USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 964 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 41 GLN :FLIP amide:sc= -0.6 F(o=-3.3,f=-2.2) USER MOD Set 1.2: A 44 GLN :FLIP amide:sc= 0.0479 F(o=-2.8,f=-2.2) USER MOD Set 1.3: A 150 LYS NZ :NH3+ -158:sc= 0.0452 (180deg=0) USER MOD Set 1.4: A 154 TYR OH : rot -4:sc= -1.73! USER MOD Set 2.1: A 20 CYS SG : rot 58:sc= 0.31 USER MOD Set 2.2: A 42 MET CE :methyl 179:sc= -2.02! (180deg=-2.04!) USER MOD Single : A 6 MET CE :methyl -178:sc= -3.59! (180deg=-3.59!) USER MOD Single : A 16 ASN : amide:sc= -4.79! C(o=-4.8!,f=-5.3!) USER MOD Single : A 22 MET CE :methyl 161:sc= -2.19! (180deg=-2.77!) USER MOD Single : A 23 ASN :FLIP amide:sc= -6.99! C(o=-12!,f=-7!) USER MOD Single : A 24 ASN : amide:sc= 0.0665 K(o=0.067,f=-1.2) USER MOD Single : A 26 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0565) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -59:sc= 0.237 USER MOD Single : A 55 ASN : amide:sc= -0.95 K(o=-0.95,f=-5.1!) USER MOD Single : A 65 THR OG1 : rot 35:sc= -0.721! USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 112:sc= 1.23 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= -0.0588 X(o=-0.059,f=-0.059) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 70:sc= 0.417 USER MOD Single : A 115 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.046) USER MOD Single : A 117 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.0026) USER MOD Single : A 120 ASN : amide:sc= 0.432 K(o=0.43,f=-2.6!) USER MOD Single : A 135 SER OG : rot 180:sc= -0.361 USER MOD Single : A 138 THR OG1 : rot 177:sc= -3.73! USER MOD Single : A 141 GLN : amide:sc= -0.288 K(o=-0.29,f=-2!) USER MOD Single : A 146 THR OG1 : rot 49:sc= 0.965 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 SER OG : rot 66:sc= 0.286 USER MOD Single : A 164 HIS :FLIP no HD1:sc= -2.73 F(o=-3.3,f=-2.7) USER MOD ----------------------------------------------------------------- ATOM 61 N MET A 6 3.493 8.458 -2.915 1.00 0.00 N ATOM 62 CA MET A 6 4.180 9.080 -4.045 1.00 0.00 C ATOM 63 C MET A 6 3.180 9.469 -5.130 1.00 0.00 C ATOM 64 O MET A 6 2.095 8.894 -5.217 1.00 0.00 O ATOM 65 CB MET A 6 5.224 8.132 -4.635 1.00 0.00 C ATOM 66 CG MET A 6 6.271 7.680 -3.629 1.00 0.00 C ATOM 67 SD MET A 6 6.197 5.913 -3.292 1.00 0.00 S ATOM 68 CE MET A 6 4.429 5.650 -3.150 1.00 0.00 C ATOM 0 HA MET A 6 4.681 9.976 -3.678 1.00 0.00 H new ATOM 0 HB2 MET A 6 4.719 7.255 -5.040 1.00 0.00 H new ATOM 0 HB3 MET A 6 5.722 8.627 -5.469 1.00 0.00 H new ATOM 0 HG2 MET A 6 7.262 7.932 -4.005 1.00 0.00 H new ATOM 0 HG3 MET A 6 6.134 8.229 -2.697 1.00 0.00 H new ATOM 0 HE1 MET A 6 4.235 4.605 -2.906 1.00 0.00 H new ATOM 0 HE2 MET A 6 4.029 6.287 -2.361 1.00 0.00 H new ATOM 0 HE3 MET A 6 3.947 5.897 -4.096 1.00 0.00 H new ATOM 78 N ASP A 7 3.546 10.449 -5.950 1.00 0.00 N ATOM 79 CA ASP A 7 2.669 10.918 -7.021 1.00 0.00 C ATOM 80 C ASP A 7 2.372 9.800 -8.015 1.00 0.00 C ATOM 81 O ASP A 7 1.213 9.482 -8.271 1.00 0.00 O ATOM 82 CB ASP A 7 3.311 12.102 -7.747 1.00 0.00 C ATOM 83 CG ASP A 7 2.290 13.124 -8.201 1.00 0.00 C ATOM 84 OD1 ASP A 7 1.192 12.715 -8.634 1.00 0.00 O ATOM 85 OD2 ASP A 7 2.587 14.335 -8.124 1.00 0.00 O ATOM 0 H ASP A 7 4.442 10.934 -5.895 1.00 0.00 H new ATOM 0 HA ASP A 7 1.728 11.237 -6.572 1.00 0.00 H new ATOM 0 HB2 ASP A 7 4.032 12.582 -7.086 1.00 0.00 H new ATOM 0 HB3 ASP A 7 3.865 11.737 -8.612 1.00 0.00 H new ATOM 196 N ARG A 15 -1.508 -1.855 -7.513 1.00 0.00 N ATOM 197 CA ARG A 15 -2.336 -0.684 -7.797 1.00 0.00 C ATOM 198 C ARG A 15 -3.776 -0.872 -7.318 1.00 0.00 C ATOM 199 O ARG A 15 -4.558 -1.595 -7.935 1.00 0.00 O ATOM 200 CB ARG A 15 -2.320 -0.404 -9.302 1.00 0.00 C ATOM 201 CG ARG A 15 -3.051 0.865 -9.700 1.00 0.00 C ATOM 202 CD ARG A 15 -2.350 1.569 -10.851 1.00 0.00 C ATOM 203 NE ARG A 15 -2.937 1.217 -12.143 1.00 0.00 N ATOM 204 CZ ARG A 15 -3.124 2.082 -13.139 1.00 0.00 C ATOM 205 NH1 ARG A 15 -2.769 3.355 -13.005 1.00 0.00 N ATOM 206 NH2 ARG A 15 -3.665 1.673 -14.278 1.00 0.00 N ATOM 0 HA ARG A 15 -1.919 0.163 -7.253 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -1.285 -0.336 -9.638 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.769 -1.249 -9.824 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.074 0.623 -9.988 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.112 1.536 -8.843 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -2.409 2.648 -10.707 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -1.293 1.305 -10.848 1.00 0.00 H new ATOM 0 HE ARG A 15 -3.221 0.249 -12.291 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -2.349 3.678 -12.134 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.916 4.009 -13.774 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -3.938 0.697 -14.391 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.809 2.335 -15.041 1.00 0.00 H new ATOM 220 N ASN A 16 -4.126 -0.182 -6.236 1.00 0.00 N ATOM 221 CA ASN A 16 -5.478 -0.231 -5.689 1.00 0.00 C ATOM 222 C ASN A 16 -5.950 1.187 -5.389 1.00 0.00 C ATOM 223 O ASN A 16 -5.197 2.138 -5.563 1.00 0.00 O ATOM 224 CB ASN A 16 -5.535 -1.093 -4.422 1.00 0.00 C ATOM 225 CG ASN A 16 -5.370 -2.568 -4.721 1.00 0.00 C ATOM 226 OD1 ASN A 16 -6.286 -3.365 -4.519 1.00 0.00 O ATOM 227 ND2 ASN A 16 -4.190 -2.934 -5.199 1.00 0.00 N ATOM 0 H ASN A 16 -3.487 0.421 -5.718 1.00 0.00 H new ATOM 0 HA ASN A 16 -6.138 -0.688 -6.427 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.752 -0.775 -3.733 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -6.488 -0.931 -3.918 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.010 -3.914 -5.417 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -3.462 -2.236 -5.349 1.00 0.00 H new ATOM 234 N VAL A 17 -7.190 1.339 -4.941 1.00 0.00 N ATOM 235 CA VAL A 17 -7.714 2.663 -4.620 1.00 0.00 C ATOM 236 C VAL A 17 -8.583 2.626 -3.368 1.00 0.00 C ATOM 237 O VAL A 17 -8.940 1.556 -2.882 1.00 0.00 O ATOM 238 CB VAL A 17 -8.531 3.270 -5.783 1.00 0.00 C ATOM 239 CG1 VAL A 17 -7.739 3.258 -7.075 1.00 0.00 C ATOM 240 CG2 VAL A 17 -9.851 2.546 -5.969 1.00 0.00 C ATOM 0 H VAL A 17 -7.846 0.572 -4.793 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.845 3.296 -4.442 1.00 0.00 H new ATOM 0 HB VAL A 17 -8.745 4.306 -5.520 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.340 3.691 -7.874 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -6.828 3.843 -6.949 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -7.479 2.231 -7.333 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.401 2.998 -6.795 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.662 1.496 -6.191 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.440 2.623 -5.055 1.00 0.00 H new ATOM 250 N GLY A 18 -8.928 3.804 -2.861 1.00 0.00 N ATOM 251 CA GLY A 18 -9.763 3.887 -1.679 1.00 0.00 C ATOM 252 C GLY A 18 -10.866 4.917 -1.826 1.00 0.00 C ATOM 253 O GLY A 18 -10.810 5.770 -2.713 1.00 0.00 O ATOM 0 H GLY A 18 -8.644 4.704 -3.248 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.205 2.911 -1.479 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.145 4.140 -0.817 1.00 0.00 H new ATOM 257 N ILE A 19 -11.880 4.831 -0.971 1.00 0.00 N ATOM 258 CA ILE A 19 -13.004 5.756 -1.037 1.00 0.00 C ATOM 259 C ILE A 19 -13.301 6.402 0.314 1.00 0.00 C ATOM 260 O ILE A 19 -13.630 5.718 1.285 1.00 0.00 O ATOM 261 CB ILE A 19 -14.272 5.032 -1.534 1.00 0.00 C ATOM 262 CG1 ILE A 19 -14.020 4.401 -2.904 1.00 0.00 C ATOM 263 CG2 ILE A 19 -15.462 5.980 -1.596 1.00 0.00 C ATOM 264 CD1 ILE A 19 -13.765 2.912 -2.842 1.00 0.00 C ATOM 0 H ILE A 19 -11.946 4.134 -0.229 1.00 0.00 H new ATOM 0 HA ILE A 19 -12.721 6.541 -1.738 1.00 0.00 H new ATOM 0 HB ILE A 19 -14.510 4.243 -0.821 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -14.881 4.588 -3.546 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -13.164 4.890 -3.369 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -16.340 5.439 -1.950 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -15.659 6.382 -0.602 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -15.240 6.799 -2.280 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -13.594 2.530 -3.848 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -12.886 2.719 -2.226 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -14.630 2.413 -2.406 1.00 0.00 H new ATOM 276 N CYS A 20 -13.227 7.730 0.354 1.00 0.00 N ATOM 277 CA CYS A 20 -13.529 8.478 1.565 1.00 0.00 C ATOM 278 C CYS A 20 -14.868 9.176 1.392 1.00 0.00 C ATOM 279 O CYS A 20 -14.956 10.233 0.767 1.00 0.00 O ATOM 280 CB CYS A 20 -12.432 9.501 1.863 1.00 0.00 C ATOM 281 SG CYS A 20 -12.569 10.279 3.490 1.00 0.00 S ATOM 0 H CYS A 20 -12.959 8.309 -0.442 1.00 0.00 H new ATOM 0 HA CYS A 20 -13.578 7.789 2.408 1.00 0.00 H new ATOM 0 HB2 CYS A 20 -11.462 9.010 1.788 1.00 0.00 H new ATOM 0 HB3 CYS A 20 -12.456 10.277 1.098 1.00 0.00 H new ATOM 0 HG CYS A 20 -12.540 9.364 4.413 1.00 0.00 H new ATOM 287 N LEU A 21 -15.912 8.561 1.925 1.00 0.00 N ATOM 288 CA LEU A 21 -17.255 9.107 1.802 1.00 0.00 C ATOM 289 C LEU A 21 -17.731 9.745 3.100 1.00 0.00 C ATOM 290 O LEU A 21 -17.733 9.113 4.154 1.00 0.00 O ATOM 291 CB LEU A 21 -18.230 8.005 1.375 1.00 0.00 C ATOM 292 CG LEU A 21 -19.714 8.335 1.567 1.00 0.00 C ATOM 293 CD1 LEU A 21 -20.260 9.066 0.351 1.00 0.00 C ATOM 294 CD2 LEU A 21 -20.506 7.068 1.841 1.00 0.00 C ATOM 0 H LEU A 21 -15.856 7.686 2.446 1.00 0.00 H new ATOM 0 HA LEU A 21 -17.225 9.887 1.042 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -18.058 7.778 0.323 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -18.000 7.100 1.938 1.00 0.00 H new ATOM 0 HG LEU A 21 -19.816 8.994 2.430 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -21.315 9.292 0.506 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -19.708 9.994 0.206 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -20.149 8.436 -0.532 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -21.558 7.319 1.975 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -20.400 6.384 0.999 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -20.128 6.591 2.746 1.00 0.00 H new ATOM 306 N MET A 22 -18.154 11.001 3.002 1.00 0.00 N ATOM 307 CA MET A 22 -18.656 11.723 4.162 1.00 0.00 C ATOM 308 C MET A 22 -20.059 12.257 3.901 1.00 0.00 C ATOM 309 O MET A 22 -20.498 12.346 2.754 1.00 0.00 O ATOM 310 CB MET A 22 -17.725 12.876 4.539 1.00 0.00 C ATOM 311 CG MET A 22 -17.168 13.628 3.342 1.00 0.00 C ATOM 312 SD MET A 22 -18.391 14.714 2.582 1.00 0.00 S ATOM 313 CE MET A 22 -17.504 16.269 2.590 1.00 0.00 C ATOM 0 H MET A 22 -18.159 11.537 2.134 1.00 0.00 H new ATOM 0 HA MET A 22 -18.694 11.021 4.995 1.00 0.00 H new ATOM 0 HB2 MET A 22 -18.267 13.575 5.176 1.00 0.00 H new ATOM 0 HB3 MET A 22 -16.896 12.484 5.128 1.00 0.00 H new ATOM 0 HG2 MET A 22 -16.307 14.218 3.656 1.00 0.00 H new ATOM 0 HG3 MET A 22 -16.811 12.913 2.601 1.00 0.00 H new ATOM 0 HE1 MET A 22 -17.959 16.951 1.872 1.00 0.00 H new ATOM 0 HE2 MET A 22 -17.549 16.708 3.587 1.00 0.00 H new ATOM 0 HE3 MET A 22 -16.463 16.096 2.316 1.00 0.00 H new ATOM 323 N ASN A 23 -20.757 12.616 4.975 1.00 0.00 N ATOM 324 CA ASN A 23 -22.108 13.146 4.861 1.00 0.00 C ATOM 325 C ASN A 23 -22.085 14.664 4.941 1.00 0.00 C ATOM 326 O ASN A 23 -21.064 15.263 5.278 1.00 0.00 O ATOM 327 CB ASN A 23 -23.015 12.613 5.978 1.00 0.00 C ATOM 328 CG ASN A 23 -22.618 11.250 6.488 1.00 0.00 C ATOM 329 OD1 ASN A 23 -21.527 11.202 7.241 1.00 0.00 O flip ATOM 330 ND2 ASN A 23 -23.296 10.260 6.221 1.00 0.00 N flip ATOM 0 H ASN A 23 -20.408 12.549 5.931 1.00 0.00 H new ATOM 0 HA ASN A 23 -22.503 12.824 3.897 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -23.005 13.318 6.809 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -24.040 12.568 5.610 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -24.127 10.353 5.637 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -23.028 9.345 6.584 1.00 0.00 H new ATOM 337 N ASN A 24 -23.227 15.280 4.671 1.00 0.00 N ATOM 338 CA ASN A 24 -23.358 16.730 4.755 1.00 0.00 C ATOM 339 C ASN A 24 -22.979 17.250 6.150 1.00 0.00 C ATOM 340 O ASN A 24 -22.957 18.460 6.378 1.00 0.00 O ATOM 341 CB ASN A 24 -24.788 17.154 4.415 1.00 0.00 C ATOM 342 CG ASN A 24 -25.818 16.468 5.291 1.00 0.00 C ATOM 343 OD1 ASN A 24 -26.157 15.304 5.077 1.00 0.00 O ATOM 344 ND2 ASN A 24 -26.323 17.190 6.286 1.00 0.00 N ATOM 0 H ASN A 24 -24.080 14.797 4.391 1.00 0.00 H new ATOM 0 HA ASN A 24 -22.669 17.166 4.032 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -24.880 18.234 4.528 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -24.993 16.924 3.369 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -27.020 16.783 6.909 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -26.013 18.152 6.427 1.00 0.00 H new ATOM 351 N ASP A 25 -22.700 16.336 7.085 1.00 0.00 N ATOM 352 CA ASP A 25 -22.346 16.714 8.452 1.00 0.00 C ATOM 353 C ASP A 25 -20.840 16.707 8.665 1.00 0.00 C ATOM 354 O ASP A 25 -20.361 16.908 9.780 1.00 0.00 O ATOM 355 CB ASP A 25 -22.979 15.737 9.430 1.00 0.00 C ATOM 356 CG ASP A 25 -24.357 16.177 9.890 1.00 0.00 C ATOM 357 OD1 ASP A 25 -25.347 15.836 9.209 1.00 0.00 O ATOM 358 OD2 ASP A 25 -24.443 16.859 10.931 1.00 0.00 O ATOM 0 H ASP A 25 -22.713 15.330 6.918 1.00 0.00 H new ATOM 0 HA ASP A 25 -22.716 17.725 8.622 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -23.053 14.756 8.960 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -22.329 15.626 10.298 1.00 0.00 H new ATOM 363 N LYS A 26 -20.112 16.446 7.597 1.00 0.00 N ATOM 364 CA LYS A 26 -18.658 16.375 7.650 1.00 0.00 C ATOM 365 C LYS A 26 -18.220 15.096 8.348 1.00 0.00 C ATOM 366 O LYS A 26 -17.080 14.983 8.798 1.00 0.00 O ATOM 367 CB LYS A 26 -18.063 17.598 8.357 1.00 0.00 C ATOM 368 CG LYS A 26 -18.276 18.899 7.602 1.00 0.00 C ATOM 369 CD LYS A 26 -17.376 18.985 6.379 1.00 0.00 C ATOM 370 CE LYS A 26 -18.075 19.674 5.219 1.00 0.00 C ATOM 371 NZ LYS A 26 -18.517 21.051 5.576 1.00 0.00 N ATOM 0 H LYS A 26 -20.505 16.277 6.671 1.00 0.00 H new ATOM 0 HA LYS A 26 -18.285 16.368 6.626 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -18.507 17.686 9.349 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -16.994 17.441 8.499 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -19.319 18.976 7.294 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -18.075 19.742 8.263 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -16.467 19.530 6.633 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -17.073 17.982 6.078 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -17.401 19.719 4.364 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -18.938 19.083 4.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -18.882 21.529 4.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -19.268 20.999 6.