USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=22 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 Set 1.1: A 43 SER OG : rot -4:sc= -0.477 USER MOD Set 1.2: A 56 TYR OH : rot 143:sc= -0.0198 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.122 USER MOD Single : A 14 TYR OH : rot -89:sc= 0.687 USER MOD Single : A 17 ASN : amide:sc= -3.45! C(o=-3.5!,f=-4.7!) USER MOD Single : A 19 ASN : amide:sc= -1.89 K(o=-1.9,f=-6!) USER MOD Single : A 23 THR OG1 : rot 180:sc=2.59e-05 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -21:sc= -2.34! USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 165:sc= -0.0253 (180deg=-0.39) USER MOD Single : A 59 TYR OH : rot 165:sc= -2.42! USER MOD Single : A 62 GLN :FLIP amide:sc= -3.38! C(o=-3.9!,f=-3.4!) USER MOD Single : A 64 SER OG : rot 145:sc= -0.223 USER MOD Single : A 65 THR OG1 : rot -70:sc= 0.604 USER MOD Single : A 71 ASN :FLIP amide:sc= -6.67! C(o=-9.2!,f=-6.7!) USER MOD Single : A 73 ASN : amide:sc= -1.13! C(o=-1.1!,f=-5.4!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HE2:sc= -1.08 K(o=-1.1,f=-1.9!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.344 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 314 MET CE :methyl 145:sc= -0.253 (180deg=-1.46!) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 325 SER OG : rot -146:sc= 0.129 USER MOD Single : B 331 LYS NZ :NH3+ 162:sc= -0.0449 (180deg=-0.455) USER MOD Single : B 335 LYS NZ :NH3+ 168:sc=-0.000721 (180deg=-0.151) USER MOD Single : B 336 GLN : amide:sc= -2.45! C(o=-2.4!,f=-2.4!) USER MOD Single : B 337 ASN : amide:sc= -0.0364 K(o=-0.036,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -1.429 -17.370 -2.753 1.00 0.00 N ATOM 143 CA ALA A 11 -0.655 -17.999 -1.690 1.00 0.00 C ATOM 144 C ALA A 11 -1.293 -17.732 -0.327 1.00 0.00 C ATOM 145 O ALA A 11 -1.994 -16.736 -0.143 1.00 0.00 O ATOM 146 CB ALA A 11 0.782 -17.462 -1.704 1.00 0.00 C ATOM 0 HA ALA A 11 -0.642 -19.075 -1.863 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.355 -17.936 -0.907 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.244 -17.685 -2.666 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.769 -16.383 -1.549 1.00 0.00 H new ATOM 152 N TYR A 12 -1.046 -18.627 0.629 1.00 0.00 N ATOM 153 CA TYR A 12 -1.597 -18.479 1.977 1.00 0.00 C ATOM 154 C TYR A 12 -0.552 -18.848 3.032 1.00 0.00 C ATOM 155 O TYR A 12 0.353 -19.640 2.772 1.00 0.00 O ATOM 156 CB TYR A 12 -2.842 -19.376 2.137 1.00 0.00 C ATOM 157 CG TYR A 12 -4.084 -18.615 1.724 1.00 0.00 C ATOM 158 CD1 TYR A 12 -4.715 -17.766 2.640 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.598 -18.757 0.430 1.00 0.00 C ATOM 160 CE1 TYR A 12 -5.862 -17.057 2.260 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.742 -18.048 0.052 1.00 0.00 C ATOM 162 CZ TYR A 12 -6.375 -17.199 0.965 1.00 0.00 C ATOM 163 OH TYR A 12 -7.505 -16.499 0.591 1.00 0.00 O ATOM 0 H TYR A 12 -0.471 -19.459 0.497 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.882 -17.437 2.121 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.735 -20.273 1.527 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.934 -19.704 3.172 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.318 -17.657 3.639 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.111 -19.414 -0.276 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -6.350 -16.401 2.966 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.138 -18.156 -0.947 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.727 -16.710 -0.340 1.00 0.00 H new ATOM 173 N ILE A 13 -0.685 -18.271 4.227 1.00 0.00 N ATOM 174 CA ILE A 13 0.249 -18.557 5.317 1.00 0.00 C ATOM 175 C ILE A 13 -0.378 -19.564 6.286 1.00 0.00 C ATOM 176 O ILE A 13 -1.417 -19.298 6.889 1.00 0.00 O ATOM 177 CB ILE A 13 0.606 -17.261 6.068 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.677 -16.099 5.074 1.00 0.00 C ATOM 179 CG2 ILE A 13 1.972 -17.415 6.759 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.148 -14.835 5.796 1.00 0.00 C ATOM 0 H ILE A 13 -1.424 -17.608 4.464 1.00 0.00 H new ATOM 0 HA ILE A 13 1.161 -18.981 4.897 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.160 -17.062 6.818 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.362 -16.343 4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.302 -15.930 4.625 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.218 -16.494 7.288 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.930 -18.241 7.469 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.738 -17.619 6.010 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.198 -14.008 5.087 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.446 -14.588 6.592 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.136 -15.007 6.223 1.00 0.00 H new ATOM 192 N TYR A 14 0.261 -20.720 6.430 1.00 0.00 N ATOM 193 CA TYR A 14 -0.247 -21.760 7.321 1.00 0.00 C ATOM 194 C TYR A 14 -0.022 -21.389 8.778 1.00 0.00 C ATOM 195 O TYR A 14 1.111 -21.389 9.258 1.00 0.00 O ATOM 196 CB TYR A 14 0.458 -23.084 7.029 1.00 0.00 C ATOM 197 CG TYR A 14 -0.176 -24.186 7.844 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.260 -24.904 7.327 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.321 -24.487 9.119 1.00 0.00 C ATOM 200 CE1 TYR A 14 -1.848 -25.925 8.083 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.269 -25.508 9.875 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.352 -26.228 9.356 1.00 0.00 C ATOM 203 OH TYR A 14 -1.931 -27.234 10.103 1.00 0.00 O ATOM 0 H TYR A 14 1.126 -20.961 5.946 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.318 -21.860 7.145 1.00 0.00 H new ATOM 0 HB2 TYR A 14 0.389 -23.318 5.967 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.518 -23.004 7.269 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -1.643 -24.670 6.345 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.158 -23.933 9.518 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.685 -26.479 7.684 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.112 -25.740 10.859 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.661 -26.863 10.641 1.00 0.00 H new ATOM 213 N ILE A 15 -1.113 -21.078 9.483 1.00 0.00 N ATOM 214 CA ILE A 15 -1.019 -20.714 10.897 1.00 0.00 C ATOM 215 C ILE A 15 -1.638 -21.815 11.753 1.00 0.00 C ATOM 216 O ILE A 15 -2.853 -22.020 11.732 1.00 0.00 O ATOM 217 CB ILE A 15 -1.746 -19.389 11.150 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.210 -18.312 10.195 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.503 -18.941 12.594 1.00 0.00 C ATOM 220 CD1 ILE A 15 -2.120 -17.071 10.242 1.00 0.00 C ATOM 0 H ILE A 15 -2.060 -21.071 9.103 1.00 0.00 H new ATOM 0 HA ILE A 15 0.031 -20.596 11.164 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.814 -19.529 10.980 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.193 -18.039 10.475 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.166 -18.704 9.179 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -2.020 -17.998 12.774 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.882 -19.700 13.279 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.434 -18.806 12.758 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.734 -16.311 9.562 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.130 -17.349 9.940 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.141 -16.673 11.257 1.00 0.00 H new ATOM 232 N GLY A 16 -0.796 -22.522 12.509 1.00 0.00 N ATOM 233 CA GLY A 16 -1.274 -23.610 13.372 1.00 0.00 C ATOM 234 C GLY A 16 -0.609 -23.558 14.741 1.00 0.00 C ATOM 235 O GLY A 16 0.250 -22.714 14.990 1.00 0.00 O ATOM 0 H GLY A 16 0.211 -22.365 12.543 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.356 -23.538 13.487 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.067 -24.570 12.900 1.00 0.00 H new ATOM 239 N ASN A 17 -1.015 -24.467 15.627 1.00 0.00 N ATOM 240 CA ASN A 17 -0.453 -24.516 16.973 1.00 0.00 C ATOM 241 C ASN A 17 -0.610 -23.165 17.660 1.00 0.00 C ATOM 242 O ASN A 17 0.284 -22.715 18.377 1.00 0.00 O ATOM 243 CB ASN A 17 1.032 -24.893 16.907 1.00 0.00 C ATOM 244 CG ASN A 17 1.510 -25.379 18.274 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.694 -25.693 19.141 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.789 -25.464 18.517 1.00 0.00 N ATOM 0 H ASN A 17 -1.726 -25.174 15.438 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.990 -25.270 17.548 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.185 -25.673 16.161 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.621 -24.031 16.592 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.115 -25.791 19.427 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.463 -25.203 17.797 1.00 0.00 H new ATOM 253 N LEU A 18 -1.753 -22.519 17.439 1.00 0.00 N ATOM 254 CA LEU A 18 -2.019 -21.215 18.044 1.00 0.00 C ATOM 255 C LEU A 18 -2.990 -21.353 19.212 1.00 0.00 C ATOM 256 O LEU A 18 -3.775 -22.299 19.270 1.00 0.00 O ATOM 257 CB LEU A 18 -2.611 -20.267 16.991 1.00 0.00 C ATOM 258 CG LEU A 18 -3.918 -20.876 16.403 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.139 -20.174 17.008 1.00 0.00 C ATOM 260 CD2 LEU A 18 -3.938 -20.690 14.879 1.00 0.00 C ATOM 0 H LEU A 18 -2.506 -22.874 16.849 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.080 -20.807 18.417 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.822 -19.297 17.441 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.887 -20.098 16.193 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.951 -21.938 16.644 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.050 -20.605 16.592 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.136 -20.307 18.090 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.101 -19.110 16.773 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.854 -21.118 14.472 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.897 -19.627 14.642 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.077 -21.193 14.440 1.00 0.00 H new ATOM 272 N ASN A 19 -2.933 -20.405 20.136 1.00 0.00 N ATOM 273 CA ASN A 19 -3.817 -20.432 21.295 1.00 0.00 C ATOM 274 C ASN A 19 -5.254 -20.145 20.872 1.00 0.00 C ATOM 275 O ASN A 19 -5.530 -19.129 20.236 1.00 0.00 O ATOM 276 CB ASN A 19 -3.361 -19.391 22.321 1.00 0.00 C ATOM 277 CG ASN A 19 -4.202 -19.502 23.587 1.00 0.00 C ATOM 278 OD1 ASN A 19 -4.998 -20.432 23.725 1.00 0.00 O ATOM 279 ND2 ASN A 19 -4.075 -18.606 24.526 1.00 0.00 N ATOM 0 H ASN A 19 -2.290 -19.613 20.108 1.00 0.00 H new ATOM 0 HA ASN A 19 -3.774 -21.424 21.745 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.308 -19.541 22.560 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.453 -18.390 21.900 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -4.635 -18.675 25.376 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -3.416 -17.836 24.411 1.00 0.00 H new ATOM 286 N ARG A 20 -6.163 -21.047 21.229 1.00 0.00 N ATOM 287 CA ARG A 20 -7.569 -20.884 20.876 1.00 0.00 C ATOM 288 C ARG A 20 -8.105 -19.562 21.412 1.00 0.00 C ATOM 289 O ARG A 20 -9.140 -19.071 20.960 1.00 0.00 O ATOM 290 CB ARG A 20 -8.390 -22.043 21.446 1.00 0.00 C ATOM 291 CG ARG A 20 -8.327 -22.008 22.974 1.00 0.00 C ATOM 292 CD ARG A 20 -8.948 -23.289 23.538 1.00 0.00 C ATOM 293 NE ARG A 20 -8.874 -23.285 24.996 1.00 0.00 N ATOM 294 CZ ARG A 20 -9.818 -22.703 25.734 1.00 0.00 C ATOM 295 NH1 ARG A 20 -10.834 -22.123 25.155 1.00 0.00 N ATOM 296 NH2 ARG A 20 -9.729 -22.714 27.036 1.00 0.00 N ATOM 0 H ARG A 20 -5.953 -21.893 21.759 1.00 0.00 H new ATOM 0 HA ARG A 20 -7.654 -20.882 19.789 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -9.425 -21.969 21.112 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.003 -22.993 21.077 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -7.292 -21.916 23.304 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -8.860 -21.135 23.351 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -9.987 -23.369 23.219 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.426 -24.160 23.142 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.085 -23.736 25.458 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.905 -22.115 24.138 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.557 -21.677 25.720 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -8.936 -23.168 27.489 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.452 -22.268 27.600 1.00 0.00 H new ATOM 310 N GLU A 21 -7.395 -18.991 22.375 1.00 0.00 N ATOM 311 CA GLU A 21 -7.803 -17.722 22.961 1.00 0.00 C ATOM 312 C GLU A 21 -7.819 -16.630 21.897 1.00 0.00 C ATOM 313 O GLU A 21 -8.606 -15.687 21.976 1.00 0.00 O ATOM 314 CB GLU A 21 -6.844 -17.334 24.089 1.00 0.00 C ATOM 315 CG GLU A 21 -7.323 -16.034 24.742 1.00 0.00 C ATOM 316 CD GLU A 21 -6.446 -15.702 25.945 1.00 0.00 C ATOM 317 OE1 GLU A 21 -5.540 -16.468 26.221 1.00 0.00 O ATOM 318 OE2 GLU A 21 -6.697 -14.684 26.571 1.00 0.00 O ATOM 0 H GLU A 21 -6.538 -19.384 22.765 1.00 0.00 H new ATOM 0 HA GLU A 21 -8.808 -17.832 23.368 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.798 -18.131 24.831 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.836 -17.206 23.695 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.287 -15.219 24.019 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.362 -16.136 25.056 1.00 0.00 H new ATOM 325 N LEU A 22 -6.942 -16.761 20.907 1.00 0.00 N ATOM 326 CA LEU A 22 -6.862 -15.773 19.839 1.00 0.00 C ATOM 327 C LEU A 22 -8.087 -15.863 18.935 1.00 0.00 C ATOM 328 O LEU A 22 -8.491 -16.950 18.523 1.00 0.00 O ATOM 329 CB LEU A 22 -5.599 -16.008 19.005 1.00 0.00 C ATOM 330 CG LEU A 22 -4.367 -15.978 19.922 1.00 0.00 C ATOM 331 CD1 LEU A 22 -3.116 -16.316 19.104 1.00 0.00 C ATOM 332 CD2 LEU A 22 -4.209 -14.577 20.542 1.00 0.00 C ATOM 0 H LEU A 22 -6.283 -17.535 20.823 1.00 0.00 H new ATOM 0 HA LEU A 22 -6.825 -14.781 20.289 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.662 -16.968 18.493 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.511 -15.242 18.235 1.00 0.00 H new ATOM 0 HG LEU A 22 -4.495 -16.711 20.719 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.240 -16.295 19.753 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.223 -17.310 18.670 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -2.994 -15.583 18.306 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.333 -14.563 21.191 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.084 -13.840 19.749 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.097 -14.335 21.126 1.00 0.00 H new ATOM 344 N THR A 23 -8.678 -14.712 18.626 1.00 0.00 N ATOM 345 CA THR A 23 -9.860 -14.668 17.763 1.00 0.00 C ATOM 346 C THR A 23 -9.489 -14.151 16.376 1.00 0.00 C ATOM 347 O THR A 23 -8.323 -13.874 16.098 1.00 0.00 O ATOM 348 CB THR A 23 -10.926 -13.761 18.382 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.425 -12.435 18.469 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.282 -14.269 19.780 1.00 0.00 C ATOM 0 H THR A 23 -8.362 -13.801 18.957 1.00 0.00 H new ATOM 0 HA THR A 23 -10.257 -15.679 17.668 1.00 0.00 H new ATOM 0 HB THR A 23 -11.819 -13.771 17.757 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.107 -11.853 18.864 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.041 -13.622 20.220 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.668 -15.286 19.710 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.391 -14.261 20.408 1.00 0.00 H new ATOM 358 N GLU A 24 -10.487 -14.028 15.510 1.00 0.00 N ATOM 359 CA GLU A 24 -10.249 -13.550 14.153 1.00 0.00 C ATOM 360 C GLU A 24 -9.647 -12.148 14.186 1.00 0.00 C ATOM 361 O GLU A 24 -8.661 -11.864 13.500 1.00 0.00 O ATOM 362 CB GLU A 24 -11.567 -13.528 13.368 1.00 0.00 C ATOM 363 CG GLU A 24 -11.274 -13.354 11.871 1.00 0.00 C ATOM 364 CD GLU A 24 -10.904 -11.903 11.575 1.00 0.00 C ATOM 365 OE1 GLU A 24 -11.417 -11.031 12.256 1.00 0.00 O ATOM 366 OE2 GLU A 24 -10.111 -11.686 10.675 1.00 0.00 O ATOM 0 H GLU A 24 -11.460 -14.250 15.720 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.549 -14.225 13.662 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.117 -14.454 13.536 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -12.199 -12.713 13.722 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.459 -14.014 11.573 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.147 -13.642 11.286 1.00 0.00 H new ATOM 373 N GLY A 25 -10.244 -11.276 14.991 1.00 0.00 N ATOM 374 CA GLY A 25 -9.756 -9.911 15.119 1.00 0.00 C ATOM 375 C GLY A 25 -8.354 -9.897 15.714 1.00 0.00 C ATOM 376 O GLY A 25 -7.514 -9.082 15.331 1.00 0.00 O ATOM 0 H GLY A 25 -11.062 -11.490 15.561 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.747 -9.429 14.141 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.431 -9.335 15.752 1.00 0.00 H new ATOM 380 N ASP A 26 -8.111 -10.802 16.661 1.00 0.00 N ATOM 381 CA ASP A 26 -6.808 -10.882 17.307 1.00 0.00 C ATOM 382 C ASP A 26 -5.728 -11.221 16.289 1.00 0.00 C ATOM 383 O ASP A 26 -4.627 -10.674 16.335 1.00 0.00 O ATOM 384 CB ASP A 26 -6.833 -11.951 18.402 1.00 0.00 C ATOM 385 CG ASP A 26 -7.696 -11.482 19.568 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.981 -10.298 19.632 1.00 0.00 O ATOM 387 OD2 ASP A 26 -8.063 -12.317 20.379 1.00 0.00 O ATOM 0 H ASP A 26 -8.794 -11.483 16.993 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.582 -9.912 17.751 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.226 -12.885 18.001 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.819 -12.154 18.747 1.00 0.00 H new ATOM 392 N ILE A 27 -6.051 -12.125 15.368 1.00 0.00 N ATOM 393 CA ILE A 27 -5.099 -12.528 14.339 1.00 0.00 C ATOM 394 C ILE A 27 -4.707 -11.328 13.492 1.00 0.00 C ATOM 395 O ILE A 27 -3.533 -11.139 13.178 1.00 0.00 O ATOM 396 CB ILE A 27 -5.710 -13.610 13.444 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.842 -14.913 14.241 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.809 -13.851 12.219 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.728 -15.896 13.474 1.00 0.00 C ATOM 0 H ILE A 27 -6.958 -12.589 15.313 1.00 0.00 H new ATOM 0 HA ILE A 27 -4.211 -12.930 14.827 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.693 -13.282 13.106 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.858 -15.350 14.409 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.272 -14.709 15.222 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.251 -14.622 11.588 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.714 -12.926 11.650 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.823 -14.175 12.551 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.821 -16.822 14.042 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.716 -15.459 13.329 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.280 -16.109 12.504 1.00 0.00 H new ATOM 411 N LEU A 28 -5.697 -10.524 13.126 1.00 0.00 N ATOM 412 CA LEU A 28 -5.432 -9.347 12.315 1.00 0.00 C ATOM 413 C LEU A 28 -4.425 -8.439 13.011 1.00 0.00 C ATOM 414 O LEU A 28 -3.445 -8.027 12.407 1.00 0.00 O ATOM 415 CB LEU A 28 -6.741 -8.576 12.071 1.00 0.00 C ATOM 416 CG LEU A 28 -7.517 -9.225 10.909 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.967 -8.724 10.924 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.849 -8.853 9.552 1.00 0.00 C ATOM 0 H LEU A 28 -6.676 -10.663 13.374 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.016 -9.668 11.360 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.350 -8.580 12.975 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.523 -7.534 11.838 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.503 -10.309 11.027 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.519 -9.182 10.103 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.435 -8.994 11.871 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.979 -7.640 10.809 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.403 -9.315 8.735 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.856 -7.770 9.428 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.820 -9.213 9.542 1.00 0.00 H new ATOM 430 N THR A 29 -4.671 -8.142 14.282 1.00 0.00 N ATOM 431 CA THR A 29 -3.778 -7.273 15.044 1.00 0.00 C ATOM 432 C THR A 29 -2.378 -7.869 15.140 1.00 0.00 C ATOM 433 O THR A 29 -1.377 -7.163 15.030 1.00 0.00 O ATOM 434 CB THR A 29 -4.327 -7.060 16.455 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.569 -6.374 16.376 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.329 -6.235 17.278 1.00 0.00 C ATOM 0 H THR A 29 -5.476 -8.487 14.805 1.00 0.00 H new ATOM 0 HA THR A 29 -3.719 -6.319 14.521 1.00 0.00 H new ATOM 0 HB THR A 29 -4.475 -8.025 16.939 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.925 -6.237 17.279 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.723 -6.085 18.283 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.379 -6.766 17.336 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.175 -5.267 16.800 1.00 0.00 H new ATOM 444 N VAL A 30 -2.315 -9.170 15.353 1.00 0.00 N ATOM 445 CA VAL A 30 -1.032 -9.841 15.476 1.00 0.00 C ATOM 446 C VAL A 30 -0.219 -9.733 14.183 1.00 0.00 C ATOM 447 O VAL A 30 0.963 -9.400 14.210 1.00 0.00 O ATOM 448 CB VAL A 30 -1.259 -11.321 15.817 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.078 -12.072 15.761 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.858 -11.438 17.227 1.00 0.00 C ATOM 0 H VAL A 30 -3.128 -9.779 15.444 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.469 -9.355 16.273 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.949 -11.757 15.095 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.084 -13.122 16.003 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.499 -11.992 14.759 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.770 -11.636 16.481 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.019 -12.489 17.468 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.171 -11.000 17.952 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.810 -10.908 17.263 1.00 0.00 H new ATOM 460 N PHE A 31 -0.859 -10.025 13.052 1.00 0.00 N ATOM 461 CA PHE A 31 -0.186 -9.976 11.748 1.00 0.00 C ATOM 462 C PHE A 31 -0.279 -8.586 11.095 1.00 0.00 C ATOM 463 O PHE A 31 0.442 -8.284 10.144 1.00 0.00 O ATOM 464 CB PHE A 31 -0.807 -11.022 10.817 1.00 0.00 C ATOM 465 CG PHE A 31 -0.356 -12.407 11.233 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.940 -13.032 12.340 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.645 -13.064 10.510 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.524 -14.312 12.725 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.062 -14.345 10.893 1.00 0.00 C ATOM 470 CZ PHE A 31 0.477 -14.968 12.002 1.00 0.00 C ATOM 0 H PHE A 31 -1.841 -10.298 13.008 1.00 0.00 H new ATOM 0 HA PHE A 31 0.870 -10.190 11.913 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.894 -10.957 10.854 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.511 -10.827 9.786 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.713 -12.526 12.899 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.097 -12.583 9.655 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.976 -14.793 13.580 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.834 -14.852 10.333 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.799 -15.955 12.299 1.00 0.00 H new ATOM 480 N SER A 32 -1.181 -7.748 11.600 1.00 0.00 N ATOM 481 CA SER A 32 -1.389 -6.409 11.027 1.00 0.00 C ATOM 482 C SER A 32 -0.069 -5.668 10.791 1.00 0.00 C ATOM 483 O SER A 32 0.242 -5.274 9.664 1.00 0.00 O ATOM 484 CB SER A 32 -2.262 -5.562 11.955 1.00 0.00 C ATOM 485 OG SER A 32 -1.792 -5.706 13.281 1.00 0.00 O ATOM 0 H SER A 32 -1.778 -7.964 12.398 1.00 0.00 H new ATOM 0 HA SER A 32 -1.882 -6.554 10.066 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.227 -4.515 11.654 1.00 0.00 H new ATOM 0 HB3 SER A 32 -3.303 -5.879 11.887 1.00 0.00 H new ATOM 0 HG SER A 32 -1.271 -6.533 13.356 1.00 0.00 H new ATOM 491 N GLU A 33 0.706 -5.492 11.857 1.00 0.00 N ATOM 492 CA GLU A 33 1.985 -4.787 11.765 1.00 0.00 C ATOM 493 C GLU A 33 2.996 -5.573 10.937 1.00 0.00 C ATOM 494 O GLU A 33 4.051 -5.061 10.564 1.00 0.00 O ATOM 495 CB GLU A 33 2.552 -4.544 13.176 1.00 0.00 C ATOM 496 CG GLU A 33 3.032 -5.875 13.787 1.00 0.00 C ATOM 497 CD GLU A 33 1.892 -6.887 13.795 1.00 0.00 C ATOM 498 OE1 GLU A 33 1.696 -7.536 12.782 1.00 0.00 O ATOM 499 OE2 GLU A 33 1.230 -6.998 14.815 1.00 0.00 O ATOM 0 H GLU A 33 0.474 -5.826 12.793 1.00 0.00 H new ATOM 0 HA GLU A 33 1.806 -3.833 11.269 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.380 -3.837 13.127 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.788 -4.097 13.812 