE B 328 17.587 -9.290 26.222 1.00 0.00 H new ATOM 2306 N GLU B 329 17.050 -10.316 18.934 1.00 0.00 N ATOM 2307 CA GLU B 329 17.962 -9.437 18.214 1.00 0.00 C ATOM 2308 C GLU B 329 17.285 -8.108 17.890 1.00 0.00 C ATOM 2309 O GLU B 329 17.950 -7.085 17.722 1.00 0.00 O ATOM 2310 CB GLU B 329 18.422 -10.107 16.917 1.00 0.00 C ATOM 2311 CG GLU B 329 19.484 -9.238 16.242 1.00 0.00 C ATOM 2312 CD GLU B 329 20.011 -9.936 14.992 1.00 0.00 C ATOM 2313 OE1 GLU B 329 19.490 -10.990 14.663 1.00 0.00 O ATOM 2314 OE2 GLU B 329 20.926 -9.407 14.382 1.00 0.00 O ATOM 0 H GLU B 329 16.884 -11.217 18.485 1.00 0.00 H new ATOM 0 HA GLU B 329 18.826 -9.246 18.850 1.00 0.00 H new ATOM 0 HB2 GLU B 329 18.828 -11.096 17.130 1.00 0.00 H new ATOM 0 HB3 GLU B 329 17.573 -10.248 16.248 1.00 0.00 H new ATOM 0 HG2 GLU B 329 19.059 -8.270 15.976 1.00 0.00 H new ATOM 0 HG3 GLU B 329 20.304 -9.047 16.935 1.00 0.00 H new ATOM 2321 N GLU B 330 15.959 -8.131 17.803 1.00 0.00 N ATOM 2322 CA GLU B 330 15.201 -6.924 17.492 1.00 0.00 C ATOM 2323 C GLU B 330 15.567 -5.797 18.455 1.00 0.00 C ATOM 2324 O GLU B 330 15.484 -4.619 18.108 1.00 0.00 O ATOM 2325 CB GLU B 330 13.700 -7.208 17.586 1.00 0.00 C ATOM 2326 CG GLU B 330 12.918 -6.020 17.024 1.00 0.00 C ATOM 2327 CD GLU B 330 13.122 -5.929 15.515 1.00 0.00 C ATOM 2328 OE1 GLU B 330 13.599 -6.895 14.943 1.00 0.00 O ATOM 2329 OE2 GLU B 330 12.798 -4.896 14.953 1.00 0.00 O ATOM 0 H GLU B 330 15.390 -8.966 17.942 1.00 0.00 H new ATOM 0 HA GLU B 330 15.449 -6.616 16.476 1.00 0.00 H new ATOM 0 HB2 GLU B 330 13.455 -8.113 17.030 1.00 0.00 H new ATOM 0 HB3 GLU B 330 13.417 -7.385 18.624 1.00 0.00 H new ATOM 0 HG2 GLU B 330 11.858 -6.132 17.250 1.00 0.00 H new ATOM 0 HG3 GLU B 330 13.250 -5.097 17.501 1.00 0.00 H new ATOM 2336 N LYS B 331 15.974 -6.169 19.662 1.00 0.00 N ATOM 2337 CA LYS B 331 16.333 -5.180 20.673 1.00 0.00 C ATOM 2338 C LYS B 331 17.384 -4.216 20.131 1.00 0.00 C ATOM 2339 O LYS B 331 17.409 -3.040 20.494 1.00 0.00 O ATOM 2340 CB LYS B 331 16.877 -5.882 21.920 1.00 0.00 C ATOM 2341 CG LYS B 331 18.252 -6.485 21.614 1.00 0.00 C ATOM 2342 CD LYS B 331 18.665 -7.434 22.749 1.00 0.00 C ATOM 2343 CE LYS B 331 20.029 -7.015 23.299 1.00 0.00 C ATOM 2344 NZ LYS B 331 19.922 -5.664 23.916 1.00 0.00 N ATOM 0 H LYS B 331 16.064 -7.139 19.964 1.00 0.00 H new ATOM 0 HA LYS B 331 15.439 -4.615 20.935 1.00 0.00 H new ATOM 0 HB2 LYS B 331 16.955 -5.172 22.744 1.00 0.00 H new ATOM 0 HB3 LYS B 331 16.188 -6.665 22.238 1.00 0.00 H new ATOM 0 HG2 LYS B 331 18.220 -7.026 20.668 1.00 0.00 H new ATOM 0 HG3 LYS B 331 18.991 -5.692 21.503 1.00 0.00 H new ATOM 0 HD2 LYS B 331 17.919 -7.413 23.544 1.00 0.00 H new ATOM 0 HD3 LYS B 331 18.709 -8.459 22.381 1.00 0.00 H new ATOM 0 HE2 LYS B 331 20.372 -7.738 24.039 1.00 0.00 H new ATOM 0 HE3 LYS B 331 20.768 -7.003 22.498 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 20.611 -5.580 24.690 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 20.118 -4.938 23.198 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 18.962 -5.529 24.291 1.00 0.00 H new ATOM 2358 N TRP B 332 18.251 -4.723 19.261 1.00 0.00 N ATOM 2359 CA TRP B 332 19.309 -3.901 18.684 1.00 0.00 C ATOM 2360 C TRP B 332 18.716 -2.739 17.891 1.00 0.00 C ATOM 2361 O TRP B 332 19.143 -1.594 18.037 1.00 0.00 O ATOM 2362 CB TRP B 332 20.190 -4.751 17.767 1.00 0.00 C ATOM 2363 CG TRP B 332 21.354 -3.937 17.302 1.00 0.00 C ATOM 2364 CD1 TRP B 332 22.516 -3.789 17.978 1.00 0.00 C ATOM 2365 CD2 TRP B 332 21.491 -3.164 16.076 1.00 0.00 C ATOM 2366 NE1 TRP B 332 23.358 -2.972 17.245 1.00 0.00 N ATOM 2367 CE2 TRP B 332 22.771 -2.561 16.064 1.00 0.00 C ATOM 2368 CE3 TRP B 332 20.638 -2.926 14.982 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 23.189 -1.752 15.007 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 21.056 -2.113 13.916 1.00 0.00 C ATOM 2371 CH2 TRP B 332 22.330 -1.527 13.929 1.00 0.00 C ATOM 0 H TRP B 332 18.243 -5.692 18.942 1.00 0.00 H new ATOM 0 HA TRP B 332 19.913 -3.499 19.497 1.00 0.00 H new ATOM 0 HB2 TRP B 332 20.540 -5.636 18.299 1.00 0.00 H new ATOM 0 HB3 TRP B 332 19.612 -5.101 16.912 1.00 0.00 H new ATOM 0 HD1 TRP B 332 22.748 -4.235 18.934 1.00 0.00 H new ATOM 0 HE1 TRP B 332 24.297 -2.706 17.540 1.00 0.00 H new ATOM 0 HE3 TRP B 332 19.655 -3.372 14.962 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 24.171 -1.302 15.022 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 20.393 -1.938 13.082 1.00 0.00 H new ATOM 0 HH2 TRP B 332 22.646 -0.903 13.107 1.00 0.00 H new ATOM 2382 N PHE B 333 17.731 -3.043 17.053 1.00 0.00 N ATOM 2383 CA PHE B 333 17.087 -2.017 16.240 1.00 0.00 C ATOM 2384 C PHE B 333 16.361 -1.010 17.128 1.00 0.00 C ATOM 2385 O PHE B 333 16.364 0.190 16.852 1.00 0.00 O ATOM 2386 CB PHE B 333 16.090 -2.663 15.274 1.00 0.00 C ATOM 2387 CG PHE B 333 16.832 -3.235 14.088 1.00 0.00 C ATOM 2388 CD1 PHE B 333 17.478 -2.379 13.187 1.00 0.00 C ATOM 2389 CD2 PHE B 333 16.874 -4.621 13.890 1.00 0.00 C ATOM 2390 CE1 PHE B 333 18.165 -2.909 12.089 1.00 0.00 C ATOM 2391 CE2 PHE B 333 