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -17.711 21.587 5.956 1.00 0.00 H new ATOM 385 N LYS A 27 -19.126 14.121 8.415 1.00 0.00 N ATOM 386 CA LYS A 27 -18.817 12.844 9.037 1.00 0.00 C ATOM 387 C LYS A 27 -18.421 11.855 7.951 1.00 0.00 C ATOM 388 O LYS A 27 -18.967 11.882 6.853 1.00 0.00 O ATOM 389 CB LYS A 27 -20.012 12.326 9.842 1.00 0.00 C ATOM 390 CG LYS A 27 -20.632 13.375 10.749 1.00 0.00 C ATOM 391 CD LYS A 27 -20.766 12.876 12.179 1.00 0.00 C ATOM 392 CE LYS A 27 -20.288 13.917 13.177 1.00 0.00 C ATOM 393 NZ LYS A 27 -20.897 13.718 14.522 1.00 0.00 N ATOM 0 H LYS A 27 -20.074 14.195 8.047 1.00 0.00 H new ATOM 0 HA LYS A 27 -17.988 12.968 9.734 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -20.772 11.958 9.153 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -19.692 11.477 10.447 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -20.019 14.276 10.734 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -21.615 13.651 10.367 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -21.807 12.626 12.383 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -20.188 11.960 12.302 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -19.202 13.869 13.259 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -20.536 14.913 12.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -20.545 14.448 15.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -21.932 13.789 14.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -20.639 12.778 14.884 1.00 0.00 H new ATOM 407 N ILE A 28 -17.445 11.013 8.253 1.00 0.00 N ATOM 408 CA ILE A 28 -16.950 10.050 7.281 1.00 0.00 C ATOM 409 C ILE A 28 -17.479 8.649 7.525 1.00 0.00 C ATOM 410 O ILE A 28 -17.682 8.221 8.661 1.00 0.00 O ATOM 411 CB ILE A 28 -15.412 9.997 7.256 1.00 0.00 C ATOM 412 CG1 ILE A 28 -14.831 11.406 7.139 1.00 0.00 C ATOM 413 CG2 ILE A 28 -14.929 9.125 6.106 1.00 0.00 C ATOM 414 CD1 ILE A 28 -14.895 12.193 8.427 1.00 0.00 C ATOM 0 H ILE A 28 -16.981 10.977 9.161 1.00 0.00 H new ATOM 0 HA ILE A 28 -17.318 10.401 6.317 1.00 0.00 H new ATOM 0 HB ILE A 28 -15.066 9.558 8.192 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.792 11.336 6.816 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -15.370 11.950 6.363 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -13.839 9.098 6.103 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.317 8.114 6.229 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.285 9.538 5.162 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -14.466 13.183 8.270 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -15.934 12.294 8.741 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.332 11.671 9.201 1.00 0.00 H new ATOM 426 N PHE A 29 -17.686 7.948 6.425 1.00 0.00 N ATOM 427 CA PHE A 29 -18.182 6.587 6.444 1.00 0.00 C ATOM 428 C PHE A 29 -17.088 5.618 6.885 1.00 0.00 C ATOM 429 O PHE A 29 -15.937 5.743 6.475 1.00 0.00 O ATOM 430 CB PHE A 29 -18.674 6.225 5.042 1.00 0.00 C ATOM 431 CG PHE A 29 -19.104 4.798 4.891 1.00 0.00 C ATOM 432 CD1 PHE A 29 -20.352 4.396 5.324 1.00 0.00 C ATOM 433 CD2 PHE A 29 -18.267 3.864 4.305 1.00 0.00 C ATOM 434 CE1 PHE A 29 -20.759 3.089 5.180 1.00 0.00 C ATOM 435 CE2 PHE A 29 -18.671 2.551 4.154 1.00 0.00 C ATOM 436 CZ PHE A 29 -19.923 2.165 4.593 1.00 0.00 C ATOM 0 H PHE A 29 -17.513 8.311 5.488 1.00 0.00 H new ATOM 0 HA PHE A 29 -19.003 6.511 7.157 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -19.511 6.874 4.784 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -17.879 6.431 4.326 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -21.016 5.115 5.781 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.288 4.165 3.962 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -21.736 2.787 5.528 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.011 1.830 3.695 1.00 0.00 H new ATOM 0 HZ PHE A 29 -20.245 1.141 4.476 1.00 0.00 H new ATOM 446 N ALA A 30 -17.455 4.651 7.718 1.00 0.00 N ATOM 447 CA ALA A 30 -16.505 3.658 8.208 1.00 0.00 C ATOM 448 C ALA A 30 -17.165 2.292 8.259 1.00 0.00 C ATOM 449 O ALA A 30 -18.362 2.185 8.501 1.00 0.00 O ATOM 450 CB ALA A 30 -15.985 4.035 9.589 1.00 0.00 C ATOM 0 H ALA A 30 -18.405 4.533 8.069 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.659 3.626 7.521 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.279 3.278 9.931 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -15.484 5.002 9.538 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.819 4.095 10.288 1.00 0.00 H new ATOM 456 N ALA A 31 -16.383 1.251 8.020 1.00 0.00 N ATOM 457 CA ALA A 31 -16.907 -0.106 8.032 1.00 0.00 C ATOM 458 C ALA A 31 -15.950 -1.055 8.739 1.00 0.00 C ATOM 459 O ALA A 31 -14.736 -0.982 8.554 1.00 0.00 O ATOM 460 CB ALA A 31 -17.175 -0.571 6.612 1.00 0.00 C ATOM 0 H ALA A 31 -15.386 1.319 7.816 1.00 0.00 H new ATOM 0 HA ALA A 31 -17.846 -0.109 8.586 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -17.567 -1.588 6.630 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -17.904 0.091 6.144 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -16.247 -0.550 6.041 1.00 0.00 H new ATOM 466 N SER A 32 -16.504 -1.945 9.554 1.00 0.00 N ATOM 467 CA SER A 32 -15.698 -2.903 10.294 1.00 0.00 C ATOM 468 C SER A 32 -15.701 -4.270 9.620 1.00 0.00 C ATOM 469 O SER A 32 -16.709 -4.692 9.054 1.00 0.00 O ATOM 470 CB SER A 32 -16.206 -3.026 11.730 1.00 0.00 C ATOM 471 OG SER A 32 -17.493 -3.617 11.766 1.00 0.00 O ATOM 0 H SER A 32 -17.508 -2.022 9.718 1.00 0.00 H new ATOM 0 HA SER A 32 -14.672 -2.535 10.307 1.00 0.00 H new ATOM 0 HB2 SER A 32 -15.510 -3.627 12.315 1.00 0.00 H new ATOM 0 HB3 SER A 32 -16.242 -2.039 12.192 1.00 0.00 H new ATOM 0 HG SER A 32 -18.117 -3.075 11.240 1.00 0.00 H new ATOM 477 N ARG A 33 -14.568 -4.964 9.694 1.00 0.00 N ATOM 478 CA ARG A 33 -14.437 -6.288 9.101 1.00 0.00 C ATOM 479 C ARG A 33 -15.263 -7.309 9.873 1.00 0.00 C ATOM 480 O ARG A 33 -15.122 -7.435 11.088 1.00 0.00 O ATOM 481 CB ARG A 33 -12.973 -6.725 9.094 1.00 0.00 C ATOM 482 CG ARG A 33 -12.027 -5.720 8.453 1.00 0.00 C ATOM 483 CD ARG A 33 -10.625 -5.815 9.042 1.00 0.00 C ATOM 484 NE ARG A 33 -10.193 -7.204 9.220 1.00 0.00 N ATOM 485 CZ ARG A 33 -8.987 -7.662 8.882 1.00 0.00 C ATOM 486 NH1 ARG A 33 -8.085 -6.856 8.333 1.00 0.00 N ATOM 487 NH2 ARG A 33 -8.680 -8.935 9.096 1.00 0.00 N ATOM 0 H ARG A 33 -13.726 -4.628 10.161 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.804 -6.235 8.076 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.654 -6.904 10.121 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.891 -7.674 8.564 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.983 -5.895 7.378 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.415 -4.712 8.596 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.922 -5.299 8.388 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.601 -5.303 10.004 1.00 0.00 H new ATOM 0 HE ARG A 33 -10.857 -7.862 9.628 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -8.312 -5.876 8.166 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.166 -7.217 8.079 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -9.366 -9.561 9.518 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.758 -9.288 8.838 1.00 0.00 H new ATOM 501 N LEU A 34 -16.123 -8.037 9.165 1.00 0.00 N ATOM 502 CA LEU A 34 -16.967 -9.053 9.796 1.00 0.00 C ATOM 503 C LEU A 34 -16.162 -9.873 10.795 1.00 0.00 C ATOM 504 O LEU A 34 -16.668 -10.290 11.837 1.00 0.00 O ATOM 505 CB LEU A 34 -17.571 -9.977 8.742 1.00 0.00 C ATOM 506 CG LEU A 34 -18.735 -9.370 7.965 1.00 0.00 C ATOM 507 CD1 LEU A 34 -18.362 -9.156 6.511 1.00 0.00 C ATOM 508 CD2 LEU A 34 -19.983 -10.228 8.090 1.00 0.00 C ATOM 0 H LEU A 34 -16.255 -7.944 8.158 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.772 -8.542 10.324 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -16.790 -10.264 8.038 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -17.912 -10.890 9.229 1.00 0.00 H new ATOM 0 HG LEU A 34 -18.958 -8.396 8.401 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -19.208 -8.722 5.978 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.510 -8.479 6.450 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.100 -10.112 6.058 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -20.797 -9.771 7.526 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.781 -11.223 7.694 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -20.268 -10.306 9.139 1.00 0.00 H new ATOM 520 N ASP A 35 -14.899 -10.089 10.459 1.00 0.00 N ATOM 521 CA ASP A 35 -13.992 -10.848 11.309 1.00 0.00 C ATOM 522 C ASP A 35 -13.598 -10.040 12.540 1.00 0.00 C ATOM 523 O ASP A 35 -13.534 -10.569 13.649 1.00 0.00 O ATOM 524 CB ASP A 35 -12.741 -11.246 10.521 1.00 0.00 C ATOM 525 CG ASP A 35 -12.135 -12.546 11.014 1.00 0.00 C ATOM 526 OD1 ASP A 35 -11.785 -12.621 12.209 1.00 0.00 O ATOM 527 OD2 ASP A 35 -12.011 -13.487 10.202 1.00 0.00 O ATOM 0 H ASP A 35 -14.476 -9.746 9.597 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.508 -11.749 11.640 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.996 -11.345 9.466 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -11.999 -10.451 10.597 1.00 0.00 H new ATOM 532 N ILE A 36 -13.336 -8.751 12.336 1.00 0.00 N ATOM 533 CA ILE A 36 -12.948 -7.866 13.427 1.00 0.00 C ATOM 534 C ILE A 36 -13.931 -6.705 13.568 1.00 0.00 C ATOM 535 O ILE A 36 -13.916 -5.769 12.768 1.00 0.00 O ATOM 536 CB ILE A 36 -11.532 -7.298 13.219 1.00 0.00 C ATOM 537 CG1 ILE A 36 -10.572 -8.404 12.774 1.00 0.00 C ATOM 538 CG2 ILE A 36 -11.038 -6.637 14.497 1.00 0.00 C ATOM 539 CD1 ILE A 36 -9.213 -7.890 12.351 1.00 0.00 C ATOM 0 H ILE A 36 -13.386 -8.298 11.424 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.959 -8.466 14.337 1.00 0.00 H new ATOM 0 HB ILE A 36 -11.569 -6.544 12.433 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -10.445 -9.114 13.591 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -11.020 -8.950 11.944 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.036 -6.239 14.337 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -11.711 -5.825 14.770 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.012 -7.373 15.301 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.585 -8.728 12.049 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -9.329 -7.202 11.513 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.745 -7.369 13.186 1.00 0.00 H new ATOM 551 N PRO A 37 -14.806 -6.752 14.589 1.00 0.00 N ATOM 552 CA PRO A 37 -15.801 -5.701 14.830 1.00 0.00 C ATOM 553 C PRO A 37 -15.167 -4.373 15.238 1.00 0.00 C ATOM 554 O PRO A 37 -15.779 -3.315 15.097 1.00 0.00 O ATOM 555 CB PRO A 37 -16.654 -6.255 15.982 1.00 0.00 C ATOM 556 CG PRO A 37 -16.303 -7.702 16.085 1.00 0.00 C ATOM 557 CD PRO A 37 -14.897 -7.829 15.582 1.00 0.00 C ATOM 0 HA PRO A 37 -16.371 -5.482 13.927 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.439 -5.733 16.914 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.717 -6.123 15.780 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.380 -8.049 17.115 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -16.985 -8.311 15.492 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.168 -7.703 16.383 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -14.714 -8.807 15.136 1.00 0.00 H new ATOM 565 N ASP A 38 -13.940 -4.434 15.744 1.00 0.00 N ATOM 566 CA ASP A 38 -13.228 -3.232 16.172 1.00 0.00 C ATOM 567 C ASP A 38 -12.368 -2.661 15.046 1.00 0.00 C ATOM 568 O ASP A 38 -11.761 -1.601 15.198 1.00 0.00 O ATOM 569 CB ASP A 38 -12.353 -3.539 17.388 1.00 0.00 C ATOM 570 CG ASP A 38 -13.158 -4.030 18.574 1.00 0.00 C ATOM 571 OD1 ASP A 38 -13.667 -5.168 18.515 1.00 0.00 O ATOM 572 OD2 ASP A 38 -13.279 -3.276 19.562 1.00 0.00 O ATOM 0 H ASP A 38 -13.417 -5.301 15.868 1.00 0.00 H new ATOM 0 HA ASP A 38 -13.974 -2.484 16.442 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -11.613 -4.293 17.118 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.804 -2.641 17.672 1.00 0.00 H new ATOM 577 N ALA A 39 -12.310 -3.368 13.920 1.00 0.00 N ATOM 578 CA ALA A 39 -11.516 -2.923 12.781 1.00 0.00 C ATOM 579 C ALA A 39 -12.351 -2.095 11.813 1.00 0.00 C ATOM 580 O ALA A 39 -12.970 -2.635 10.903 1.00 0.00 O ATOM 581 CB ALA A 39 -10.915 -4.122 12.064 1.00 0.00 C ATOM 0 H ALA A 39 -12.803 -4.249 13.773 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.712 -2.289 13.156 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.324 -3.779 11.215 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -10.275 -4.674 12.752 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -11.715 -4.773 11.710 1.00 0.00 H new ATOM 587 N TRP A 40 -12.340 -0.781 12.005 1.00 0.00 N ATOM 588 CA TRP A 40 -13.084 0.128 11.137 1.00 0.00 C ATOM 589 C TRP A 40 -12.224 0.554 9.957 1.00 0.00 C ATOM 590 O TRP A 40 -11.011 0.705 10.082 1.00 0.00 O ATOM 591 CB TRP A 40 -13.560 1.348 11.923 1.00 0.00 C ATOM 592 CG TRP A 40 -14.706 1.026 12.832 1.00 0.00 C ATOM 593 CD1 TRP A 40 -14.645 0.567 14.115 1.00 0.00 C ATOM 594 CD2 TRP A 40 -16.089 1.125 12.507 1.00 0.00 C ATOM 595 NE1 TRP A 40 -15.919 0.381 14.609 1.00 0.00 N ATOM 596 CE2 TRP A 40 -16.823 0.722 13.636 1.00 0.00 C ATOM 597 CE3 TRP A 40 -16.774 1.520 11.367 1.00 0.00 C ATOM 598 CZ2 TRP A 40 -18.219 0.708 13.650 1.00 0.00 C ATOM 599 CZ3 TRP A 40 -18.148 1.506 11.379 1.00 0.00 C ATOM 600 CH2 TRP A 40 -18.861 1.105 12.514 1.00 0.00 C ATOM 0 H TRP A 40 -11.824 -0.320 12.754 1.00 0.00 H new ATOM 0 HA TRP A 40 -13.960 -0.396 10.755 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -12.732 1.744 12.511 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -13.860 2.132 11.227 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -13.734 0.377 14.663 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -16.151 0.045 15.544 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -16.236 1.833 10.484 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -18.769 0.395 14.525 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -18.688 1.811 10.495 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -19.941 1.110 12.490 1.00 0.00 H new ATOM 611 N GLN A 41 -12.849 0.726 8.802 1.00 0.00 N ATOM 612 CA GLN A 41 -12.116 1.122 7.610 1.00 0.00 C ATOM 613 C GLN A 41 -13.040 1.745 6.574 1.00 0.00 C ATOM 614 O GLN A 41 -14.258 1.585 6.627 1.00 0.00 O ATOM 615 CB GLN A 41 -11.373 -0.072 6.990 1.00 0.00 C ATOM 616 CG GLN A 41 -11.327 -1.315 7.868 1.00 0.00 C ATOM 617 CD GLN A 41 -11.014 -2.569 7.077 1.00 0.00 C ATOM 618 OE1 GLN A 41 -9.898 -3.209 7.405 1.00 0.00 O flip ATOM 619 NE2 GLN A 41 -11.764 -2.957 6.183 1.00 0.00 N flip ATOM 0 H GLN A 41 -13.852 0.599 8.665 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.384 1.868 7.919 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.850 -0.329 6.044 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.352 0.232 6.760 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.574 -1.181 8.644 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -12.286 -1.436 8.372 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -12.612 -2.433 5.965 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.539 -3.803 5.659 1.00 0.00 H new ATOM 628 N MET A 42 -12.439 2.454 5.634 1.00 0.00 N ATOM 629 CA MET A 42 -13.175 3.111 4.568 1.00 0.00 C ATOM 630 C MET A 42 -13.157 2.261 3.300 1.00 0.00 C ATOM 631 O MET A 42 -12.196 1.531 3.051 1.00 0.00 O ATOM 632 CB MET A 42 -12.549 4.475 4.289 1.00 0.00 C ATOM 633 CG MET A 42 -13.481 5.647 4.533 1.00 0.00 C ATOM 634 SD MET A 42 -12.654 7.038 5.331 1.00 0.00 S ATOM 635 CE MET A 42 -11.098 7.083 4.438 1.00 0.00 C ATOM 0 H MET A 42 -11.429 2.590 5.588 1.00 0.00 H new ATOM 0 HA MET A 42 -14.211 3.240 4.880 1.00 0.00 H new ATOM 0 HB2 MET A 42 -11.665 4.592 4.915 1.00 0.00 H new ATOM 0 HB3 MET A 42 -12.212 4.503 3.253 1.00 0.00 H new ATOM 0 HG2 MET A 42 -13.901 5.976 