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.872 -6.266 13.213 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.390 -5.710 14.803 1.00 0.00 H new ATOM 506 N TYR A 34 2.673 -6.825 10.662 1.00 0.00 N ATOM 507 CA TYR A 34 3.562 -7.701 9.900 1.00 0.00 C ATOM 508 C TYR A 34 2.983 -8.003 8.525 1.00 0.00 C ATOM 509 O TYR A 34 3.147 -9.107 8.008 1.00 0.00 O ATOM 510 CB TYR A 34 3.806 -9.002 10.670 1.00 0.00 C ATOM 511 CG TYR A 34 4.639 -8.716 11.904 1.00 0.00 C ATOM 512 CD1 TYR A 34 5.941 -8.207 11.774 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.115 -8.956 13.180 1.00 0.00 C ATOM 514 CE1 TYR A 34 6.709 -7.942 12.912 1.00 0.00 C ATOM 515 CE2 TYR A 34 4.884 -8.689 14.319 1.00 0.00 C ATOM 516 CZ TYR A 34 6.181 -8.183 14.186 1.00 0.00 C ATOM 517 OH TYR A 34 6.940 -7.921 15.308 1.00 0.00 O ATOM 0 H TYR A 34 1.800 -7.264 10.954 1.00 0.00 H new ATOM 0 HA TYR A 34 4.513 -7.186 9.762 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.855 -9.450 10.957 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.318 -9.723 10.033 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.350 -8.020 10.792 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.114 -9.348 13.286 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.710 -7.551 12.808 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.475 -8.874 15.301 1.00 0.00 H new ATOM 0 HH TYR A 34 6.424 -8.143 16.111 1.00 0.00 H new ATOM 527 N GLY A 35 2.289 -7.019 7.939 1.00 0.00 N ATOM 528 CA GLY A 35 1.683 -7.224 6.628 1.00 0.00 C ATOM 529 C GLY A 35 0.208 -7.579 6.754 1.00 0.00 C ATOM 530 O GLY A 35 -0.188 -8.714 6.493 1.00 0.00 O ATOM 0 H GLY A 35 2.138 -6.095 8.345 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.793 -6.320 6.028 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.208 -8.021 6.102 1.00 0.00 H new ATOM 534 N VAL A 36 -0.598 -6.604 7.172 1.00 0.00 N ATOM 535 CA VAL A 36 -2.019 -6.848 7.372 1.00 0.00 C ATOM 536 C VAL A 36 -2.665 -7.407 6.094 1.00 0.00 C ATOM 537 O VAL A 36 -2.595 -6.790 5.031 1.00 0.00 O ATOM 538 CB VAL A 36 -2.722 -5.529 7.751 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.825 -4.612 6.521 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.129 -5.839 8.280 1.00 0.00 C ATOM 0 H VAL A 36 -0.294 -5.652 7.375 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.130 -7.579 8.173 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.142 -5.022 8.522 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.323 -3.683 6.800 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.825 -4.390 6.148 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.400 -5.112 5.742 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.630 -4.909 8.549 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.704 -6.350 7.508 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -4.054 -6.479 9.159 1.00 0.00 H new ATOM 550 N PRO A 37 -3.290 -8.579 6.192 1.00 0.00 N ATOM 551 CA PRO A 37 -3.960 -9.248 5.038 1.00 0.00 C ATOM 552 C PRO A 37 -5.298 -8.595 4.698 1.00 0.00 C ATOM 553 O PRO A 37 -5.883 -7.886 5.515 1.00 0.00 O ATOM 554 CB PRO A 37 -4.159 -10.702 5.502 1.00 0.00 C ATOM 555 CG PRO A 37 -4.248 -10.634 6.993 1.00 0.00 C ATOM 556 CD PRO A 37 -3.432 -9.417 7.422 1.00 0.00 C ATOM 0 HA PRO A 37 -3.365 -9.174 4.128 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.065 -11.131 5.073 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.328 -11.332 5.186 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.285 -10.539 7.316 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.855 -11.544 7.447 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.936 -8.866 8.216 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.457 -9.714 7.809 1.00 0.00 H new ATOM 564 N VAL A 38 -5.774 -8.839 3.487 1.00 0.00 N ATOM 565 CA VAL A 38 -7.046 -8.273 3.045 1.00 0.00 C ATOM 566 C VAL A 38 -8.193 -9.250 3.307 1.00 0.00 C ATOM 567 O VAL A 38 -9.350 -8.958 3.010 1.00 0.00 O ATOM 568 CB VAL A 38 -6.977 -7.945 1.551 1.00 0.00 C ATOM 569 CG1 VAL A 38 -6.038 -6.756 1.329 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.445 -9.159 0.786 1.00 0.00 C ATOM 0 H VAL A 38 -5.304 -9.421 2.794 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.233 -7.359 3.610 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.974 -7.693 1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.990 -6.524 0.265 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.414 -5.889 1.873 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.041 -7.007 1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.396 -8.926 -0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.448 -9.410 1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.112 -10.007 0.941 1.00 0.00 H new ATOM 580 N ASP A 39 -7.861 -10.413 3.866 1.00 0.00 N ATOM 581 CA ASP A 39 -8.872 -11.426 4.166 1.00 0.00 C ATOM 582 C ASP A 39 -8.298 -12.512 5.077 1.00 0.00 C ATOM 583 O ASP A 39 -7.134 -12.889 4.944 1.00 0.00 O ATOM 584 CB ASP A 39 -9.372 -12.060 2.867 1.00 0.00 C ATOM 585 CG ASP A 39 -10.659 -12.836 3.128 1.00 0.00 C ATOM 586 OD1 ASP A 39 -11.130 -12.802 4.253 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.154 -13.453 2.199 1.00 0.00 O ATOM 0 H ASP A 39 -6.908 -10.676 4.119 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.702 -10.942 4.681 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.549 -11.287 2.120 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.611 -12.727 2.462 1.00 0.00 H new ATOM 592 N VAL A 40 -9.123 -13.016 6.003 1.00 0.00 N ATOM 593 CA VAL A 40 -8.683 -14.067 6.929 1.00 0.00 C ATOM 594 C VAL A 40 -9.656 -15.245 6.899 1.00 0.00 C ATOM 595 O VAL A 40 -10.857 -15.071 7.113 1.00 0.00 O ATOM 596 CB VAL A 40 -8.585 -13.513 8.355 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.907 -14.546 9.260 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.767 -12.214 8.348 1.00 0.00 C ATOM 0 H VAL A 40 -10.090 -12.717 6.131 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.699 -14.413 6.613 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.586 -13.305 8.733 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.838 -14.152 10.274 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.494 -15.464 9.267 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.906 -14.758 8.884 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.698 -11.822 9.363 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.765 -12.417 7.969 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.256 -11.480 7.707 1.00 0.00 H new ATOM 608 N ILE A 41 -9.135 -16.445 6.632 1.00 0.00 N ATOM 609 CA ILE A 41 -9.972 -17.650 6.575 1.00 0.00 C ATOM 610 C ILE A 41 -9.682 -18.560 7.764 1.00 0.00 C ATOM 611 O ILE A 41 -8.554 -19.016 7.949 1.00 0.00 O ATOM 612 CB ILE A 41 -9.708 -18.411 5.274 1.00 0.00 C ATOM 613 CG1 ILE A 41 -10.023 -17.505 4.083 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.601 -19.653 5.220 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.520 -18.162 2.794 1.00 0.00 C ATOM 0 H ILE A 41 -8.145 -16.610 6.453 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.017 -17.344 6.611 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.662 -18.714 5.235 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.097 -17.330 4.020 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.549 -16.533 4.217 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.414 -20.196 4.294 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.379 -20.298 6.070 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.648 -19.351 5.258 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.744 -17.516 1.945 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.443 -18.314 2.859 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.014 -19.124 2.659 1.00 0.00 H new ATOM 627 N LEU A 42 -10.708 -18.827 8.569 1.00 0.00 N ATOM 628 CA LEU A 42 -10.555 -19.690 9.738 1.00 0.00 C ATOM 629 C LEU A 42 -11.169 -21.060 9.478 1.00 0.00 C ATOM 630 O LEU A 42 -12.297 -21.164 8.997 1.00 0.00 O ATOM 631 CB LEU A 42 -11.231 -19.045 10.953 1.00 0.00 C ATOM 632 CG LEU A 42 -10.581 -17.687 11.243 1.00 0.00 C ATOM 633 CD1 LEU A 42 -11.340 -16.992 12.380 1.00 0.00 C ATOM 634 CD2 LEU A 42 -9.111 -17.893 11.659 1.00 0.00 C ATOM 0 H LEU A 42 -11.650 -18.460 8.434 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.491 -19.816 9.938 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.297 -18.916 10.763 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.138 -19.697 11.822 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.619 -17.069 10.346 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.879 -16.026 12.588 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.379 -16.843 12.086 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -11.302 -17.612 13.275 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.652 -16.926 11.864 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.070 -18.512 12.555 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -8.570 -18.387 10.852 1.00 0.00 H new ATOM 646 N SER A 43 -10.419 -22.107 9.798 1.00 0.00 N ATOM 647 CA SER A 43 -10.901 -23.466 9.592 1.00 0.00 C ATOM 648 C SER A 43 -12.009 -23.792 10.586 1.00 0.00 C ATOM 649 O SER A 43 -11.818 -23.693 11.797 1.00 0.00 O ATOM 650 CB SER A 43 -9.749 -24.459 9.760 1.00 0.00 C ATOM 651 OG SER A 43 -8.753 -24.191 8.782 1.00 0.00 O ATOM 0 H SER A 43 -9.483 -22.042 10.198 1.00 0.00 H new ATOM 0 HA SER A 43 -11.300 -23.544 8.581 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.325 -24.376 10.761 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.115 -25.480 9.653 1.00 0.00 H new ATOM 0 HG SER A 43 -9.062 -23.475 8.188 1.00 0.00 H new ATOM 657 N ARG A 44 -13.168 -24.183 10.065 1.00 0.00 N ATOM 658 CA ARG A 44 -14.302 -24.520 10.917 1.00 0.00 C ATOM 659 C ARG A 44 -15.305 -25.388 10.161 1.00 0.00 C ATOM 660 O ARG A 44 -15.375 -25.345 8.932 1.00 0.00 O ATOM 661 CB ARG A 44 -14.989 -23.238 11.394 1.00 0.00 C ATOM 662 CG ARG A 44 -15.435 -22.414 10.184 1.00 0.00 C ATOM 663 CD ARG A 44 -16.121 -21.133 10.661 1.00 0.00 C ATOM 664 NE ARG A 44 -17.381 -21.451 11.324 1.00 0.00 N ATOM 665 CZ ARG A 44 -18.088 -20.511 11.943 1.00 0.00 C ATOM 666 NH1 ARG A 44 -17.657 -19.279 11.966 1.00 0.00 N ATOM 667 NH2 ARG A 44 -19.213 -20.820 12.527 1.00 0.00 N ATOM 0 H ARG A 44 -13.346 -24.274 9.065 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.935 -25.080 11.777 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.849 -23.484 12.016 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -14.306 -22.655 12.012 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -14.575 -22.168 9.562 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -16.119 -22.997 9.567 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -15.466 -20.596 11.347 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -16.305 -20.473 9.813 1.00 0.00 H new ATOM 0 HE ARG A 44 -17.725 -22.411 11.312 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -16.778 -19.038 11.509 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -18.200 -18.558 12.441 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -19.550 -21.783 12.508 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -19.756 -20.099 13.002 1.00 0.00 H new ATOM 786 N GLY A 53 -8.146 -24.288 15.179 1.00 0.00 N ATOM 787 CA GLY A 53 -6.789 -24.815 15.310 1.00 0.00 C ATOM 788 C GLY A 53 -5.953 -24.473 14.081 1.00 0.00 C ATOM 789 O GLY A 53 -4.737 -24.668 14.072 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.318 -24.402 16.202 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.825 -25.896 15.441 1.00 0.00 H new ATOM 793 N PHE A 54 -6.609 -23.960 13.040 1.00 0.00 N ATOM 794 CA PHE A 54 -5.907 -23.592 11.809 1.00 0.00 C ATOM 795 C PHE A 54 -6.506 -22.322 11.211 1.00 0.00 C ATOM 796 O PHE A 54 -7.701 -22.064 11.356 1.00 0.00 O ATOM 797 CB PHE A 54 -6.007 -24.729 10.790 1.00 0.00 C ATOM 798 CG PHE A 54 -5.740 -26.045 11.480 1.00 0.00 C ATOM 799 CD1 PHE A 54 -4.469 -26.327 11.994 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.769 -26.989 11.607 1.00 0.00 C ATOM 801 CE1 PHE A 54 -4.226 -27.548 12.635 1.00 0.00 C ATOM 802 CE2 PHE A 54 -6.527 -28.210 12.247 1.00 0.00 C ATOM 803 CZ PHE A 54 -5.255 -28.490 12.761 1.00 0.00 C ATOM 0 H PHE A 54 -7.615 -23.791 13.023 