17.563 -5.149 12.791 1.00 0.00 C ATOM 2392 CZ PHE B 333 18.208 -4.294 11.892 1.00 0.00 C ATOM 0 H PHE B 333 17.363 -3.985 16.919 1.00 0.00 H new ATOM 0 HA PHE B 333 17.856 -1.495 15.670 1.00 0.00 H new ATOM 0 HB2 PHE B 333 15.534 -3.451 15.782 1.00 0.00 H new ATOM 0 HB3 PHE B 333 15.362 -1.924 14.939 1.00 0.00 H new ATOM 0 HD1 PHE B 333 17.446 -1.310 13.340 1.00 0.00 H new ATOM 0 HD2 PHE B 333 16.376 -5.282 14.584 1.00 0.00 H new ATOM 0 HE1 PHE B 333 18.662 -2.249 11.393 1.00 0.00 H new ATOM 0 HE2 PHE B 333 17.596 -6.218 12.638 1.00 0.00 H new ATOM 0 HZ PHE B 333 18.740 -4.703 11.045 1.00 0.00 H new ATOM 2402 N ALA B 334 15.739 -1.506 18.193 1.00 0.00 N ATOM 2403 CA ALA B 334 15.009 -0.640 19.110 1.00 0.00 C ATOM 2404 C ALA B 334 15.943 0.398 19.724 1.00 0.00 C ATOM 2405 O ALA B 334 15.578 1.565 19.871 1.00 0.00 O ATOM 2406 CB ALA B 334 14.374 -1.477 20.223 1.00 0.00 C ATOM 0 H ALA B 334 15.726 -2.495 18.441 1.00 0.00 H new ATOM 0 HA ALA B 334 14.228 -0.125 18.550 1.00 0.00 H new ATOM 0 HB1 ALA B 334 13.830 -0.823 20.905 1.00 0.00 H new ATOM 0 HB2 ALA B 334 13.685 -2.200 19.786 1.00 0.00 H new ATOM 0 HB3 ALA B 334 15.154 -2.005 20.772 1.00 0.00 H new ATOM 2412 N LYS B 335 17.147 -0.033 20.081 1.00 0.00 N ATOM 2413 CA LYS B 335 18.123 0.868 20.683 1.00 0.00 C ATOM 2414 C LYS B 335 18.514 1.968 19.701 1.00 0.00 C ATOM 2415 O LYS B 335 18.580 3.144 20.063 1.00 0.00 O ATOM 2416 CB LYS B 335 19.371 0.086 21.101 1.00 0.00 C ATOM 2417 CG LYS B 335 20.262 0.971 21.984 1.00 0.00 C ATOM 2418 CD LYS B 335 19.855 0.805 23.453 1.00 0.00 C ATOM 2419 CE LYS B 335 20.527 -0.442 24.035 1.00 0.00 C ATOM 2420 NZ LYS B 335 21.924 -0.113 24.439 1.00 0.00 N ATOM 0 H LYS B 335 17.470 -0.994 19.965 1.00 0.00 H new ATOM 0 HA LYS B 335 17.671 1.326 21.563 1.00 0.00 H new ATOM 0 HB2 LYS B 335 19.083 -0.814 21.644 1.00 0.00 H new ATOM 0 HB3 LYS B 335 19.923 -0.237 20.218 1.00 0.00 H new ATOM 0 HG2 LYS B 335 21.309 0.697 21.853 1.00 0.00 H new ATOM 0 HG3 LYS B 335 20.166 2.015 21.685 1.00 0.00 H new ATOM 0 HD2 LYS B 335 20.146 1.687 24.023 1.00 0.00 H new ATOM 0 HD3 LYS B 335 18.771 0.717 23.533 1.00 0.00 H new ATOM 0 HE2 LYS B 335 19.964 -0.803 24.896 1.00 0.00 H new ATOM 0 HE3 LYS B 335 20.530 -1.244 23.297 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 22.497 -0.981 24.444 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 22.330 0.566 23.764 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 21.921 0.305 25.391 1.00 0.00 H new ATOM 2434 N GLN B 336 18.773 1.579 18.457 1.00 0.00 