3.583 1.00 0.00 H new ATOM 0 HG3 MET A 42 -14.315 5.320 5.154 1.00 0.00 H new ATOM 0 HE1 MET A 42 -10.488 7.906 4.811 1.00 0.00 H new ATOM 0 HE2 MET A 42 -10.567 6.142 4.585 1.00 0.00 H new ATOM 0 HE3 MET A 42 -11.292 7.228 3.375 1.00 0.00 H new ATOM 645 N PRO A 43 -14.212 2.341 2.473 1.00 0.00 N ATOM 646 CA PRO A 43 -14.296 1.576 1.228 1.00 0.00 C ATOM 647 C PRO A 43 -13.019 1.692 0.397 1.00 0.00 C ATOM 648 O PRO A 43 -12.258 2.648 0.540 1.00 0.00 O ATOM 649 CB PRO A 43 -15.485 2.201 0.482 1.00 0.00 C ATOM 650 CG PRO A 43 -15.882 3.407 1.271 1.00 0.00 C ATOM 651 CD PRO A 43 -15.397 3.181 2.674 1.00 0.00 C ATOM 0 HA PRO A 43 -14.422 0.510 1.418 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.206 2.475 -0.535 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -16.312 1.495 0.406 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -15.439 4.309 0.849 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -16.963 3.544 1.252 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -15.149 4.118 3.173 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.148 2.682 3.287 1.00 0.00 H new ATOM 659 N GLN A 44 -12.789 0.707 -0.466 1.00 0.00 N ATOM 660 CA GLN A 44 -11.603 0.691 -1.315 1.00 0.00 C ATOM 661 C GLN A 44 -11.639 -0.502 -2.265 1.00 0.00 C ATOM 662 O GLN A 44 -12.584 -1.291 -2.250 1.00 0.00 O ATOM 663 CB GLN A 44 -10.339 0.634 -0.456 1.00 0.00 C ATOM 664 CG GLN A 44 -10.289 -0.566 0.474 1.00 0.00 C ATOM 665 CD GLN A 44 -9.058 -0.563 1.357 1.00 0.00 C ATOM 666 OE1 GLN A 44 -9.181 0.027 2.539 1.00 0.00 O flip ATOM 667 NE2 GLN A 44 -8.009 -1.086 0.982 1.00 0.00 N flip ATOM 0 H GLN A 44 -13.410 -0.092 -0.596 1.00 0.00 H new ATOM 0 HA GLN A 44 -11.591 1.607 -1.905 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -9.467 0.613 -1.109 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -10.272 1.546 0.137 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -11.181 -0.574 1.100 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -10.306 -1.481 -0.118 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -7.959 -1.529 0.064 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -7.189 -1.077 1.589 1.00 0.00 H new ATOM 676 N GLY A 45 -10.607 -0.628 -3.094 1.00 0.00 N ATOM 677 CA GLY A 45 -10.547 -1.730 -4.040 1.00 0.00 C ATOM 678 C GLY A 45 -9.421 -1.566 -5.038 1.00 0.00 C ATOM 679 O GLY A 45 -8.950 -0.454 -5.269 1.00 0.00 O ATOM 0 H GLY A 45 -9.813 0.011 -3.128 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.416 -2.666 -3.497 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.495 -1.801 -4.573 1.00 0.00 H new ATOM 683 N GLY A 46 -8.979 -2.674 -5.625 1.00 0.00 N ATOM 684 CA GLY A 46 -7.894 -2.613 -6.586 1.00 0.00 C ATOM 685 C GLY A 46 -8.349 -2.240 -7.982 1.00 0.00 C ATOM 686 O GLY A 46 -9.365 -2.733 -8.469 1.00 0.00 O ATOM 0 H GLY A 46 -9.351 -3.608 -5.453 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -7.157 -1.886 -6.245 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.394 -3.581 -6.621 1.00 0.00 H new ATOM 690 N ILE A 47 -7.583 -1.365 -8.624 1.00 0.00 N ATOM 691 CA ILE A 47 -7.891 -0.915 -9.976 1.00 0.00 C ATOM 692 C ILE A 47 -7.683 -2.039 -10.986 1.00 0.00 C ATOM 693 O ILE A 47 -6.746 -2.827 -10.868 1.00 0.00 O ATOM 694 CB ILE A 47 -7.013 0.284 -10.381 1.00 0.00 C ATOM 695 CG1 ILE A 47 -7.062 1.373 -9.310 1.00 0.00 C ATOM 696 CG2 ILE A 47 -7.459 0.841 -11.723 1.00 0.00 C ATOM 697 CD1 ILE A 47 -6.072 2.491 -9.545 1.00 0.00 C ATOM 0 H ILE A 47 -6.739 -0.951 -8.227 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.938 -0.610 -9.979 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.983 -0.062 -10.474 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -8.068 1.791 -9.273 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.867 0.924 -8.336 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.828 1.687 -11.994 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.373 0.066 -12.485 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -8.496 1.169 -11.654 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.161 3.229 -8.748 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.060 2.085 -9.553 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -6.280 2.966 -10.504 1.00 0.00 H new ATOM 709 N ASP A 48 -8.558 -2.101 -11.984 1.00 0.00 N ATOM 710 CA ASP A 48 -8.465 -3.124 -13.019 1.00 0.00 C ATOM 711 C ASP A 48 -7.243 -2.893 -13.904 1.00 0.00 C ATOM 712 O ASP A 48 -6.433 -2.003 -13.644 1.00 0.00 O ATOM 713 CB ASP A 48 -9.734 -3.131 -13.872 1.00 0.00 C ATOM 714 CG ASP A 48 -10.997 -3.111 -13.031 1.00 0.00 C ATOM 715 OD1 ASP A 48 -11.360 -2.025 -12.533 1.00 0.00 O ATOM 716 OD2 ASP A 48 -11.619 -4.182 -12.869 1.00 0.00 O ATOM 0 H ASP A 48 -9.339 -1.455 -12.098 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.359 -4.093 -12.530 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -9.728 -2.265 -14.534 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.737 -4.017 -14.506 1.00 0.00 H new ATOM 721 N GLU A 49 -7.124 -3.699 -14.956 1.00 0.00 N ATOM 722 CA GLU A 49 -6.006 -3.586 -15.891 1.00 0.00 C ATOM 723 C GLU A 49 -5.799 -2.135 -16.331 1.00 0.00 C ATOM 724 O GLU A 49 -4.934 -1.436 -15.807 1.00 0.00 O ATOM 725 CB GLU A 49 -6.243 -4.479 -17.112 1.00 0.00 C ATOM 726 CG GLU A 49 -5.571 -5.838 -17.010 1.00 0.00 C ATOM 727 CD GLU A 49 -6.023 -6.797 -18.095 1.00 0.00 C ATOM 728 OE1 GLU A 49 -7.072 -7.450 -17.909 1.00 0.00 O ATOM 729 OE2 GLU A 49 -5.330 -6.894 -19.130 1.00 0.00 O ATOM 0 H GLU A 49 -7.789 -4.439 -15.183 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.103 -3.917 -15.378 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.315 -4.622 -17.245 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -5.877 -3.968 -18.002 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.490 -5.710 -17.071 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.786 -6.273 -16.034 1.00 0.00 H new ATOM 736 N GLY A 50 -6.602 -1.693 -17.297 1.00 0.00 N ATOM 737 CA GLY A 50 -6.491 -0.333 -17.789 1.00 0.00 C ATOM 738 C GLY A 50 -7.672 0.527 -17.382 1.00 0.00 C ATOM 739 O GLY A 50 -8.330 1.131 -18.231 1.00 0.00 O ATOM 0 H GLY A 50 -7.326 -2.253 -17.746 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.572 0.114 -17.410 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -6.413 -0.348 -18.876 1.00 0.00 H new ATOM 743 N GLU A 51 -7.941 0.581 -16.084 1.00 0.00 N ATOM 744 CA GLU A 51 -9.052 1.370 -15.564 1.00 0.00 C ATOM 745 C GLU A 51 -8.548 2.506 -14.681 1.00 0.00 C ATOM 746 O GLU A 51 -7.535 2.372 -13.995 1.00 0.00 O ATOM 747 CB GLU A 51 -10.010 0.479 -14.770 1.00 0.00 C ATOM 748 CG GLU A 51 -11.258 1.202 -14.289 1.00 0.00 C ATOM 749 CD GLU A 51 -12.173 1.605 -15.428 1.00 0.00 C ATOM 750 OE1 GLU A 51 -12.741 0.705 -16.082 1.00 0.00 O ATOM 751 OE2 GLU A 51 -12.323 2.823 -15.667 1.00 0.00 O ATOM 0 H GLU A 51 -7.405 0.087 -15.370 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.585 1.802 -16.411 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.307 -0.366 -15.392 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.482 0.070 -13.908 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -11.804 0.558 -13.600 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.966 2.091 -13.730 1.00 0.00 H new ATOM 758 N ASP A 52 -9.264 3.624 -14.699 1.00 0.00 N ATOM 759 CA ASP A 52 -8.892 4.780 -13.893 1.00 0.00 C ATOM 760 C ASP A 52 -9.123 4.494 -12.410 1.00 0.00 C ATOM 761 O ASP A 52 -9.821 3.543 -12.059 1.00 0.00 O ATOM 762 CB ASP A 52 -9.696 6.010 -14.324 1.00 0.00 C ATOM 763 CG ASP A 52 -9.250 6.549 -15.668 1.00 0.00 C ATOM 764 OD1 ASP A 52 -9.248 5.773 -16.648 1.00 0.00 O ATOM 765 OD2 ASP A 52 -8.903 7.747 -15.744 1.00 0.00 O ATOM 0 H ASP A 52 -10.104 3.754 -15.262 1.00 0.00 H new ATOM 0 HA ASP A 52 -7.832 4.982 -14.048 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.754 5.751 -14.372 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.593 6.791 -13.570 1.00 0.00 H new ATOM 770 N PRO A 53 -8.542 5.313 -11.519 1.00 0.00 N ATOM 771 CA PRO A 53 -8.690 5.143 -10.073 1.00 0.00 C ATOM 772 C PRO A 53 -10.060 5.584 -9.597 1.00 0.00 C ATOM 773 O PRO A 53 -10.727 4.891 -8.832 1.00 0.00 O ATOM 774 CB PRO A 53 -7.613 6.062 -9.480 1.00 0.00 C ATOM 775 CG PRO A 53 -6.803 6.552 -10.639 1.00 0.00 C ATOM 776 CD PRO A 53 -7.700 6.470 -11.836 1.00 0.00 C ATOM 0 HA PRO A 53 -8.585 4.100 -9.775 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.065 6.894 -8.940 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.988 5.522 -8.768 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.466 7.575 -10.474 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -5.911 5.941 -10.778 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -8.289 7.378 -11.965 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -7.136 6.322 -12.757 1.00 0.00 H new ATOM 784 N ARG A 54 -10.465 6.751 -10.069 1.00 0.00 N ATOM 785 CA ARG A 54 -11.760 7.330 -9.719 1.00 0.00 C ATOM 786 C ARG A 54 -12.877 6.333 -9.955 1.00 0.00 C ATOM 787 O ARG A 54 -13.753 6.146 -9.112 1.00 0.00 O ATOM 788 CB ARG A 54 -12.016 8.568 -10.573 1.00 0.00 C ATOM 789 CG ARG A 54 -13.195 9.422 -10.118 1.00 0.00 C ATOM 790 CD ARG A 54 -13.133 9.766 -8.638 1.00 0.00 C ATOM 791 NE ARG A 54 -12.844 11.186 -8.418 1.00 0.00 N ATOM 792 CZ ARG A 54 -13.544 12.188 -8.952 1.00 0.00 C ATOM 793 NH1 ARG A 54 -14.604 11.947 -9.713 1.00 0.00 N ATOM 794 NH2 ARG A 54 -13.187 13.443 -8.707 1.00 0.00 N ATOM 0 H ARG A 54 -9.911 7.326 -10.704 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.740 7.598 -8.663 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.117 9.184 -10.574 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.188 8.254 -11.602 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.217 10.343 -10.700 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -14.124 8.891 -10.325 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -14.082 9.511 -8.166 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.365 9.161 -8.157 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.055 11.424 -7.817 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.893 10.986 -9.896 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -15.130 12.723 -10.115 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -12.381 13.637 -8.113 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -13.719 14.213 -9.113 1.00 0.00 H new ATOM 808 N ASN A 55 -12.832 5.690 -11.106 1.00 0.00 N ATOM 809 CA ASN A 55 -13.842 4.701 -11.452 1.00 0.00 C ATOM 810 C ASN A 55 -13.762 3.513 -10.508 1.00 0.00 C ATOM 811 O ASN A 55 -14.771 3.072 -9.965 1.00 0.00 O ATOM 812 CB ASN A 55 -13.681 4.222 -12.891 1.00 0.00 C ATOM 813 CG ASN A 55 -13.684 5.361 -13.891 1.00 0.00 C ATOM 814 OD1 ASN A 55 -12.869 6.278 -13.808 1.00 0.00 O ATOM 815 ND2 ASN A 55 -14.606 5.303 -14.847 1.00 0.00 N ATOM 0 H ASN A 55 -12.113 5.831 -11.815 1.00 0.00 H new ATOM 0 HA ASN A 55 -14.818 5.178 -11.355 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.748 3.666 -12.982 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -14.488 3.531 -13.132 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -14.657 6.039 -15.551 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -15.262 4.522 -14.876 1.00 0.00 H new ATOM 822 N ALA A 56 -12.551 3.007 -10.306 1.00 0.00 N ATOM 823 CA ALA A 56 -12.348 1.876 -9.414 1.00 0.00 C ATOM 824 C ALA A 56 -12.784 2.244 -8.007 1.00 0.00 C ATOM 825 O ALA A 56 -13.461 1.468 -7.331 1.00 0.00 O ATOM 826 CB ALA A 56 -10.891 1.440 -9.424 1.00 0.00 C ATOM 0 H ALA A 56 -11.701 3.360 -10.745 1.00 0.00 H new ATOM 0 HA ALA A 56 -12.954 1.040 -9.764 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -10.760 0.593 -8.751 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -10.606 1.148 -10.435 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.262 2.267 -9.094 1.00 0.00 H new ATOM 832 N ALA A 57 -12.415 3.445 -7.581 1.00 0.00 N ATOM 833 CA ALA A 57 -12.796 3.926 -6.268 1.00 0.00 C ATOM 834 C ALA A 57 -14.312 3.952 -6.146 1.00 0.00 C ATOM 835 O ALA A 57 -14.893 3.302 -5.278 1.00 0.00 O ATOM 836 CB ALA A 57 -12.213 5.308 -6.020 1.00 0.00 C ATOM 0 H ALA A 57 -11.854 4.099 -8.127 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.397 3.249 -5.513 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -12.508 5.655 -5.030 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.126 5.260 -6.078 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.587 6.001 -6.774 1.00 0.00 H new ATOM 842 N ILE A 58 -14.942 4.700 -7.043 1.00 0.00 N ATOM 843 CA ILE A 58 -16.389 4.814 -7.063 1.00 0.00 C ATOM 844 C ILE A 58 -17.056 3.443 -7.196 1.00 0.00 C ATOM 845 O ILE A 58 -17.964 3.114 -6.433 1.00 0.00 O ATOM 846 CB ILE A 58 -16.862 5.727 -8.213 1.00 0.00 C ATOM 847 CG1 ILE A 58 -16.199 7.107 -8.116 1.00 0.00 C ATOM 848 CG2 ILE A 58 -18.379 5.866 -8.195 1.00 0.00 C ATOM 849 CD1 ILE A 58 -16.127 7.830 -9.441 1.00 0.00 C ATOM 0 H ILE A 58 -14.468 5.238 -7.768 1.00 0.00 H new ATOM 0 HA ILE A 58 -16.684 5.258 -6.112 1.00 0.00 H new ATOM 0 HB ILE A 58 -16.567 5.268 -9.157 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -16.754 7.720 -7.405 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -15.191 6.991 -7.718 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -18.695 6.513 -9.013 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -18.836 4.883 -8.313 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -18.693 6.301 -7.246 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -15.647 8.799 -9.301 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -15.547 7.237 -10.148 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -17.134 7.977 -9.831 1.00 0.00 H new ATOM 861 N ARG A 59 -16.607 2.644 -8.167 1.00 0.00 N ATOM 862 CA ARG A 59 -17.182 1.316 -8.376 1.00 0.00 C ATOM 863 C ARG A 59 -16.932 0.409 -7.179 1.00 0.00 C ATOM 864 O ARG A 59 -17.876 -0.018 -6.514 1.00 0.00 O ATOM 865 CB ARG A 59 -16.619 0.677 -9.649 1.00 0.00 C ATOM 866 CG ARG A 59 -17.673 -0.016 -10.496 1.00 0.00 C ATOM 867 CD ARG A 59 -17.077 -0.582 -11.777 1.00 0.00 C ATOM 868 NE ARG A 59 -16.597 -1.950 -11.601 1.00 0.00 N ATOM 869 CZ ARG A 59 -15.674 -2.519 -12.373 1.00 0.00 C ATOM 870 NH1 ARG A 59 -15.129 -1.844 -13.378 1.00 0.00 N ATOM 871 NH2 ARG A 59 -15.293 -3.767 -12.139 1.00 0.00 N ATOM 0 H ARG A 59 -15.857 2.890 -8.813 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.259 1.438 -8.490 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -16.132 1.447 -10.247 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -15.852 -0.047 -9.374 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -18.132 -0.820 -9.921 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -18.465 0.691 -10.743 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -17.828 -0.560 -12.566 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -16.253 0.052 -12.104 1.00 0.00 H new ATOM 0 HE ARG A 59 -16.993 -2.503 -10.841 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -15.417 -0.883 -13.563 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -14.422 -2.286 -13.966 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -15.707 -4.291 -11.368 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -14.586 -4.204 -12.730 1.00 0.00 H new ATOM 885 N GLU A 60 -15.661 0.117 -6.903 1.00 0.00 N ATOM 886 CA GLU A 60 -15.305 -0.742 -5.774 1.00 0.00 C ATOM 887 C