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.860 -23.411 12.051 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.998 -24.739 10.335 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.288 -24.575 9.985 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -3.675 -25.602 11.896 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.750 -26.774 11.210 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.245 -27.763 13.032 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -7.321 -28.936 12.344 1.00 0.00 H new ATOM 0 HZ PHE A 54 -5.067 -29.432 13.255 1.00 0.00 H new ATOM 813 N ALA A 55 -5.670 -21.532 10.539 1.00 0.00 N ATOM 814 CA ALA A 55 -6.132 -20.292 9.918 1.00 0.00 C ATOM 815 C ALA A 55 -5.285 -19.957 8.689 1.00 0.00 C ATOM 816 O ALA A 55 -4.087 -20.250 8.644 1.00 0.00 O ATOM 817 CB ALA A 55 -6.046 -19.144 10.925 1.00 0.00 C ATOM 0 H ALA A 55 -4.677 -21.726 10.411 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.167 -20.428 9.605 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.392 -18.222 10.457 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.672 -19.369 11.788 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.013 -19.021 11.249 1.00 0.00 H new ATOM 823 N TYR A 56 -5.913 -19.339 7.688 1.00 0.00 N ATOM 824 CA TYR A 56 -5.203 -18.961 6.462 1.00 0.00 C ATOM 825 C TYR A 56 -5.649 -17.570 6.003 1.00 0.00 C ATOM 826 O TYR A 56 -6.827 -17.347 5.733 1.00 0.00 O ATOM 827 CB TYR A 56 -5.486 -19.992 5.358 1.00 0.00 C ATOM 828 CG TYR A 56 -5.612 -21.367 5.971 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.488 -21.998 6.518 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.855 -22.015 5.993 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.607 -23.272 7.087 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.974 -23.288 6.560 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.849 -23.917 7.107 1.00 0.00 C ATOM 834 OH TYR A 56 -5.966 -25.173 7.668 1.00 0.00 O ATOM 0 H TYR A 56 -6.902 -19.091 7.699 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.132 -18.938 6.665 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.404 -19.732 4.830 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -4.682 -19.983 4.622 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.529 -21.502 6.501 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.723 -21.530 5.571 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.740 -23.757 7.511 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.933 -23.785 6.576 1.00 0.00 H new ATOM 0 HH TYR A 56 -6.822 -25.242 8.139 1.00 0.00 H new ATOM 844 N LEU A 57 -4.700 -16.638 5.908 1.00 0.00 N ATOM 845 CA LEU A 57 -5.000 -15.260 5.491 1.00 0.00 C ATOM 846 C LEU A 57 -4.274 -14.924 4.189 1.00 0.00 C ATOM 847 O LEU A 57 -3.130 -15.330 3.985 1.00 0.00 O ATOM 848 CB LEU A 57 -4.587 -14.252 6.600 1.00 0.00 C ATOM 849 CG LEU A 57 -3.566 -14.896 7.551 1.00 0.00 C ATOM 850 CD1 LEU A 57 -2.231 -15.076 6.818 1.00 0.00 C ATOM 851 CD2 LEU A 57 -3.355 -14.003 8.786 1.00 0.00 C ATOM 0 H LEU A 57 -3.716 -16.808 6.113 1.00 0.00 H new ATOM 0 HA LEU A 57 -6.075 -15.182 5.326 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.159 -13.358 6.147 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.467 -13.936 7.160 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.943 -15.866 7.874 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.505 -15.533 7.491 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.376 -15.719 5.950 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.861 -14.104 6.491 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.630 -14.469 9.453 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.984 -13.028 8.471 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.302 -13.878 9.311 1.00 0.00 H new ATOM 863 N LYS A 58 -4.946 -14.174 3.315 1.00 0.00 N ATOM 864 CA LYS A 58 -4.354 -13.784 2.038 1.00 0.00 C ATOM 865 C LYS A 58 -3.658 -12.434 2.165 1.00 0.00 C ATOM 866 O LYS A 58 -4.260 -11.453 2.604 1.00 0.00 O ATOM 867 CB LYS A 58 -5.434 -13.704 0.957 1.00 0.00 C ATOM 868 CG LYS A 58 -4.791 -13.361 -0.388 1.00 0.00 C ATOM 869 CD LYS A 58 -5.853 -13.396 -1.488 1.00 0.00 C ATOM 870 CE LYS A 58 -5.240 -12.926 -2.808 1.00 0.00 C ATOM 871 NZ LYS A 58 -4.157 -13.866 -3.217 1.00 0.00 N ATOM 0 H LYS A 58 -5.893 -13.827 3.467 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.619 -14.538 1.756 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.963 -14.654 0.887 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.172 -12.947 1.222 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.333 -12.373 -0.342 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.995 -14.071 -0.614 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.245 -14.407 -1.597 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.693 -12.756 -1.217 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.007 -12.880 -3.581 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.839 -11.919 -2.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.915 -13.704 -4.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -3.316 -13.705 -2.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.483 -14.846 -3.095 1.00 0.00 H new ATOM 885 N TYR A 59 -2.387 -12.389 1.779 1.00 0.00 N ATOM 886 CA TYR A 59 -1.615 -11.150 1.854 1.00 0.00 C ATOM 887 C TYR A 59 -1.448 -10.534 0.468 1.00 0.00 C ATOM 888 O TYR A 59 -1.597 -11.215 -0.546 1.00 0.00 O ATOM 889 CB TYR A 59 -0.241 -11.431 2.454 1.00 0.00 C ATOM 890 CG TYR A 59 0.446 -12.506 1.648 1.00 0.00 C ATOM 891 CD1 TYR A 59 1.060 -12.185 0.432 1.00 0.00 C ATOM 892 CD2 TYR A 59 0.475 -13.825 2.120 1.00 0.00 C ATOM 893 CE1 TYR A 59 1.698 -13.181 -0.315 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.116 -14.821 1.374 1.00 0.00 C ATOM 895 CZ TYR A 59 1.729 -14.498 0.158 1.00 0.00 C ATOM 896 OH TYR A 59 2.362 -15.478 -0.576 1.00 0.00 O ATOM 0 H TYR A 59 -1.871 -13.189 1.413 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.155 -10.447 2.488 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.360 -10.522 2.456 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -0.343 -11.748 3.492 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.041 -11.168 0.070 1.00 0.00 H new ATOM 0 HD2 TYR A 59 0.003 -14.073 3.059 1.00 0.00 H new ATOM 0 HE1 TYR A 59 2.166 -12.934 -1.256 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.138 -15.838 1.737 1.00 0.00 H new ATOM 0 HH TYR A 59 2.503 -16.268 -0.014 1.00 0.00 H new ATOM 906 N GLU A 60 -1.146 -9.241 0.434 1.00 0.00 N ATOM 907 CA GLU A 60 -0.960 -8.543 -0.834 1.00 0.00 C ATOM 908 C GLU A 60 0.403 -8.872 -1.447 1.00 0.00 C ATOM 909 O GLU A 60 0.514 -9.115 -2.649 1.00 0.00 O ATOM 910 CB GLU A 60 -1.075 -7.033 -0.616 1.00 0.00 C ATOM 911 CG GLU A 60 -0.987 -6.315 -1.965 1.00 0.00 C ATOM 912 CD GLU A 60 -1.200 -4.817 -1.772 1.00 0.00 C ATOM 913 OE1 GLU A 60 -1.360 -4.403 -0.636 1.00 0.00 O ATOM 914 OE2 GLU A 60 -1.201 -4.106 -2.764 1.00 0.00 O ATOM 0 H GLU A 60 -1.025 -8.658 1.262 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.737 -8.874 -1.523 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.020 -6.796 -0.127 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.279 -6.688 0.044 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.014 -6.497 -2.420 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -1.738 -6.713 -2.648 1.00 0.00 H new ATOM 921 N ASP A 61 1.447 -8.875 -0.611 1.00 0.00 N ATOM 922 CA ASP A 61 2.812 -9.167 -1.081 1.00 0.00 C ATOM 923 C ASP A 61 3.437 -10.303 -0.274 1.00 0.00 C ATOM 924 O ASP A 61 3.115 -10.491 0.899 1.00 0.00 O ATOM 925 CB ASP A 61 3.679 -7.913 -0.956 1.00 0.00 C ATOM 926 CG ASP A 61 3.079 -6.780 -1.780 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.700 -7.033 -2.912 1.00 0.00 O ATOM 928 OD2 ASP A 61 3.004 -5.675 -1.267 1.00 0.00 O ATOM 0 H ASP A 61 1.378 -8.680 0.388 1.00 0.00 H new ATOM 0 HA ASP A 61 2.757 -9.475 -2.125 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.752 -7.614 0.090 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.692 -8.126 -1.298 1.00 0.00 H new ATOM 933 N GLN A 62 4.334 -11.057 -0.908 1.00 0.00 N ATOM 934 CA GLN A 62 4.995 -12.173 -0.242 1.00 0.00 C ATOM 935 C GLN A 62 5.870 -11.668 0.899 1.00 0.00 C ATOM 936 O GLN A 62 6.249 -12.429 1.793 1.00 0.00 O ATOM 937 CB GLN A 62 5.854 -12.952 -1.242 1.00 0.00 C ATOM 938 CG GLN A 62 4.951 -13.613 -2.284 1.00 0.00 C ATOM 939 CD GLN A 62 4.337 -12.549 -3.189 1.00 0.00 C ATOM 940 OE1 GLN A 62 5.104 -11.646 -3.733 1.00 0.00 O flip ATOM 941 NE2 GLN A 62 3.126 -12.544 -3.407 1.00 0.00 N flip ATOM 0 H GLN A 62 4.617 -10.915 -1.877 1.00 0.00 H new ATOM 0 HA GLN A 62 4.229 -12.834 0.164 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.561 -12.281 -1.731 1.00 0.00 H new ATOM 0 HB3 GLN A 62 6.441 -13.709 -0.721 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.527 -14.321 -2.880 1.00 0.00 H new ATOM 0 HG3 GLN A 62 4.163 -14.180 -1.788 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.528 -13.252 -2.980 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.720 -11.832 -4.015 1.00 0.00 H new ATOM 950 N ARG A 63 6.186 -10.379 0.862 1.00 0.00 N ATOM 951 CA ARG A 63 7.017 -9.779 1.893 1.00 0.00 C ATOM 952 C ARG A 63 6.362 -9.949 3.257 1.00 0.00 C ATOM 953 O ARG A 63 7.046 -10.084 4.272 1.00 0.00 O ATOM 954 CB ARG A 63 7.218 -8.292 1.602 1.00 0.00 C ATOM 955 CG ARG A 63 8.096 -8.130 0.359 1.00 0.00 C ATOM 956 CD ARG A 63 8.205 -6.647 0.001 1.00 0.00 C ATOM 957 NE ARG A 63 9.093 -6.468 -1.142 1.00 0.00 N ATOM 958 CZ ARG A 63 8.657 -6.645 -2.386 1.00 0.00 C ATOM 959 NH1 ARG A 63 7.416 -6.983 -2.600 1.00 0.00 N ATOM 960 NH2 ARG A 63 9.470 -6.478 -3.392 1.00 0.00 N ATOM 0 H ARG A 63 5.881 -9.734 0.133 1.00 0.00 H new ATOM 0 HA ARG A 63 7.986 -10.278 1.897 1.00 0.00 H new ATOM 0 HB2 ARG A 63 6.254 -7.808 1.445 1.00 0.00 H new ATOM 0 HB3 ARG A 63 7.685 -7.803 2.457 1.00 0.00 H new ATOM 0 HG2 ARG A 63 9.087 -8.544 0.544 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.669 -8.686 -0.476 1.00 0.00 H new ATOM 0 HD2 ARG A 63 7.217 -6.248 -0.231 1.00 0.00 H new ATOM 0 HD3 ARG A 63 8.583 -6.086 0.856 1.00 0.00 H new ATOM 0 HE ARG A 63 10.065 -6.202 -0.985 1.00 0.00 H new ATOM 0 HH11 ARG A 63 6.780 -7.112 -1.813 1.00 0.00 H new ATOM 0 HH12 ARG A 63 7.082 -7.119 -3.554 1.00 0.00 H new ATOM 0 HH21 ARG A 63 10.440 -6.212 -3.225 1.00 0.00 H new ATOM 0 HH22 ARG A 63 9.136 -6.614 -4.346 1.00 0.00 H new ATOM 974 N SER A 64 5.033 -9.939 3.273 1.00 0.00 N ATOM 975 CA SER A 64 4.294 -10.101 4.517 1.00 0.00 C ATOM 976 C SER A 64 4.605 -11.449 5.155 1.00 0.00 C ATOM 977 O SER A 64 4.742 -11.552 6.373 1.00 0.00 O ATOM 978 CB SER A 64 2.792 -9.997 4.252 1.00 0.00 C ATOM 979 OG SER A 64 2.084 -10.251 5.458 1.00 0.00 O ATOM 0 H SER A 64 4.450 -9.821 2.444 1.00 0.00 H new ATOM 0 HA SER A 64 4.598 -9.309 5.201 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.546 -9.005 3.874 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.496 -10.713 3.485 1.00 0.00 H new ATOM 0 HG SER A 64 1.279 -9.693 5.488 1.00 0.00 H new ATOM 985 N THR A 65 4.709 -12.480 4.321 1.00 0.00 N ATOM 986 CA THR A 65 4.990 -13.819 4.820 1.00 0.00 C ATOM 987 C THR A 65 6.369 -13.883 5.453 1.00 0.00 C ATOM 988 O THR A 65 6.533 -14.409 6.550 1.00 0.00 O ATOM 989 CB THR A 65 4.920 -14.829 3.671 1.00 0.00 C ATOM 990 OG1 THR A 65 5.959 -14.560 2.741 1.00 0.00 O ATOM 991 CG2 THR A 65 3.566 -14.711 2.971 1.00 0.00 C ATOM 0 H THR A 65 4.604 -12.414 3.309 1.00 0.00 H new ATOM 0 HA THR A 65 4.242 -14.062 5.575 1.00 0.00 H new ATOM 0 HB THR A 65 5.038 -15.838 4.066 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.770 -13.720 2.273 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.515 -15.430 2.153 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.768 -14.917 3.685 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.448 -13.702 2.576 1.00 0.00 H new ATOM 999 N ILE A 66 7.354 -13.334 4.761 1.00 0.00 N ATOM 1000 CA ILE A 66 8.723 -13.343 5.265 1.00 0.00 C ATOM 1001 C ILE A 66 8.809 -12.609 6.598 1.00 0.00 C ATOM 1002 O ILE A 66 9.477 -13.066 7.527 1.00 0.00 O ATOM 1003 CB ILE A 66 9.655 -12.673 4.252 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.693 -13.504 2.968 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.066 -12.584 4.839 