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 138 THR OG1 : rot 140:sc= -3.61! USER MOD Set 1.2: A 141 GLN : amide:sc= -4.24 K(o=-7.8,f=-13!) USER MOD Set 2.1: A 22 MET CE :methyl -144:sc= -3.95! (180deg=-3.9!) USER MOD Set 2.2: A 26 LYS NZ :NH3+ -162:sc= -1.56 (180deg=0) USER MOD Set 2.3: A 111 LYS NZ :NH3+ 155:sc= 0 (180deg=0) USER MOD Set 3.1: A 41 GLN : amide:sc= -5.09 K(o=-7.1,f=-7.9!) USER MOD Set 3.2: A 44 GLN : amide:sc= 0.22 K(o=-7.1,f=-22!) USER MOD Set 3.3: A 146 THR OG1 : rot 36:sc= -0.263 USER MOD Set 3.4: A 150 LYS NZ :NH3+ -133:sc= 0.483 (180deg=0) USER MOD Set 3.5: A 154 TYR OH : rot 0:sc= -2.44 USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -5.4! C(o=-5.4!,f=-7.4!) USER MOD Single : A 20 CYS SG : rot 41:sc= 0.0618 USER MOD Single : A 23 ASN :FLIP amide:sc= -9.34! C(o=-11!,f=-9.3!) USER MOD Single : A 24 ASN : amide:sc=-0.00934 K(o=-0.0093,f=-1.6) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -72:sc= 0.601 USER MOD Single : A 42 MET CE :methyl -124:sc= -4.42 (180deg=-10.4!) USER MOD Single : A 55 ASN :FLIP amide:sc= -0.0162 F(o=-0.8,f=-0.016) USER MOD Single : A 65 THR OG1 : rot 20:sc= 0.193 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 95:sc= 0.579 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 GLN :FLIP amide:sc= 1.08 F(o=-0.25,f=1.1) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 62:sc= 1.13 USER MOD Single : A 115 GLN : amide:sc= -0.191 K(o=-0.19,f=-1.4!) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 ASN : amide:sc= -0.013 X(o=-0.013,f=0) USER MOD Single : A 135 SER OG : rot 180:sc= -0.157 USER MOD Single : A 151 LYS NZ :NH3+ 179:sc= 0.0239 (180deg=0.0238) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 SER OG : rot 70:sc= 0.73 USER MOD Single : A 164 HIS : no HD1:sc= -4.74 X(o=-4.7,f=-4.3!) USER MOD ----------------------------------------------------------------- ATOM 61 N MET A 6 3.755 9.137 -3.360 1.00 0.00 N ATOM 62 CA MET A 6 4.222 9.273 -4.735 1.00 0.00 C ATOM 63 C MET A 6 3.052 9.518 -5.680 1.00 0.00 C ATOM 64 O MET A 6 2.061 8.786 -5.661 1.00 0.00 O ATOM 65 CB MET A 6 4.990 8.022 -5.170 1.00 0.00 C ATOM 66 CG MET A 6 6.311 7.828 -4.442 1.00 0.00 C ATOM 67 SD MET A 6 6.099 7.375 -2.709 1.00 0.00 S ATOM 68 CE MET A 6 5.833 5.609 -2.850 1.00 0.00 C ATOM 0 HA MET A 6 4.893 10.131 -4.779 1.00 0.00 H new ATOM 0 HB2 MET A 6 4.363 7.146 -5.004 1.00 0.00 H new ATOM 0 HB3 MET A 6 5.181 8.079 -6.242 1.00 0.00 H new ATOM 0 HG2 MET A 6 6.888 7.053 -4.947 1.00 0.00 H new ATOM 0 HG3 MET A 6 6.892 8.748 -4.503 1.00 0.00 H new ATOM 0 HE1 MET A 6 5.685 5.183 -1.858 1.00 0.00 H new ATOM 0 HE2 MET A 6 4.950 5.422 -3.460 1.00 0.00 H new ATOM 0 HE3 MET A 6 6.702 5.146 -3.318 1.00 0.00 H new ATOM 78 N ASP A 7 3.169 10.552 -6.507 1.00 0.00 N ATOM 79 CA ASP A 7 2.115 10.885 -7.456 1.00 0.00 C ATOM 80 C ASP A 7 1.986 9.791 -8.511 1.00 0.00 C ATOM 81 O ASP A 7 0.893 9.506 -8.997 1.00 0.00 O ATOM 82 CB ASP A 7 2.405 12.229 -8.127 1.00 0.00 C ATOM 83 CG ASP A 7 3.815 12.307 -8.679 1.00 0.00 C ATOM 84 OD1 ASP A 7 4.082 11.663 -9.715 1.00 0.00 O ATOM 85 OD2 ASP A 7 4.651 13.011 -8.075 1.00 0.00 O ATOM 0 H ASP A 7 3.979 11.171 -6.539 1.00 0.00 H new ATOM 0 HA ASP A 7 1.174 10.962 -6.912 1.00 0.00 H new ATOM 0 HB2 ASP A 7 1.692 12.390 -8.935 1.00 0.00 H new ATOM 0 HB3 ASP A 7 2.255 13.032 -7.405 1.00 0.00 H new ATOM 196 N ARG A 15 -1.567 -1.760 -7.547 1.00 0.00 N ATOM 197 CA ARG A 15 -2.429 -0.605 -7.793 1.00 0.00 C ATOM 198 C ARG A 15 -3.841 -0.820 -7.251 1.00 0.00 C ATOM 199 O ARG A 15 -4.617 -1.606 -7.793 1.00 0.00 O ATOM 200 CB ARG A 15 -2.493 -0.301 -9.290 1.00 0.00 C ATOM 201 CG ARG A 15 -3.129 1.041 -9.610 1.00 0.00 C ATOM 202 CD ARG A 15 -2.390 1.756 -10.728 1.00 0.00 C ATOM 203 NE ARG A 15 -2.835 1.317 -12.049 1.00 0.00 N ATOM 204 CZ ARG A 15 -2.806 2.085 -13.139 1.00 0.00 C ATOM 205 NH1 ARG A 15 -2.361 3.334 -13.073 1.00 0.00 N ATOM 206 NH2 ARG A 15 -3.225 1.600 -14.299 1.00 0.00 N ATOM 0 HA ARG A 15 -1.993 0.243 -7.265 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -1.483 -0.323 -9.700 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -3.057 -1.089 -9.789 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.170 0.892 -9.898 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.132 1.666 -8.717 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -2.542 2.831 -10.633 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -1.320 1.576 -10.628 1.00 0.00 H new ATOM 0 HE ARG A 15 -3.189 0.365 -12.143 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -2.038 3.714 -12.183 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.343 3.914 -13.912 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -3.569 0.641 -14.357 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.204 2.185 -15.134 1.00 0.00 H new ATOM 220 N ASN A 16 -4.162 -0.087 -6.194 1.00 0.00 N ATOM 221 CA ASN A 16 -5.478 -0.145 -5.568 1.00 0.00 C ATOM 222 C ASN A 16 -5.993 1.280 -5.361 1.00 0.00 C ATOM 223 O ASN A 16 -5.279 2.240 -5.639 1.00 0.00 O ATOM 224 CB ASN A 16 -5.396 -0.870 -4.224 1.00 0.00 C ATOM 225 CG ASN A 16 -5.651 -2.361 -4.339 1.00 0.00 C ATOM 226 OD1 ASN A 16 -6.623 -2.879 -3.791 1.00 0.00 O ATOM 227 ND2 ASN A 16 -4.775 -3.061 -5.049 1.00 0.00 N ATOM 0 H ASN A 16 -3.518 0.565 -5.745 1.00 0.00 H new ATOM 0 HA ASN A 16 -6.162 -0.695 -6.214 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.410 -0.708 -3.790 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -6.122 -0.435 -3.537 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.894 -4.068 -5.157 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -3.982 -2.592 -5.487 1.00 0.00 H new ATOM 234 N VAL A 17 -7.217 1.427 -4.866 1.00 0.00 N ATOM 235 CA VAL A 17 -7.773 2.758 -4.614 1.00 0.00 C ATOM 236 C VAL A 17 -8.646 2.768 -3.367 1.00 0.00 C ATOM 237 O VAL A 17 -9.034 1.718 -2.863 1.00 0.00 O ATOM 238 CB VAL A 17 -8.589 3.318 -5.802 1.00 0.00 C ATOM 239 CG1 VAL A 17 -7.816 3.219 -7.096 1.00 0.00 C ATOM 240 CG2 VAL A 17 -9.929 2.623 -5.949 1.00 0.00 C ATOM 0 H VAL A 17 -7.839 0.653 -4.633 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.908 3.405 -4.469 1.00 0.00 H new ATOM 0 HB VAL A 17 -8.774 4.369 -5.582 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.418 3.621 -7.911 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -6.891 3.790 -7.012 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -7.580 2.175 -7.300 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.468 3.048 -6.795 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.770 1.558 -6.118 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.513 2.763 -5.039 1.00 0.00 H new ATOM 250 N GLY A 18 -8.965 3.964 -2.887 1.00 0.00 N ATOM 251 CA GLY A 18 -9.807 4.093 -1.711 1.00 0.00 C ATOM 252 C GLY A 18 -10.857 5.173 -1.876 1.00 0.00 C ATOM 253 O GLY A 18 -10.722 6.053 -2.725 1.00 0.00 O ATOM 0 H GLY A 18 -8.656 4.848 -3.291 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.297 3.140 -1.510 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.186 4.321 -0.845 1.00 0.00 H new ATOM 257 N ILE A 19 -11.907 5.108 -1.066 1.00 0.00 N ATOM 258 CA ILE A 19 -12.977 6.094 -1.142 1.00 0.00 C ATOM 259 C ILE A 19 -13.293 6.683 0.227 1.00 0.00 C ATOM 260 O ILE A 19 -13.701 5.972 1.145 1.00 0.00 O ATOM 261 CB ILE A 19 -14.262 5.489 -1.740 1.00 0.00 C ATOM 262 CG1 ILE A 19 -13.944 4.723 -3.025 1.00 0.00 C ATOM 263 CG2 ILE A 19 -15.285 6.580 -2.013 1.00 0.00 C ATOM 264 CD1 ILE A 19 -13.769 3.234 -2.821 1.00 0.00 C ATOM 0 H ILE A 19 -12.040 4.389 -0.355 1.00 0.00 H new ATOM 0 HA ILE A 19 -12.620 6.889 -1.797 1.00 0.00 H new ATOM 0 HB ILE A 19 -14.684 4.791 -1.017 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -14.746 4.890 -3.744 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -13.033 5.130 -3.463 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -16.187 6.136 -2.435 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -15.533 7.088 -1.081 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -14.870 7.299 -2.719 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -13.546 2.760 -3.777 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -12.948 3.056 -2.127 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -14.687 2.812 -2.412 1.00 0.00 H new ATOM 276 N CYS A 20 -13.125 7.994 0.348 1.00 0.00 N ATOM 277 CA CYS A 20 -13.413 8.687 1.591 1.00 0.00 C ATOM 278 C CYS A 20 -14.793 9.315 1.504 1.00 0.00 C ATOM 279 O CYS A 20 -14.952 10.428 1.007 1.00 0.00 O ATOM 280 CB CYS A 20 -12.356 9.754 1.866 1.00 0.00 C ATOM 281 SG CYS A 20 -12.129 10.139 3.617 1.00 0.00 S ATOM 0 H CYS A 20 -12.790 8.597 -0.403 1.00 0.00 H new ATOM 0 HA CYS A 20 -13.393 7.974 2.415 1.00 0.00 H new ATOM 0 HB2 CYS A 20 -11.404 9.421 1.452 1.00 0.00 H new ATOM 0 HB3 CYS A 20 -12.631 10.667 1.338 1.00 0.00 H new ATOM 0 HG CYS A 20 -12.171 9.041 4.312 1.00 0.00 H new ATOM 287 N LEU A 21 -15.792 8.579 1.967 1.00 0.00 N ATOM 288 CA LEU A 21 -17.167 9.045 1.915 1.00 0.00 C ATOM 289 C LEU A 21 -17.556 9.800 3.182 1.00 0.00 C ATOM 290 O LEU A 21 -17.452 9.275 4.287 1.00 0.00 O ATOM 291 CB LEU A 21 -18.104 7.861 1.699 1.00 0.00 C ATOM 292 CG LEU A 21 -19.594 8.184 1.772 1.00 0.00 C ATOM 293 CD1 LEU A 21 -20.023 9.017 0.572 1.00 0.00 C ATOM 294 CD2 LEU A 21 -20.401 6.901 1.852 1.00 0.00 C ATOM 0 H LEU A 21 -15.675 