GLU A 60 -16.149 -0.389 -4.555 1.00 0.00 C ATOM 888 O GLU A 60 -16.670 -1.268 -3.870 1.00 0.00 O ATOM 889 CB GLU A 60 -13.818 -0.608 -5.450 1.00 0.00 C ATOM 890 CG GLU A 60 -12.915 -1.213 -6.513 1.00 0.00 C ATOM 891 CD GLU A 60 -13.034 -2.722 -6.586 1.00 0.00 C ATOM 892 OE1 GLU A 60 -12.447 -3.408 -5.722 1.00 0.00 O ATOM 893 OE2 GLU A 60 -13.714 -3.219 -7.509 1.00 0.00 O ATOM 0 H GLU A 60 -14.866 0.460 -7.442 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.506 -1.778 -6.048 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -13.572 0.447 -5.332 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.616 -1.091 -4.494 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.165 -0.785 -7.484 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.880 -0.943 -6.302 1.00 0.00 H new ATOM 900 N LEU A 61 -16.301 0.911 -4.312 1.00 0.00 N ATOM 901 CA LEU A 61 -17.109 1.392 -3.197 1.00 0.00 C ATOM 902 C LEU A 61 -18.490 0.746 -3.235 1.00 0.00 C ATOM 903 O LEU A 61 -18.964 0.202 -2.239 1.00 0.00 O ATOM 904 CB LEU A 61 -17.242 2.921 -3.255 1.00 0.00 C ATOM 905 CG LEU A 61 -18.410 3.512 -2.459 1.00 0.00 C ATOM 906 CD1 LEU A 61 -18.239 3.228 -0.976 1.00 0.00 C ATOM 907 CD2 LEU A 61 -18.525 5.010 -2.711 1.00 0.00 C ATOM 0 H LEU A 61 -15.875 1.649 -4.873 1.00 0.00 H new ATOM 0 HA LEU A 61 -16.615 1.119 -2.265 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -16.315 3.363 -2.889 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -17.348 3.220 -4.298 1.00 0.00 H new ATOM 0 HG LEU A 61 -19.332 3.038 -2.795 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -19.077 3.655 -0.425 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -18.208 2.151 -0.813 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.309 3.675 -0.625 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -19.360 5.412 -2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -17.603 5.503 -2.403 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -18.695 5.188 -3.773 1.00 0.00 H new ATOM 919 N ARG A 62 -19.124 0.803 -4.403 1.00 0.00 N ATOM 920 CA ARG A 62 -20.443 0.216 -4.581 1.00 0.00 C ATOM 921 C ARG A 62 -20.401 -1.294 -4.375 1.00 0.00 C ATOM 922 O ARG A 62 -21.005 -1.826 -3.447 1.00 0.00 O ATOM 923 CB ARG A 62 -20.985 0.525 -5.974 1.00 0.00 C ATOM 924 CG ARG A 62 -22.477 0.279 -6.092 1.00 0.00 C ATOM 925 CD ARG A 62 -22.899 0.022 -7.528 1.00 0.00 C ATOM 926 NE ARG A 62 -23.701 -1.193 -7.646 1.00 0.00 N ATOM 927 CZ ARG A 62 -24.563 -1.424 -8.632 1.00 0.00 C ATOM 928 NH1 ARG A 62 -24.745 -0.527 -9.593 1.00 0.00 N ATOM 929 NH2 ARG A 62 -25.249 -2.560 -8.657 1.00 0.00 N ATOM 0 H ARG A 62 -18.744 1.250 -5.238 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.104 0.655 -3.833 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.772 1.566 -6.219 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.461 -0.088 -6.707 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -22.754 -0.575 -5.474 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.019 1.142 -5.704 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -23.471 0.873 -7.897 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -22.013 -0.064 -8.158 1.00 0.00 H new ATOM 0 HE ARG A 62 -23.593 -1.909 -6.927 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -24.222 0.348 -9.579 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -25.408 -0.713 -10.345 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -25.114 -3.253 -7.921 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -25.911 -2.740 -9.412 1.00 0.00 H new ATOM 943 N GLU A 63 -19.687 -1.976 -5.256 1.00 0.00 N ATOM 944 CA GLU A 63 -19.565 -3.428 -5.189 1.00 0.00 C ATOM 945 C GLU A 63 -19.200 -3.901 -3.785 1.00 0.00 C ATOM 946 O GLU A 63 -19.472 -5.044 -3.417 1.00 0.00 O ATOM 947 CB GLU A 63 -18.518 -3.913 -6.193 1.00 0.00 C ATOM 948 CG GLU A 63 -18.811 -3.499 -7.626 1.00 0.00 C ATOM 949 CD GLU A 63 -19.066 -4.685 -8.536 1.00 0.00 C ATOM 950 OE1 GLU A 63 -19.604 -5.701 -8.050 1.00 0.00 O ATOM 951 OE2 GLU A 63 -18.726 -4.596 -9.735 1.00 0.00 O ATOM 0 H GLU A 63 -19.180 -1.547 -6.030 1.00 0.00 H new ATOM 0 HA GLU A 63 -20.536 -3.854 -5.441 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -17.542 -3.524 -5.904 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -18.455 -5.000 -6.143 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -19.681 -2.842 -7.640 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -17.970 -2.923 -8.013 1.00 0.00 H new ATOM 958 N GLU A 64 -18.559 -3.032 -3.016 1.00 0.00 N ATOM 959 CA GLU A 64 -18.130 -3.381 -1.666 1.00 0.00 C ATOM 960 C GLU A 64 -19.165 -3.002 -0.604 1.00 0.00 C ATOM 961 O GLU A 64 -19.378 -3.755 0.346 1.00 0.00 O ATOM 962 CB GLU A 64 -16.796 -2.707 -1.350 1.00 0.00 C ATOM 963 CG GLU A 64 -15.613 -3.338 -2.065 1.00 0.00 C ATOM 964 CD GLU A 64 -14.506 -3.747 -1.115 1.00 0.00 C ATOM 965 OE1 GLU A 64 -14.819 -4.324 -0.051 1.00 0.00 O ATOM 966 OE2 GLU A 64 -13.325 -3.492 -1.432 1.00 0.00 O ATOM 0 H GLU A 64 -18.324 -2.081 -3.302 1.00 0.00 H new ATOM 0 HA GLU A 64 -18.017 -4.465 -1.637 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -16.856 -1.654 -1.624 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -16.624 -2.747 -0.274 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -15.953 -4.213 -2.619 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -15.217 -2.633 -2.796 1.00 0.00 H new ATOM 973 N THR A 65 -19.795 -1.839 -0.748 1.00 0.00 N ATOM 974 CA THR A 65 -20.786 -1.399 0.235 1.00 0.00 C ATOM 975 C THR A 65 -22.148 -1.161 -0.409 1.00 0.00 C ATOM 976 O THR A 65 -23.187 -1.385 0.211 1.00 0.00 O ATOM 977 CB THR A 65 -20.318 -0.118 0.932 1.00 0.00 C ATOM 978 OG1 THR A 65 -19.508 0.658 0.067 1.00 0.00 O ATOM 979 CG2 THR A 65 -19.524 -0.375 2.192 1.00 0.00 C ATOM 0 H THR A 65 -19.642 -1.192 -1.522 1.00 0.00 H new ATOM 0 HA THR A 65 -20.889 -2.196 0.971 1.00 0.00 H new ATOM 0 HB THR A 65 -21.232 0.412 1.200 1.00 0.00 H new ATOM 0 HG1 THR A 65 -19.836 0.572 -0.853 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.225 0.575 2.634 1.00 0.00 H new ATOM 0 HG22 THR A 65 -20.138 -0.928 2.903 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.636 -0.958 1.950 1.00 0.00 H new ATOM 987 N GLY A 66 -22.134 -0.685 -1.647 1.00 0.00 N ATOM 988 CA GLY A 66 -23.371 -0.398 -2.348 1.00 0.00 C ATOM 989 C GLY A 66 -23.617 1.095 -2.448 1.00 0.00 C ATOM 990 O GLY A 66 -24.490 1.545 -3.188 1.00 0.00 O ATOM 0 H GLY A 66 -21.286 -0.492 -2.180 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -23.333 -0.830 -3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.204 -0.871 -1.828 1.00 0.00 H new ATOM 994 N VAL A 67 -22.827 1.860 -1.693 1.00 0.00 N ATOM 995 CA VAL A 67 -22.928 3.311 -1.682 1.00 0.00 C ATOM 996 C VAL A 67 -22.749 3.894 -3.073 1.00 0.00 C ATOM 997 O VAL A 67 -21.655 3.873 -3.635 1.00 0.00 O ATOM 998 CB VAL A 67 -21.881 3.930 -0.735 1.00 0.00 C ATOM 999 CG1 VAL A 67 -21.723 5.425 -0.980 1.00 0.00 C ATOM 1000 CG2 VAL A 67 -22.250 3.661 0.713 1.00 0.00 C ATOM 0 H VAL A 67 -22.104 1.489 -1.077 1.00 0.00 H new ATOM 0 HA VAL A 67 -23.928 3.556 -1.325 1.00 0.00 H new ATOM 0 HB VAL A 67 -20.921 3.458 -0.944 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -20.977 5.829 -0.295 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -21.401 5.593 -2.008 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -22.677 5.924 -0.813 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -21.500 4.105 1.368 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -23.225 4.099 0.928 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -22.290 2.585 0.884 1.00 0.00 H new ATOM 1010 N THR A 68 -23.827 4.438 -3.604 1.00 0.00 N ATOM 1011 CA THR A 68 -23.795 5.061 -4.912 1.00 0.00 C ATOM 1012 C THR A 68 -24.254 6.507 -4.805 1.00 0.00 C ATOM 1013 O THR A 68 -23.698 7.395 -5.451 1.00 0.00 O ATOM 1014 CB THR A 68 -24.666 4.285 -5.895 1.00 0.00 C ATOM 1015 OG1 THR A 68 -25.770 3.693 -5.231 1.00 0.00 O ATOM 1016 CG2 THR A 68 -23.912 3.182 -6.607 1.00 0.00 C ATOM 0 H THR A 68 -24.739 4.461 -3.147 1.00 0.00 H new ATOM 0 HA THR A 68 -22.772 5.047 -5.288 1.00 0.00 H new ATOM 0 HB THR A 68 -24.999 5.016 -6.632 1.00 0.00 H new ATOM 0 HG1 THR A 68 -26.316 3.202 -5.879 1.00 0.00 H new ATOM 0 HG21 THR A 68 -24.584 2.666 -7.293 1.00 0.00 H new ATOM 0 HG22 THR A 68 -23.082 3.612 -7.167 1.00 0.00 H new ATOM 0 HG23 THR A 68 -23.527 2.473 -5.874 1.00 0.00 H new ATOM 1024 N SER A 69 -25.266 6.736 -3.971 1.00 0.00 N ATOM 1025 CA SER A 69 -25.797 8.076 -3.754 1.00 0.00 C ATOM 1026 C SER A 69 -24.736 8.997 -3.163 1.00 0.00 C ATOM 1027 O SER A 69 -24.765 9.310 -1.974 1.00 0.00 O ATOM 1028 CB SER A 69 -27.004 8.033 -2.825 1.00 0.00 C ATOM 1029 OG SER A 69 -27.949 7.067 -3.251 1.00 0.00 O ATOM 0 H SER A 69 -25.735 6.007 -3.434 1.00 0.00 H new ATOM 0 HA SER A 69 -26.104 8.468 -4.724 1.00 0.00 H new ATOM 0 HB2 SER A 69 -26.677 7.802 -1.811 1.00 0.00 H new ATOM 0 HB3 SER A 69 -27.475 9.015 -2.792 1.00 0.00 H new ATOM 0 HG SER A 69 -27.982 6.333 -2.602 1.00 0.00 H new ATOM 1035 N ALA A 70 -23.794 9.419 -3.991 1.00 0.00 N ATOM 1036 CA ALA A 70 -22.724 10.292 -3.533 1.00 0.00 C ATOM 1037 C ALA A 70 -22.024 10.995 -4.694 1.00 0.00 C ATOM 1038 O ALA A 70 -22.029 10.510 -5.825 1.00 0.00 O ATOM 1039 CB ALA A 70 -21.716 9.493 -2.717 1.00 0.00 C ATOM 0 H ALA A 70 -23.748 9.173 -4.980 1.00 0.00 H new ATOM 0 HA ALA A 70 -23.171 11.064 -2.906 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -20.918 10.153 -2.377 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -22.214 9.052 -1.854 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -21.293 8.701 -3.335 1.00 0.00 H new ATOM 1045 N GLU A 71 -21.411 12.140 -4.395 1.00 0.00 N ATOM 1046 CA GLU A 71 -20.691 12.915 -5.401 1.00 0.00 C ATOM 1047 C GLU A 71 -19.269 13.202 -4.932 1.00 0.00 C ATOM 1048 O GLU A 71 -19.021 13.366 -3.741 1.00 0.00 O ATOM 1049 CB GLU A 71 -21.408 14.237 -5.690 1.00 0.00 C ATOM 1050 CG GLU A 71 -22.909 14.198 -5.447 1.00 0.00 C ATOM 1051 CD GLU A 71 -23.679 15.033 -6.452 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -23.423 16.252 -6.529 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -24.535 14.466 -7.164 1.00 0.00 O ATOM 0 H GLU A 71 -21.400 12.551 -3.461 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.658 12.325 -6.317 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.971 15.018 -5.068 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.226 14.517 -6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -23.255 13.166 -5.495 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -23.121 14.559 -4.441 1.00 0.00 H new ATOM 1060 N VAL A 72 -18.338 13.279 -5.875 1.00 0.00 N ATOM 1061 CA VAL A 72 -16.945 13.564 -5.539 1.00 0.00 C ATOM 1062 C VAL A 72 -16.745 15.030 -5.201 1.00 0.00 C ATOM 1063 O VAL A 72 -17.105 15.918 -5.974 1.00 0.00 O ATOM 1064 CB VAL A 72 -15.968 13.164 -6.667 1.00 0.00 C ATOM 1065 CG1 VAL A 72 -14.536 13.165 -6.148 1.00 0.00 C ATOM 1066 CG2 VAL A 72 -16.332 11.803 -7.248 1.00 0.00 C ATOM 0 H VAL A 72 -18.518 13.150 -6.871 1.00 0.00 H new ATOM 0 HA VAL A 72 -16.720 12.956 -4.663 1.00 0.00 H new ATOM 0 HB VAL A 72 -16.048 13.899 -7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.857 12.881 -6.952 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.279 14.162 -5.791 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.445 12.452 -5.329 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.629 11.546 -8.040 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.287 11.048 -6.463 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -17.341 11.840 -7.657 1.00 0.00 H new ATOM 1076 N ILE A 73 -16.157 15.270 -4.039 1.00 0.00 N ATOM 1077 CA ILE A 73 -15.888 16.622 -3.581 1.00 0.00 C ATOM 1078 C ILE A 73 -14.404 16.924 -3.676 1.00 0.00 C ATOM 1079 O ILE A 73 -13.991 18.084 -3.703 1.00 0.00 O ATOM 1080 CB ILE A 73 -16.319 16.835 -2.115 1.00 0.00 C ATOM 1081 CG1 ILE A 73 -17.590 16.048 -1.783 1.00 0.00 C ATOM 1082 CG2 ILE A 73 -16.515 18.314 -1.840 1.00 0.00 C ATOM 1083 CD1 ILE A 73 -17.432 15.157 -0.570 1.00 0.00 C ATOM 0 H ILE A 73 -15.856 14.540 -3.393 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.464 17.288 -4.223 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.525 16.458 -1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -18.409 16.746 -1.610 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -17.868 15.437 -2.642 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -16.819 18.454 -0.803 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -15.580 18.844 -2.019 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -17.287 18.708 -2.501 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -18.365 14.625 -0.385 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -16.634 14.437 -0.749 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -17.183 15.766 0.299 1.00 0.00 H new ATOM 1095 N ALA A 74 -13.602 15.868 -3.719 1.00 0.00 N ATOM 1096 CA ALA A 74 -12.158 16.021 -3.804 1.00 0.00 C ATOM 1097 C ALA A 74 -11.469 14.695 -4.090 1.00 0.00 C ATOM 1098 O ALA A 74 -12.112 13.649 -4.182 1.00 0.00 O ATOM 1099 CB ALA A 74 -11.628 16.626 -2.514 1.00 0.00 C ATOM 0 H ALA A 74 -13.926 14.901 -3.696 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.937 16.690 -4.635 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.546 16.739 -2.583 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.085 17.603 -2.355 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.872 15.971 -1.678 1.00 0.00 H new ATOM 1105 N GLU A 75 -10.150 14.755 -4.226 1.00 0.00 N ATOM 1106 CA GLU A 75 -9.349 13.570 -4.498 1.00 0.00 C ATOM 1107 C GLU A 75 -7.917 13.770 -4.012 1.00 0.00 C ATOM 1108 O GLU A 75 -7.412 14.892 -3.988 1.00 0.00 O ATOM 1109 CB GLU A 75 -9.357 13.261 -5.996 1.00 0.00 C ATOM 1110 CG GLU A 75 -8.764 14.371 -6.847 1.00 0.00 C ATOM 1111 CD GLU A 75 -9.811 15.084 -7.682 1.00 0.00 C ATOM 1112 OE1 GLU A 75 -10.682 15.758 -7.094 1.00 0.00 O ATOM 1113 OE2 GLU A 75 -9.759 14.968 -8.924 1.00 0.00 O ATOM 0 H GLU A 75 -9.611 15.618 -4.152 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.784 12.727 -3.960 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.799 12.341 -6.172 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -10.383 13.078 -6.316 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -8.265 15.093 -6.201 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -8.002 13.953 -7.505 1.00 0.00 H new ATOM 1120 N VAL A 76 -7.267 12.678 -3.624 1.00 0.00 N ATOM 1121 CA VAL A 76 -5.895 12.745 -3.139 1.00 0.00 C ATOM 1122 C VAL A 76 -4.925 13.036 -4.285 1.00 0.00 C ATOM 1123 O VAL A 76 -5.035 12.457 -5.367 1.00 0.00 O ATOM 1124 CB VAL A 76 -5.499 11.439 -2.409 1.00 0.00 C ATOM 1125 CG1 VAL A 76 -3.997 11.363 -2.162 1.00 0.00 C ATOM 1126 CG2 VAL A 76 -6.252 11.334 -1.095 1.00 0.00 C ATOM 0 H VAL A 76 -7.667 11.740 -3.636 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.834 13.565 -2.423 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.769 10.601 -3.052 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.760 10.432 -1.648 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.469 11.396 -3.115 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.686 12.207 -1.546 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.969 10.413 -0.586 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.004 