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.359 -12.693 1.854 1.00 0.00 C ATOM 0 H ILE A 66 7.236 -12.879 3.856 1.00 0.00 H new ATOM 0 HA ILE A 66 9.029 -14.379 5.413 1.00 0.00 H new ATOM 0 HB ILE A 66 9.288 -11.671 4.028 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.243 -14.429 3.137 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.682 -13.784 2.673 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.730 -12.107 4.118 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.042 -11.995 5.756 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.432 -13.587 5.061 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.386 -13.285 0.939 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.790 -11.780 1.679 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.376 -12.435 2.150 1.00 0.00 H new ATOM 1018 N LEU A 67 8.135 -11.469 6.684 1.00 0.00 N ATOM 1019 CA LEU A 67 8.149 -10.678 7.908 1.00 0.00 C ATOM 1020 C LEU A 67 7.483 -11.424 9.064 1.00 0.00 C ATOM 1021 O LEU A 67 8.115 -11.704 10.077 1.00 0.00 O ATOM 1022 CB LEU A 67 7.415 -9.344 7.678 1.00 0.00 C ATOM 1023 CG LEU A 67 8.362 -8.346 6.985 1.00 0.00 C ATOM 1024 CD1 LEU A 67 7.548 -7.158 6.464 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.433 -7.841 7.992 1.00 0.00 C ATOM 0 H LEU A 67 7.576 -11.074 5.928 1.00 0.00 H new ATOM 0 HA LEU A 67 9.190 -10.492 8.171 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.529 -9.506 7.064 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.074 -8.936 8.630 1.00 0.00 H new ATOM 0 HG LEU A 67 8.863 -8.843 6.154 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.214 -6.448 5.973 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.804 -7.512 5.750 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.046 -6.667 7.298 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.098 -7.136 7.493 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.941 -7.345 8.829 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.013 -8.687 8.361 1.00 0.00 H new ATOM 1037 N ALA A 68 6.205 -11.749 8.902 1.00 0.00 N ATOM 1038 CA ALA A 68 5.456 -12.432 9.957 1.00 0.00 C ATOM 1039 C ALA A 68 6.144 -13.724 10.383 1.00 0.00 C ATOM 1040 O ALA A 68 6.179 -14.057 11.567 1.00 0.00 O ATOM 1041 CB ALA A 68 4.045 -12.756 9.463 1.00 0.00 C ATOM 0 H ALA A 68 5.667 -11.553 8.058 1.00 0.00 H new ATOM 0 HA ALA A 68 5.410 -11.765 10.818 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.491 -13.265 10.252 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.532 -11.832 9.197 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.106 -13.403 8.588 1.00 0.00 H new ATOM 1047 N VAL A 69 6.694 -14.441 9.418 1.00 0.00 N ATOM 1048 CA VAL A 69 7.366 -15.698 9.716 1.00 0.00 C ATOM 1049 C VAL A 69 8.530 -15.503 10.693 1.00 0.00 C ATOM 1050 O VAL A 69 8.473 -15.945 11.835 1.00 0.00 O ATOM 1051 CB VAL A 69 7.895 -16.321 8.411 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.836 -17.492 8.739 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.713 -16.839 7.565 1.00 0.00 C ATOM 0 H VAL A 69 6.690 -14.180 8.432 1.00 0.00 H new ATOM 0 HA VAL A 69 6.639 -16.361 10.185 1.00 0.00 H new ATOM 0 HB VAL A 69 8.440 -15.562 7.849 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.208 -17.930 7.813 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.676 -17.129 9.332 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.292 -18.248 9.305 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.091 -17.279 6.642 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.165 -17.594 8.129 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.047 -16.010 7.325 1.00 0.00 H new ATOM 1063 N ASP A 70 9.578 -14.830 10.238 1.00 0.00 N ATOM 1064 CA ASP A 70 10.762 -14.618 11.070 1.00 0.00 C ATOM 1065 C ASP A 70 10.452 -13.759 12.299 1.00 0.00 C ATOM 1066 O ASP A 70 11.191 -13.772 13.283 1.00 0.00 O ATOM 1067 CB ASP A 70 11.853 -13.935 10.244 1.00 0.00 C ATOM 1068 CG ASP A 70 12.321 -14.864 9.130 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.383 -16.059 9.366 1.00 0.00 O ATOM 1070 OD2 ASP A 70 12.608 -14.366 8.054 1.00 0.00 O ATOM 0 H ASP A 70 9.636 -14.423 9.305 1.00 0.00 H new ATOM 0 HA ASP A 70 11.100 -15.595 11.417 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.471 -13.007 9.819 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.694 -13.670 10.885 1.00 0.00 H new ATOM 1075 N ASN A 71 9.359 -13.009 12.233 1.00 0.00 N ATOM 1076 CA ASN A 71 8.973 -12.132 13.340 1.00 0.00 C ATOM 1077 C ASN A 71 8.225 -12.891 14.440 1.00 0.00 C ATOM 1078 O ASN A 71 8.340 -12.558 15.620 1.00 0.00 O ATOM 1079 CB ASN A 71 8.080 -11.009 12.813 1.00 0.00 C ATOM 1080 CG ASN A 71 8.893 -10.071 11.923 1.00 0.00 C ATOM 1081 OD1 ASN A 71 10.191 -10.199 11.862 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 8.331 -9.199 11.263 1.00 0.00 N flip ATOM 0 H ASN A 71 8.726 -12.987 11.433 1.00 0.00 H new ATOM 0 HA ASN A 71 9.887 -11.725 13.772 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.248 -11.429 12.248 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.651 -10.453 13.646 1.00 0.00 H new ATOM 0 HD21 ASN A 71 7.317 -9.098 11.310 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.879 -8.577 10.669 1.00 0.00 H new ATOM 1089 N LEU A 72 7.452 -13.911 14.047 1.00 0.00 N ATOM 1090 CA LEU A 72 6.667 -14.700 15.011 1.00 0.00 C ATOM 1091 C LEU A 72 7.159 -16.147 15.087 1.00 0.00 C ATOM 1092 O LEU A 72 6.635 -16.955 15.855 1.00 0.00 O ATOM 1093 CB LEU A 72 5.194 -14.676 14.598 1.00 0.00 C ATOM 1094 CG LEU A 72 4.738 -13.222 14.391 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.249 -13.204 14.029 1.00 0.00 C ATOM 1096 CD2 LEU A 72 4.962 -12.414 15.682 1.00 0.00 C ATOM 0 H LEU A 72 7.352 -14.209 13.077 1.00 0.00 H new ATOM 0 HA LEU A 72 6.789 -14.255 15.999 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.055 -15.245 13.679 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.583 -15.153 15.365 1.00 0.00 H new ATOM 0 HG LEU A 72 5.318 -12.774 13.584 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.923 -12.174 13.882 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.091 -13.770 13.111 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.673 -13.655 14.837 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.637 -11.385 15.528 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.387 -12.859 16.494 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.021 -12.425 15.939 1.00 0.00 H new ATOM 1108 N ASN A 73 8.168 -16.466 14.290 1.00 0.00 N ATOM 1109 CA ASN A 73 8.722 -17.820 14.279 1.00 0.00 C ATOM 1110 C ASN A 73 9.598 -18.041 15.506 1.00 0.00 C ATOM 1111 O ASN A 73 10.681 -17.467 15.623 1.00 0.00 O ATOM 1112 CB ASN A 73 9.553 -18.043 13.008 1.00 0.00 C ATOM 1113 CG ASN A 73 10.330 -19.354 13.098 1.00 0.00 C ATOM 1114 OD1 ASN A 73 10.106 -20.148 14.012 1.00 0.00 O ATOM 1115 ND2 ASN A 73 11.235 -19.630 12.200 1.00 0.00 N ATOM 0 H ASN A 73 8.619 -15.816 13.647 1.00 0.00 H new ATOM 0 HA ASN A 73 7.896 -18.531 14.296 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.898 -18.061 12.137 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.245 -17.212 12.869 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.758 -20.504 12.255 1.00 0.00 H new ATOM 0 HD22 ASN A 73 11.420 -18.972 11.443 1.00 0.00 H new ATOM 1122 N GLY A 74 9.124 -18.881 16.423 1.00 0.00 N ATOM 1123 CA GLY A 74 9.873 -19.174 17.642 1.00 0.00 C ATOM 1124 C GLY A 74 9.328 -18.376 18.824 1.00 0.00 C ATOM 1125 O GLY A 74 9.821 -18.499 19.944 1.00 0.00 O ATOM 0 H GLY A 74 8.231 -19.368 16.346 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.816 -20.240 17.861 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.926 -18.936 17.492 1.00 0.00 H new ATOM 1129 N PHE A 75 8.305 -17.557 18.568 1.00 0.00 N ATOM 1130 CA PHE A 75 7.697 -16.744 19.625 1.00 0.00 C ATOM 1131 C PHE A 75 6.476 -17.459 20.203 1.00 0.00 C ATOM 1132 O PHE A 75 5.530 -17.778 19.481 1.00 0.00 O ATOM 1133 CB PHE A 75 7.284 -15.368 19.074 1.00 0.00 C ATOM 1134 CG PHE A 75 6.427 -14.633 20.095 1.00 0.00 C ATOM 1135 CD1 PHE A 75 6.801 -14.599 21.453 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.248 -13.993 19.689 1.00 0.00 C ATOM 1137 CE1 PHE A 75 6.006 -13.932 22.389 1.00 0.00 C ATOM 1138 CE2 PHE A 75 4.452 -13.324 20.629 1.00 0.00 C ATOM 1139 CZ PHE A 75 4.831 -13.295 21.979 1.00 0.00 C ATOM 0 H PHE A 75 7.883 -17.439 17.647 1.00 0.00 H new ATOM 0 HA PHE A 75 8.433 -16.599 20.416 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.171 -14.779 18.841 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.730 -15.491 18.144 1.00 0.00 H new ATOM 0 HD1 PHE A 75 7.708 -15.091 21.773 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.952 -14.015 18.650 1.00 0.00 H new ATOM 0 HE1 PHE A 75 6.299 -13.909 23.428 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.545 -12.830 20.313 1.00 0.00 H new ATOM 0 HZ PHE A 75 4.215 -12.781 22.702 1.00 0.00 H new ATOM 1149 N LYS A 76 6.503 -17.705 21.508 1.00 0.00 N ATOM 1150 CA LYS A 76 5.393 -18.381 22.175 1.00 0.00 C ATOM 1151 C LYS A 76 4.279 -17.401 22.531 1.00 0.00 C ATOM 1152 O LYS A 76 4.545 -16.290 22.989 1.00 0.00 O ATOM 1153 CB LYS A 76 5.892 -19.072 23.445 1.00 0.00 C ATOM 1154 CG LYS A 76 6.745 -20.283 23.067 1.00 0.00 C ATOM 1155 CD LYS A 76 7.151 -21.037 24.334 1.00 0.00 C ATOM 1156 CE LYS A 76 7.980 -22.264 23.952 1.00 0.00 C ATOM 1157 NZ LYS A 76 8.348 -23.016 25.185 1.00 0.00 N ATOM 0 H LYS A 76 7.275 -17.449 22.123 1.00 0.00 H new ATOM 0 HA LYS A 76 4.989 -19.123 21.486 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.477 -18.375 24.045 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.046 -19.386 24.057 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.186 -20.942 22.403 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.633 -19.960 22.523 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.728 -20.385 24.989 1.00 0.00 H new ATOM 0 HD3 LYS A 76 6.264 -21.342 24.889 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.412 -22.905 23.278 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.879 -21.957 23.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.912 -23.851 24.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 8.905 -22.402 25.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.484 -23.320 25.677 1.00 0.00 H new ATOM 1171 N ILE A 77 3.026 -17.820 22.321 1.00 0.00 N ATOM 1172 CA ILE A 77 1.871 -16.976 22.637 1.00 0.00 C ATOM 1173 C ILE A 77 0.778 -17.797 23.316 1.00 0.00 C ATOM 1174 O ILE A 77 0.306 -18.794 22.770 1.00 0.00 O ATOM 1175 CB ILE A 77 1.311 -16.328 21.360 1.00 0.00 C ATOM 1176 CG1 ILE A 77 2.294 -15.266 20.842 1.00 0.00 C ATOM 1177 CG2 ILE A 77 -0.043 -15.666 21.661 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.845 -14.751 19.458 1.00 0.00 C ATOM 0 H ILE A 77 2.788 -18.734 21.936 1.00 0.00 H new ATOM 0 HA ILE A 77 2.202 -16.192 23.318 1.00 0.00 H new ATOM 0 HB ILE A 77 1.176 -17.099 20.601 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.348 -14.436 21.547 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.295 -15.691 20.772 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.434 -15.209 20.752 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.745 -16.419 22.019 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.088 -14.900 22.425 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.550 -13.999 19.103 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.815 -15.582 18.753 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.853 -14.308 19.539 1.00 0.00 H new ATOM 1190 N GLY A 78 0.375 -17.367 24.506 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.669 -18.065 25.243 1.00 0.00 C ATOM 1192 C GLY A 78 -0.158 -19.396 25.782 1.00 0.00 C ATOM 1193 O GLY A 78 -0.945 -20.283 26.116 1.00 0.00 O ATOM 0 H GLY A 78 0.752 -16.545 24.977 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.015 -17.443 26.068 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.526 -18.237 24.592 1.00 0.00 H new ATOM 1197 N GLY A 79 1.162 -19.530 25.864 1.00 0.00 N ATOM 1198 CA GLY A 79 1.769 -20.759 26.366 1.00 0.00 C ATOM 1199 C GLY A 79 2.016 -21.750 25.235 1.00 0.00 C ATOM 1200 O GLY A 79 2.698 -22.758 25.421 1.00 0.00 O ATOM 0 H GLY A 79 1.829 -18.808 25.591 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.711 -20.527 26.862 