7.655 2.383 1.00 0.00 H new ATOM 0 HA LEU A 21 -17.256 9.739 1.079 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -17.891 7.424 0.723 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -17.878 7.099 2.445 1.00 0.00 H new ATOM 0 HG LEU A 21 -19.781 8.770 2.672 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -21.088 9.236 0.643 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -19.461 9.951 0.557 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -19.828 8.461 -0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -21.463 7.142 1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -20.209 6.295 0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -20.111 6.344 2.743 1.00 0.00 H new ATOM 306 N MET A 22 -18.001 11.040 3.006 1.00 0.00 N ATOM 307 CA MET A 22 -18.406 11.870 4.132 1.00 0.00 C ATOM 308 C MET A 22 -19.879 12.233 4.043 1.00 0.00 C ATOM 309 O MET A 22 -20.456 12.283 2.956 1.00 0.00 O ATOM 310 CB MET A 22 -17.559 13.148 4.225 1.00 0.00 C ATOM 311 CG MET A 22 -16.861 13.531 2.929 1.00 0.00 C ATOM 312 SD MET A 22 -17.927 14.463 1.814 1.00 0.00 S ATOM 313 CE MET A 22 -17.434 16.141 2.197 1.00 0.00 C ATOM 0 H MET A 22 -18.090 11.491 2.095 1.00 0.00 H new ATOM 0 HA MET A 22 -18.242 11.283 5.036 1.00 0.00 H new ATOM 0 HB2 MET A 22 -18.200 13.973 4.537 1.00 0.00 H new ATOM 0 HB3 MET A 22 -16.808 13.016 5.004 1.00 0.00 H new ATOM 0 HG2 MET A 22 -15.976 14.124 3.159 1.00 0.00 H new ATOM 0 HG3 MET A 22 -16.517 12.627 2.426 1.00 0.00 H new ATOM 0 HE1 MET A 22 -18.303 16.796 2.145 1.00 0.00 H new ATOM 0 HE2 MET A 22 -17.012 16.176 3.201 1.00 0.00 H new ATOM 0 HE3 MET A 22 -16.686 16.474 1.478 1.00 0.00 H new ATOM 323 N ASN A 23 -20.482 12.468 5.197 1.00 0.00 N ATOM 324 CA ASN A 23 -21.893 12.812 5.269 1.00 0.00 C ATOM 325 C ASN A 23 -22.069 14.317 5.377 1.00 0.00 C ATOM 326 O ASN A 23 -21.098 15.056 5.536 1.00 0.00 O ATOM 327 CB ASN A 23 -22.525 12.159 6.497 1.00 0.00 C ATOM 328 CG ASN A 23 -21.804 10.898 6.898 1.00 0.00 C ATOM 329 OD1 ASN A 23 -21.789 10.618 8.192 1.00 0.00 O flip ATOM 330 ND2 ASN A 23 -21.249 10.200 6.054 1.00 0.00 N flip ATOM 0 H ASN A 23 -20.013 12.426 6.102 1.00 0.00 H new ATOM 0 HA ASN A 23 -22.378 12.453 4.361 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -22.514 12.863 7.329 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -23.570 11.929 6.288 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -21.291 10.461 5.069 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -20.746 9.359 6.338 1.00 0.00 H new ATOM 337 N ASN A 24 -23.318 14.761 5.344 1.00 0.00 N ATOM 338 CA ASN A 24 -23.636 16.174 5.498 1.00 0.00 C ATOM 339 C ASN A 24 -23.073 16.718 6.819 1.00 0.00 C ATOM 340 O ASN A 24 -23.155 17.916 7.086 1.00 0.00 O ATOM 341 CB ASN A 24 -25.151 16.378 5.460 1.00 0.00 C ATOM 342 CG ASN A 24 -25.738 16.171 4.078 1.00 0.00 C ATOM 343 OD1 ASN A 24 -25.107 15.574 3.204 1.00 0.00 O ATOM 344 ND2 ASN A 24 -26.954 16.664 3.876 1.00 0.00 N ATOM 0 H ASN A 24 -24.131 14.160 5.211 1.00 0.00 H new ATOM 0 HA ASN A 24 -23.177 16.719 4.673 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -25.624 15.686 6.158 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -25.386 17.386 5.802 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -27.404 16.556 2.967 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -27.438 17.151 4.630 1.00 0.00 H new ATOM 351 N ASP A 25 -22.517 15.829 7.652 1.00 0.00 N ATOM 352 CA ASP A 25 -21.966 16.226 8.942 1.00 0.00 C ATOM 353 C ASP A 25 -20.451 16.331 8.890 1.00 0.00 C ATOM 354 O ASP A 25 -19.810 16.661 9.889 1.00 0.00 O ATOM 355 CB ASP A 25 -22.352 15.209 10.011 1.00 0.00 C ATOM 356 CG ASP A 25 -23.657 15.551 10.700 1.00 0.00 C ATOM 357 OD1 ASP A 25 -24.724 15.189 10.163 1.00 0.00 O ATOM 358 OD2 ASP A 25 -23.612 16.181 11.778 1.00 0.00 O ATOM 0 H ASP A 25 -22.440 14.832 7.451 1.00 0.00 H new ATOM 0 HA ASP A 25 -22.378 17.205 9.187 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -22.434 14.222 9.555 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -21.558 15.151 10.755 1.00 0.00 H new ATOM 363 N LYS A 26 -19.888 16.022 7.735 1.00 0.00 N ATOM 364 CA LYS A 26 -18.448 16.050 7.541 1.00 0.00 C ATOM 365 C LYS A 26 -17.806 14.835 8.203 1.00 0.00 C ATOM 366 O LYS A 26 -16.610 14.840 8.494 1.00 0.00 O ATOM 367 CB LYS A 26 -17.828 17.342 8.091 1.00 0.00 C ATOM 368 CG LYS A 26 -18.280 18.593 7.357 1.00 0.00 C ATOM 369 CD LYS A 26 -17.579 18.728 6.016 1.00 0.00 C ATOM 370 CE LYS A 26 -18.354 18.026 4.914 1.00 0.00 C ATOM 371 NZ LYS A 26 -18.201 18.707 3.599 1.00 0.00 N ATOM 0 H LYS A 26 -20.415 15.745 6.906 1.00 0.00 H new ATOM 0 HA LYS A 26 -18.256 16.020 6.469 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -18.084 17.437 9.146 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -16.742 17.268 8.032 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -19.359 18.558 7.204 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -18.073 19.471 7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -17.465 19.783 5.768 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -16.576 18.306 6.084 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -18.010 16.995 4.830 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -19.410 17.989 5.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -18.960 18.399 2.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -18.257 19.737 3.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -17.278 18.462 3.186 1.00 0.00 H new ATOM 385 N LYS A 27 -18.600 13.782 8.422 1.00 0.00 N ATOM 386 CA LYS A 27 -18.080 12.568 9.027 1.00 0.00 C ATOM 387 C LYS A 27 -17.621 11.630 7.925 1.00 0.00 C ATOM 388 O LYS A 27 -17.781 11.943 6.750 1.00 0.00 O ATOM 389 CB LYS A 27 -19.148 11.899 9.892 1.00 0.00 C ATOM 390 CG LYS A 27 -19.186 12.423 11.318 1.00 0.00 C ATOM 391 CD LYS A 27 -20.610 12.563 11.829 1.00 0.00 C ATOM 392 CE LYS A 27 -20.639 12.973 13.294 1.00 0.00 C ATOM 393 NZ LYS A 27 -21.480 14.181 13.513 1.00 0.00 N ATOM 0 H LYS A 27 -19.593 13.752 8.190 1.00 0.00 H new ATOM 0 HA LYS A 27 -17.236 12.814 9.672 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -20.124 12.049 9.432 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -18.967 10.824 9.913 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -18.631 11.747 11.969 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -18.687 13.391 11.363 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -21.141 13.305 11.232 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -21.137 11.617 11.704 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -21.023 12.149 13.895 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -19.623 13.170 13.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -21.475 14.429 14.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -21.099 14.975 12.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -22.455 13.985 13.210 1.00 0.00 H new ATOM 407 N ILE A 28 -17.033 10.502 8.287 1.00 0.00 N ATOM 408 CA ILE A 28 -16.545 9.561 7.283 1.00 0.00 C ATOM 409 C ILE A 28 -17.238 8.212 7.391 1.00 0.00 C ATOM 410 O ILE A 28 -17.436 7.683 8.487 1.00 0.00 O ATOM 411 CB ILE A 28 -15.024 9.318 7.394 1.00 0.00 C ATOM 412 CG1 ILE A 28 -14.301 10.534 7.969 1.00 0.00 C ATOM 413 CG2 ILE A 28 -14.447 8.951 6.034 1.00 0.00 C ATOM 414 CD1 ILE A 28 -14.528 11.815 7.200 1.00 0.00 C ATOM 0 H ILE A 28 -16.882 10.215 9.254 1.00 0.00 H new ATOM 0 HA ILE A 28 -16.770 10.024 6.322 1.00 0.00 H new ATOM 0 HB ILE A 28 -14.869 8.486 8.081 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -14.625 10.681 8.999 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.231 10.326 7.997 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -13.374 8.783 6.127 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -14.926 8.043 5.668 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -14.627 9.764 5.331 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.979 12.627 7.676 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -14.177 11.691 6.175 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -15.592 12.052 7.193 1.00 0.00 H new ATOM 426 N PHE A 29 -17.579 7.653 6.240 1.00 0.00 N ATOM 427 CA PHE A 29 -18.224 6.352 6.179 1.00 0.00 C ATOM 428 C PHE A 29 -17.289 5.274 6.725 1.00 0.00 C ATOM 429 O PHE A 29 -16.372 4.835 6.033 1.00 0.00 O ATOM 430 CB PHE A 29 -18.603 6.024 4.733 1.00 0.00 C ATOM 431 CG PHE A 29 -19.173 4.648 4.554 1.00 0.00 C ATOM 432 CD1 PHE A 29 -20.029 4.111 5.500 1.00 0.00 C ATOM 433 CD2 PHE A 29 -18.847 3.886 3.442 1.00 0.00 C ATOM 434 CE1 PHE A 29 -20.547 2.844 5.343 1.00 0.00 C ATOM 435 CE2 PHE A 29 -19.364 2.616 3.281 1.00 0.00 C ATOM 436 CZ PHE A 29 -20.217 2.095 4.235 1.00 0.00 C ATOM 0 H PHE A 29 -17.418 8.084 5.330 1.00 0.00 H new ATOM 0 HA PHE A 29 -19.127 6.380 6.789 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -19.330 6.757 4.383 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -17.719 6.126 4.103 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -20.294 4.692 6.371 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -18.181 4.291 2.694 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -21.213 2.437 6.090 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -19.102 2.031 2.412 1.00 0.00 H new ATOM 0 HZ PHE A 29 -20.624 1.102 4.112 1.00 0.00 H new ATOM 446 N ALA A 30 -17.523 4.851 7.963 1.00 0.00 N ATOM 447 CA ALA A 30 -16.688 3.824 8.573 1.00 0.00 C ATOM 448 C ALA A 30 -17.334 2.449 8.465 1.00 0.00 C ATOM 449 O ALA A 30 -18.533 2.296 8.682 1.00 0.00 O ATOM 450 CB ALA A 30 -16.387 4.154 10.031 1.00 0.00 C ATOM 0 H ALA A 30 -18.275 5.199 8.557 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.747 3.802 8.024 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.762 3.370 10.460 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -15.862 5.108 10.087 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.321 4.220 10.589 1.00 0.00 H new ATOM 456 N ALA A 31 -16.521 1.451 8.134 1.00 0.00 N ATOM 457 CA ALA A 31 -16.994 0.078 8.001 1.00 0.00 C ATOM 458 C ALA A 31 -15.997 -0.891 8.636 1.00 0.00 C ATOM 459 O ALA A 31 -14.786 -0.708 8.521 1.00 0.00 O ATOM 460 CB ALA A 31 -17.220 -0.262 6.533 1.00 0.00 C ATOM 0 H ALA A 31 -15.524 1.569 7.952 1.00 0.00 H new ATOM 0 HA ALA A 31 -17.945 -0.019 8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -17.573 -1.290 6.448 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -17.965 0.414 6.114 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -16.283 -0.153 5.986 1.00 0.00 H new ATOM 466 N SER A 32 -16.508 -1.909 9.327 1.00 0.00 N ATOM 467 CA SER A 32 -15.647 -2.879 9.998 1.00 0.00 C ATOM 468 C SER A 32 -15.579 -4.210 9.251 1.00 0.00 C ATOM 469 O SER A 32 -16.528 -4.608 8.577 1.00 0.00 O ATOM 470 CB SER A 32 -16.125 -3.111 11.430 1.00 0.00 C ATOM 471 OG SER A 32 -17.330 -3.855 11.451 1.00 0.00 O ATOM 0 H SER A 32 -17.507 -2.082 9.436 1.00 0.00 H new ATOM 0 HA SER A 32 -14.641 -2.458 10.011 1.00 0.00 H new ATOM 0 HB2 SER A 32 -15.356 -3.642 11.992 1.00 0.00 H new ATOM 0 HB3 SER A 32 -16.277 -2.152 11.926 1.00 0.00 H new ATOM 0 HG SER A 32 -18.067 -3.293 11.133 1.00 0.00 H new ATOM 477 N ARG A 33 -14.443 -4.893 9.390 1.00 0.00 N ATOM 478 CA ARG A 33 -14.227 -6.183 8.749 1.00 0.00 C ATOM 479 C ARG A 33 -15.006 -7.289 9.453 1.00 0.00 C ATOM 480 O ARG A 33 -14.939 -7.416 10.673 1.00 0.00 O ATOM 481 CB ARG A 33 -12.735 -6.520 8.765 1.00 0.00 C ATOM 482 CG ARG A 33 -11.861 -5.440 8.147 1.00 0.00 C ATOM 483 CD ARG A 33 -10.487 -5.385 8.803 1.00 0.00 C ATOM 484 NE ARG A 33 -9.930 -6.718 9.031 1.00 0.00 N ATOM 485 CZ ARG A 33 -8.665 -7.056 8.777 1.00 0.00 C ATOM 486 NH1 ARG A 33 -7.810 -6.165 8.290 1.00 0.00 N ATOM 487 NH2 ARG A 33 -8.251 -8.294 9.016 1.00 0.00 N ATOM 0 H ARG A 33 -13.653 -4.567 9.947 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.583 -6.115 7.721 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.419 -6.686 9.795 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.576 -7.455 8.228 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.748 -5.630 7.080 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.352 -4.472 8.248 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.808 -4.812 8.172 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.561 -4.856 9.753 1.00 0.00 H new ATOM 0 HE ARG A 33 -10.549 -7.435 9.409 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -8.118 -5.210 8.106 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -6.845 -6.435 8.100 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.900 -8.985 9.393 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.284 -8.555 8.822 1.00 0.00 H new ATOM 501 N LEU A 34 -15.749 -8.076 8.675 1.00 0.00 N ATOM 502 CA LEU A 34 -16.555 -9.186 9.201 1.00 0.00 C ATOM 503 C LEU A 34 -15.710 -10.193 9.989 1.00 0.00 C ATOM 504 O LEU A 34 -15.747 -11.393 9.715 1.00 0.00 O ATOM 505 CB LEU A 34 -17.257 -9.904 8.054 1.00 0.00 C ATOM 506 CG LEU A 34 -18.615 -9.319 7.699 1.00 0.00 C ATOM 507 CD1 LEU A 34 -18.705 -9.022 6.220 1.00 0.00 C ATOM 508 CD2 LEU A 34 -19.735 -10.244 8.132 1.00 0.00 C ATOM 0 H LEU A 34 -15.811 -7.965 7.663 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.288 -8.759 9.885 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -16.617 -9.872 7.172 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -17.383 -10.954 8.318 1.00 0.00 H new ATOM 0 HG LEU A 34 -18.726 -8.379 8.240 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -19.686 -8.605 5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.932 -8.304 5.945 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.562 -9.943 5.655 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -20.695 -9.802 7.866 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.627 -11.206 7.630 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -19.689 -10.391 9.211 1.00 0.00 H new ATOM 520 N ASP A 35 -14.952 -9.708 10.957 1.00 0.00 N ATOM 521 CA ASP A 35 -14.103 -10.563 11.769 1.00 0.00 C ATOM 522 C ASP A 35 -13.446 -9.751 12.877 1.00 0.00 C ATOM 523 O ASP A 35 -13.264 -10.233 13.995 1.00 0.00 O ATOM 524 CB ASP A 35 -13.032 -11.224 10.898 1.00 0.00 C ATOM 525 CG ASP A 35 -13.151 -12.736 10.881 1.00 0.00 C ATOM 526 OD1 ASP A 35 -14.251 -13.240 10.573 1.00 0.00 O ATOM 527 OD2 ASP A 35 -12.145 -13.414 11.175 1.00 0.00 O ATOM 0 H ASP A 35 -14.907 -8.719 11.201 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.719 -11.341 12.220 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -13.111 -10.845 9.879 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.045 -10.944 11.266 1.00 0.00 H new ATOM 532 N ILE A 36 -13.083 -8.514 12.546 1.00 0.00 N ATOM 533 CA ILE A 36 -12.435 -7.625 13.497 1.00 0.00 C ATOM 534 C ILE A 36 -13.356 -6.457 13.862 1.00 0.00 C ATOM 535 O ILE A 36 -13.576 -5.554 13.055 1.00 0.00 O ATOM 536 CB ILE A 36 -11.113 -7.075 12.928 1.00 0.00 C ATOM 537 CG1 ILE A 36 -10.431 -8.118 12.037 1.00 0.00 C ATOM 538 CG2 ILE A 36 -10.187 -6.656 14.055 1.00 0.00 C ATOM 539 CD1 ILE A 36 -9.975 -9.353 12.783 1.00 0.00 C ATOM 0 H ILE A 36 -13.229 -8.107 11.622 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.219 -8.206 14.394 1.00 0.00 H new ATOM 0 HB ILE A 36 -11.340 -6.200 12.319 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -11.122 -8.416 11.248 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.570 -7.660 11.551 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.257 -6.270 13.637 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -10.667 -5.880 14.651 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.970 -7.517 14.687 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -9.502 -10.045 12.086 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -9.259 -9.069 13.554 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -10.835 -9.836 13.247 1.00 0.00 H new ATOM 551 N PRO A 37 -13.926 -6.476 15.081 1.00 0.00 N ATOM 552 CA PRO A 37 -14.852 -5.431 15.552 1.00 0.00 C ATOM 553 C PRO A 37 -14.243 -4.029 15.576 1.00 0.00 C ATOM 554 O PRO A 37 -14.745 -3.118 14.916 1.00 0.00 O ATOM 555 CB PRO A 37 -15.202 -5.874 16.978 1.00 0.00 C ATOM 556 CG PRO A 37 -14.900 -7.331 17.015 1.00 0.00 C ATOM 557 CD PRO A 37 -13.736 -7.531 16.093 1.00 0.00 C ATOM 0 HA PRO A 37 -15.707 -5.344 14.882 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -14.612 -5.330 17.716 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.251 -5.683 17.204 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -14.657 -7.654 18.027 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.760 -7.917 16.691 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -12.785 -7.423 16.615 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.742 -8.525 15.645 1.00 0.00 H new ATOM 565 N ASP A 38 -13.176 -3.852 16.350 1.00 0.00 N ATOM 566 CA ASP A 38 -12.525 -2.546 16.472 1.00 0.00 C ATOM 567 C ASP A 38 -11.840 -2.111 15.177 1.00 0.00 C ATOM 568 O ASP A 38 -11.204 -1.058 15.134 1.00 0.00 O ATOM 569 CB ASP A 38 -11.502 -2.568 17.611 1.00 0.00 C ATOM 570 CG ASP A 38 -10.492 -3.689 17.465 1.00 0.00 C ATOM 571 OD1 ASP A 38 -9.591 -3.570 16.610 1.00 0.00 O ATOM 572 OD2 ASP A 38 -10.604 -4.688 18.208 1.00 0.00 O ATOM 0 H ASP A 38 -12.743 -4.593 16.902 1.00 0.00 H new ATOM 0 HA ASP A 38 -13.309 -1.821 16.690 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.978 -1.613 17.642 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -12.024 -2.676 18.562 1.00 0.00 H new ATOM 577 N ALA A 39 -11.966 -2.912 14.122 1.00 0.00 N ATOM 578 CA ALA A 39 -11.348 -2.586 12.844 1.00 0.00 C ATOM 579 C ALA A 39 -12.308 -1.825 11.939 1.00 0.00 C ATOM 580 O ALA A 39 -13.078 -2.424 11.198 1.00 0.00 O ATOM 581 CB ALA A 39 -10.872 -3.851 12.152 1.00 0.00 C ATOM 0 H ALA A 39 -12.489 -3.788 14.128 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.491 -1.942 13.043 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.412 -3.593 11.198 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -10.141 -4.357 12.782 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -11.721 -4.512 11.978 1.00 0.00 H new ATOM 587 N TRP A 40 -12.239 -0.502 11.995 1.00 0.00 N ATOM 588 CA TRP A 40 -13.087 0.345 11.167 1.00 0.00 C ATOM 589 C TRP A 40 -12.318 0.816 9.942 1.00 0.00 C ATOM 590 O TRP A 40 -11.092 0.854 9.951 1.00 0.00 O ATOM 591 CB TRP A 40 -13.611 1.521 11.984 1.00 0.00 C ATOM 592 CG TRP A 40 -14.714 1.102 12.906 1.00 0.00 C ATOM 593 CD1 TRP A 40 -14.595 0.619 14.176 1.00 0.00 C ATOM 594 CD2 TRP A 40 -16.109 1.098 12.608 1.00 0.00 C ATOM 595 NE1 TRP A 40 -15.842 0.330 14.688 1.00 0.00 N ATOM 596 CE2 TRP A 40 -16.786 0.620 13.744 1.00 0.00 C ATOM 597 CE3 TRP A 40 -16.847 1.462 11.490 1.00 0.00 C ATOM 598 CZ2 TRP A 40 -18.174 0.500 13.785 1.00 0.00 C ATOM 599 CZ3 TRP A 40 -18.218 1.341 11.533 1.00 0.00 C ATOM 600 CH2 TRP A 40 -18.873 0.866 12.672 1.00 0.00 C ATOM 0 H TRP A 40 -11.603 0.009 12.607 1.00 0.00 H new ATOM 0 HA TRP A 40 -13.946 -0.231 10.822 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -12.796 1.954 12.564 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -13.973 2.299 11.312 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -13.662 0.483 14.703 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -16.029 -0.040 15.620 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -16.355 1.833 10.603 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -18.678 0.131 14.