12.188 -0.464 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.324 11.326 -1.290 1.00 0.00 H new ATOM 1136 N PRO A 77 -3.958 13.947 -4.060 1.00 0.00 N ATOM 1137 CA PRO A 77 -2.961 14.324 -5.072 1.00 0.00 C ATOM 1138 C PRO A 77 -2.206 13.117 -5.611 1.00 0.00 C ATOM 1139 O PRO A 77 -2.373 12.721 -6.764 1.00 0.00 O ATOM 1140 CB PRO A 77 -2.000 15.251 -4.306 1.00 0.00 C ATOM 1141 CG PRO A 77 -2.282 14.989 -2.864 1.00 0.00 C ATOM 1142 CD PRO A 77 -3.746 14.680 -2.803 1.00 0.00 C ATOM 0 HA PRO A 77 -3.423 14.791 -5.942 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -0.961 15.032 -4.551 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -2.174 16.297 -4.559 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -1.687 14.155 -2.491 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.036 15.856 -2.250 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.999 14.076 -1.931 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -4.352 15.585 -2.751 1.00 0.00 H new ATOM 1150 N TYR A 78 -1.373 12.547 -4.756 1.00 0.00 N ATOM 1151 CA TYR A 78 -0.569 11.390 -5.102 1.00 0.00 C ATOM 1152 C TYR A 78 -1.274 10.104 -4.693 1.00 0.00 C ATOM 1153 O TYR A 78 -2.423 10.128 -4.263 1.00 0.00 O ATOM 1154 CB TYR A 78 0.781 11.482 -4.387 1.00 0.00 C ATOM 1155 CG TYR A 78 0.685 11.930 -2.941 1.00 0.00 C ATOM 1156 CD1 TYR A 78 -0.315 11.447 -2.103 1.00 0.00 C ATOM 1157 CD2 TYR A 78 1.599 12.833 -2.416 1.00 0.00 C ATOM 1158 CE1 TYR A 78 -0.400 11.852 -0.788 1.00 0.00 C ATOM 1159 CE2 TYR A 78 1.521 13.243 -1.098 1.00 0.00 C ATOM 1160 CZ TYR A 78 0.519 12.750 -0.289 1.00 0.00 C ATOM 1161 OH TYR A 78 0.439 13.155 1.024 1.00 0.00 O ATOM 0 H TYR A 78 -1.236 12.876 -3.800 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.419 11.376 -6.182 1.00 0.00 H new ATOM 0 HB2 TYR A 78 1.267 10.507 -4.423 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.421 12.177 -4.930 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.037 10.743 -2.489 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.384 13.222 -3.048 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -1.183 11.467 -0.152 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.241 13.945 -0.704 1.00 0.00 H new ATOM 0 HH TYR A 78 1.162 13.788 1.216 1.00 0.00 H new ATOM 1171 N TRP A 79 -0.576 8.985 -4.814 1.00 0.00 N ATOM 1172 CA TRP A 79 -1.137 7.700 -4.430 1.00 0.00 C ATOM 1173 C TRP A 79 -0.821 7.423 -2.962 1.00 0.00 C ATOM 1174 O TRP A 79 -0.545 8.350 -2.206 1.00 0.00 O ATOM 1175 CB TRP A 79 -0.590 6.592 -5.334 1.00 0.00 C ATOM 1176 CG TRP A 79 -1.109 6.686 -6.733 1.00 0.00 C ATOM 1177 CD1 TRP A 79 -0.908 7.710 -7.609 1.00 0.00 C ATOM 1178 CD2 TRP A 79 -1.927 5.730 -7.417 1.00 0.00 C ATOM 1179 NE1 TRP A 79 -1.544 7.449 -8.799 1.00 0.00 N ATOM 1180 CE2 TRP A 79 -2.178 6.240 -8.704 1.00 0.00 C ATOM 1181 CE3 TRP A 79 -2.473 4.492 -7.065 1.00 0.00 C ATOM 1182 CZ2 TRP A 79 -2.947 5.558 -9.639 1.00 0.00 C ATOM 1183 CZ3 TRP A 79 -3.236 3.816 -7.995 1.00 0.00 C ATOM 1184 CH2 TRP A 79 -3.467 4.350 -9.270 1.00 0.00 C ATOM 0 H TRP A 79 0.377 8.941 -5.174 1.00 0.00 H new ATOM 0 HA TRP A 79 -2.220 7.724 -4.552 1.00 0.00 H new ATOM 0 HB2 TRP A 79 0.499 6.644 -5.349 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -0.856 5.621 -4.916 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -0.332 8.599 -7.399 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.544 8.057 -9.618 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -2.301 4.073 -6.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -3.127 5.968 -10.622 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -3.663 2.858 -7.736 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -4.068 3.795 -9.975 1.00 0.00 H new ATOM 1195 N LEU A 80 -0.857 6.157 -2.561 1.00 0.00 N ATOM 1196 CA LEU A 80 -0.576 5.781 -1.177 1.00 0.00 C ATOM 1197 C LEU A 80 -0.258 4.296 -1.098 1.00 0.00 C ATOM 1198 O LEU A 80 -1.125 3.451 -1.320 1.00 0.00 O ATOM 1199 CB LEU A 80 -1.775 6.087 -0.267 1.00 0.00 C ATOM 1200 CG LEU A 80 -2.245 7.547 -0.236 1.00 0.00 C ATOM 1201 CD1 LEU A 80 -3.573 7.660 0.496 1.00 0.00 C ATOM 1202 CD2 LEU A 80 -1.197 8.433 0.421 1.00 0.00 C ATOM 0 H LEU A 80 -1.078 5.372 -3.174 1.00 0.00 H new ATOM 0 HA LEU A 80 0.280 6.364 -0.838 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.612 5.464 -0.582 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.519 5.787 0.749 1.00 0.00 H new ATOM 0 HG LEU A 80 -2.385 7.886 -1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.893 8.702 0.510 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.323 7.056 -0.015 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.456 7.303 1.519 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.549 9.465 0.433 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.025 8.096 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.266 8.374 -0.142 1.00 0.00 H new ATOM 1601 N ALA A 104 0.140 0.420 -4.385 1.00 0.00 N ATOM 1602 CA ALA A 104 -0.083 1.854 -4.547 1.00 0.00 C ATOM 1603 C ALA A 104 -1.568 2.138 -4.649 1.00 0.00 C ATOM 1604 O ALA A 104 -2.251 1.640 -5.545 1.00 0.00 O ATOM 1605 CB ALA A 104 0.660 2.388 -5.765 1.00 0.00 C ATOM 0 HA ALA A 104 0.311 2.369 -3.671 1.00 0.00 H new ATOM 0 HB1 ALA A 104 0.477 3.458 -5.863 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.729 2.212 -5.645 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.306 1.876 -6.660 1.00 0.00 H new ATOM 1611 N GLN A 105 -2.071 2.902 -3.689 1.00 0.00 N ATOM 1612 CA GLN A 105 -3.489 3.204 -3.642 1.00 0.00 C ATOM 1613 C GLN A 105 -3.788 4.695 -3.531 1.00 0.00 C ATOM 1614 O GLN A 105 -3.285 5.381 -2.645 1.00 0.00 O ATOM 1615 CB GLN A 105 -4.115 2.480 -2.452 1.00 0.00 C ATOM 1616 CG GLN A 105 -3.715 1.021 -2.348 1.00 0.00 C ATOM 1617 CD GLN A 105 -4.416 0.305 -1.209 1.00 0.00 C ATOM 1618 OE1 GLN A 105 -5.642 0.185 -1.197 1.00 0.00 O ATOM 1619 NE2 GLN A 105 -3.641 -0.168 -0.242 1.00 0.00 N ATOM 0 H GLN A 105 -1.520 3.320 -2.939 1.00 0.00 H new ATOM 0 HA GLN A 105 -3.917 2.864 -4.585 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.828 2.993 -1.534 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.200 2.546 -2.528 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.946 0.517 -3.286 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -2.636 0.953 -2.206 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -2.630 -0.046 -0.293 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -4.056 -0.654 0.553 1.00 0.00 H new ATOM 1628 N LYS A 106 -4.647 5.177 -4.425 1.00 0.00 N ATOM 1629 CA LYS A 106 -5.064 6.574 -4.420 1.00 0.00 C ATOM 1630 C LYS A 106 -6.480 6.681 -3.869 1.00 0.00 C ATOM 1631 O LYS A 106 -7.350 5.881 -4.217 1.00 0.00 O ATOM 1632 CB LYS A 106 -4.995 7.175 -5.821 1.00 0.00 C ATOM 1633 CG LYS A 106 -4.693 8.664 -5.817 1.00 0.00 C ATOM 1634 CD LYS A 106 -5.073 9.314 -7.138 1.00 0.00 C ATOM 1635 CE LYS A 106 -4.251 8.755 -8.286 1.00 0.00 C ATOM 1636 NZ LYS A 106 -4.338 9.608 -9.504 1.00 0.00 N ATOM 0 H LYS A 106 -5.069 4.616 -5.165 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.382 7.137 -3.782 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.227 6.656 -6.395 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.943 7.004 -6.330 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.238 9.144 -5.004 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.631 8.820 -5.626 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.133 9.151 -7.334 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -4.923 10.392 -7.072 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -3.209 8.669 -7.977 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -4.597 7.749 -8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -3.762 9.190 -10.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -5.329 9.669 -9.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.984 10.561 -9.286 1.00 0.00 H new ATOM 1650 N TRP A 107 -6.702 7.641 -2.983 1.00 0.00 N ATOM 1651 CA TRP A 107 -8.009 7.808 -2.360 1.00 0.00 C ATOM 1652 C TRP A 107 -8.802 8.967 -2.955 1.00 0.00 C ATOM 1653 O TRP A 107 -8.252 9.840 -3.626 1.00 0.00 O ATOM 1654 CB TRP A 107 -7.836 8.001 -0.856 1.00 0.00 C ATOM 1655 CG TRP A 107 -7.629 6.708 -0.138 1.00 0.00 C ATOM 1656 CD1 TRP A 107 -6.480 5.972 -0.084 1.00 0.00 C ATOM 1657 CD2 TRP A 107 -8.604 5.988 0.612 1.00 0.00 C ATOM 1658 NE1 TRP A 107 -6.685 4.833 0.657 1.00 0.00 N ATOM 1659 CE2 TRP A 107 -7.984 4.821 1.096 1.00 0.00 C ATOM 1660 CE3 TRP A 107 -9.943 6.217 0.921 1.00 0.00 C ATOM 1661 CZ2 TRP A 107 -8.661 3.888 1.872 1.00 0.00 C ATOM 1662 CZ3 TRP A 107 -10.613 5.293 1.690 1.00 0.00 C ATOM 1663 CH2 TRP A 107 -9.975 4.138 2.159 1.00 0.00 C ATOM 0 H TRP A 107 -5.998 8.314 -2.680 1.00 0.00 H new ATOM 0 HA TRP A 107 -8.584 6.903 -2.557 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -6.985 8.656 -0.672 1.00 0.00 H new ATOM 0 HB3 TRP A 107 -8.717 8.501 -0.453 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -5.547 6.245 -0.555 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -5.986 4.115 0.849 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -10.446 7.103 0.564 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -8.168 2.998 2.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -11.651 5.462 1.937 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -10.530 3.432 2.758 1.00 0.00 H new ATOM 1674 N PHE A 108 -10.109 8.954 -2.695 1.00 0.00 N ATOM 1675 CA PHE A 108 -11.009 9.988 -3.192 1.00 0.00 C ATOM 1676 C PHE A 108 -12.016 10.394 -2.119 1.00 0.00 C ATOM 1677 O PHE A 108 -12.356 9.602 -1.238 1.00 0.00 O ATOM 1678 CB PHE A 108 -11.764 9.495 -4.425 1.00 0.00 C ATOM 1679 CG PHE A 108 -10.891 9.224 -5.618 1.00 0.00 C ATOM 1680 CD1 PHE A 108 -10.513 10.259 -6.453 1.00 0.00 C ATOM 1681 CD2 PHE A 108 -10.456 7.938 -5.908 1.00 0.00 C ATOM 1682 CE1 PHE A 108 -9.717 10.024 -7.557 1.00 0.00 C ATOM 1683 CE2 PHE A 108 -9.657 7.695 -7.012 1.00 0.00 C ATOM 1684 CZ PHE A 108 -9.288 8.741 -7.838 1.00 0.00 C ATOM 0 H PHE A 108 -10.568 8.233 -2.139 1.00 0.00 H new ATOM 0 HA PHE A 108 -10.403 10.853 -3.459 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -12.300 8.582 -4.167 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -12.513 10.238 -4.699 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -10.844 11.264 -6.239 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -10.744 7.119 -5.266 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -9.430 10.843 -8.200 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.323 6.691 -7.228 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.666 8.555 -8.701 1.00 0.00 H new ATOM 1694 N LEU A 109 -12.494 11.630 -2.206 1.00 0.00 N ATOM 1695 CA LEU A 109 -13.472 12.151 -1.254 1.00 0.00 C ATOM 1696 C LEU A 109 -14.840 12.303 -1.909 1.00 0.00 C ATOM 1697 O LEU A 109 -14.977 13.014 -2.903 1.00 0.00 O ATOM 1698 CB LEU A 109 -13.015 13.502 -0.707 1.00 0.00 C ATOM 1699 CG LEU A 109 -13.845 14.036 0.458 1.00 0.00 C ATOM 1700 CD1 LEU A 109 -13.976 12.978 1.542 1.00 0.00 C ATOM 1701 CD2 LEU A 109 -13.223 15.306 1.020 1.00 0.00 C ATOM 0 H LEU A 109 -12.219 12.294 -2.930 1.00 0.00 H new ATOM 0 HA LEU A 109 -13.553 11.439 -0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.977 13.415 -0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -13.038 14.232 -1.516 1.00 0.00 H new ATOM 0 HG LEU A 109 -14.842 14.279 0.090 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -14.570 13.373 2.366 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -14.466 12.095 1.132 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -12.985 12.706 1.907 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.829 15.672 1.849 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.215 15.091 1.374 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -13.180 16.066 0.240 1.00 0.00 H new ATOM 1713 N PHE A 110 -15.856 11.646 -1.348 1.00 0.00 N ATOM 1714 CA PHE A 110 -17.203 11.732 -1.903 1.00 0.00 C ATOM 1715 C PHE A 110 -18.226 12.129 -0.842 1.00 0.00 C ATOM 1716 O PHE A 110 -18.100 11.776 0.329 1.00 0.00 O ATOM 1717 CB PHE A 110 -17.632 10.391 -2.517 1.00 0.00 C ATOM 1718 CG PHE A 110 -16.643 9.784 -3.477 1.00 0.00 C ATOM 1719 CD1 PHE A 110 -15.800 10.580 -4.236 1.00 0.00 C ATOM 1720 CD2 PHE A 110 -16.569 8.409 -3.627 1.00 0.00 C ATOM 1721 CE1 PHE A 110 -14.903 10.016 -5.122 1.00 0.00 C ATOM 1722 CE2 PHE A 110 -15.674 7.840 -4.513 1.00 0.00 C ATOM 1723 CZ PHE A 110 -14.839 8.645 -5.260 1.00 0.00 C ATOM 0 H PHE A 110 -15.772 11.056 -0.520 1.00 0.00 H new ATOM 0 HA PHE A 110 -17.173 12.500 -2.676 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -17.815 9.681 -1.710 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -18.579 10.533 -3.037 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -15.845 11.654 -4.134 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -17.219 7.773 -3.044 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -14.252 10.649 -5.707 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -15.628 6.766 -4.621 1.00 0.00 H new ATOM 0 HZ PHE A 110 -14.137 8.203 -5.951 1.00 0.00 H new ATOM 1733 N LYS A 111 -19.256 12.843 -1.283 1.00 0.00 N ATOM 1734 CA LYS A 111 -20.341 13.272 -0.400 1.00 0.00 C ATOM 1735 C LYS A 111 -21.521 12.319 -0.547 1.00 0.00 C ATOM 1736 O LYS A 111 -22.015 12.117 -1.651 1.00 0.00 O ATOM 1737 CB LYS A 111 -20.795 14.696 -0.743 1.00 0.00 C ATOM 1738 CG LYS A 111 -21.642 15.341 0.341 1.00 0.00 C ATOM 1739 CD LYS A 111 -21.587 16.859 0.259 1.00 0.00 C ATOM 1740 CE LYS A 111 -21.810 17.501 1.619 1.00 0.00 C ATOM 1741 NZ LYS A 111 -21.643 18.981 1.569 1.00 0.00 N ATOM 0 H LYS A 111 -19.365 13.140 -2.253 1.00 0.00 H new ATOM 0 HA LYS A 111 -19.975 13.261 0.627 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.916 15.315 -0.923 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.364 14.673 -1.672 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -22.675 15.007 0.244 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -21.292 15.015 1.320 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -20.619 17.168 -0.136 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -22.344 17.214 -0.440 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -22.812 17.261 1.974 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -21.107 17.080 2.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -21.803 19.381 2.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -20.679 19.211 1.