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.118 -21.211 27.114 1.00 0.00 H new ATOM 1204 N ARG A 80 1.460 -21.459 24.057 1.00 0.00 N ATOM 1205 CA ARG A 80 1.627 -22.333 22.891 1.00 0.00 C ATOM 1206 C ARG A 80 2.377 -21.602 21.774 1.00 0.00 C ATOM 1207 O ARG A 80 2.184 -20.405 21.563 1.00 0.00 O ATOM 1208 CB ARG A 80 0.242 -22.806 22.382 1.00 0.00 C ATOM 1209 CG ARG A 80 0.012 -24.280 22.760 1.00 0.00 C ATOM 1210 CD ARG A 80 -0.161 -24.404 24.276 1.00 0.00 C ATOM 1211 NE ARG A 80 -0.643 -25.735 24.624 1.00 0.00 N ATOM 1212 CZ ARG A 80 -0.903 -26.064 25.886 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -0.729 -25.188 26.837 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -1.331 -27.263 26.173 1.00 0.00 N ATOM 0 H ARG A 80 0.893 -20.629 23.884 1.00 0.00 H new ATOM 0 HA ARG A 80 2.213 -23.202 23.189 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -0.543 -22.186 22.813 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.184 -22.687 21.300 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.873 -24.662 22.251 1.00 0.00 H new ATOM 0 HG3 ARG A 80 0.856 -24.886 22.430 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.789 -24.213 24.774 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.864 -23.651 24.631 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.783 -26.426 23.887 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -0.394 -24.251 26.612 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -0.928 -25.440 27.805 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -1.466 -27.948 25.429 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -1.530 -27.515 27.141 1.00 0.00 H new ATOM 1228 N ALA A 81 3.229 -22.334 21.057 1.00 0.00 N ATOM 1229 CA ALA A 81 4.000 -21.745 19.960 1.00 0.00 C ATOM 1230 C ALA A 81 3.287 -21.950 18.627 1.00 0.00 C ATOM 1231 O ALA A 81 3.026 -23.080 18.226 1.00 0.00 O ATOM 1232 CB ALA A 81 5.396 -22.383 19.901 1.00 0.00 C ATOM 0 H ALA A 81 3.403 -23.327 21.213 1.00 0.00 H new ATOM 0 HA ALA A 81 4.096 -20.675 20.143 1.00 0.00 H new ATOM 0 HB1 ALA A 81 5.964 -21.940 19.083 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.917 -22.206 20.842 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.299 -23.456 19.736 1.00 0.00 H new ATOM 1238 N LEU A 82 2.982 -20.847 17.947 1.00 0.00 N ATOM 1239 CA LEU A 82 2.305 -20.910 16.654 1.00 0.00 C ATOM 1240 C LEU A 82 3.299 -21.311 15.564 1.00 0.00 C ATOM 1241 O LEU A 82 4.501 -21.080 15.692 1.00 0.00 O ATOM 1242 CB LEU A 82 1.664 -19.539 16.312 1.00 0.00 C ATOM 1243 CG LEU A 82 2.462 -18.403 16.975 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.927 -18.464 16.515 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.862 -17.051 16.575 1.00 0.00 C ATOM 0 H LEU A 82 3.192 -19.902 18.268 1.00 0.00 H new ATOM 0 HA LEU A 82 1.515 -21.659 16.709 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.644 -19.397 15.231 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.630 -19.516 16.656 1.00 0.00 H new ATOM 0 HG LEU A 82 2.415 -18.517 18.058 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.490 -17.658 16.986 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.358 -19.423 16.801 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.973 -18.354 15.432 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.429 -16.248 17.046 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.906 -16.940 15.492 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.824 -17.003 16.903 1.00 0.00 H new ATOM 1257 N LYS A 83 2.788 -21.913 14.491 1.00 0.00 N ATOM 1258 CA LYS A 83 3.644 -22.347 13.383 1.00 0.00 C ATOM 1259 C LYS A 83 3.339 -21.553 12.116 1.00 0.00 C ATOM 1260 O LYS A 83 2.210 -21.576 11.618 1.00 0.00 O ATOM 1261 CB LYS A 83 3.428 -23.848 13.112 1.00 0.00 C ATOM 1262 CG LYS A 83 4.673 -24.443 12.416 1.00 0.00 C ATOM 1263 CD LYS A 83 5.704 -24.870 13.471 1.00 0.00 C ATOM 1264 CE LYS A 83 6.888 -25.559 12.789 1.00 0.00 C ATOM 1265 NZ LYS A 83 7.863 -26.010 13.821 1.00 0.00 N ATOM 0 H LYS A 83 1.796 -22.111 14.364 1.00 0.00 H new ATOM 0 HA LYS A 83 4.682 -22.170 13.664 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.240 -24.372 14.049 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.548 -23.990 12.485 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.386 -25.300 11.807 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.112 -23.706 11.743 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.050 -23.999 14.028 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.243 -25.547 14.191 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.540 -26.411 12.206 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.370 -24.872 12.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.668 -26.478 13.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 8.204 -25.188 14.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.399 -26.679 14.468 1.00 0.00 H new ATOM 1279 N ILE A 84 4.350 -20.850 11.594 1.00 0.00 N ATOM 1280 CA ILE A 84 4.180 -20.046 10.379 1.00 0.00 C ATOM 1281 C ILE A 84 4.880 -20.725 9.204 1.00 0.00 C ATOM 1282 O ILE A 84 6.101 -20.875 9.200 1.00 0.00 O ATOM 1283 CB ILE A 84 4.764 -18.618 10.585 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.539 -18.154 12.052 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.065 -17.635 9.621 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.066 -17.802 12.273 1.00 0.00 C ATOM 0 H ILE A 84 5.289 -20.821 11.991 1.00 0.00 H new ATOM 0 HA ILE A 84 3.115 -19.961 10.164 1.00 0.00 H new ATOM 0 HB ILE A 84 5.834 -18.637 10.380 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.840 -18.943 12.741 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.164 -17.287 12.267 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.472 -16.634 9.763 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.234 -17.952 8.592 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.995 -17.624 9.826 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.920 -17.478 13.304 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.779 -16.998 11.596 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.449 -18.679 12.077 1.00 0.00 H new ATOM 1298 N ASP A 85 4.098 -21.130 8.207 1.00 0.00 N ATOM 1299 CA ASP A 85 4.658 -21.789 7.027 1.00 0.00 C ATOM 1300 C ASP A 85 3.810 -21.491 5.795 1.00 0.00 C ATOM 1301 O ASP A 85 2.589 -21.382 5.882 1.00 0.00 O ATOM 1302 CB ASP A 85 4.718 -23.303 7.251 1.00 0.00 C ATOM 1303 CG ASP A 85 5.651 -23.947 6.230 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.795 -23.528 6.156 1.00 0.00 O ATOM 1305 OD2 ASP A 85 5.208 -24.848 5.537 1.00 0.00 O ATOM 0 H ASP A 85 3.085 -21.016 8.190 1.00 0.00 H new ATOM 0 HA ASP A 85 5.665 -21.405 6.865 1.00 0.00 H new ATOM 0 HB2 ASP A 85 5.069 -23.515 8.261 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.719 -23.731 7.164 1.00 0.00 H new ATOM 1310 N HIS A 86 4.464 -21.360 4.648 1.00 0.00 N ATOM 1311 CA HIS A 86 3.755 -21.068 3.408 1.00 0.00 C ATOM 1312 C HIS A 86 2.951 -22.284 2.953 1.00 0.00 C ATOM 1313 O HIS A 86 3.381 -23.425 3.127 1.00 0.00 O ATOM 1314 CB HIS A 86 4.756 -20.686 2.317 1.00 0.00 C ATOM 1315 CG HIS A 86 5.600 -19.533 2.791 1.00 0.00 C ATOM 1316 ND1 HIS A 86 6.803 -19.202 2.189 1.00 0.00 N ATOM 1317 CD2 HIS A 86 5.431 -18.632 3.812 1.00 0.00 C ATOM 1318 CE1 HIS A 86 7.307 -18.141 2.846 1.00 0.00 C ATOM 1319 NE2 HIS A 86 6.510 -17.753 3.844 1.00 0.00 N ATOM 0 H HIS A 86 5.475 -21.450 4.550 1.00 0.00 H new ATOM 0 HA HIS A 86 3.072 -20.238 3.587 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.390 -21.539 2.075 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.228 -20.412 1.404 1.00 0.00 H new ATOM 0 HD1 HIS A 86 7.229 -19.676 1.393 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.589 -18.608 4.488 1.00 0.00 H new ATOM 0 HE1 HIS A 86 8.242 -17.662 2.596 1.00 0.00 H new ATOM 1328 N THR A 87 1.777 -22.036 2.368 1.00 0.00 N ATOM 1329 CA THR A 87 0.918 -23.122 1.886 1.00 0.00 C ATOM 1330 C THR A 87 0.282 -22.750 0.549 1.00 0.00 C ATOM 1331 O THR A 87 -0.142 -21.612 0.345 1.00 0.00 O ATOM 1332 CB THR A 87 -0.185 -23.418 2.915 1.00 0.00 C ATOM 1333 OG1 THR A 87 -1.151 -24.288 2.339 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.865 -22.111 3.345 1.00 0.00 C ATOM 0 H THR A 87 1.401 -21.100 2.217 1.00 0.00 H new ATOM 0 HA THR A 87 1.534 -24.011 1.749 1.00 0.00 H new ATOM 0 HB THR A 87 0.260 -23.894 3.789 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.853 -24.478 2.996 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.645 -22.330 4.074 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.126 -21.446 3.793 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.307 -21.627 2.474 1.00 0.00 H new ATOM 1342 N PHE A 88 0.215 -23.720 -0.362 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.373 -23.483 -1.678 1.00 0.00 C ATOM 1344 C PHE A 88 -1.871 -23.754 -1.641 1.00 0.00 C ATOM 1345 O PHE A 88 -2.556 -23.637 -2.657 1.00 0.00 O ATOM 1346 CB PHE A 88 0.283 -24.391 -2.720 1.00 0.00 C ATOM 1347 CG PHE A 88 1.736 -24.009 -2.878 1.00 0.00 C ATOM 1348 CD1 PHE A 88 2.088 -22.909 -3.669 1.00 0.00 C ATOM 1349 CD2 PHE A 88 2.731 -24.754 -2.232 1.00 0.00 C ATOM 1350 CE1 PHE A 88 3.435 -22.554 -3.815 1.00 0.00 C ATOM 1351 CE2 PHE A 88 4.077 -24.400 -2.378 1.00 0.00 C ATOM 1352 CZ PHE A 88 4.429 -23.300 -3.169 1.00 0.00 C ATOM 0 H PHE A 88 0.558 -24.669 -0.214 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.203 -22.441 -1.950 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.201 -25.433 -2.412 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.234 -24.299 -3.675 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.321 -22.334 -4.167 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.459 -25.602 -1.621 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.707 -21.706 -4.425 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.844 -24.975 -1.881 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.468 -23.026 -3.281 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.371 -24.112 -0.466 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.790 -24.394 -0.311 1.00 0.00 C ATOM 1364 C TYR A 89 -4.624 -23.256 -0.899 1.00 0.00 C ATOM 1365 O TYR A 89 -4.431 -22.089 -0.553 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.125 -24.578 1.177 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.625 -24.543 1.372 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.416 -25.601 0.910 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.221 -23.445 2.005 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -7.805 -25.563 1.082 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.611 -23.407 2.177 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.402 -24.466 1.717 1.00 0.00 C ATOM 1373 OH TYR A 89 -9.771 -24.428 1.886 1.00 0.00 O ATOM 0 H TYR A 89 -1.820 -24.213 0.386 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.028 -25.313 -0.847 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -3.724 -25.526 1.535 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.654 -23.791 1.765 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.955 -26.447 0.421 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.610 -22.628 2.360 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -8.416 -26.379 0.725 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.072 -22.561 2.664 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.021 -23.599 2.345 1.00 0.00 H new ATOM 2031 N PHE B 311 12.397 -4.462 5.631 1.00 0.00 N ATOM 2032 CA PHE B 311 11.492 -3.835 4.672 1.00 0.00 C ATOM 2033 C PHE B 311 11.032 -2.475 5.183 1.00 0.00 C ATOM 2034 O PHE B 311 11.078 -2.203 6.383 1.00 0.00 O ATOM 2035 CB PHE B 311 10.277 -4.731 4.448 1.00 0.00 C ATOM 2036 CG PHE B 311 10.740 -6.140 4.157 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.071 -6.996 5.213 1.00 0.00 C ATOM 2038 CD2 PHE B 311 10.835 -6.591 2.837 1.00 0.00 C ATOM 2039 CE1 PHE B 311 11.499 -8.302 4.949 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.259 -7.898 2.572 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.592 -8.753 3.630 1.00 0.00 C ATOM 0 HA PHE B 311 12.024 -3.697 3.731 1.00 0.00 H new ATOM 0 HB2 PHE B 311 9.637 -4.722 5.330 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.681 -4.353 3.617 1.00 0.00 H new ATOM 0 HD1 