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -18.800 1.620 10.667 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -19.950 0.787 12.671 1.00 0.00 H new ATOM 611 N GLN A 41 -13.032 1.141 8.878 1.00 0.00 N ATOM 612 CA GLN A 41 -12.388 1.573 7.648 1.00 0.00 C ATOM 613 C GLN A 41 -13.382 2.286 6.730 1.00 0.00 C ATOM 614 O GLN A 41 -14.204 3.070 7.190 1.00 0.00 O ATOM 615 CB GLN A 41 -11.758 0.355 6.953 1.00 0.00 C ATOM 616 CG GLN A 41 -10.286 0.174 7.263 1.00 0.00 C ATOM 617 CD GLN A 41 -10.002 -1.117 8.001 1.00 0.00 C ATOM 618 OE1 GLN A 41 -9.959 -1.148 9.231 1.00 0.00 O ATOM 619 NE2 GLN A 41 -9.811 -2.193 7.251 1.00 0.00 N ATOM 0 H GLN A 41 -14.051 1.115 8.840 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.602 2.290 7.885 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -12.297 -0.543 7.253 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -11.884 0.457 5.875 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.718 0.189 6.333 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.938 1.015 7.863 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -9.856 -2.121 6.235 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -9.619 -3.093 7.690 1.00 0.00 H new ATOM 628 N MET A 42 -13.303 2.020 5.436 1.00 0.00 N ATOM 629 CA MET A 42 -14.186 2.637 4.472 1.00 0.00 C ATOM 630 C MET A 42 -13.894 2.070 3.090 1.00 0.00 C ATOM 631 O MET A 42 -12.853 1.452 2.876 1.00 0.00 O ATOM 632 CB MET A 42 -14.015 4.161 4.485 1.00 0.00 C ATOM 633 CG MET A 42 -12.622 4.628 4.102 1.00 0.00 C ATOM 634 SD MET A 42 -12.362 6.381 4.446 1.00 0.00 S ATOM 635 CE MET A 42 -10.618 6.391 4.852 1.00 0.00 C ATOM 0 H MET A 42 -12.627 1.373 5.030 1.00 0.00 H new ATOM 0 HA MET A 42 -15.221 2.417 4.735 1.00 0.00 H new ATOM 0 HB2 MET A 42 -14.737 4.603 3.799 1.00 0.00 H new ATOM 0 HB3 MET A 42 -14.252 4.535 5.481 1.00 0.00 H new ATOM 0 HG2 MET A 42 -11.883 4.041 4.647 1.00 0.00 H new ATOM 0 HG3 MET A 42 -12.459 4.441 3.041 1.00 0.00 H new ATOM 0 HE1 MET A 42 -10.477 6.828 5.841 1.00 0.00 H new ATOM 0 HE2 MET A 42 -10.238 5.369 4.849 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.076 6.982 4.114 1.00 0.00 H new ATOM 645 N PRO A 43 -14.814 2.255 2.139 1.00 0.00 N ATOM 646 CA PRO A 43 -14.670 1.751 0.776 1.00 0.00 C ATOM 647 C PRO A 43 -13.243 1.850 0.242 1.00 0.00 C ATOM 648 O PRO A 43 -12.602 2.899 0.321 1.00 0.00 O ATOM 649 CB PRO A 43 -15.619 2.641 -0.034 1.00 0.00 C ATOM 650 CG PRO A 43 -16.235 3.597 0.949 1.00 0.00 C ATOM 651 CD PRO A 43 -16.081 2.962 2.296 1.00 0.00 C ATOM 0 HA PRO A 43 -14.903 0.688 0.717 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.079 3.178 -0.814 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -16.385 2.044 -0.530 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -15.737 4.566 0.915 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -17.286 3.771 0.718 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -16.042 3.701 3.096 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.903 2.285 2.527 1.00 0.00 H new ATOM 659 N GLN A 44 -12.757 0.738 -0.301 1.00 0.00 N ATOM 660 CA GLN A 44 -11.410 0.665 -0.854 1.00 0.00 C ATOM 661 C GLN A 44 -11.192 -0.687 -1.529 1.00 0.00 C ATOM 662 O GLN A 44 -11.655 -1.716 -1.036 1.00 0.00 O ATOM 663 CB GLN A 44 -10.377 0.872 0.259 1.00 0.00 C ATOM 664 CG GLN A 44 -8.942 0.594 -0.169 1.00 0.00 C ATOM 665 CD GLN A 44 -8.417 -0.723 0.366 1.00 0.00 C ATOM 666 OE1 GLN A 44 -8.224 -0.884 1.567 1.00 0.00 O ATOM 667 NE2 GLN A 44 -8.177 -1.671 -0.531 1.00 0.00 N ATOM 0 H GLN A 44 -13.283 -0.133 -0.370 1.00 0.00 H new ATOM 0 HA GLN A 44 -11.290 1.452 -1.599 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -10.446 1.899 0.618 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -10.627 0.223 1.098 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.887 0.587 -1.258 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -8.300 1.404 0.178 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -8.352 -1.493 -1.520 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -7.817 -2.577 -0.231 1.00 0.00 H new ATOM 676 N GLY A 45 -10.486 -0.683 -2.653 1.00 0.00 N ATOM 677 CA GLY A 45 -10.224 -1.922 -3.362 1.00 0.00 C ATOM 678 C GLY A 45 -9.068 -1.798 -4.332 1.00 0.00 C ATOM 679 O GLY A 45 -8.205 -0.938 -4.167 1.00 0.00 O ATOM 0 H GLY A 45 -10.091 0.152 -3.085 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.007 -2.711 -2.642 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.120 -2.223 -3.905 1.00 0.00 H new ATOM 683 N GLY A 46 -9.045 -2.661 -5.345 1.00 0.00 N ATOM 684 CA GLY A 46 -7.970 -2.617 -6.319 1.00 0.00 C ATOM 685 C GLY A 46 -8.454 -2.321 -7.722 1.00 0.00 C ATOM 686 O GLY A 46 -9.484 -2.834 -8.158 1.00 0.00 O ATOM 0 H GLY A 46 -9.746 -3.384 -5.507 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -7.249 -1.856 -6.021 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.445 -3.572 -6.316 1.00 0.00 H new ATOM 690 N ILE A 47 -7.702 -1.485 -8.425 1.00 0.00 N ATOM 691 CA ILE A 47 -8.035 -1.099 -9.788 1.00 0.00 C ATOM 692 C ILE A 47 -7.862 -2.262 -10.760 1.00 0.00 C ATOM 693 O ILE A 47 -6.957 -3.083 -10.608 1.00 0.00 O ATOM 694 CB ILE A 47 -7.154 0.074 -10.253 1.00 0.00 C ATOM 695 CG1 ILE A 47 -7.192 1.206 -9.228 1.00 0.00 C ATOM 696 CG2 ILE A 47 -7.605 0.575 -11.611 1.00 0.00 C ATOM 697 CD1 ILE A 47 -6.221 2.327 -9.531 1.00 0.00 C ATOM 0 H ILE A 47 -6.848 -1.057 -8.068 1.00 0.00 H new ATOM 0 HA ILE A 47 -9.082 -0.795 -9.785 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.127 -0.281 -10.342 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -8.202 1.613 -9.185 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.969 0.800 -8.241 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.970 1.404 -11.922 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.531 -0.232 -12.340 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -8.639 0.914 -11.549 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.302 3.096 -8.763 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.204 1.934 -9.545 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -6.457 2.759 -10.503 1.00 0.00 H new ATOM 709 N ASP A 48 -8.730 -2.320 -11.766 1.00 0.00 N ATOM 710 CA ASP A 48 -8.667 -3.375 -12.773 1.00 0.00 C ATOM 711 C ASP A 48 -7.431 -3.211 -13.654 1.00 0.00 C ATOM 712 O ASP A 48 -6.592 -2.343 -13.409 1.00 0.00 O ATOM 713 CB ASP A 48 -9.927 -3.365 -13.640 1.00 0.00 C ATOM 714 CG ASP A 48 -11.199 -3.306 -12.816 1.00 0.00 C ATOM 715 OD1 ASP A 48 -11.284 -4.029 -11.802 1.00 0.00 O ATOM 716 OD2 ASP A 48 -12.111 -2.537 -13.189 1.00 0.00 O ATOM 0 H ASP A 48 -9.485 -1.649 -11.906 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.601 -4.331 -12.254 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -9.894 -2.508 -14.313 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.943 -4.259 -14.263 1.00 0.00 H new ATOM 721 N GLU A 49 -7.330 -4.048 -14.682 1.00 0.00 N ATOM 722 CA GLU A 49 -6.201 -3.998 -15.609 1.00 0.00 C ATOM 723 C GLU A 49 -5.943 -2.568 -16.087 1.00 0.00 C ATOM 724 O GLU A 49 -4.993 -1.922 -15.647 1.00 0.00 O ATOM 725 CB GLU A 49 -6.448 -4.923 -16.806 1.00 0.00 C ATOM 726 CG GLU A 49 -5.182 -5.579 -17.336 1.00 0.00 C ATOM 727 CD GLU A 49 -5.449 -6.496 -18.514 1.00 0.00 C ATOM 728 OE1 GLU A 49 -6.065 -7.564 -18.311 1.00 0.00 O ATOM 729 OE2 GLU A 49 -5.041 -6.146 -19.642 1.00 0.00 O ATOM 0 H GLU A 49 -8.017 -4.771 -14.896 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.314 -4.342 -15.077 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.156 -5.699 -16.515 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.914 -4.350 -17.608 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.475 -4.806 -17.635 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.711 -6.150 -16.536 1.00 0.00 H new ATOM 736 N GLY A 50 -6.795 -2.081 -16.987 1.00 0.00 N ATOM 737 CA GLY A 50 -6.638 -0.733 -17.504 1.00 0.00 C ATOM 738 C GLY A 50 -7.805 0.161 -17.140 1.00 0.00 C ATOM 739 O GLY A 50 -8.445 0.745 -18.015 1.00 0.00 O ATOM 0 H GLY A 50 -7.590 -2.596 -17.366 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.717 -0.301 -17.113 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -6.537 -0.772 -18.589 1.00 0.00 H new ATOM 743 N GLU A 51 -8.078 0.268 -15.847 1.00 0.00 N ATOM 744 CA GLU A 51 -9.174 1.097 -15.360 1.00 0.00 C ATOM 745 C GLU A 51 -8.644 2.258 -14.523 1.00 0.00 C ATOM 746 O GLU A 51 -7.626 2.132 -13.844 1.00 0.00 O ATOM 747 CB GLU A 51 -10.145 0.255 -14.530 1.00 0.00 C ATOM 748 CG GLU A 51 -11.487 0.929 -14.293 1.00 0.00 C ATOM 749 CD GLU A 51 -12.244 1.190 -15.580 1.00 0.00 C ATOM 750 OE1 GLU A 51 -11.947 2.203 -16.248 