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -22.330 19.386 0.902 1.00 0.00 H new ATOM 1755 N PHE A 112 -21.981 11.741 0.560 1.00 0.00 N ATOM 1756 CA PHE A 112 -23.114 10.818 0.512 1.00 0.00 C ATOM 1757 C PHE A 112 -24.430 11.578 0.404 1.00 0.00 C ATOM 1758 O PHE A 112 -24.935 12.108 1.392 1.00 0.00 O ATOM 1759 CB PHE A 112 -23.134 9.914 1.746 1.00 0.00 C ATOM 1760 CG PHE A 112 -24.085 8.751 1.633 1.00 0.00 C ATOM 1761 CD1 PHE A 112 -23.743 7.625 0.899 1.00 0.00 C ATOM 1762 CD2 PHE A 112 -25.318 8.779 2.267 1.00 0.00 C ATOM 1763 CE1 PHE A 112 -24.609 6.553 0.801 1.00 0.00 C ATOM 1764 CE2 PHE A 112 -26.186 7.711 2.168 1.00 0.00 C ATOM 1765 CZ PHE A 112 -25.831 6.595 1.436 1.00 0.00 C ATOM 0 H PHE A 112 -21.593 11.892 1.491 1.00 0.00 H new ATOM 0 HA PHE A 112 -22.996 10.196 -0.375 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -22.128 9.533 1.922 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -23.406 10.510 2.617 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -22.787 7.586 0.398 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -25.602 9.646 2.845 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -24.328 5.682 0.227 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -27.145 7.748 2.664 1.00 0.00 H new ATOM 0 HZ PHE A 112 -26.509 5.758 1.362 1.00 0.00 H new ATOM 1775 N THR A 113 -24.983 11.622 -0.802 1.00 0.00 N ATOM 1776 CA THR A 113 -26.246 12.309 -1.038 1.00 0.00 C ATOM 1777 C THR A 113 -27.395 11.307 -1.070 1.00 0.00 C ATOM 1778 O THR A 113 -28.288 11.396 -1.914 1.00 0.00 O ATOM 1779 CB THR A 113 -26.188 13.091 -2.353 1.00 0.00 C ATOM 1780 OG1 THR A 113 -26.242 12.212 -3.463 1.00 0.00 O ATOM 1781 CG2 THR A 113 -24.939 13.933 -2.493 1.00 0.00 C ATOM 0 H THR A 113 -24.576 11.190 -1.632 1.00 0.00 H new ATOM 0 HA THR A 113 -26.418 13.011 -0.222 1.00 0.00 H new ATOM 0 HB THR A 113 -27.053 13.754 -2.333 1.00 0.00 H new ATOM 0 HG1 THR A 113 -27.138 11.821 -3.527 1.00 0.00 H new ATOM 0 HG21 THR A 113 -24.961 14.461 -3.446 1.00 0.00 H new ATOM 0 HG22 THR A 113 -24.895 14.656 -1.679 1.00 0.00 H new ATOM 0 HG23 THR A 113 -24.060 13.289 -2.455 1.00 0.00 H new ATOM 1789 N GLY A 114 -27.359 10.352 -0.148 1.00 0.00 N ATOM 1790 CA GLY A 114 -28.397 9.341 -0.085 1.00 0.00 C ATOM 1791 C GLY A 114 -28.766 8.969 1.336 1.00 0.00 C ATOM 1792 O GLY A 114 -28.686 9.797 2.244 1.00 0.00 O ATOM 0 H GLY A 114 -26.628 10.260 0.558 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -29.284 9.705 -0.603 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -28.062 8.449 -0.614 1.00 0.00 H new ATOM 1796 N GLN A 115 -29.172 7.719 1.530 1.00 0.00 N ATOM 1797 CA GLN A 115 -29.555 7.232 2.852 1.00 0.00 C ATOM 1798 C GLN A 115 -28.700 6.039 3.271 1.00 0.00 C ATOM 1799 O GLN A 115 -28.236 5.268 2.434 1.00 0.00 O ATOM 1800 CB GLN A 115 -31.034 6.844 2.866 1.00 0.00 C ATOM 1801 CG GLN A 115 -31.944 7.874 2.217 1.00 0.00 C ATOM 1802 CD GLN A 115 -32.940 8.472 3.193 1.00 0.00 C ATOM 1803 OE1 GLN A 115 -34.127 8.599 2.888 1.00 0.00 O ATOM 1804 NE2 GLN A 115 -32.459 8.847 4.372 1.00 0.00 N ATOM 0 H GLN A 115 -29.245 7.023 0.788 1.00 0.00 H new ATOM 0 HA GLN A 115 -29.389 8.038 3.566 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -31.155 5.891 2.352 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -31.351 6.692 3.898 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -31.336 8.672 1.790 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -32.484 7.408 1.393 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -31.469 8.723 4.582 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -33.080 9.259 5.068 1.00 0.00 H new ATOM 1813 N ASP A 116 -28.496 5.898 4.577 1.00 0.00 N ATOM 1814 CA ASP A 116 -27.693 4.809 5.128 1.00 0.00 C ATOM 1815 C ASP A 116 -28.249 3.456 4.724 1.00 0.00 C ATOM 1816 O ASP A 116 -27.506 2.519 4.432 1.00 0.00 O ATOM 1817 CB ASP A 116 -27.695 4.909 6.648 1.00 0.00 C ATOM 1818 CG ASP A 116 -29.090 4.798 7.233 1.00 0.00 C ATOM 1819 OD1 ASP A 116 -29.539 3.660 7.485 1.00 0.00 O ATOM 1820 OD2 ASP A 116 -29.734 5.848 7.436 1.00 0.00 O ATOM 0 H ASP A 116 -28.879 6.530 5.280 1.00 0.00 H new ATOM 0 HA ASP A 116 -26.680 4.898 4.736 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -27.067 4.121 7.062 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -27.253 5.859 6.947 1.00 0.00 H new ATOM 1825 N GLN A 117 -29.565 3.374 4.718 1.00 0.00 N ATOM 1826 CA GLN A 117 -30.269 2.142 4.362 1.00 0.00 C ATOM 1827 C GLN A 117 -29.901 1.644 2.961 1.00 0.00 C ATOM 1828 O GLN A 117 -30.358 0.582 2.538 1.00 0.00 O ATOM 1829 CB GLN A 117 -31.781 2.356 4.452 1.00 0.00 C ATOM 1830 CG GLN A 117 -32.286 3.505 3.595 1.00 0.00 C ATOM 1831 CD GLN A 117 -33.682 3.259 3.063 1.00 0.00 C ATOM 1832 OE1 GLN A 117 -34.613 4.009 3.359 1.00 0.00 O ATOM 1833 NE2 GLN A 117 -33.838 2.202 2.274 1.00 0.00 N ATOM 0 H GLN A 117 -30.180 4.151 4.957 1.00 0.00 H new ATOM 0 HA GLN A 117 -29.958 1.378 5.074 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -32.288 1.439 4.151 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -32.052 2.543 5.491 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -32.281 4.423 4.183 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -31.603 3.658 2.759 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -33.039 1.607 2.054 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -34.757 1.985 1.888 1.00 0.00 H new ATOM 1842 N GLU A 118 -29.069 2.399 2.244 1.00 0.00 N ATOM 1843 CA GLU A 118 -28.648 2.007 0.903 1.00 0.00 C ATOM 1844 C GLU A 118 -27.390 1.145 0.970 1.00 0.00 C ATOM 1845 O GLU A 118 -27.059 0.430 0.024 1.00 0.00 O ATOM 1846 CB GLU A 118 -28.377 3.248 0.050 1.00 0.00 C ATOM 1847 CG GLU A 118 -28.039 2.932 -1.397 1.00 0.00 C ATOM 1848 CD GLU A 118 -28.886 3.716 -2.381 1.00 0.00 C ATOM 1849 OE1 GLU A 118 -29.028 4.943 -2.196 1.00 0.00 O ATOM 1850 OE2 GLU A 118 -29.407 3.102 -3.336 1.00 0.00 O ATOM 0 H GLU A 118 -28.675 3.282 2.569 1.00 0.00 H new ATOM 0 HA GLU A 118 -29.450 1.427 0.447 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -29.254 3.895 0.076 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -27.554 3.809 0.492 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -26.986 3.150 -1.576 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -28.178 1.865 -1.574 1.00 0.00 H new ATOM 1857 N ILE A 119 -26.700 1.220 2.101 1.00 0.00 N ATOM 1858 CA ILE A 119 -25.484 0.456 2.318 1.00 0.00 C ATOM 1859 C ILE A 119 -25.801 -0.928 2.865 1.00 0.00 C ATOM 1860 O ILE A 119 -26.189 -1.076 4.024 1.00 0.00 O ATOM 1861 CB ILE A 119 -24.545 1.182 3.291 1.00 0.00 C ATOM 1862 CG1 ILE A 119 -24.508 2.672 2.950 1.00 0.00 C ATOM 1863 CG2 ILE A 119 -23.148 0.575 3.244 1.00 0.00 C ATOM 1864 CD1 ILE A 119 -23.540 3.457 3.794 1.00 0.00 C ATOM 0 H ILE A 119 -26.968 1.810 2.889 1.00 0.00 H new ATOM 0 HA ILE A 119 -24.988 0.354 1.353 1.00 0.00 H new ATOM 0 HB ILE A 119 -24.922 1.064 4.307 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -24.241 2.790 1.900 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -25.507 3.090 3.073 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -22.498 1.104 3.941 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -23.199 -0.477 3.523 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -22.746 0.664 2.235 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -23.566 4.506 3.498 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -23.819 3.370 4.844 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -22.533 3.065 3.652 1.00 0.00 H new ATOM 1876 N ASN A 120 -25.644 -1.941 2.025 1.00 0.00 N ATOM 1877 CA ASN A 120 -25.925 -3.312 2.430 1.00 0.00 C ATOM 1878 C ASN A 120 -24.650 -4.035 2.854 1.00 0.00 C ATOM 1879 O ASN A 120 -24.706 -5.012 3.600 1.00 0.00 O ATOM 1880 CB ASN A 120 -26.599 -4.068 1.284 1.00 0.00 C ATOM 1881 CG ASN A 120 -25.859 -3.904 -0.030 1.00 0.00 C ATOM 1882 OD1 ASN A 120 -25.803 -2.810 -0.592 1.00 0.00 O ATOM 1883 ND2 ASN A 120 -25.286 -4.992 -0.525 1.00 0.00 N ATOM 0 H ASN A 120 -25.325 -1.841 1.062 1.00 0.00 H new ATOM 0 HA ASN A 120 -26.597 -3.281 3.287 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -26.657 -5.127 1.535 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -27.622 -3.711 1.169 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -24.773 -4.943 -1.405 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -25.358 -5.878 -0.025 1.00 0.00 H new ATOM 1890 N LEU A 121 -23.505 -3.548 2.376 1.00 0.00 N ATOM 1891 CA LEU A 121 -22.203 -4.135 2.705 1.00 0.00 C ATOM 1892 C LEU A 121 -21.948 -5.424 1.921 1.00 0.00 C ATOM 1893 O LEU A 121 -20.811 -5.718 1.552 1.00 0.00 O ATOM 1894 CB LEU A 121 -22.077 -4.399 4.213 1.00 0.00 C ATOM 1895 CG LEU A 121 -22.059 -3.149 5.102 1.00 0.00 C ATOM 1896 CD1 LEU A 121 -21.779 -3.527 6.548 1.00 0.00 C ATOM 1897 CD2 LEU A 121 -21.020 -2.151 4.608 1.00 0.00 C ATOM 0 H LEU A 121 -23.452 -2.741 1.754 1.00 0.00 H new ATOM 0 HA LEU A 121 -21.445 -3.408 2.415 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -22.907 -5.033 4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -21.161 -4.963 4.390 1.00 0.00 H new ATOM 0 HG LEU A 121 -23.041 -2.680 5.048 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -21.770 -2.628 7.164 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -22.556 -4.203 6.904 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -20.810 -4.021 6.614 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -21.024 -1.272 5.253 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -20.033 -2.613 4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -21.258 -1.853 3.587 1.00 0.00 H new ATOM 2016 N GLU A 130 -17.600 -8.233 3.123 1.00 0.00 N ATOM 2017 CA GLU A 130 -16.320 -7.658 3.526 1.00 0.00 C ATOM 2018 C GLU A 130 -16.419 -7.031 4.913 1.00 0.00 C ATOM 2019 O GLU A 130 -15.640 -7.359 5.807 1.00 0.00 O ATOM 2020 CB GLU A 130 -15.865 -6.607 2.511 1.00 0.00 C ATOM 2021 CG GLU A 130 -15.405 -7.196 1.189 1.00 0.00 C ATOM 2022 CD GLU A 130 -16.561 -7.616 0.302 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -17.167 -6.733 -0.341 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -16.860 -8.826 0.250 1.00 0.00 O ATOM 0 HA GLU A 130 -15.584 -8.462 3.560 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -16.686 -5.915 2.324 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -15.050 -6.026 2.943 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -14.795 -6.462 0.661 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -14.768 -8.059 1.382 1.00 0.00 H new ATOM 2031 N PHE A 131 -17.384 -6.135 5.089 1.00 0.00 N ATOM 2032 CA PHE A 131 -17.583 -5.472 6.373 1.00 0.00 C ATOM 2033 C PHE A 131 -18.853 -5.978 7.038 1.00 0.00 C ATOM 2034 O PHE A 131 -19.860 -6.223 6.373 1.00 0.00 O ATOM 2035 CB PHE A 131 -17.663 -3.956 6.198 1.00 0.00 C ATOM 2036 CG PHE A 131 -16.852 -3.422 5.050 1.00 0.00 C ATOM 2037 CD1 PHE A 131 -15.474 -3.323 5.144 1.00 0.00 C ATOM 2038 CD2 PHE A 131 -17.472 -3.010 3.881 1.00 0.00 C ATOM 2039 CE1 PHE A 131 -14.728 -2.825 4.092 1.00 0.00 C ATOM 2040 CE2 PHE A 131 -16.732 -2.510 2.827 1.00 0.00 C ATOM 2041 CZ PHE A 131 -15.359 -2.418 2.932 1.00 0.00 C ATOM 0 H PHE A 131 -18.039 -5.851 4.361 1.00 0.00 H new ATOM 0 HA PHE A 131 -16.728 -5.705 7.007 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -18.706 -3.673 6.054 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -17.328 -3.478 7.118 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -14.976 -3.638 6.049 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -18.546 -3.081 3.793 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -13.654 -2.754 4.177 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -17.227 -2.191 1.922 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.779 -2.028 2.109 1.00 0.00 H new ATOM 2051 N GLY A 132 -18.798 -6.137 8.351 1.00 0.00 N ATOM 2052 CA GLY A 132 -19.949 -6.620 9.084 1.00 0.00 C ATOM 2053 C GLY A 132 -20.830 -5.494 9.581 1.00 0.00 C ATOM 2054 O GLY A 132 -22.047 -5.648 9.693 1.00 0.00 O ATOM 0 H GLY A 132 -17.976 -5.940 8.923 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -20.534 -7.280 8.443 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -19.612 -7.216 9.932 1.00 0.00 H new ATOM 2058 N GLU A 133 -20.213 -4.354 9.870 1.00 0.00 N ATOM 2059 CA GLU A 133 -20.941 -3.182 10.349 1.00 0.00 C ATOM 2060 C GLU A 133 -20.248 -1.906 9.908 1.00 0.00 C ATOM 2061 O GLU A 133 -19.030 -1.876 9.748 1.00 0.00 O ATOM 2062 CB GLU A 133 -21.059 -3.196 11.879 1.00 0.00 C ATOM 2063 CG GLU A 133 -22.467 -2.913 12.378 1.00 0.00 C ATOM 2064 CD GLU A 133 -22.956 -3.950 13.372 1.00 0.00 C ATOM 2065 OE1 GLU A 133 -22.121 -4.484 14.130 1.00 0.00 O ATOM 2066 OE2 GLU A 133 -24.174 -4.224 13.390 1.00 0.00 O ATOM 0 H GLU A 133 -19.206 -4.215 9.781 1.00 0.00 H new ATOM 0 HA GLU A 133 -21.942 -3.215 9.918 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -20.738 -4.169 12.252 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -20.378 -2.454 12.295 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -22.491 -1.928 12.845 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -23.149 -2.880 11.529 1.00 0.00 H new ATOM 2073 N TRP A 134 -21.023 -0.847 9.721 1.00 0.00 N ATOM 2074 CA TRP A 134 -20.461 0.429 9.308 1.00 0.00 C ATOM 2075 C TRP A 134 -21.098 1.584 10.076 1.00 0.00 C ATOM 2076 O TRP A 134 -22.092 1.399 10.780 1.00 0.00 O ATOM 2077 CB TRP A 134 -20.618 0.621 7.802 1.00 0.00 C ATOM 2078 CG TRP A 134 -22.026 0.844 7.354 1.00 0.00 C ATOM 2079 CD1 TRP A 134 -22.884 -0.072 6.811 1.00 0.00 C ATOM 2080 CD2 TRP A 134 -22.734 2.080 7.401 1.00 0.00 C ATOM 2081 NE1 TRP A 134 -24.082 0.533 6.509 1.00 0.00 N ATOM 2082 CE2 TRP A 134 -24.011 1.853 6.866 1.00 0.00 C ATOM 2083 CE3 TRP A 134 -22.406 3.361 7.844 1.00 0.00 C ATOM 2084 CZ2 TRP A 134 -24.962 2.863 6.760 1.00 0.00 C ATOM 2085 CZ3 TRP A 134 -23.344 4.359 7.742 1.00 0.00 C ATOM 2086 CH2 TRP A 134 -24.610 4.110 7.204 1.00 0.00 C ATOM 0 H TRP A 134 -22.035 -0.846 9.848 1.00 0.00 H new ATOM 0 HA TRP A 134 -19.396 0.423 9.542 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -20.011 1.471 7.491 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -20.222 -0.257 7.292 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -22.655 -1.114 6.644 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -24.890 0.074 6.088 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -21.431 3.565 8.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -25.940 2.671 6.344 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -23.099 5.354 8.084 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -25.325 4.917 7.137 1.00 0.00 H new ATOM 2097 N SER A 135 -20.509 2.769 9.955 1.00 0.00 N ATOM 2098 CA SER A 135 -21.015 3.946 10.661 1.00 0.00 C ATOM 2099 C SER A 135 -20.468 5.249 10.091 1.00 0.00 C ATOM 2100 O SER A 135 -19.583 5.253 9.233 1.00 0.00 O ATOM 2101 CB SER A 135 -20.638 3.875 12.144 1.00 0.00 C ATOM 2102 OG SER A 135 -21.224 4.940 12.872 1.00 0.00 O ATOM 0 H SER A 135 -19.685 2.942 9.379 1.00 0.00 H new ATOM 0 HA SER A 135 -22.098 3.941 10.534 1.00 0.00 H new ATOM 0 HB2 SER A 135 -20.966 2.922 12.560 1.00 0.00 H new ATOM 0 HB3 SER A 135 -19.554 3.912 12.249 1.00 0.00 H new ATOM 0 HG SER A 135 -20.969 4.870 13.816 1.00 0.00 H new ATOM 2108 N TRP A 136 -20.987 6.354 10.619 1.00 0.00 N ATOM 2109 CA TRP A 136 -20.551 7.694 10.226 1.00 0.00 C ATOM 2110 C TRP A 136 -19.786 8.322 11.384 1.00 0.00 C ATOM 2111 O TRP A 136 -20.377 8.703 12.392 1.00 0.00 O ATOM 2112 CB TRP A 136 -21.737 8.597 9.862 1.00 0.00 C ATOM 2113 CG TRP A 136 -22.748 7.988 8.933 1.00 0.00 C ATOM 2114 CD1 TRP A 136 -23.936 7.415 9.286 1.00 0.00 C ATOM 2115 CD2 TRP A 136 -22.680 7.919 7.500 1.00 0.00 C ATOM 2116 NE1 TRP A 136 -24.612 6.996 8.165 1.00 0.00 N ATOM 2117 CE2 TRP A 136 -23.861 7.291 7.056 1.00 0.00 C ATOM 2118 CE3 TRP A 136 -21.739 8.324 6.547 1.00 0.00 C ATOM 2119 CZ2 TRP A 136 -24.122 7.063 5.708 1.00 0.00 C ATOM 2120 CZ3 TRP A 136 -22.002 8.099 5.209 1.00 0.00 C ATOM 2121 CH2 TRP A 136 -23.184 7.473 4.800 1.00 0.00 C ATOM 0 H TRP A 136 -21.719 6.348 11.329 1.00 0.00 H new ATOM 0 HA TRP A 136 -19.917 7.600 9.344 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -22.244 8.891 10.781 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -21.351 9.508 9.405 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -24.293 7.307 10.300 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -25.524 6.540 8.159 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -20.821 8.805 6.