PHE B 311 10.996 -6.649 6.233 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.581 -5.930 2.021 1.00 0.00 H new ATOM 0 HE1 PHE B 311 11.757 -8.961 5.765 1.00 0.00 H new ATOM 0 HE2 PHE B 311 11.329 -8.247 1.552 1.00 0.00 H new ATOM 0 HZ PHE B 311 11.921 -9.761 3.426 1.00 0.00 H new ATOM 2051 N ALA B 312 10.592 -1.624 4.267 1.00 0.00 N ATOM 2052 CA ALA B 312 10.127 -0.289 4.634 1.00 0.00 C ATOM 2053 C ALA B 312 8.636 -0.309 4.970 1.00 0.00 C ATOM 2054 O ALA B 312 7.913 0.644 4.678 1.00 0.00 O ATOM 2055 CB ALA B 312 10.382 0.683 3.484 1.00 0.00 C ATOM 0 H ALA B 312 10.546 -1.830 3.269 1.00 0.00 H new ATOM 0 HA ALA B 312 10.678 0.038 5.516 1.00 0.00 H new ATOM 0 HB1 ALA B 312 10.033 1.677 3.764 1.00 0.00 H new ATOM 0 HB2 ALA B 312 11.450 0.720 3.269 1.00 0.00 H new ATOM 0 HB3 ALA B 312 9.845 0.346 2.597 1.00 0.00 H new ATOM 2061 N ILE B 313 8.179 -1.399 5.585 1.00 0.00 N ATOM 2062 CA ILE B 313 6.768 -1.525 5.959 1.00 0.00 C ATOM 2063 C ILE B 313 6.572 -1.140 7.420 1.00 0.00 C ATOM 2064 O ILE B 313 7.045 -1.828 8.324 1.00 0.00 O ATOM 2065 CB ILE B 313 6.294 -2.964 5.736 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.371 -3.301 4.243 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.849 -3.111 6.217 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.152 -4.800 4.046 1.00 0.00 C ATOM 0 H ILE B 313 8.758 -2.201 5.834 1.00 0.00 H new ATOM 0 HA ILE B 313 6.180 -0.852 5.334 1.00 0.00 H new ATOM 0 HB ILE B 313 6.933 -3.645 6.298 1.00 0.00 H new ATOM 0 HG12 ILE B 313 5.617 -2.737 3.693 1.00 0.00 H new ATOM 0 HG13 ILE B 313 7.342 -3.009 3.843 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.515 -4.136 6.057 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.793 -2.873 7.279 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.208 -2.429 5.658 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.207 -5.039 2.984 1.00 0.00 H new ATOM 0 HD12 ILE B 313 6.922 -5.354 4.583 1.00 0.00 H new ATOM 0 HD13 ILE B 313 5.171 -5.078 4.430 1.00 0.00 H new ATOM 2080 N MET B 314 5.864 -0.032 7.649 1.00 0.00 N ATOM 2081 CA MET B 314 5.610 0.440 9.010 1.00 0.00 C ATOM 2082 C MET B 314 4.283 -0.117 9.559 1.00 0.00 C ATOM 2083 O MET B 314 3.378 -0.433 8.787 1.00 0.00 O ATOM 2084 CB MET B 314 5.570 1.972 9.026 1.00 0.00 C ATOM 2085 CG MET B 314 4.494 2.467 8.059 1.00 0.00 C ATOM 2086 SD MET B 314 4.649 4.261 7.857 1.00 0.00 S ATOM 2087 CE MET B 314 6.226 4.256 6.955 1.00 0.00 C ATOM 0 H MET B 314 5.460 0.550 6.916 1.00 0.00 H new ATOM 0 HA MET B 314 6.418 0.083 9.648 1.00 0.00 H new ATOM 0 HB2 MET B 314 5.360 2.330 10.034 1.00 0.00 H new ATOM 0 HB3 MET B 314 6.542 2.374 8.741 1.00 0.00 H new ATOM 0 HG2 MET B 314 4.600 1.971 7.094 1.00 0.00 H new ATOM 0 HG3 MET B 314 3.504 2.217 8.440 1.00 0.00 H new ATOM 0 HE1 MET B 314 6.229 5.063 6.222 1.00 0.00 H new ATOM 0 HE2 MET B 314 7.047 4.400 7.657 1.00 0.00 H new ATOM 0 HE3 MET B 314 6.350 3.301 6.444 1.00 0.00 H new ATOM 2097 N PRO B 315 4.150 -0.230 10.876 1.00 0.00 N ATOM 2098 CA PRO B 315 2.905 -0.749 11.533 1.00 0.00 C ATOM 2099 C PRO B 315 1.656 0.025 11.099 1.00 0.00 C ATOM 2100 O PRO B 315 1.687 1.249 10.974 1.00 0.00 O ATOM 2101 CB PRO B 315 3.169 -0.554 13.044 1.00 0.00 C ATOM 2102 CG PRO B 315 4.654 -0.501 13.189 1.00 0.00 C ATOM 2103 CD PRO B 315 5.178 0.108 11.901 1.00 0.00 C ATOM 0 HA PRO B 315 2.708 -1.786 11.261 1.00 0.00 H new ATOM 0 HB2 PRO B 315 2.707 0.364 13.407 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.748 -1.375 13.625 1.00 0.00 H new ATOM 0 HG2 PRO B 315 4.941 0.102 14.051 1.00 0.00 H new ATOM 0 HG3 PRO B 315 5.067 -1.498 13.346 1.00 0.00 H new ATOM 0 HD2 PRO B 315 5.303 1.187 11.995 1.00 0.00 H new ATOM 0 HD3 PRO B 315 6.152 -0.304 11.636 1.00 0.00 H new ATOM 2111 N GLY B 316 0.559 -0.699 10.868 1.00 0.00 N ATOM 2112 CA GLY B 316 -0.695 -0.068 10.452 1.00 0.00 C ATOM 2113 C GLY B 316 -1.531 0.336 11.664 1.00 0.00 C ATOM 2114 O GLY B 316 -1.185 0.017 12.801 1.00 0.00 O ATOM 0 H GLY B 316 0.513 -1.714 10.961 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -0.480 0.811 9.844 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.263 -0.757 9.827 1.00 0.00 H new ATOM 2118 N SER B 317 -2.632 1.038 11.413 1.00 0.00 N ATOM 2119 CA SER B 317 -3.512 1.474 12.493 1.00 0.00 C ATOM 2120 C SER B 317 -4.276 0.288 13.078 1.00 0.00 C ATOM 2121 O SER B 317 -4.734 0.332 14.222 1.00 0.00 O ATOM 2122 CB SER B 317 -4.507 2.510 11.969 1.00 0.00 C ATOM 2123 OG SER B 317 -5.401 1.884 11.057 1.00 0.00 O ATOM 0 H SER B 317 -2.935 1.315 10.479 1.00 0.00 H new ATOM 0 HA SER B 317 -2.898 1.919 13.276 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.063 2.949 12.798 1.00 0.00 H new ATOM 0 HB3 SER B 317 -3.976 3.324 11.475 1.00 0.00 H new ATOM 0 HG SER B 317 -6.041 2.545 10.721 1.00 0.00 H new ATOM 2129 N ARG B 318 -4.410 -0.773 12.287 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.122 -1.963 12.733 1.00 0.00 C ATOM 2131 C ARG B 318 -4.323 -2.693 13.803 1.00 0.00 C ATOM 2132 O ARG B 318 -4.826 -3.614 14.446 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.384 -2.896 11.553 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.293 -4.050 12.000 1.00 0.00 C ATOM 2135 CD ARG B 318 -6.992 -4.644 10.785 1.00 0.00 C ATOM 2136 NE ARG B 318 -7.939 -3.683 10.228 1.00 0.00 N ATOM 2137 CZ ARG B 318 -8.533 -3.902 9.061 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -8.273 -4.990 8.390 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -9.378 -3.027 8.584 1.00 0.00 N ATOM 0 H ARG B 318 -4.037 -0.832 11.340 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.076 -1.653 13.159 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -5.853 -2.345 10.738 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -4.442 -3.289 11.171 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -5.705 -4.816 12.505 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.030 -3.690 12.717 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -6.255 -4.918 10.030 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -7.514 -5.558 11.068 1.00 0.00 H new ATOM 0 HE ARG B 318 -8.148 -2.828 10.744 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -7.613 -5.673 8.762 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -8.730 -5.158 7.493 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -9.581 -2.176 9.108 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -9.834 -3.195 7.687 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.076 -2.276 13.983 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.213 -2.894 14.975 1.00 0.00 C ATOM 2155 C TRP B 319 -2.796 -2.730 16.374 1.00 0.00 C ATOM 2156 O TRP B 319 -2.398 -3.416 17.313 1.00 0.00 O ATOM 2157 CB TRP B 319 -0.817 -2.273 14.923 1.00 0.00 C ATOM 2158 CG TRP B 319 0.048 -2.900 15.971 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.026 -4.189 16.378 1.00 0.00 C ATOM 2160 CD2 TRP B 319 1.112 -2.291 16.749 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.923 -4.408 17.355 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.649 -3.269 17.619 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.658 -0.997 16.786 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.686 -2.976 18.489 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.708 -0.697 17.665 1.00 0.00 C ATOM 2166 CH2 TRP B 319 3.222 -1.683 18.516 1.00 0.00 C ATOM 0 H TRP B 319 -2.644 -1.516 13.457 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.141 -3.958 14.747 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.378 -2.422 13.937 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -0.880 -1.197 15.084 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.717 -4.927 15.999 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.068 -5.302 17.823 1.00 0.00 H new ATOM 0 HE3 TRP B 319 1.267 -0.230 16.134 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.079 -3.741 19.143 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 3.123 0.300 17.686 1.00 0.00 H new ATOM 0 HH2 TRP B 319 4.030 -1.446 19.192 1.00 0.00 H new ATOM 2177 N ASP B 320 -3.732 -1.806 16.513 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.366 -1.555 17.808 1.00 0.00 C ATOM 2179 C ASP B 320 -3.333 -1.118 18.853 1.00 0.00 C ATOM 2180 O ASP B 320 -3.687 -0.642 19.931 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.074 -2.827 18.286 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.135 -2.477 19.327 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -6.860 -1.523 19.104 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.204 -3.169 20.331 1.00 0.00 O ATOM 0 H ASP B 320 -4.072 -1.217 15.753 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.091 -0.750 17.686 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.537 -3.335 17.440 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -4.348 -3.518 18.714 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.051 -1.277 18.525 1.00 0.00 N ATOM 2190 CA GLY B 321 -0.978 -0.899 19.440 1.00 0.00 C ATOM 2191 C GLY B 321 -0.694 -2.013 20.449 1.00 0.00 C ATOM 2192 O GLY B 321 0.010 -1.804 21.437 1.00 0.00 O ATOM 0 H GLY B 321 -1.733 -1.663 17.636 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.073 -0.679 18.873 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.252 0.014 19.969 1.00 0.00 H new ATOM 2196 N VAL B 322 -1.244 -3.197 20.192 1.00 0.00 N ATOM 2197 CA VAL B 322 -1.039 -4.342 21.077 1.00 0.00 C ATOM 2198 C VAL B 322 0.444 -4.713 21.131 1.00 0.00 C ATOM 2199 O VAL B 322 1.180 -4.509 20.168 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.863 -5.550 20.591 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.352 -6.838 21.256 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -3.340 -5.347 20.963 1.00 0.00 C ATOM 0 H VAL B 322 -1.833 -3.389 19.382 1.00 0.00 H new ATOM 0 HA VAL B 322 -1.372 -4.067 22.078 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.760 -5.635 19.509 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.941 -7.686 20.906 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.305 -6.991 20.996 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -1.448 -6.751 22.338 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.923 -6.202 20.619 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -3.433 -5.256 22.045 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.713 -4.439 20.489 1.00 0.00 H new ATOM 2212 N HIS B 323 0.872 -5.264 22.262 1.00 0.00 N ATOM 2213 CA HIS B 323 2.270 -5.654 22.429 1.00 0.00 C ATOM 2214 C HIS B 323 2.630 -6.789 21.470 1.00 0.00 C ATOM 2215 O HIS B 323 1.804 -7.650 21.170 1.00 0.00 O ATOM 2216 CB HIS B 323 2.511 -6.109 23.870 1.00 0.00 C ATOM 2217 CG HIS B 323 2.326 -4.944 24.801 1.00 0.00 C ATOM 2218 ND1 HIS B 323 1.097 -4.632 25.362 1.00 0.00 N ATOM 2219 CD2 HIS B 323 3.206 -4.005 25.281 1.00 0.00 C ATOM 2220 CE1 HIS B 323 1.269 -3.547 26.139 1.00 0.00 C ATOM 2221 NE2 HIS B 323 2.535 -3.124 26.124 1.00 0.00 N ATOM 0 H HIS B 323 0.278 -5.450 23.070 1.00 0.00 H new ATOM 0 HA HIS B 323 2.899 -4.792 22.206 1.00 0.00 H new ATOM 0 HB2 HIS B 323 1.819 -6.910 24.130 1.00 0.00 H new ATOM 0 HB3 HIS B 323 3.518 -6.513 23.971 1.00 0.00 H new ATOM 0 HD2 HIS B 323 4.258 -3.958 25.041 1.00 0.00 H new ATOM 0 HE1 HIS B 323 0.479 -3.076 26.706 1.00 0.00 H new ATOM 0 HE2 HIS B 323 2.927 -2.326 26.624 1.00 0.00 H new ATOM 2230 N ARG B 324 3.873 -6.782 20.985 1.00 0.00 N ATOM 2231 CA ARG B 324 4.336 -7.812 20.047 1.00 0.00 C ATOM 2232 C ARG B 324 5.745 -8.274 20.405 1.00 0.00 C ATOM 2233 O ARG B 324 6.500 -7.547 21.050 1.00 0.00 O ATOM 2234 CB ARG B 324 4.328 -7.256 18.621 1.00 0.00 C ATOM 2235 CG ARG B 324 5.274 -6.055 18.534 1.00 0.00 C ATOM 2236 CD ARG B 324 5.132 -5.390 17.165 1.00 0.00 C ATOM 2237 NE ARG B 324 5.972 -4.197 17.091 1.00 0.00 N ATOM 2238 CZ ARG B 324 5.986 -3.431 16.004 1.00 0.00 C ATOM 2239 NH1 ARG B 324 5.244 -3.740 14.978 1.00 0.00 N ATOM 2240 NH2 ARG B 324 6.743 -2.369 15.963 1.00 0.00 N ATOM 0 H ARG B 324 4.574 -6.081 21.223 1.00 0.00 H new ATOM 0 HA ARG B 324 3.661 -8.665 20.112 1.00 0.00 H new ATOM 0 HB2 ARG B 324 4.638 -8.028 17.917 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.318 -6.957 18.342 1.00 0.00 H new ATOM 0 HG2 ARG B 324 5.043 -5.339 19.323 1.00 0.00 H new ATOM 0 HG3 ARG B 324 6.304 -6.378 18.688 1.00 0.00 H new ATOM 0 HD2 ARG B 324 5.416 -6.092 