1.00 0.00 O ATOM 751 OE2 GLU A 51 -13.134 0.383 -15.920 1.00 0.00 O ATOM 0 H GLU A 51 -7.554 -0.210 -15.114 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.703 1.505 -16.222 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.310 -0.697 -15.035 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.686 0.030 -13.567 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -12.094 0.302 -13.640 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -11.328 1.873 -13.771 1.00 0.00 H new ATOM 758 N ASP A 52 -9.342 3.387 -14.574 1.00 0.00 N ATOM 759 CA ASP A 52 -8.939 4.564 -13.814 1.00 0.00 C ATOM 760 C ASP A 52 -9.179 4.348 -12.321 1.00 0.00 C ATOM 761 O ASP A 52 -9.966 3.485 -11.932 1.00 0.00 O ATOM 762 CB ASP A 52 -9.708 5.797 -14.292 1.00 0.00 C ATOM 763 CG ASP A 52 -9.279 6.246 -15.676 1.00 0.00 C ATOM 764 OD1 ASP A 52 -9.757 5.653 -16.667 1.00 0.00 O ATOM 765 OD2 ASP A 52 -8.466 7.187 -15.768 1.00 0.00 O ATOM 0 H ASP A 52 -10.187 3.512 -15.132 1.00 0.00 H new ATOM 0 HA ASP A 52 -7.874 4.726 -13.977 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.775 5.576 -14.299 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.557 6.613 -13.585 1.00 0.00 H new ATOM 770 N PRO A 53 -8.508 5.133 -11.461 1.00 0.00 N ATOM 771 CA PRO A 53 -8.658 5.023 -10.007 1.00 0.00 C ATOM 772 C PRO A 53 -10.027 5.492 -9.548 1.00 0.00 C ATOM 773 O PRO A 53 -10.715 4.810 -8.793 1.00 0.00 O ATOM 774 CB PRO A 53 -7.574 5.956 -9.452 1.00 0.00 C ATOM 775 CG PRO A 53 -6.684 6.271 -10.608 1.00 0.00 C ATOM 776 CD PRO A 53 -7.556 6.189 -11.824 1.00 0.00 C ATOM 0 HA PRO A 53 -8.562 3.992 -9.666 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.013 6.863 -9.037 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -7.017 5.475 -8.648 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.246 7.264 -10.506 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -5.857 5.563 -10.670 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -8.058 7.135 -12.028 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -6.985 5.932 -12.716 1.00 0.00 H new ATOM 784 N ARG A 54 -10.408 6.665 -10.024 1.00 0.00 N ATOM 785 CA ARG A 54 -11.698 7.258 -9.687 1.00 0.00 C ATOM 786 C ARG A 54 -12.824 6.277 -9.951 1.00 0.00 C ATOM 787 O ARG A 54 -13.711 6.089 -9.125 1.00 0.00 O ATOM 788 CB ARG A 54 -11.931 8.505 -10.530 1.00 0.00 C ATOM 789 CG ARG A 54 -13.131 9.340 -10.095 1.00 0.00 C ATOM 790 CD ARG A 54 -13.109 9.659 -8.610 1.00 0.00 C ATOM 791 NE ARG A 54 -12.781 11.064 -8.364 1.00 0.00 N ATOM 792 CZ ARG A 54 -13.443 12.095 -8.889 1.00 0.00 C ATOM 793 NH1 ARG A 54 -14.509 11.897 -9.657 1.00 0.00 N ATOM 794 NH2 ARG A 54 -13.043 13.334 -8.635 1.00 0.00 N ATOM 0 H ARG A 54 -9.839 7.233 -10.651 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.685 7.517 -8.628 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.037 9.127 -10.492 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.068 8.207 -11.569 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.148 10.270 -10.663 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -14.049 8.804 -10.335 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -14.082 9.430 -8.174 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.378 9.022 -8.111 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.993 11.268 -7.750 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.829 10.948 -9.850 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -15.007 12.694 -10.053 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -12.231 13.496 -8.039 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -13.548 14.125 -9.035 1.00 0.00 H new ATOM 808 N ASN A 55 -12.763 5.645 -11.106 1.00 0.00 N ATOM 809 CA ASN A 55 -13.775 4.667 -11.480 1.00 0.00 C ATOM 810 C ASN A 55 -13.723 3.482 -10.531 1.00 0.00 C ATOM 811 O ASN A 55 -14.753 3.015 -10.046 1.00 0.00 O ATOM 812 CB ASN A 55 -13.578 4.179 -12.909 1.00 0.00 C ATOM 813 CG ASN A 55 -13.994 5.204 -13.947 1.00 0.00 C ATOM 814 OD1 ASN A 55 -13.202 6.261 -14.091 1.00 0.00 O flip ATOM 815 ND2 ASN A 55 -15.015 5.047 -14.616 1.00 0.00 N flip ATOM 0 H ASN A 55 -12.030 5.787 -11.801 1.00 0.00 H new ATOM 0 HA ASN A 55 -14.748 5.153 -11.416 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.529 3.923 -13.059 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -14.153 3.265 -13.058 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -15.596 4.221 -14.474 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -15.280 5.743 -15.312 1.00 0.00 H new ATOM 822 N ALA A 56 -12.513 3.008 -10.259 1.00 0.00 N ATOM 823 CA ALA A 56 -12.329 1.885 -9.356 1.00 0.00 C ATOM 824 C ALA A 56 -12.822 2.257 -7.971 1.00 0.00 C ATOM 825 O ALA A 56 -13.549 1.496 -7.334 1.00 0.00 O ATOM 826 CB ALA A 56 -10.870 1.457 -9.316 1.00 0.00 C ATOM 0 H ALA A 56 -11.649 3.384 -10.650 1.00 0.00 H new ATOM 0 HA ALA A 56 -12.912 1.039 -9.721 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -10.756 0.615 -8.633 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -10.550 1.160 -10.315 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.256 2.289 -8.971 1.00 0.00 H new ATOM 832 N ALA A 57 -12.443 3.446 -7.518 1.00 0.00 N ATOM 833 CA ALA A 57 -12.871 3.928 -6.217 1.00 0.00 C ATOM 834 C ALA A 57 -14.390 3.947 -6.148 1.00 0.00 C ATOM 835 O ALA A 57 -14.997 3.351 -5.260 1.00 0.00 O ATOM 836 CB ALA A 57 -12.306 5.314 -5.944 1.00 0.00 C ATOM 0 H ALA A 57 -11.842 4.090 -8.033 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.491 3.253 -5.451 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -12.639 5.656 -4.964 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.217 5.273 -5.963 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.657 6.007 -6.709 1.00 0.00 H new ATOM 842 N ILE A 58 -14.995 4.640 -7.110 1.00 0.00 N ATOM 843 CA ILE A 58 -16.445 4.747 -7.184 1.00 0.00 C ATOM 844 C ILE A 58 -17.104 3.368 -7.245 1.00 0.00 C ATOM 845 O ILE A 58 -18.024 3.085 -6.479 1.00 0.00 O ATOM 846 CB ILE A 58 -16.894 5.582 -8.404 1.00 0.00 C ATOM 847 CG1 ILE A 58 -16.253 6.977 -8.378 1.00 0.00 C ATOM 848 CG2 ILE A 58 -18.413 5.699 -8.437 1.00 0.00 C ATOM 849 CD1 ILE A 58 -16.152 7.619 -9.743 1.00 0.00 C ATOM 0 H ILE A 58 -14.499 5.136 -7.850 1.00 0.00 H new ATOM 0 HA ILE A 58 -16.766 5.255 -6.274 1.00 0.00 H new ATOM 0 HB ILE A 58 -16.562 5.070 -9.307 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -16.836 7.624 -7.723 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -15.255 6.902 -7.946 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -18.714 6.290 -9.302 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -18.853 4.704 -8.506 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -18.760 6.187 -7.526 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -15.690 8.602 -9.650 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -15.544 6.993 -10.396 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -17.149 7.726 -10.169 1.00 0.00 H new ATOM 861 N ARG A 59 -16.645 2.512 -8.164 1.00 0.00 N ATOM 862 CA ARG A 59 -17.228 1.176 -8.295 1.00 0.00 C ATOM 863 C ARG A 59 -16.976 0.329 -7.049 1.00 0.00 C ATOM 864 O ARG A 59 -17.919 -0.192 -6.455 1.00 0.00 O ATOM 865 CB ARG A 59 -16.711 0.466 -9.553 1.00 0.00 C ATOM 866 CG ARG A 59 -15.252 0.057 -9.486 1.00 0.00 C ATOM 867 CD ARG A 59 -14.726 -0.337 -10.859 1.00 0.00 C ATOM 868 NE ARG A 59 -14.728 -1.786 -11.059 1.00 0.00 N ATOM 869 CZ ARG A 59 -15.399 -2.410 -12.029 1.00 0.00 C ATOM 870 NH1 ARG A 59 -16.156 -1.727 -12.881 1.00 0.00 N ATOM 871 NH2 ARG A 59 -15.311 -3.727 -12.151 1.00 0.00 N ATOM 0 H ARG A 59 -15.887 2.716 -8.815 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.306 1.301 -8.397 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -17.317 -0.423 -9.729 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -16.853 1.124 -10.411 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -14.659 0.881 -9.089 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -15.138 -0.779 -8.796 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -15.337 0.135 -11.629 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -13.712 0.043 -10.980 1.00 0.00 H new ATOM 0 HE ARG A 59 -14.181 -2.357 -10.415 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.229 -0.713 -12.798 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -16.664 -2.217 -13.618 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -14.731 -4.261 -11.504 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -15.823 -4.206 -12.892 1.00 0.00 H new ATOM 885 N GLU A 60 -15.709 0.196 -6.640 1.00 0.00 N ATOM 886 CA GLU A 60 -15.377 -0.587 -5.447 1.00 0.00 C ATOM 887 C GLU A 60 -16.320 -0.220 -4.307 1.00 0.00 C ATOM 888 O GLU A 60 -16.848 -1.087 -3.609 1.00 0.00 O ATOM 889 CB GLU A 60 -13.923 -0.346 -5.024 1.00 0.00 C ATOM 890 CG GLU A 60 -12.958 -1.430 -5.487 1.00 0.00 C ATOM 891 CD GLU A 60 -13.114 -1.765 -6.958 1.00 0.00 C ATOM 892 OE1 GLU A 60 -12.720 -0.934 -7.801 1.00 0.00 O ATOM 893 OE2 GLU A 60 -13.634 -2.860 -7.264 1.00 0.00 O ATOM 0 H GLU A 60 -14.907 0.615 -7.111 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.494 -1.644 -5.685 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -13.594 0.614 -5.422 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.878 -0.273 -3.937 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.935 -1.104 -5.300 