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -25.034 6.579 5.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -21.283 8.412 4.467 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -23.360 7.310 3.747 1.00 0.00 H new ATOM 2132 N VAL A 137 -18.473 8.422 11.243 1.00 0.00 N ATOM 2133 CA VAL A 137 -17.641 9.000 12.289 1.00 0.00 C ATOM 2134 C VAL A 137 -16.863 10.194 11.758 1.00 0.00 C ATOM 2135 O VAL A 137 -16.864 10.450 10.559 1.00 0.00 O ATOM 2136 CB VAL A 137 -16.668 7.950 12.862 1.00 0.00 C ATOM 2137 CG1 VAL A 137 -17.439 6.759 13.418 1.00 0.00 C ATOM 2138 CG2 VAL A 137 -15.674 7.501 11.800 1.00 0.00 C ATOM 0 H VAL A 137 -17.961 8.112 10.417 1.00 0.00 H new ATOM 0 HA VAL A 137 -18.299 9.337 13.090 1.00 0.00 H new ATOM 0 HB VAL A 137 -16.108 8.408 13.677 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -16.738 6.027 13.819 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -18.106 7.096 14.212 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -18.026 6.301 12.621 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -14.997 6.760 12.225 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -16.212 7.061 10.961 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -15.100 8.360 11.453 1.00 0.00 H new ATOM 2148 N THR A 138 -16.179 10.909 12.640 1.00 0.00 N ATOM 2149 CA THR A 138 -15.387 12.053 12.208 1.00 0.00 C ATOM 2150 C THR A 138 -14.134 11.566 11.509 1.00 0.00 C ATOM 2151 O THR A 138 -13.825 10.375 11.534 1.00 0.00 O ATOM 2152 CB THR A 138 -15.022 12.955 13.388 1.00 0.00 C ATOM 2153 OG1 THR A 138 -14.052 12.348 14.221 1.00 0.00 O ATOM 2154 CG2 THR A 138 -16.208 13.318 14.243 1.00 0.00 C ATOM 0 H THR A 138 -16.155 10.722 13.643 1.00 0.00 H new ATOM 0 HA THR A 138 -15.984 12.644 11.514 1.00 0.00 H new ATOM 0 HB THR A 138 -14.624 13.864 12.938 1.00 0.00 H new ATOM 0 HG1 THR A 138 -13.803 12.968 14.938 1.00 0.00 H new ATOM 0 HG21 THR A 138 -15.883 13.959 15.063 1.00 0.00 H new ATOM 0 HG22 THR A 138 -16.944 13.848 13.638 1.00 0.00 H new ATOM 0 HG23 THR A 138 -16.656 12.411 14.648 1.00 0.00 H new ATOM 2162 N PRO A 139 -13.374 12.474 10.890 1.00 0.00 N ATOM 2163 CA PRO A 139 -12.145 12.096 10.214 1.00 0.00 C ATOM 2164 C PRO A 139 -11.154 11.537 11.220 1.00 0.00 C ATOM 2165 O PRO A 139 -10.670 10.418 11.080 1.00 0.00 O ATOM 2166 CB PRO A 139 -11.625 13.400 9.591 1.00 0.00 C ATOM 2167 CG PRO A 139 -12.723 14.410 9.746 1.00 0.00 C ATOM 2168 CD PRO A 139 -13.637 13.917 10.836 1.00 0.00 C ATOM 0 HA PRO A 139 -12.296 11.323 9.461 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -10.716 13.734 10.092 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -11.375 13.256 8.540 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -12.313 15.387 10.002 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -13.270 14.529 8.811 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -13.419 14.399 11.789 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -14.682 14.125 10.606 1.00 0.00 H new ATOM 2176 N GLU A 140 -10.888 12.324 12.253 1.00 0.00 N ATOM 2177 CA GLU A 140 -9.980 11.920 13.317 1.00 0.00 C ATOM 2178 C GLU A 140 -10.523 10.703 14.067 1.00 0.00 C ATOM 2179 O GLU A 140 -9.756 9.894 14.588 1.00 0.00 O ATOM 2180 CB GLU A 140 -9.753 13.085 14.281 1.00 0.00 C ATOM 2181 CG GLU A 140 -8.375 13.710 14.149 1.00 0.00 C ATOM 2182 CD GLU A 140 -7.372 13.114 15.116 1.00 0.00 C ATOM 2183 OE1 GLU A 140 -7.798 12.604 16.174 1.00 0.00 O ATOM 2184 OE2 GLU A 140 -6.160 13.155 14.814 1.00 0.00 O ATOM 0 H GLU A 140 -11.292 13.253 12.377 1.00 0.00 H new ATOM 0 HA GLU A 140 -9.026 11.640 12.869 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -10.510 13.849 14.103 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -9.889 12.734 15.304 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -8.015 13.576 13.129 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -8.448 14.784 14.323 1.00 0.00 H new ATOM 2191 N GLN A 141 -11.848 10.572 14.107 1.00 0.00 N ATOM 2192 CA GLN A 141 -12.486 9.445 14.782 1.00 0.00 C ATOM 2193 C GLN A 141 -12.269 8.167 13.991 1.00 0.00 C ATOM 2194 O GLN A 141 -11.903 7.133 14.548 1.00 0.00 O ATOM 2195 CB GLN A 141 -13.985 9.694 14.976 1.00 0.00 C ATOM 2196 CG GLN A 141 -14.321 10.377 16.294 1.00 0.00 C ATOM 2197 CD GLN A 141 -15.555 9.792 16.954 1.00 0.00 C ATOM 2198 OE1 GLN A 141 -15.904 8.634 16.729 1.00 0.00 O ATOM 2199 NE2 GLN A 141 -16.223 10.596 17.776 1.00 0.00 N ATOM 0 H GLN A 141 -12.499 11.231 13.681 1.00 0.00 H new ATOM 0 HA GLN A 141 -12.028 9.339 15.765 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -14.353 10.308 14.154 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -14.513 8.742 14.924 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -13.473 10.287 16.973 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -14.477 11.441 16.118 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -15.897 11.550 17.933 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -17.061 10.259 18.249 1.00 0.00 H new ATOM 2208 N LEU A 142 -12.489 8.246 12.682 1.00 0.00 N ATOM 2209 CA LEU A 142 -12.307 7.092 11.815 1.00 0.00 C ATOM 2210 C LEU A 142 -10.883 6.576 11.943 1.00 0.00 C ATOM 2211 O LEU A 142 -10.650 5.370 11.978 1.00 0.00 O ATOM 2212 CB LEU A 142 -12.600 7.470 10.359 1.00 0.00 C ATOM 2213 CG LEU A 142 -12.198 6.419 9.314 1.00 0.00 C ATOM 2214 CD1 LEU A 142 -13.430 5.774 8.711 1.00 0.00 C ATOM 2215 CD2 LEU A 142 -11.335 7.042 8.226 1.00 0.00 C ATOM 0 H LEU A 142 -12.792 9.094 12.202 1.00 0.00 H new ATOM 0 HA LEU A 142 -13.002 6.308 12.117 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -13.667 7.667 10.260 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -12.082 8.401 10.131 1.00 0.00 H new ATOM 0 HG LEU A 142 -11.612 5.647 9.813 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -13.127 5.032 7.972 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -14.008 5.289 9.497 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -14.041 6.537 8.229 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -11.062 6.279 7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -11.893 7.836 7.729 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -10.431 7.458 8.672 1.00 0.00 H new ATOM 2227 N ILE A 143 -9.936 7.500 12.030 1.00 0.00 N ATOM 2228 CA ILE A 143 -8.534 7.129 12.172 1.00 0.00 C ATOM 2229 C ILE A 143 -8.319 6.361 13.472 1.00 0.00 C ATOM 2230 O ILE A 143 -7.541 5.407 13.528 1.00 0.00 O ATOM 2231 CB ILE A 143 -7.611 8.362 12.160 1.00 0.00 C ATOM 2232 CG1 ILE A 143 -7.895 9.231 10.935 1.00 0.00 C ATOM 2233 CG2 ILE A 143 -6.152 7.935 12.188 1.00 0.00 C ATOM 2234 CD1 ILE A 143 -7.522 8.578 9.622 1.00 0.00 C ATOM 0 H ILE A 143 -10.110 8.505 12.005 1.00 0.00 H new ATOM 0 HA ILE A 143 -8.281 6.499 11.319 1.00 0.00 H new ATOM 0 HB ILE A 143 -7.812 8.953 13.053 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -8.956 9.481 10.917 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -7.348 10.169 11.032 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -5.514 8.819 12.179 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -5.959 7.357 13.092 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -5.935 7.322 11.313 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -7.753 9.256 8.800 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -6.456 8.353 9.618 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -8.088 7.655 9.501 1.00 0.00 H new ATOM 2246 N ASP A 144 -9.015 6.784 14.518 1.00 0.00 N ATOM 2247 CA ASP A 144 -8.910 6.136 15.816 1.00 0.00 C ATOM 2248 C ASP A 144 -9.548 4.754 15.783 1.00 0.00 C ATOM 2249 O ASP A 144 -8.948 3.762 16.195 1.00 0.00 O ATOM 2250 CB ASP A 144 -9.576 6.994 16.895 1.00 0.00 C ATOM 2251 CG ASP A 144 -8.691 7.176 18.113 1.00 0.00 C ATOM 2252 OD1 ASP A 144 -7.451 7.174 17.950 1.00 0.00 O ATOM 2253 OD2 ASP A 144 -9.236 7.319 19.227 1.00 0.00 O ATOM 0 H ASP A 144 -9.659 7.574 14.492 1.00 0.00 H new ATOM 0 HA ASP A 144 -7.852 6.024 16.055 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -9.823 7.971 16.479 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -10.515 6.530 17.197 1.00 0.00 H new ATOM 2258 N LEU A 145 -10.781 4.714 15.305 1.00 0.00 N ATOM 2259 CA LEU A 145 -11.545 3.476 15.221 1.00 0.00 C ATOM 2260 C LEU A 145 -11.040 2.545 14.121 1.00 0.00 C ATOM 2261 O LEU A 145 -11.307 1.344 14.155 1.00 0.00 O ATOM 2262 CB LEU A 145 -13.019 3.795 14.972 1.00 0.00 C ATOM 2263 CG LEU A 145 -13.817 4.204 16.212 1.00 0.00 C ATOM 2264 CD1 LEU A 145 -14.126 5.693 16.182 1.00 0.00 C ATOM 2265 CD2 LEU A 145 -15.100 3.392 16.314 1.00 0.00 C ATOM 0 H LEU A 145 -11.281 5.535 14.965 1.00 0.00 H new ATOM 0 HA LEU A 145 -11.419 2.959 16.172 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -13.081 4.599 14.239 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -13.493 2.920 14.527 1.00 0.00 H new ATOM 0 HG LEU A 145 -13.210 3.998 17.094 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -14.694 5.965 17.072 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -13.194 6.258 16.160 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -14.712 5.925 15.293 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -15.654 3.697 17.202 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -15.711 3.564 15.428 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -14.855 2.332 16.385 1.00 0.00 H new ATOM 2277 N THR A 146 -10.327 3.088 13.138 1.00 0.00 N ATOM 2278 CA THR A 146 -9.826 2.265 12.040 1.00 0.00 C ATOM 2279 C THR A 146 -8.660 1.394 12.483 1.00 0.00 C ATOM 2280 O THR A 146 -8.172 1.512 13.608 1.00 0.00 O ATOM 2281 CB THR A 146 -9.414 3.124 10.837 1.00 0.00 C ATOM 2282 OG1 THR A 146 -9.222 2.316 9.684 1.00 0.00 O ATOM 2283 CG2 THR A 146 -8.143 3.912 11.065 1.00 0.00 C ATOM 0 H THR A 146 -10.086 4.077 13.078 1.00 0.00 H new ATOM 0 HA THR A 146 -10.645 1.614 11.734 1.00 0.00 H new ATOM 0 HB THR A 146 -10.234 3.828 10.694 1.00 0.00 H new ATOM 0 HG1 THR A 146 -9.994 1.723 9.568 1.00 0.00 H new ATOM 0 HG21 THR A 146 -7.912 4.496 10.174 1.00 0.00 H new ATOM 0 HG22 THR A 146 -8.278 4.583 11.913 1.00 0.00 H new ATOM 0 HG23 THR A 146 -7.322 3.226 11.272 1.00 0.00 H new ATOM 2291 N VAL A 147 -8.219 0.520 11.588 1.00 0.00 N ATOM 2292 CA VAL A 147 -7.108 -0.377 11.872 1.00 0.00 C ATOM 2293 C VAL A 147 -5.778 0.366 11.780 1.00 0.00 C ATOM 2294 O VAL A 147 -5.672 1.384 11.096 1.00 0.00 O ATOM 2295 CB VAL A 147 -7.089 -1.564 10.889 1.00 0.00 C ATOM 2296 CG1 VAL A 147 -8.320 -2.435 11.075 1.00 0.00 C ATOM 2297 CG2 VAL A 147 -6.992 -1.064 9.455 1.00 0.00 C ATOM 0 H VAL A 147 -8.616 0.413 10.655 1.00 0.00 H new ATOM 0 HA VAL A 147 -7.245 -0.755 12.885 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.210 -2.173 11.100 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -8.287 -3.267 10.371 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -8.341 -2.822 12.094 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -9.216 -1.842 10.893 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.980 -1.914 8.773 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.851 -0.432 9.231 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -6.075 -0.487 9.332 1.00 0.00 H new ATOM 2307 N GLU A 148 -4.765 -0.146 12.471 1.00 0.00 N ATOM 2308 CA GLU A 148 -3.445 0.473 12.463 1.00 0.00 C ATOM 2309 C GLU A 148 -2.887 0.562 11.045 1.00 0.00 C ATOM 2310 O GLU A 148 -2.525 1.640 10.578 1.00 0.00 O ATOM 2311 CB GLU A 148 -2.481 -0.319 13.349 1.00 0.00 C ATOM 2312 CG GLU A 148 -2.842 -0.282 14.825 1.00 0.00 C ATOM 2313 CD GLU A 148 -2.099 -1.330 15.633 1.00 0.00 C ATOM 2314 OE1 GLU A 148 -1.854 -2.429 15.095 1.00 0.00 O ATOM 2315 OE2 GLU A 148 -1.764 -1.048 16.803 1.00 0.00 O ATOM 0 H GLU A 148 -4.833 -0.988 13.043 1.00 0.00 H new ATOM 0 HA GLU A 148 -3.548 1.484 12.857 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -2.462 -1.356 13.014 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -1.474 0.077 13.220 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -2.618 0.707 15.226 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -3.915 -0.436 14.937 1.00 0.00 H new ATOM 2322 N PHE A 149 -2.811 -0.579 10.367 1.00 0.00 N ATOM 2323 CA PHE A 149 -2.288 -0.640 9.002 1.00 0.00 C ATOM 2324 C PHE A 149 -3.024 0.292 8.027 1.00 0.00 C ATOM 2325 O PHE A 149 -2.677 0.343 6.847 1.00 0.00 O ATOM 2326 CB PHE A 149 -2.295 -2.082 8.476 1.00 0.00 C ATOM 2327 CG PHE A 149 -3.655 -2.723 8.394 1.00 0.00 C ATOM 2328 CD1 PHE A 149 -4.282 -3.210 9.531 1.00 0.00 C ATOM 2329 CD2 PHE A 149 -4.297 -2.855 7.173 1.00 0.00 C ATOM 2330 CE1 PHE A 149 -5.521 -3.814 9.449 1.00 0.00 C ATOM 2331 CE2 PHE A 149 -5.537 -3.458 7.087 1.00 0.00 C ATOM 2332 CZ PHE A 149 -6.150 -3.937 8.226 1.00 0.00 C ATOM 0 H PHE A 149 -3.106 -1.480 10.742 1.00 0.00 H new ATOM 0 HA PHE A 149 -1.259 -0.284 9.056 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -1.844 -2.093 7.484 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -1.661 -2.691 9.121 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -3.796 -3.116 10.491 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -3.822 -2.482 6.278 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -5.998 -4.190 10.342 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -6.026 -3.554 6.129 1.00 0.00 H new ATOM 0 HZ PHE A 149 -7.120 -4.407 8.161 1.00 0.00 H new ATOM 2342 N LYS A 150 -4.035 1.025 8.499 1.00 0.00 N ATOM 2343 CA LYS A 150 -4.781 1.931 7.622 1.00 0.00 C ATOM 2344 C LYS A 150 -5.019 3.300 8.264 1.00 0.00 C ATOM 2345 O LYS A 150 -5.497 4.222 7.603 1.00 0.00 O ATOM 2346 CB LYS A 150 -6.123 1.312 7.236 1.00 0.00 C ATOM 2347 CG LYS A 150 -5.995 -0.017 6.506 1.00 0.00 C ATOM 2348 CD LYS A 150 -7.316 -0.437 5.882 1.00 0.00 C ATOM 2349 CE LYS A 150 -7.119 -1.487 4.802 1.00 0.00 C ATOM 2350 NZ LYS A 150 -8.337 -2.324 4.610 1.00 0.00 N ATOM 0 H LYS A 150 -4.353 1.011 9.468 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.170 2.081 6.732 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.718 1.166 8.137 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.668 2.013 6.604 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -5.234 0.064 5.730 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -5.659 -0.785 7.202 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -7.975 -0.830 6.656 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -7.811 0.436 5.455 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -6.864 -0.997 3.862 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -6.277 -2.127 5.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -8.071 -3.227 4.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -8.781 -2.507 5.