16.381 1.00 0.00 H new ATOM 0 HD3 ARG B 324 4.090 -5.121 16.990 1.00 0.00 H new ATOM 0 HE ARG B 324 6.558 -3.947 17.887 1.00 0.00 H new ATOM 0 HH11 ARG B 324 4.652 -4.570 15.008 1.00 0.00 H new ATOM 0 HH12 ARG B 324 5.255 -3.152 14.145 1.00 0.00 H new ATOM 0 HH21 ARG B 324 7.325 -2.126 16.765 1.00 0.00 H new ATOM 0 HH22 ARG B 324 6.753 -1.782 15.129 1.00 0.00 H new ATOM 2254 N SER B 325 6.095 -9.492 19.984 1.00 0.00 N ATOM 2255 CA SER B 325 7.424 -10.047 20.271 1.00 0.00 C ATOM 2256 C SER B 325 8.127 -10.462 18.982 1.00 0.00 C ATOM 2257 O SER B 325 7.601 -11.256 18.202 1.00 0.00 O ATOM 2258 CB SER B 325 7.290 -11.259 21.189 1.00 0.00 C ATOM 2259 OG SER B 325 8.585 -11.752 21.508 1.00 0.00 O ATOM 0 H SER B 325 5.485 -10.109 19.448 1.00 0.00 H new ATOM 0 HA SER B 325 8.019 -9.277 20.762 1.00 0.00 H new ATOM 0 HB2 SER B 325 6.759 -10.983 22.100 1.00 0.00 H new ATOM 0 HB3 SER B 325 6.702 -12.036 20.701 1.00 0.00 H new ATOM 0 HG SER B 325 8.552 -12.728 21.592 1.00 0.00 H new ATOM 2286 N PHE B 328 14.135 -11.971 15.750 1.00 0.00 N ATOM 2287 CA PHE B 328 14.866 -12.962 14.966 1.00 0.00 C ATOM 2288 C PHE B 328 15.856 -12.279 14.026 1.00 0.00 C ATOM 2289 O PHE B 328 17.019 -12.671 13.943 1.00 0.00 O ATOM 2290 CB PHE B 328 13.881 -13.806 14.151 1.00 0.00 C ATOM 2291 CG PHE B 328 14.590 -15.027 13.611 1.00 0.00 C ATOM 2292 CD1 PHE B 328 14.783 -16.139 14.438 1.00 0.00 C ATOM 2293 CD2 PHE B 328 15.052 -15.046 12.290 1.00 0.00 C ATOM 2294 CE1 PHE B 328 15.439 -17.272 13.944 1.00 0.00 C ATOM 2295 CE2 PHE B 328 15.708 -16.179 11.796 1.00 0.00 C ATOM 2296 CZ PHE B 328 15.901 -17.293 12.623 1.00 0.00 C ATOM 0 HA PHE B 328 15.420 -13.606 15.649 1.00 0.00 H new ATOM 0 HB2 PHE B 328 13.040 -14.107 14.776 1.00 0.00 H new ATOM 0 HB3 PHE B 328 13.473 -13.216 13.330 1.00 0.00 H new ATOM 0 HD1 PHE B 328 14.426 -16.123 15.457 1.00 0.00 H new ATOM 0 HD2 PHE B 328 14.902 -14.187 11.653 1.00 0.00 H new ATOM 0 HE1 PHE B 328 15.589 -18.130 14.582 1.00 0.00 H new ATOM 0 HE2 PHE B 328 16.066 -16.195 10.777 1.00 0.00 H new ATOM 0 HZ PHE B 328 16.406 -18.168 12.241 1.00 0.00 H new ATOM 2306 N GLU B 329 15.388 -11.253 13.324 1.00 0.00 N ATOM 2307 CA GLU B 329 16.240 -10.520 12.389 1.00 0.00 C ATOM 2308 C GLU B 329 17.360 -9.798 13.132 1.00 0.00 C ATOM 2309 O GLU B 329 18.389 -9.447 12.547 1.00 0.00 O ATOM 2310 CB GLU B 329 15.402 -9.505 11.604 1.00 0.00 C ATOM 2311 CG GLU B 329 14.776 -8.494 12.572 1.00 0.00 C ATOM 2312 CD GLU B 329 13.946 -7.474 11.799 1.00 0.00 C ATOM 2313 OE1 GLU B 329 13.960 -7.529 10.581 1.00 0.00 O ATOM 2314 OE2 GLU B 329 13.308 -6.653 12.437 1.00 0.00 O ATOM 0 H GLU B 329 14.429 -10.910 13.382 1.00 0.00 H new ATOM 0 HA GLU B 329 16.686 -11.234 11.697 1.00 0.00 H new ATOM 0 HB2 GLU B 329 16.027 -8.988 10.877 1.00 0.00 H new ATOM 0 HB3 GLU B 329 14.621 -10.019 11.044 1.00 0.00 H new ATOM 0 HG2 GLU B 329 14.147 -9.013 13.296 1.00 0.00 H new ATOM 0 HG3 GLU B 329 15.558 -7.986 13.136 1.00 0.00 H new ATOM 2321 N GLU B 330 17.150 -9.575 14.424 1.00 0.00 N ATOM 2322 CA GLU B 330 18.139 -8.880 15.235 1.00 0.00 C ATOM 2323 C GLU B 330 19.521 -9.503 15.045 1.00 0.00 C ATOM 2324 O GLU B 330 20.534 -8.804 15.077 1.00 0.00 O ATOM 2325 CB GLU B 330 17.744 -8.948 16.722 1.00 0.00 C ATOM 2326 CG GLU B 330 18.454 -7.829 17.498 1.00 0.00 C ATOM 2327 CD GLU B 330 19.959 -8.075 17.514 1.00 0.00 C ATOM 2328 OE1 GLU B 330 20.351 -9.219 17.684 1.00 0.00 O ATOM 2329 OE2 GLU B 330 20.696 -7.119 17.348 1.00 0.00 O ATOM 0 H GLU B 330 16.311 -9.863 14.928 1.00 0.00 H new ATOM 0 HA GLU B 330 18.174 -7.838 14.917 1.00 0.00 H new ATOM 0 HB2 GLU B 330 16.664 -8.847 16.826 1.00 0.00 H new ATOM 0 HB3 GLU B 330 18.015 -9.919 17.136 1.00 0.00 H new ATOM 0 HG2 GLU B 330 18.240 -6.864 17.037 1.00 0.00 H new ATOM 0 HG3 GLU B 330 18.074 -7.786 18.519 1.00 0.00 H new ATOM 2336 N LYS B 331 19.558 -10.820 14.853 1.00 0.00 N ATOM 2337 CA LYS B 331 20.828 -11.518 14.672 1.00 0.00 C ATOM 2338 C LYS B 331 21.585 -10.948 13.478 1.00 0.00 C ATOM 2339 O LYS B 331 22.800 -10.759 13.536 1.00 0.00 O ATOM 2340 CB LYS B 331 20.572 -13.015 14.453 1.00 0.00 C ATOM 2341 CG LYS B 331 19.920 -13.233 13.084 1.00 0.00 C ATOM 2342 CD LYS B 331 19.409 -14.670 12.983 1.00 0.00 C ATOM 2343 CE LYS B 331 18.682 -14.859 11.651 1.00 0.00 C ATOM 2344 NZ LYS B 331 19.640 -14.652 10.528 1.00 0.00 N ATOM 0 H LYS B 331 18.733 -11.419 14.819 1.00 0.00 H new ATOM 0 HA LYS B 331 21.432 -11.380 15.569 1.00 0.00 H new ATOM 0 HB2 LYS B 331 21.510 -13.567 14.511 1.00 0.00 H new ATOM 0 HB3 LYS B 331 19.925 -13.402 15.240 1.00 0.00 H new ATOM 0 HG2 LYS B 331 19.096 -12.533 12.947 1.00 0.00 H new ATOM 0 HG3 LYS B 331 20.641 -13.036 12.291 1.00 0.00 H new ATOM 0 HD2 LYS B 331 20.241 -15.370 13.058 1.00 0.00 H new ATOM 0 HD3 LYS B 331 18.735 -14.887 13.812 1.00 0.00 H new ATOM 0 HE2 LYS B 331 18.253 -15.860 11.597 1.00 0.00 H new ATOM 0 HE3 LYS B 331 17.855 -14.153 11.572 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 19.250 -15.067 9.658 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 19.795 -13.633 10.387 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 20.545 -15.111 10.755 1.00 0.00 H new ATOM 2358 N TRP B 332 20.857 -10.673 12.402 1.00 0.00 N ATOM 2359 CA TRP B 332 21.471 -10.121 11.204 1.00 0.00 C ATOM 2360 C TRP B 332 22.077 -8.758 11.502 1.00 0.00 C ATOM 2361 O TRP B 332 23.227 -8.487 11.157 1.00 0.00 O ATOM 2362 CB TRP B 332 20.425 -9.989 10.095 1.00 0.00 C ATOM 2363 CG TRP B 332 21.092 -9.548 8.833 1.00 0.00 C ATOM 2364 CD1 TRP B 332 21.620 -10.377 7.905 1.00 0.00 C ATOM 2365 CD2 TRP B 332 21.309 -8.193 8.343 1.00 0.00 C ATOM 2366 NE1 TRP B 332 22.149 -9.617 6.876 1.00 0.00 N ATOM 2367 CE2 TRP B 332 21.981 -8.265 7.100 1.00 0.00 C ATOM 2368 CE3 TRP B 332 20.991 -6.920 8.851 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 22.327 -7.117 6.387 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 21.337 -5.761 8.136 1.00 0.00 C ATOM 2371 CH2 TRP B 332 22.004 -5.860 6.907 1.00 0.00 C ATOM 0 H TRP B 332 19.850 -10.822 12.336 1.00 0.00 H new ATOM 0 HA TRP B 332 22.262 -10.795 10.875 1.00 0.00 H new ATOM 0 HB2 TRP B 332 19.922 -10.943 9.939 1.00 0.00 H new ATOM 0 HB3 TRP B 332 19.660 -9.269 10.386 1.00 0.00 H new ATOM 0 HD1 TRP B 332 21.628 -11.456 7.958 1.00 0.00 H new ATOM 0 HE1 TRP B 332 22.607 -10.008 6.053 1.00 0.00 H new ATOM 0 HE3 TRP B 332 20.477 -6.833 9.797 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 22.841 -7.199 5.440 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 21.088 -4.789 8.535 1.00 0.00 H new ATOM 0 HH2 TRP B 332 22.268 -4.966 6.362 1.00 0.00 H new ATOM 2382 N PHE B 333 21.296 -7.902 12.155 1.00 0.00 N ATOM 2383 CA PHE B 333 21.770 -6.569 12.501 1.00 0.00 C ATOM 2384 C PHE B 333 22.947 -6.660 13.467 1.00 0.00 C ATOM 2385 O PHE B 333 23.904 -5.891 13.368 1.00 0.00 O ATOM 2386 CB PHE B 333 20.635 -5.760 13.144 1.00 0.00 C ATOM 2387 CG PHE B 333 19.692 -5.266 12.071 1.00 0.00 C ATOM 2388 CD1 PHE B 333 19.924 -4.033 11.450 1.00 0.00 C ATOM 2389 CD2 PHE B 333 18.588 -6.041 11.694 1.00 0.00 C ATOM 2390 CE1 PHE B 333 19.053 -3.574 10.455 1.00 0.00 C ATOM 2391 CE2 PHE B 333 17.717 -5.582 10.699 1.00 0.00 C ATOM 2392 CZ PHE B 333 17.949 -4.349 10.080 1.00 0.00 C ATOM 0 H PHE B 333 20.342 -8.106 12.452 1.00 0.00 H new ATOM 0 HA PHE B 333 22.098 -6.068 11.590 1.00 0.00 H new ATOM 0 HB2 PHE B 333 20.095 -6.379 13.860 1.00 0.00 H new ATOM 0 HB3 PHE B 333 21.045 -4.916 13.698 1.00 0.00 H new ATOM 0 HD1 PHE B 333 20.776 -3.435 11.739 1.00 0.00 H new ATOM 0 HD2 PHE B 333 18.409 -6.993 12.171 1.00 0.00 H new ATOM 0 HE1 PHE B 333 19.233 -2.622 9.977 1.00 0.00 H new ATOM 0 HE2 PHE B 333 16.866 -6.180 10.409 1.00 0.00 H new ATOM 0 HZ PHE B 333 17.276 -3.995 9.313 1.00 0.00 H new ATOM 2402 N ALA B 334 22.870 -7.606 14.399 1.00 0.00 N ATOM 2403 CA ALA B 334 23.934 -7.786 15.378 1.00 0.00 C ATOM 2404 C ALA B 334 25.249 -8.105 14.677 1.00 0.00 C ATOM 2405 O ALA B 334 26.306 -7.609 15.067 1.00 0.00 O ATOM 2406 CB ALA B 334 23.575 -8.921 16.336 1.00 0.00 C ATOM 0 H ALA B 334 22.088 -8.254 14.496 1.00 0.00 H new ATOM 0 HA ALA B 334 24.048 -6.860 15.942 1.00 0.00 H new ATOM 0 HB1 ALA B 334 24.376 -9.049 17.065 1.00 0.00 H new ATOM 0 HB2 ALA B 334 22.647 -8.679 16.855 1.00 0.00 H new ATOM 0 HB3 ALA B 334 23.446 -9.845 15.773 1.00 0.00 H new ATOM 2412 N LYS B 335 25.179 -8.937 13.641 1.00 0.00 N ATOM 2413 CA LYS B 335 26.372 -9.311 12.894 1.00 0.00 C ATOM 2414 C LYS B 335 26.988 -8.083 12.236 1.00 0.00 C ATOM 2415 O LYS B 335 28.206 -7.912 12.242 1.00 0.00 O ATOM 2416 CB LYS B 335 26.023 -10.353 11.819 1.00 0.00 C ATOM 2417 CG LYS B 335 27.317 -10.958 11.230 1.00 0.00 C ATOM 2418 CD LYS B 335 27.806 -12.109 12.121 1.00 0.00 C ATOM 2419 CE LYS B 335 29.045 -12.756 11.498 1.00 0.00 C ATOM 2420 NZ LYS B 335 30.201 -11.823 11.609 1.00 0.00 N ATOM 0 H LYS B 335 24.315 -9.361 13.303 1.00 0.00 H new ATOM 0 HA LYS B 335 27.093 -9.743 13.588 1.00 0.00 H new ATOM 0 HB2 LYS B 335 25.407 -11.142 12.251 1.00 0.00 H new ATOM 0 HB3 LYS B 335 25.436 -9.888 11.027 1.00 0.00 H new ATOM 0 HG2 LYS B 335 27.132 -11.322 10.219 1.00 0.00 H new ATOM 0 HG3 LYS B 335 28.087 -10.190 11.156 1.00 0.00 H new ATOM 0 HD2 LYS B 335 28.042 -11.735 13.117 1.00 0.00 H new ATOM 0 HD3 LYS B 335 27.017 -12.851 12.238 1.00 0.00 H new ATOM 0 HE2 LYS B 335 29.272 -13.695 12.004 1.00 0.00 H new ATOM 0 HE3 LYS B 335 28.856 -12.995 10.451 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 31.079 -12.329 11.376 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 30.072 -11.031 10.948 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 30.260 -11.457 12.581 1.00 0.00 H new ATOM 2434 N GLN B 336 26.141 -7.231 11.669 1.00 0.00 N ATOM 2435 CA GLN B 336 26.615 -6.017 11.011 1.00 0.00 C ATOM 2436 C GLN B 336 27.330 -5.108 12.010 1.00 0.00 C ATOM 2437 O GLN B 336 28.306 -4.444 11.671 1.00 0.00 O ATOM 2438 CB GLN B 336 25.423 -5.269 10.370 1.00 0.00 C ATOM 2439 CG GLN B 336 25.269 -5.683 8.896 1.00 0.00 C ATOM 2440 CD GLN B 336 25.323 -7.205 8.769 1.00 0.00 C ATOM 2441 OE1 GLN B 336 24.435 -7.901 9.257 1.00 0.00 O ATOM 2442 NE2 GLN B 336 26.321 -7.761 8.141 1.00 0.00 N ATOM 0 H GLN B 336 25.129 -7.356 11.651 1.00 0.00 H new ATOM 0 HA GLN B 336 27.324 -6.296 10.232 1.00 0.00 H new ATOM 0 HB2 GLN B 336 24.507 -5.493 10.916 1.00 0.00 H new ATOM 0 HB3 GLN B 336 25.580 -4.193 10.439 1.00 0.00 H new ATOM 0 HG2 GLN B 336 24.323 -5.311 8.503 1.00 0.00 H new ATOM 0 HG3 GLN B 336 26.062 -5.232 8.299 1.00 0.00 H new ATOM 0 HE21 GLN B 336 27.056 -7.181 7.737 1.00 0.00 H new ATOM 0 HE22 GLN B 336 26.367 -8.776 8.053 1.00 0.00 H new ATOM 2451 N ASN B 337 26.828 -5.073 13.238 1.00 0.00 N ATOM 2452 CA ASN B 337 27.430 -4.236 14.274 1.00 0.00 C ATOM 2453 C ASN B 337 28.662 -4.907 14.881 1.00 0.00 C ATOM 2454 O ASN B 337 29.692 -4.267 15.098 1.00 0.00 O ATOM 2455 CB ASN B 337 26.401 -3.964 15.375 1.00 0.00 C ATOM 2456 CG ASN B 337 26.856 -2.790 16.237 1.00 0.00 C ATOM 2457 OD1 ASN B 337 27.604 -1.932 15.771 1.00 0.00 O ATOM 2458 ND2 ASN B 337 26.441 -2.699 17.471 1.00 0.00 N ATOM 0 H ASN B 337 26.014 -5.608 13.541 1.00 0.00 H new ATOM 0 HA ASN B 337 27.743 -3.298 13.816 1.00 0.00 H new ATOM 0 HB2 ASN B 337 25.430 -3.745 14.931 1.00 0.00 H new ATOM 0 HB3 ASN B 337 26.275 -4.853 15.994 1.00 0.00 H new ATOM 0 HD21 ASN B 337 26.737 -1.915 18.052 1.00 0.00 H new ATOM 0 HD22 ASN B 337 25.821 -3.412 17.854 1.00 0.00 H new ATOM 2465 N GLU B 338 28.550 -6.203 15.149 1.00 0.00 N ATOM 2466 CA GLU B 338 29.655 -6.953 15.739 1.00 0.00 C ATOM 2467 C GLU B 338 30.848 -7.002 14.788 1.00 0.00 C ATOM 2468 O GLU B 338 32.000 -6.934 15.217 1.00 0.00 O ATOM 2469 CB GLU B 338 29.200 -8.376 16.071 1.00 0.00 C ATOM 2470 CG GLU B 338 30.316 -9.105 16.822 1.00 0.00 C ATOM 2471 CD GLU B 338 29.811 -10.454 17.323 1.00 0.00 C ATOM 2472 OE1 GLU B 338 28.666 -10.774 17.051 1.00 0.00 O ATOM 2473 OE2 GLU B 338 30.577 -11.148 17.972 1.00 0.00 O ATOM 0 H GLU B 338 27.711 -6.754 14.969 1.00 0.00 H new ATOM 0 HA GLU B 338 29.963 -6.447 16.654 1.00 0.00 H new ATOM 0 HB2 GLU B 338 28.296 -8.348 16.679 1.00 0.00 H new ATOM 0 HB3 GLU B 338 28.952 -8.913 15.156 1.00 0.00 H new ATOM 0 HG2 GLU B 338 31.174 -9.249 16.165 1.00 0.00 H new ATOM 0 HG3 GLU B 338 30.656 -8.500 17.662 1.00 0.00 H new