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -13.119 -2.331 -4.895 1.00 0.00 H new ATOM 900 N LEU A 61 -16.533 1.082 -4.145 1.00 0.00 N ATOM 901 CA LEU A 61 -17.420 1.601 -3.114 1.00 0.00 C ATOM 902 C LEU A 61 -18.778 0.909 -3.180 1.00 0.00 C ATOM 903 O LEU A 61 -19.278 0.395 -2.179 1.00 0.00 O ATOM 904 CB LEU A 61 -17.584 3.119 -3.286 1.00 0.00 C ATOM 905 CG LEU A 61 -18.763 3.748 -2.540 1.00 0.00 C ATOM 906 CD1 LEU A 61 -18.761 3.317 -1.086 1.00 0.00 C ATOM 907 CD2 LEU A 61 -18.713 5.267 -2.651 1.00 0.00 C ATOM 0 H LEU A 61 -16.098 1.802 -4.722 1.00 0.00 H new ATOM 0 HA LEU A 61 -16.981 1.400 -2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -16.667 3.605 -2.954 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -17.693 3.336 -4.349 1.00 0.00 H new ATOM 0 HG LEU A 61 -19.689 3.401 -2.999 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -19.606 3.773 -0.570 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -18.844 2.232 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.832 3.636 -0.613 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -19.558 5.699 -2.115 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -17.783 5.633 -2.217 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -18.762 5.557 -3.701 1.00 0.00 H new ATOM 919 N ARG A 62 -19.362 0.896 -4.373 1.00 0.00 N ATOM 920 CA ARG A 62 -20.657 0.264 -4.589 1.00 0.00 C ATOM 921 C ARG A 62 -20.587 -1.244 -4.365 1.00 0.00 C ATOM 922 O ARG A 62 -21.266 -1.789 -3.502 1.00 0.00 O ATOM 923 CB ARG A 62 -21.152 0.552 -6.006 1.00 0.00 C ATOM 924 CG ARG A 62 -22.636 0.278 -6.190 1.00 0.00 C ATOM 925 CD ARG A 62 -22.990 0.078 -7.653 1.00 0.00 C ATOM 926 NE ARG A 62 -22.336 1.058 -8.519 1.00 0.00 N ATOM 927 CZ ARG A 62 -22.278 0.954 -9.845 1.00 0.00 C ATOM 928 NH1 ARG A 62 -22.848 -0.072 -10.462 1.00 0.00 N ATOM 929 NH2 ARG A 62 -21.653 1.882 -10.557 1.00 0.00 N ATOM 0 H ARG A 62 -18.956 1.318 -5.208 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.356 0.683 -3.865 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.949 1.595 -6.250 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.587 -0.056 -6.712 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -22.916 -0.610 -5.623 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.213 1.110 -5.786 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -22.700 -0.927 -7.961 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -24.071 0.150 -7.777 1.00 0.00 H new ATOM 0 HE ARG A 62 -21.899 1.869 -8.081 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -23.334 -0.787 -9.920 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -22.800 -0.146 -11.478 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -21.216 2.676 -10.089 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -21.609 1.802 -11.573 1.00 0.00 H new ATOM 943 N GLU A 63 -19.774 -1.914 -5.166 1.00 0.00 N ATOM 944 CA GLU A 63 -19.626 -3.361 -5.076 1.00 0.00 C ATOM 945 C GLU A 63 -19.329 -3.821 -3.650 1.00 0.00 C ATOM 946 O GLU A 63 -19.562 -4.979 -3.305 1.00 0.00 O ATOM 947 CB GLU A 63 -18.518 -3.832 -6.016 1.00 0.00 C ATOM 948 CG GLU A 63 -18.662 -3.299 -7.433 1.00 0.00 C ATOM 949 CD GLU A 63 -18.828 -4.405 -8.456 1.00 0.00 C ATOM 950 OE1 GLU A 63 -18.106 -5.417 -8.356 1.00 0.00 O ATOM 951 OE2 GLU A 63 -19.684 -4.259 -9.356 1.00 0.00 O ATOM 0 H GLU A 63 -19.203 -1.478 -5.890 1.00 0.00 H new ATOM 0 HA GLU A 63 -20.576 -3.806 -5.374 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -17.554 -3.520 -5.614 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -18.514 -4.922 -6.044 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -19.523 -2.632 -7.481 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -17.784 -2.704 -7.685 1.00 0.00 H new ATOM 958 N GLU A 64 -18.784 -2.927 -2.837 1.00 0.00 N ATOM 959 CA GLU A 64 -18.424 -3.272 -1.467 1.00 0.00 C ATOM 960 C GLU A 64 -19.488 -2.869 -0.443 1.00 0.00 C ATOM 961 O GLU A 64 -19.717 -3.599 0.523 1.00 0.00 O ATOM 962 CB GLU A 64 -17.089 -2.621 -1.102 1.00 0.00 C ATOM 963 CG GLU A 64 -15.889 -3.304 -1.736 1.00 0.00 C ATOM 964 CD GLU A 64 -14.587 -2.582 -1.449 1.00 0.00 C ATOM 965 OE1 GLU A 64 -14.247 -2.421 -0.258 1.00 0.00 O ATOM 966 OE2 GLU A 64 -13.910 -2.174 -2.415 1.00 0.00 O ATOM 0 H GLU A 64 -18.582 -1.962 -3.099 1.00 0.00 H new ATOM 0 HA GLU A 64 -18.343 -4.358 -1.429 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -17.107 -1.576 -1.410 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -16.973 -2.632 -0.018 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -15.821 -4.327 -1.367 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -16.037 -3.363 -2.814 1.00 0.00 H new ATOM 973 N THR A 65 -20.129 -1.712 -0.624 1.00 0.00 N ATOM 974 CA THR A 65 -21.139 -1.268 0.340 1.00 0.00 C ATOM 975 C THR A 65 -22.440 -0.822 -0.323 1.00 0.00 C ATOM 976 O THR A 65 -23.399 -0.481 0.363 1.00 0.00 O ATOM 977 CB THR A 65 -20.579 -0.137 1.207 1.00 0.00 C ATOM 978 OG1 THR A 65 -19.693 0.676 0.458 1.00 0.00 O ATOM 979 CG2 THR A 65 -19.823 -0.638 2.419 1.00 0.00 C ATOM 0 H THR A 65 -19.973 -1.079 -1.408 1.00 0.00 H new ATOM 0 HA THR A 65 -21.379 -2.130 0.963 1.00 0.00 H new ATOM 0 HB THR A 65 -21.447 0.430 1.544 1.00 0.00 H new ATOM 0 HG1 THR A 65 -19.862 0.549 -0.499 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.451 0.211 2.993 1.00 0.00 H new ATOM 0 HG22 THR A 65 -20.489 -1.234 3.043 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.983 -1.253 2.095 1.00 0.00 H new ATOM 987 N GLY A 66 -22.481 -0.821 -1.649 1.00 0.00 N ATOM 988 CA GLY A 66 -23.687 -0.414 -2.350 1.00 0.00 C ATOM 989 C GLY A 66 -23.861 1.092 -2.412 1.00 0.00 C ATOM 990 O GLY A 66 -24.735 1.589 -3.123 1.00 0.00 O ATOM 0 H GLY A 66 -21.704 -1.093 -2.252 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -23.662 -0.813 -3.364 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.553 -0.854 -1.855 1.00 0.00 H new ATOM 994 N VAL A 67 -23.029 1.821 -1.675 1.00 0.00 N ATOM 995 CA VAL A 67 -23.097 3.272 -1.661 1.00 0.00 C ATOM 996 C VAL A 67 -22.911 3.850 -3.053 1.00 0.00 C ATOM 997 O VAL A 67 -21.821 3.799 -3.625 1.00 0.00 O ATOM 998 CB VAL A 67 -22.039 3.878 -0.725 1.00 0.00 C ATOM 999 CG1 VAL A 67 -22.018 5.394 -0.841 1.00 0.00 C ATOM 1000 CG2 VAL A 67 -22.283 3.450 0.712 1.00 0.00 C ATOM 0 H VAL A 67 -22.300 1.427 -1.080 1.00 0.00 H new ATOM 0 HA VAL A 67 -24.090 3.531 -1.294 1.00 0.00 H new ATOM 0 HB VAL A 67 -21.062 3.503 -1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -21.262 5.800 -0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -21.782 5.677 -1.867 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -22.995 5.793 -0.570 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -21.523 3.890 1.357 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -23.269 3.789 1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -22.233 2.363 0.782 1.00 0.00 H new ATOM 1010 N THR A 68 -23.978 4.424 -3.575 1.00 0.00 N ATOM 1011 CA THR A 68 -23.949 5.049 -4.881 1.00 0.00 C ATOM 1012 C THR A 68 -24.346 6.511 -4.751 1.00 0.00 C ATOM 1013 O THR A 68 -23.764 7.384 -5.395 1.00 0.00 O ATOM 1014 CB THR A 68 -24.873 4.314 -5.847 1.00 0.00 C ATOM 1015 OG1 THR A 68 -25.984 3.762 -5.158 1.00 0.00 O ATOM 1016 CG2 THR A 68 -24.177 3.186 -6.580 1.00 0.00 C ATOM 0 H THR A 68 -24.884 4.470 -3.108 1.00 0.00 H new ATOM 0 HA THR A 68 -22.938 4.994 -5.285 1.00 0.00 H new ATOM 0 HB THR A 68 -25.196 5.060 -6.573 1.00 0.00 H new ATOM 0 HG1 THR A 68 -26.565 3.296 -5.795 1.00 0.00 H new ATOM 0 HG21 THR A 68 -24.883 2.699 -7.253 1.00 0.00 H new ATOM 0 HG22 THR A 68 -23.343 3.587 -7.157 1.00 0.00 H new ATOM 0 HG23 THR A 68 -23.803 2.459 -5.859 1.00 0.00 H new ATOM 1024 N SER A 69 -25.332 6.768 -3.893 1.00 0.00 N ATOM 1025 CA SER A 69 -25.804 8.124 -3.643 1.00 0.00 C ATOM 1026 C SER A 69 -24.701 8.981 -3.043 1.00 0.00 C ATOM 1027 O SER A 69 -24.747 9.341 -1.867 1.00 0.00 O ATOM 1028 CB SER A 69 -26.999 8.112 -2.702 1.00 0.00 C ATOM 1029 OG SER A 69 -27.988 7.197 -3.139 1.00 0.00 O ATOM 0 H SER A 69 -25.820 6.049 -3.358 1.00 0.00 H new ATOM 0 HA SER A 69 -26.104 8.550 -4.600 1.00 0.00 H new ATOM 0 HB2 SER A 69 -26.671 7.844 -1.698 1.00 0.00 H new ATOM 0 HB3 SER A 69 -27.427 9.113 -2.642 1.00 0.00 H new ATOM 0 HG SER A 69 -27.867 6.340 -2.679 1.00 0.00 H new ATOM 1035 N ALA A 70 -23.713 9.296 -3.852 1.00 0.00 N ATOM 1036 CA ALA A 70 -22.594 10.103 -3.400 1.00 0.00 C ATOM 1037 C ALA A 70 -21.839 10.707 -4.577 1.00 0.00 C ATOM 1038 O ALA A 70 -21.827 10.152 -5.676 1.00 0.00 O ATOM 1039 CB ALA A 70 -21.655 9.274 -2.534 1.00 0.00 C ATOM 0 H ALA A 70 -23.659 9.006 -4.829 1.00 0.00 H new ATOM 0 HA ALA A 70 -22.991 10.922 -2.800 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -20.822 9.894 -2.204 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -22.196 8.901 -1.665 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -21.274 8.433 -3.113 1.00 0.00 H new ATOM 1045 N GLU A 71 -21.201 11.844 -4.332 1.00 0.00 N ATOM 1046 CA GLU A 71 -20.428 12.528 -5.361 1.00 0.00 C ATOM 1047 C GLU A 71 -19.035 12.850 -4.847 1.00 0.00 C ATOM 1048 O GLU A 71 -18.815 12.916 -3.640 1.00 0.00 O ATOM 1049 CB GLU A 71 -21.129 13.814 -5.826 1.00 0.00 C ATOM 1050 CG GLU A 71 -22.032 14.461 -4.782 1.00 0.00 C ATOM 1051 CD GLU A 71 -23.383 14.856 -5.344 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -24.115 