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -9.009 -1.823 3.995 1.00 0.00 H new ATOM 2364 N LYS A 151 -4.683 3.439 9.541 1.00 0.00 N ATOM 2365 CA LYS A 151 -4.865 4.706 10.245 1.00 0.00 C ATOM 2366 C LYS A 151 -4.013 5.810 9.615 1.00 0.00 C ATOM 2367 O LYS A 151 -4.542 6.837 9.193 1.00 0.00 O ATOM 2368 CB LYS A 151 -4.530 4.531 11.737 1.00 0.00 C ATOM 2369 CG LYS A 151 -3.749 5.685 12.356 1.00 0.00 C ATOM 2370 CD LYS A 151 -3.736 5.590 13.872 1.00 0.00 C ATOM 2371 CE LYS A 151 -2.889 4.417 14.347 1.00 0.00 C ATOM 2372 NZ LYS A 151 -1.748 4.860 15.199 1.00 0.00 N ATOM 0 H LYS A 151 -4.284 2.693 10.110 1.00 0.00 H new ATOM 0 HA LYS A 151 -5.909 5.007 10.157 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -5.460 4.401 12.291 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -3.955 3.614 11.861 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -2.726 5.678 11.980 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -4.194 6.633 12.052 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.346 6.517 14.293 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -4.756 5.477 14.240 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -3.514 3.723 14.910 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -2.507 3.873 13.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -1.198 4.031 15.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -1.137 5.502 14.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -2.113 5.357 16.037 1.00 0.00 H new ATOM 2386 N PRO A 152 -2.683 5.613 9.523 1.00 0.00 N ATOM 2387 CA PRO A 152 -1.790 6.605 8.920 1.00 0.00 C ATOM 2388 C PRO A 152 -2.093 6.789 7.442 1.00 0.00 C ATOM 2389 O PRO A 152 -1.849 7.854 6.873 1.00 0.00 O ATOM 2390 CB PRO A 152 -0.391 6.016 9.119 1.00 0.00 C ATOM 2391 CG PRO A 152 -0.607 4.556 9.320 1.00 0.00 C ATOM 2392 CD PRO A 152 -1.955 4.413 9.971 1.00 0.00 C ATOM 0 HA PRO A 152 -1.900 7.591 9.371 1.00 0.00 H new ATOM 0 HB2 PRO A 152 0.243 6.205 8.252 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.106 6.463 9.980 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -0.576 4.024 8.369 1.00 0.00 H new ATOM 0 HG3 PRO A 152 0.175 4.130 9.949 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -2.457 3.498 9.657 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -1.874 4.375 11.057 1.00 0.00 H new ATOM 2400 N VAL A 153 -2.656 5.751 6.831 1.00 0.00 N ATOM 2401 CA VAL A 153 -3.027 5.808 5.427 1.00 0.00 C ATOM 2402 C VAL A 153 -4.182 6.777 5.267 1.00 0.00 C ATOM 2403 O VAL A 153 -4.139 7.695 4.448 1.00 0.00 O ATOM 2404 CB VAL A 153 -3.438 4.425 4.885 1.00 0.00 C ATOM 2405 CG1 VAL A 153 -3.613 4.475 3.376 1.00 0.00 C ATOM 2406 CG2 VAL A 153 -2.417 3.363 5.272 1.00 0.00 C ATOM 0 H VAL A 153 -2.864 4.863 7.288 1.00 0.00 H new ATOM 0 HA VAL A 153 -2.160 6.141 4.856 1.00 0.00 H new ATOM 0 HB VAL A 153 -4.393 4.154 5.335 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -3.903 3.490 3.011 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -4.388 5.199 3.123 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -2.673 4.772 2.910 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -2.730 2.396 4.878 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.444 3.626 4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -2.345 3.306 6.358 1.00 0.00 H new ATOM 2416 N TYR A 154 -5.207 6.575 6.082 1.00 0.00 N ATOM 2417 CA TYR A 154 -6.378 7.430 6.077 1.00 0.00 C ATOM 2418 C TYR A 154 -6.013 8.813 6.589 1.00 0.00 C ATOM 2419 O TYR A 154 -6.519 9.826 6.104 1.00 0.00 O ATOM 2420 CB TYR A 154 -7.458 6.802 6.958 1.00 0.00 C ATOM 2421 CG TYR A 154 -7.963 5.474 6.438 1.00 0.00 C ATOM 2422 CD1 TYR A 154 -7.444 4.913 5.277 1.00 0.00 C ATOM 2423 CD2 TYR A 154 -8.954 4.779 7.114 1.00 0.00 C ATOM 2424 CE1 TYR A 154 -7.897 3.702 4.806 1.00 0.00 C ATOM 2425 CE2 TYR A 154 -9.415 3.564 6.647 1.00 0.00 C ATOM 2426 CZ TYR A 154 -8.881 3.028 5.490 1.00 0.00 C ATOM 2427 OH TYR A 154 -9.333 1.818 5.011 1.00 0.00 O ATOM 0 H TYR A 154 -5.248 5.816 6.762 1.00 0.00 H new ATOM 0 HA TYR A 154 -6.757 7.530 5.060 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -7.060 6.662 7.963 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -8.296 7.494 7.040 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -6.671 5.437 4.735 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -9.372 5.194 8.019 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -7.481 3.282 3.902 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -10.189 3.035 7.183 1.00 0.00 H new ATOM 0 HH TYR A 154 -8.903 1.625 4.152 1.00 0.00 H new ATOM 2437 N LYS A 155 -5.119 8.840 7.571 1.00 0.00 N ATOM 2438 CA LYS A 155 -4.662 10.089 8.158 1.00 0.00 C ATOM 2439 C LYS A 155 -4.042 10.982 7.096 1.00 0.00 C ATOM 2440 O LYS A 155 -4.273 12.191 7.074 1.00 0.00 O ATOM 2441 CB LYS A 155 -3.659 9.809 9.282 1.00 0.00 C ATOM 2442 CG LYS A 155 -4.128 10.286 10.650 1.00 0.00 C ATOM 2443 CD LYS A 155 -4.561 11.743 10.622 1.00 0.00 C ATOM 2444 CE LYS A 155 -4.324 12.420 11.965 1.00 0.00 C ATOM 2445 NZ LYS A 155 -3.747 13.781 11.802 1.00 0.00 N ATOM 0 H LYS A 155 -4.696 8.005 7.977 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.521 10.610 8.581 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.466 8.737 9.327 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.713 10.294 9.042 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -4.959 9.666 10.986 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -3.323 10.160 11.374 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -4.011 12.272 9.844 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -5.618 11.805 10.363 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -5.266 12.487 12.510 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -3.651 11.809 12.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -3.600 14.210 12.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -2.836 13.715 11.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -4.401 14.371 11.250 1.00 0.00 H new ATOM 2459 N GLU A 156 -3.271 10.377 6.202 1.00 0.00 N ATOM 2460 CA GLU A 156 -2.643 11.121 5.126 1.00 0.00 C ATOM 2461 C GLU A 156 -3.711 11.564 4.153 1.00 0.00 C ATOM 2462 O GLU A 156 -3.652 12.660 3.593 1.00 0.00 O ATOM 2463 CB GLU A 156 -1.594 10.263 4.413 1.00 0.00 C ATOM 2464 CG GLU A 156 -0.850 11.001 3.312 1.00 0.00 C ATOM 2465 CD GLU A 156 0.625 11.168 3.618 1.00 0.00 C ATOM 2466 OE1 GLU A 156 0.970 12.070 4.409 1.00 0.00 O ATOM 2467 OE2 GLU A 156 1.437 10.394 3.067 1.00 0.00 O ATOM 0 H GLU A 156 -3.068 9.377 6.203 1.00 0.00 H new ATOM 0 HA GLU A 156 -2.135 11.993 5.537 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -0.874 9.900 5.147 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -2.082 9.387 3.986 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.964 10.458 2.374 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -1.301 11.983 3.168 1.00 0.00 H new ATOM 2474 N VAL A 157 -4.704 10.707 3.978 1.00 0.00 N ATOM 2475 CA VAL A 157 -5.807 11.008 3.097 1.00 0.00 C ATOM 2476 C VAL A 157 -6.614 12.170 3.663 1.00 0.00 C ATOM 2477 O VAL A 157 -7.059 13.050 2.924 1.00 0.00 O ATOM 2478 CB VAL A 157 -6.721 9.784 2.895 1.00 0.00 C ATOM 2479 CG1 VAL A 157 -7.852 10.114 1.935 1.00 0.00 C ATOM 2480 CG2 VAL A 157 -5.913 8.596 2.393 1.00 0.00 C ATOM 0 H VAL A 157 -4.764 9.798 4.437 1.00 0.00 H new ATOM 0 HA VAL A 157 -5.397 11.283 2.125 1.00 0.00 H new ATOM 0 HB VAL A 157 -7.161 9.517 3.856 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -8.486 9.237 1.805 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -8.445 10.934 2.340 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -7.437 10.407 0.971 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -6.573 7.739 2.255 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -5.445 8.850 1.442 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -5.142 8.346 3.122 1.00 0.00 H new ATOM 2490 N LEU A 158 -6.796 12.171 4.984 1.00 0.00 N ATOM 2491 CA LEU A 158 -7.545 13.228 5.656 1.00 0.00 C ATOM 2492 C LEU A 158 -6.849 14.568 5.483 1.00 0.00 C ATOM 2493 O LEU A 158 -7.493 15.583 5.223 1.00 0.00 O ATOM 2494 CB LEU A 158 -7.692 12.915 7.146 1.00 0.00 C ATOM 2495 CG LEU A 158 -8.689 11.810 7.486 1.00 0.00 C ATOM 2496 CD1 LEU A 158 -8.846 11.683 8.993 1.00 0.00 C ATOM 2497 CD2 LEU A 158 -10.034 12.090 6.837 1.00 0.00 C ATOM 0 H LEU A 158 -6.434 11.450 5.608 1.00 0.00 H new ATOM 0 HA LEU A 158 -8.535 13.281 5.204 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.715 12.634 7.539 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.994 13.826 7.664 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.306 10.867 7.096 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -9.560 10.891 9.219 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.882 11.441 9.440 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -9.209 12.626 9.402 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -10.733 11.293 7.090 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -10.422 13.041 7.200 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.913 12.137 5.755 1.00 0.00 H new ATOM 2509 N SER A 159 -5.526 14.565 5.619 1.00 0.00 N ATOM 2510 CA SER A 159 -4.749 15.786 5.462 1.00 0.00 C ATOM 2511 C SER A 159 -5.066 16.411 4.117 1.00 0.00 C ATOM 2512 O SER A 159 -5.219 17.625 3.997 1.00 0.00 O ATOM 2513 CB SER A 159 -3.252 15.490 5.576 1.00 0.00 C ATOM 2514 OG SER A 159 -2.932 14.966 6.853 1.00 0.00 O ATOM 0 H SER A 159 -4.974 13.735 5.836 1.00 0.00 H new ATOM 0 HA SER A 159 -5.014 16.485 6.256 1.00 0.00 H new ATOM 0 HB2 SER A 159 -2.959 14.779 4.804 1.00 0.00 H new ATOM 0 HB3 SER A 159 -2.683 16.403 5.401 1.00 0.00 H new ATOM 0 HG SER A 159 -3.358 14.090 6.963 1.00 0.00 H new ATOM 2520 N VAL A 160 -5.202 15.558 3.114 1.00 0.00 N ATOM 2521 CA VAL A 160 -5.552 16.007 1.781 1.00 0.00 C ATOM 2522 C VAL A 160 -6.977 16.539 1.791 1.00 0.00 C ATOM 2523 O VAL A 160 -7.277 17.584 1.214 1.00 0.00 O ATOM 2524 CB VAL A 160 -5.462 14.860 0.758 1.00 0.00 C ATOM 2525 CG1 VAL A 160 -5.928 15.321 -0.613 1.00 0.00 C ATOM 2526 CG2 VAL A 160 -4.047 14.305 0.687 1.00 0.00 C ATOM 0 H VAL A 160 -5.075 14.550 3.201 1.00 0.00 H new ATOM 0 HA VAL A 160 -4.848 16.787 1.492 1.00 0.00 H new ATOM 0 HB VAL A 160 -6.123 14.060 1.091 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -5.855 14.494 -1.319 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -6.963 15.656 -0.552 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -5.300 16.144 -0.953 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -4.010 13.496 -0.043 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -3.360 15.096 0.387 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.756 13.924 1.666 1.00 0.00 H new ATOM 2536 N PHE A 161 -7.853 15.778 2.438 1.00 0.00 N ATOM 2537 CA PHE A 161 -9.264 16.115 2.528 1.00 0.00 C ATOM 2538 C PHE A 161 -9.554 17.156 3.606 1.00 0.00 C ATOM 2539 O PHE A 161 -10.712 17.485 3.853 1.00 0.00 O ATOM 2540 CB PHE A 161 -10.054 14.836 2.804 1.00 0.00 C ATOM 2541 CG PHE A 161 -9.999 13.844 1.671 1.00 0.00 C ATOM 2542 CD1 PHE A 161 -9.625 14.239 0.393 1.00 0.00 C ATOM 2543 CD2 PHE A 161 -10.317 12.515 1.889 1.00 0.00 C ATOM 2544 CE1 PHE A 161 -9.570 13.326 -0.641 1.00 0.00 C ATOM 2545 CE2 PHE A 161 -10.265 11.599 0.854 1.00 0.00 C ATOM 2546 CZ PHE A 161 -9.891 12.004 -0.411 1.00 0.00 C ATOM 0 H PHE A 161 -7.602 14.911 2.914 1.00 0.00 H new ATOM 0 HA PHE A 161 -9.567 16.559 1.580 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -9.667 14.366 3.708 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -11.094 15.095 3.000 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -9.374 15.273 0.206 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -10.609 12.190 2.877 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -9.276 13.646 -1.630 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -10.518 10.565 1.036 1.00 0.00 H new ATOM 0 HZ PHE A 161 -9.850 11.288 -1.219 1.00 0.00 H new ATOM 2556 N ALA A 162 -8.516 17.690 4.239 1.00 0.00 N ATOM 2557 CA ALA A 162 -8.715 18.695 5.273 1.00 0.00 C ATOM 2558 C ALA A 162 -9.449 19.910 4.714 1.00 0.00 C ATOM 2559 O ALA A 162 -10.466 20.333 5.263 1.00 0.00 O ATOM 2560 CB ALA A 162 -7.382 19.101 5.875 1.00 0.00 C ATOM 0 H ALA A 162 -7.542 17.448 4.057 1.00 0.00 H new ATOM 0 HA ALA A 162 -9.333 18.263 6.060 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -7.545 19.853 6.647 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -6.901 18.228 6.315 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -6.742 19.514 5.096 1.00 0.00 H new ATOM 2566 N PRO A 163 -8.958 20.486 3.601 1.00 0.00 N ATOM 2567 CA PRO A 163 -9.596 21.646 2.972 1.00 0.00 C ATOM 2568 C PRO A 163 -11.043 21.365 2.571 1.00 0.00 C ATOM 2569 O PRO A 163 -11.789 22.281 2.226 1.00 0.00 O ATOM 2570 CB PRO A 163 -8.740 21.908 1.725 1.00 0.00 C ATOM 2571 CG PRO A 163 -7.975 20.648 1.502 1.00 0.00 C ATOM 2572 CD PRO A 163 -7.760 20.054 2.862 1.00 0.00 C ATOM 0 HA PRO A 163 -9.644 22.495 3.654 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -9.363 22.148 0.863 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -8.069 22.753 1.879 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -8.528 19.963 0.859 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -7.024 20.850 1.009 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -7.680 18.968 2.821 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -6.845 20.423 3.324 1.00 0.00 H new ATOM 2580 N HIS A 164 -11.436 20.091 2.613 1.00 0.00 N ATOM 2581 CA HIS A 164 -12.795 19.696 2.246 1.00 0.00 C ATOM 2582 C HIS A 164 -13.578 19.202 3.459 1.00 0.00 C ATOM 2583 O HIS A 164 -14.808 19.146 3.430 1.00 0.00 O ATOM 2584 CB HIS A 164 -12.755 18.613 1.169 1.00 0.00 C ATOM 2585 CG HIS A 164 -11.892 18.977 0.001 1.00 0.00 C ATOM 2586 ND1 HIS A 164 -10.667 18.537 -0.367 1.00 0.00 N flip ATOM 2587 CD2 HIS A 164 -12.255 19.921 -0.936 1.00 0.00 C flip ATOM 2588 CE1 HIS A 164 -10.314 19.218 -1.507 1.00 0.00 C flip ATOM 2589 NE2 HIS A 164 -11.290 20.046 -1.831 1.00 0.00 N flip ATOM 0 H HIS A 164 -10.834 19.318 2.897 1.00 0.00 H new ATOM 0 HA HIS A 164 -13.305 20.575 1.853 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -12.389 17.685 1.609 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -13.769 18.421 0.818 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -13.183 20.473 -0.938 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -9.388 19.096 -2.050 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -11.298 20.675 -2.634 1.00 0.00 H new ATOM 2598 N LEU A 165 -12.867 18.848 4.522 1.00 0.00 N ATOM 2599 CA LEU A 165 -13.509 18.363 5.738 1.00 0.00 C ATOM 2600 C LEU A 165 -13.667 19.490 6.754 1.00 0.00 C ATOM 2601 O LEU A 165 -13.877 19.185 7.947 1.00 0.00 O ATOM 2602 CB LEU A 165 -12.696 17.224 6.350 1.00 0.00 C ATOM 2603 CG LEU A 165 -12.540 15.986 5.466 1.00 0.00 C ATOM 2604 CD1 LEU A 165 -11.607 14.986 6.125 1.00 0.00 C ATOM 2605 CD2 LEU A 165 -13.891 15.353 5.177 1.00 0.00 C ATOM 2606 OXT LEU A 165 -13.581 20.668 6.348 1.00 0.00 O ATOM 0 H LEU A 165 -11.849 18.887 4.567 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.499 17.992 5.473 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -11.704 17.600 6.599 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -13.167 16.925 7.286 1.00 0.00 H new ATOM 0 HG LEU A 165 -12.105 16.293 4.515 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -11.504 14.109 5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.629 15.444 6.273 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -12.017 14.686 7.089 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.754 14.474 4.547 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -14.362 15.057 6.114 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -14.527 16.073 4.662 1.00 0.00 H new