N ATOM 2435 CA GLN B 336 19.161 2.541 17.431 1.00 0.00 C ATOM 2436 C GLN B 336 18.032 3.531 17.170 1.00 0.00 C ATOM 2437 O GLN B 336 18.271 4.725 16.987 1.00 0.00 O ATOM 2438 CB GLN B 336 19.510 1.806 16.134 1.00 0.00 C ATOM 2439 CG GLN B 336 20.820 1.036 16.318 1.00 0.00 C ATOM 2440 CD GLN B 336 21.985 2.012 16.442 1.00 0.00 C ATOM 2441 OE1 GLN B 336 22.189 2.852 15.565 1.00 0.00 O ATOM 2442 NE2 GLN B 336 22.767 1.951 17.486 1.00 0.00 N ATOM 0 H GLN B 336 18.722 0.612 18.136 1.00 0.00 H new ATOM 0 HA GLN B 336 20.034 3.090 17.784 1.00 0.00 H new ATOM 0 HB2 GLN B 336 18.707 1.119 15.866 1.00 0.00 H new ATOM 0 HB3 GLN B 336 19.607 2.519 15.315 1.00 0.00 H new ATOM 0 HG2 GLN B 336 20.762 0.411 17.209 1.00 0.00 H new ATOM 0 HG3 GLN B 336 20.982 0.369 15.471 1.00 0.00 H new ATOM 0 HE21 GLN B 336 22.596 1.254 18.211 1.00 0.00 H new ATOM 0 HE22 GLN B 336 23.549 2.600 17.576 1.00 0.00 H new ATOM 2451 N ASN B 337 16.801 3.029 17.155 1.00 0.00 N ATOM 2452 CA ASN B 337 15.644 3.879 16.910 1.00 0.00 C ATOM 2453 C ASN B 337 15.541 4.968 17.974 1.00 0.00 C ATOM 2454 O ASN B 337 15.250 6.123 17.668 1.00 0.00 O ATOM 2455 CB ASN B 337 14.366 3.037 16.915 1.00 0.00 C ATOM 2456 CG ASN B 337 13.162 3.911 16.582 1.00 0.00 C ATOM 2457 OD1 ASN B 337 13.311 5.112 16.350 1.00 0.00 O ATOM 2458 ND2 ASN B 337 11.972 3.380 16.544 1.00 0.00 N ATOM 0 H ASN B 337 16.581 2.045 17.309 1.00 0.00 H new ATOM 0 HA ASN B 337 15.765 4.351 15.935 1.00 0.00 H new ATOM 0 HB2 ASN B 337 14.451 2.229 16.188 1.00 0.00 H new ATOM 0 HB3 ASN B 337 14.230 2.574 17.892 1.00 0.00 H new ATOM 0 HD21 ASN B 337 11.162 3.959 16.322 1.00 0.00 H new ATOM 0 HD22 ASN B 337 11.851 2.386 16.736 1.00 0.00 H new ATOM 2465 N GLU B 338 15.783 4.590 19.225 1.00 0.00 N ATOM 2466 CA GLU B 338 15.712 5.541 20.328 1.00 0.00 C ATOM 2467 C GLU B 338 16.746 6.647 20.148 1.00 0.00 C ATOM 2468 O GLU B 338 16.461 7.822 20.381 1.00 0.00 O ATOM 2469 CB GLU B 338 15.956 4.822 21.656 1.00 0.00 C ATOM 2470 CG GLU B 338 15.824 5.819 22.808 1.00 0.00 C ATOM 2471 CD GLU B 338 15.961 5.094 24.144 1.00 0.00 C ATOM 2472 OE1 GLU B 338 16.100 3.882 24.125 1.00 0.00 O ATOM 2473 OE2 GLU B 338 15.924 5.761 25.163 1.00 0.00 O ATOM 0 H GLU B 338 16.028 3.639 19.499 1.00 0.00 H new ATOM 0 HA GLU B 338 14.717 5.986 20.335 1.00 0.00 H new ATOM 0 HB2 GLU B 338 15.239 4.011 21.779 1.00 0.00 H new ATOM 0 HB3 GLU B 338 16.949 4.373 21.662 1.00 0.00 H new ATOM 0 HG2 GLU B 338 16.590 6.589 22.723 1.00 0.00 H new ATOM 0 HG3 GLU B 338 14.859 6.322 22.755 1.00 0.00 H new