13.962 -5.815 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -23.711 16.062 -5.308 1.00 0.00 O ATOM 0 H GLU A 71 -21.204 12.314 -3.427 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.348 11.859 -6.218 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.370 14.536 -6.128 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.724 13.588 -6.711 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -22.176 13.769 -3.952 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -21.538 15.345 -4.378 1.00 0.00 H new ATOM 1060 N VAL A 72 -18.100 13.043 -5.769 1.00 0.00 N ATOM 1061 CA VAL A 72 -16.721 13.360 -5.412 1.00 0.00 C ATOM 1062 C VAL A 72 -16.553 14.819 -5.029 1.00 0.00 C ATOM 1063 O VAL A 72 -16.988 15.722 -5.745 1.00 0.00 O ATOM 1064 CB VAL A 72 -15.739 13.035 -6.562 1.00 0.00 C ATOM 1065 CG1 VAL A 72 -14.295 13.141 -6.083 1.00 0.00 C ATOM 1066 CG2 VAL A 72 -16.022 11.658 -7.148 1.00 0.00 C ATOM 0 H VAL A 72 -18.271 12.986 -6.773 1.00 0.00 H new ATOM 0 HA VAL A 72 -16.487 12.735 -4.550 1.00 0.00 H new ATOM 0 HB VAL A 72 -15.887 13.770 -7.353 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.620 12.909 -6.907 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.102 14.154 -5.731 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.129 12.436 -5.268 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.318 11.454 -7.955 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -15.912 10.902 -6.370 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -17.039 11.631 -7.539 1.00 0.00 H new ATOM 1076 N ILE A 73 -15.900 15.039 -3.899 1.00 0.00 N ATOM 1077 CA ILE A 73 -15.642 16.384 -3.413 1.00 0.00 C ATOM 1078 C ILE A 73 -14.190 16.753 -3.642 1.00 0.00 C ATOM 1079 O ILE A 73 -13.833 17.929 -3.697 1.00 0.00 O ATOM 1080 CB ILE A 73 -15.926 16.521 -1.903 1.00 0.00 C ATOM 1081 CG1 ILE A 73 -17.088 15.627 -1.463 1.00 0.00 C ATOM 1082 CG2 ILE A 73 -16.209 17.967 -1.546 1.00 0.00 C ATOM 1083 CD1 ILE A 73 -18.150 15.460 -2.515 1.00 0.00 C ATOM 0 H ILE A 73 -15.537 14.298 -3.299 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.309 17.047 -3.964 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.034 16.192 -1.369 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -16.698 14.646 -1.193 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -17.540 16.049 -0.565 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -16.407 18.046 -0.477 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -15.345 18.581 -1.801 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -17.079 18.316 -2.103 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -18.941 14.815 -2.134 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -18.567 16.435 -2.769 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -17.712 15.010 -3.406 1.00 0.00 H new ATOM 1095 N ALA A 74 -13.355 15.734 -3.772 1.00 0.00 N ATOM 1096 CA ALA A 74 -11.936 15.954 -3.990 1.00 0.00 C ATOM 1097 C ALA A 74 -11.208 14.657 -4.307 1.00 0.00 C ATOM 1098 O ALA A 74 -11.798 13.576 -4.320 1.00 0.00 O ATOM 1099 CB ALA A 74 -11.320 16.619 -2.768 1.00 0.00 C ATOM 0 H ALA A 74 -13.634 14.754 -3.731 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.828 16.611 -4.853 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.256 16.781 -2.939 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -11.808 17.577 -2.590 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.454 15.976 -1.898 1.00 0.00 H new ATOM 1105 N GLU A 75 -9.912 14.785 -4.554 1.00 0.00 N ATOM 1106 CA GLU A 75 -9.065 13.643 -4.863 1.00 0.00 C ATOM 1107 C GLU A 75 -7.666 13.865 -4.303 1.00 0.00 C ATOM 1108 O GLU A 75 -7.175 14.992 -4.275 1.00 0.00 O ATOM 1109 CB GLU A 75 -8.995 13.429 -6.376 1.00 0.00 C ATOM 1110 CG GLU A 75 -8.462 14.635 -7.135 1.00 0.00 C ATOM 1111 CD GLU A 75 -9.560 15.425 -7.819 1.00 0.00 C ATOM 1112 OE1 GLU A 75 -10.359 14.813 -8.559 1.00 0.00 O ATOM 1113 OE2 GLU A 75 -9.623 16.655 -7.612 1.00 0.00 O ATOM 0 H GLU A 75 -9.421 15.679 -4.546 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.495 12.753 -4.403 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.359 12.568 -6.584 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -9.991 13.187 -6.747 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.927 15.287 -6.444 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.741 14.301 -7.881 1.00 0.00 H new ATOM 1120 N VAL A 76 -7.029 12.793 -3.851 1.00 0.00 N ATOM 1121 CA VAL A 76 -5.689 12.897 -3.292 1.00 0.00 C ATOM 1122 C VAL A 76 -4.671 13.191 -4.392 1.00 0.00 C ATOM 1123 O VAL A 76 -4.718 12.600 -5.469 1.00 0.00 O ATOM 1124 CB VAL A 76 -5.299 11.614 -2.518 1.00 0.00 C ATOM 1125 CG1 VAL A 76 -3.816 11.595 -2.156 1.00 0.00 C ATOM 1126 CG2 VAL A 76 -6.145 11.493 -1.264 1.00 0.00 C ATOM 0 H VAL A 76 -7.415 11.849 -3.860 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.686 13.726 -2.584 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.487 10.761 -3.171 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.585 10.678 -1.614 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.219 11.638 -3.067 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.584 12.455 -1.528 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.867 10.589 -0.723 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.979 12.362 -0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.198 11.441 -1.539 1.00 0.00 H new ATOM 1136 N PRO A 77 -3.730 14.115 -4.126 1.00 0.00 N ATOM 1137 CA PRO A 77 -2.690 14.495 -5.089 1.00 0.00 C ATOM 1138 C PRO A 77 -1.931 13.284 -5.609 1.00 0.00 C ATOM 1139 O PRO A 77 -2.033 12.921 -6.781 1.00 0.00 O ATOM 1140 CB PRO A 77 -1.752 15.398 -4.268 1.00 0.00 C ATOM 1141 CG PRO A 77 -2.121 15.148 -2.843 1.00 0.00 C ATOM 1142 CD PRO A 77 -3.589 14.857 -2.864 1.00 0.00 C ATOM 0 HA PRO A 77 -3.106 14.982 -5.971 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -0.706 15.152 -4.453 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.885 16.447 -4.531 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -1.559 14.309 -2.432 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -1.900 16.015 -2.221 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.901 14.264 -2.004 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -4.187 15.768 -2.856 1.00 0.00 H new ATOM 1150 N TYR A 78 -1.171 12.670 -4.719 1.00 0.00 N ATOM 1151 CA TYR A 78 -0.379 11.499 -5.049 1.00 0.00 C ATOM 1152 C TYR A 78 -1.116 10.226 -4.664 1.00 0.00 C ATOM 1153 O TYR A 78 -2.271 10.270 -4.248 1.00 0.00 O ATOM 1154 CB TYR A 78 0.959 11.554 -4.309 1.00 0.00 C ATOM 1155 CG TYR A 78 0.849 12.056 -2.882 1.00 0.00 C ATOM 1156 CD1 TYR A 78 -0.191 11.643 -2.051 1.00 0.00 C ATOM 1157 CD2 TYR A 78 1.783 12.943 -2.366 1.00 0.00 C ATOM 1158 CE1 TYR A 78 -0.292 12.099 -0.752 1.00 0.00 C ATOM 1159 CE2 TYR A 78 1.688 13.403 -1.066 1.00 0.00 C ATOM 1160 CZ TYR A 78 0.649 12.979 -0.265 1.00 0.00 C ATOM 1161 OH TYR A 78 0.554 13.435 1.031 1.00 0.00 O ATOM 0 H TYR A 78 -1.086 12.969 -3.748 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.205 11.493 -6.125 1.00 0.00 H new ATOM 0 HB2 TYR A 78 1.400 10.557 -4.301 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.642 12.200 -4.860 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.931 10.954 -2.430 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.598 13.279 -2.990 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -1.104 11.768 -0.121 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.425 14.092 -0.679 1.00 0.00 H new ATOM 0 HH TYR A 78 1.296 14.047 1.218 1.00 0.00 H new ATOM 1171 N TRP A 79 -0.438 9.098 -4.791 1.00 0.00 N ATOM 1172 CA TRP A 79 -1.024 7.816 -4.438 1.00 0.00 C ATOM 1173 C TRP A 79 -0.751 7.520 -2.964 1.00 0.00 C ATOM 1174 O TRP A 79 -0.495 8.434 -2.190 1.00 0.00 O ATOM 1175 CB TRP A 79 -0.454 6.716 -5.340 1.00 0.00 C ATOM 1176 CG TRP A 79 -1.024 6.757 -6.724 1.00 0.00 C ATOM 1177 CD1 TRP A 79 -0.818 7.725 -7.662 1.00 0.00 C ATOM 1178 CD2 TRP A 79 -1.900 5.798 -7.327 1.00 0.00 C ATOM 1179 NE1 TRP A 79 -1.518 7.434 -8.806 1.00 0.00 N ATOM 1180 CE2 TRP A 79 -2.188 6.256 -8.627 1.00 0.00 C ATOM 1181 CE3 TRP A 79 -2.474 4.596 -6.895 1.00 0.00 C ATOM 1182 CZ2 TRP A 79 -3.021 5.559 -9.496 1.00 0.00 C ATOM 1183 CZ3 TRP A 79 -3.302 3.906 -7.760 1.00 0.00 C ATOM 1184 CH2 TRP A 79 -3.568 4.388 -9.047 1.00 0.00 C ATOM 0 H TRP A 79 0.520 9.044 -5.136 1.00 0.00 H new ATOM 0 HA TRP A 79 -2.103 7.849 -4.589 1.00 0.00 H new ATOM 0 HB2 TRP A 79 0.630 6.820 -5.394 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -0.659 5.743 -4.895 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -0.194 8.596 -7.524 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.535 8.004 -9.652 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -2.273 4.215 -5.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -3.229 5.929 -10.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -3.752 2.979 -7.437 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -4.218 3.824 -9.699 1.00 0.00 H new ATOM 1195 N LEU A 80 -0.787 6.249 -2.587 1.00 0.00 N ATOM 1196 CA LEU A 80 -0.529 5.845 -1.211 1.00 0.00 C ATOM 1197 C LEU A 80 -0.221 4.363 -1.174 1.00 0.00 C ATOM 1198 O LEU A 80 -1.116 3.522 -1.263 1.00 0.00 O ATOM 1199 CB LEU A 80 -1.721 6.152 -0.297 1.00 0.00 C ATOM 1200 CG LEU A 80 -1.971 7.635 -0.024 1.00 0.00 C ATOM 1201 CD1 LEU A 80 -3.191 7.821 0.864 1.00 0.00 C ATOM 1202 CD2 LEU A 80 -0.744 8.268 0.615 1.00 0.00 C ATOM 0 H LEU A 80 -0.994 5.476 -3.219 1.00 0.00 H new ATOM 0 HA LEU A 80 0.324 6.415 -0.843 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.619 5.725 -0.744 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.567 5.645 0.656 1.00 0.00 H new ATOM 0 HG LEU A 80 -2.164 8.132 -0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.350 8.884 1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.068 7.402 0.370 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.031 7.311 1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.936 9.324 0.804 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.524 7.765 1.557 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.108 8.169 -0.057 1.00 0.00 H new ATOM 1601 N ALA A 104 0.087 0.281 -4.271 1.00 0.00 N ATOM 1602 CA ALA A 104 -0.170 1.711 -4.421 1.00 0.00 C ATOM 1603 C ALA A 104 -1.653 1.988 -4.511 1.00 0.00 C ATOM 1604 O ALA A 104 -2.332 1.531 -5.429 1.00 0.00 O ATOM 1605 CB ALA A 104 0.542 2.257 -5.651 1.00 0.00 C ATOM 0 HA ALA A 104 0.220 2.216 -3.537 1.00 0.00 H new ATOM 0 HB1 ALA A 104 0.338 3.324 -5.746 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.616 2.100 -5.549 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.182 1.739 -6.540 1.00 0.00 H new ATOM 1611 N GLN A 105 -2.154 2.725 -3.533 1.00 0.00 N ATOM 1612 CA GLN A 105 -3.565 3.044 -3.483 1.00 0.00 C ATOM 1613 C GLN A 105 -3.819 4.543 -3.377 1.00 0.00 C ATOM 1614 O GLN A 105 -3.357 5.193 -2.445 1.00 0.00 O ATOM 1615 CB GLN A 105 -4.210 2.356 -2.278 1.00 0.00 C ATOM 1616 CG GLN A 105 -3.800 0.904 -2.091 1.00 0.00 C ATOM 1617 CD GLN A 105 -3.175 0.635 -0.733 1.00 0.00 C ATOM 1618 OE1 GLN A 105 -3.597 -0.455 -0.096 1.00 0.00 O flip ATOM 1619 NE2 GLN A 105 -2.327 1.392 -0.263 1.00 0.00 N flip ATOM 0 H GLN A 105 -1.603 3.111 -2.766 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.003 2.689 -4.416 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.953 2.912 -1.377 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.294 2.404 -2.384 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -4.675 0.266 -2.215 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -3.091 0.629 -2.872 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -2.033 2.217 -0.787 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -1.918 1.195 0.650 1.00 0.00 H new ATOM 1628 N LYS A 106 -4.588 5.081 -4.315 1.00 0.00 N ATOM 1629 CA LYS A 106 -4.931 6.496 -4.284 1.00 0.00 C ATOM 1630 C LYS A 106 -6.357 6.658 -3.779 1.00 0.00 C ATOM 1631 O LYS A 106 -7.239 5.870 -4.121 1.00 0.00 O ATOM 1632 CB LYS A 106 -4.773 7.153 -5.653 1.00 0.00 C ATOM 1633 CG LYS A 106 -4.524 8.650 -5.555 1.00 0.00 C ATOM 1634 CD LYS A 106 -3.825 9.191 -6.792 1.00 0.00 C ATOM 1635 CE LYS A 106 -4.626 8.921 -8.057 1.00 0.00 C ATOM 1636 NZ LYS A 106 -4.514 10.041 -9.035 1.00 0.00 N ATOM 0 H LYS A 106 -4.983 4.564 -5.100 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.240 6.998 -3.607 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.945 6.684 -6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.672 6.975 -6.244 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.474 9.168 -5.419 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.917 8.860 -4.674 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -3.670 10.264 -6.682 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.839 8.734 -6.881 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -4.275 7.999 -8.519 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -5.674 8.769 -7.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.074 9.819 -9.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -4.873 10.916 -8.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.517 10.170 -9.302 1.00 0.00 H new ATOM 1650 N TRP A 107 -6.573 7.655 -2.929 1.00 0.00 N ATOM 1651 CA TRP A 107 -7.885 7.879 -2.339 1.00 0.00 C ATOM 1652 C TRP A 107 -8.633 9.044 -2.979 1.00 0.00 C ATOM 1653 O TRP A 107 -8.048 9.889 -3.656 1.00 0.00 O ATOM 1654 CB TRP A 107 -7.736 8.106 -0.836 1.00 0.00 C ATOM 1655 CG TRP A 107 -7.598 6.826 -0.075 1.00 0.00 C ATOM 1656 CD1 TRP A 107 -6.480 6.049 0.034 1.00 0.00 C ATOM 1657 CD2 TRP A 107 -8.622 6.165 0.670 1.00 0.00 C ATOM 1658 NE1 TRP A 107 -6.751 4.939 0.796 1.00 0.00 N ATOM 1659 CE2 TRP A 107 -8.058 4.989 1.199 1.00 0.00 C ATOM 1660 CE3 TRP A 107 -9.960 6.452 0.939 1.00 0.00 C ATOM 1661 CZ2 TRP A 107 -8.791 4.102 1.979 1.00 0.00 C ATOM 1662 CZ3 TRP A 107 -10.685 5.571 1.716 1.00 0.00 C ATOM 1663 CH2 TRP A 107 -10.098 4.407 2.228 1.00 0.00 C ATOM 0 H TRP A 107 -5.857 8.319 -2.634 1.00 0.00 H new ATOM 0 HA TRP A 107 -8.483 6.987 -2.526 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -6.862 8.731 -0.651 1.00 0.00 H new ATOM 0 HB3 TRP A 107 -8.603 8.653 -0.467 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -5.523 6.274 -0.413 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -6.087 4.199 1.024 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -10.420 7.347 0.547 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -8.342 3.203 2.374 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -11.722 5.783 1.933 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -10.692 3.737 2.832 1.00 0.00 H new ATOM 1674 N PHE A 108 -9.943 9.065 -2.740 1.00 0.00 N ATOM 1675 CA PHE A 108 -10.824 10.104 -3.263 1.00 0.00 C ATOM 1676 C PHE A 108 -11.846 10.501 -2.201 1.00 0.00 C ATOM 1677 O PHE A 108 -12.161 9.711 -1.313 1.00 0.00 O ATOM 1678 CB PHE A 108 -11.569 9.600 -4.501 1.00 0.00 C ATOM 1679 CG PHE A 108 -10.692 9.323 -5.687 1.00 0.00 C ATOM 1680 CD1 PHE A 108 -10.218 10.365 -6.464 1.00 0.00 C ATOM 1681 CD2 PHE A 108 -10.349 8.022 -6.031 1.00 0.00 C ATOM 1682 CE1 PHE A 108 -9.416 10.120 -7.561 1.00 0.00 C ATOM 1683 CE2 PHE A 108 -9.548 7.770 -7.130 1.00 0.00 C ATOM 1684 CZ PHE A 108 -9.080 8.823 -7.895 1.00 0.00 C ATOM 0 H PHE A 108 -10.422 8.361 -2.178 1.00 0.00 H new ATOM 0 HA PHE A 108 -10.214 10.966 -3.533 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -12.104 8.687 -4.240 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -12.318 10.339 -4.784 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -10.478 11.382 -6.210 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -10.712 7.198 -5.434 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -9.051 10.943 -8.158 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.289 6.754 -7.390 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.452 8.631 -8.753 1.00 0.00 H new ATOM 1694 N LEU A 109 -12.374 11.717 -2.297 1.00 0.00 N ATOM 1695 CA LEU A 109 -13.369 12.177 -1.344 1.00 0.00 C ATOM 1696 C LEU A 109 -14.759 12.076 -1.945 1.00 0.00 C ATOM 1697 O LEU A 109 -14.959 12.395 -3.115 1.00 0.00 O ATOM 1698 CB LEU A 109 -13.105 13.617 -0.909 1.00 0.00 C ATOM 1699 CG LEU A 109 -14.135 14.165 0.077 1.00 0.00 C ATOM 1700 CD1 LEU A 109 -14.252 13.248 1.283 1.00 0.00 C ATOM 1701 CD2 LEU A 109 -13.783 15.582 0.502 1.00 0.00 C ATOM 0 H LEU A 109 -12.130 12.394 -3.020 1.00 0.00 H new ATOM 0 HA LEU A 109 -13.303 11.536 -0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -12.116 13.673 -0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -13.087 14.255 -1.792 1.00 0.00 H new ATOM 0 HG LEU A 109 -15.103 14.200 -0.423 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -14.990 13.652 1.977 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -14.565 12.256 0.957 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -13.285 13.178 1.782 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -14.532 15.948 1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.804 15.585 0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -13.760 16.230 -0.374 1.00 0.00 H new ATOM 1713 N PHE A 110 -15.713 11.621 -1.148 1.00 0.00 N ATOM 1714 CA PHE A 110 -17.078 11.470 -1.626 1.00 0.00 C ATOM 1715 C PHE A 110 -18.098 11.908 -0.592 1.00 0.00 C ATOM 1716 O PHE A 110 -17.999 11.568 0.581 1.00 0.00 O ATOM 1717 CB PHE A 110 -17.365 10.009 -1.982 1.00 0.00 C ATOM 1718 CG PHE A 110 -16.821 9.581 -3.309 1.00 0.00 C ATOM 1719 CD1 PHE A 110 -15.457 9.451 -3.505 1.00 0.00 C ATOM 1720 CD2 PHE A 110 -17.677 9.302 -4.361 1.00 0.00 C ATOM 1721 CE1 PHE A 110 -14.957 9.053 -4.728 1.00 0.00 C ATOM 1722 CE2 PHE A 110 -17.183 8.904 -5.587 1.00 0.00 C ATOM 1723 CZ PHE A 110 -15.819 8.780 -5.769 1.00 0.00 C ATOM 0 H PHE A 110 -15.569 11.352 -0.175 1.00 0.00 H new ATOM 0 HA PHE A 110 -17.167 12.106 -2.507 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -16.945 9.369 -1.206 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -18.443 9.851 -1.976 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -14.777 9.663 -2.693 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -18.744 9.397 -4.221 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -13.891 8.955 -4.870 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -17.860 8.690 -6.401 1.00 0.00 H new ATOM 0 HZ PHE A 110 -15.428 8.469 -6.727 1.00 0.00 H new ATOM 1733 N LYS A 111 -19.108 12.625 -1.056 1.00 0.00 N ATOM 1734 CA LYS A 111 -20.191 13.062 -0.172 1.00 0.00 C ATOM 1735 C LYS A 111 -21.408 12.169 -0.383 1.00 0.00 C ATOM 1736 O LYS A 111 -21.875 12.010 -1.508 1.00 0.00 O ATOM 1737 CB LYS A 111 -20.562 14.527 -0.412 1.00 0.00 C ATOM 1738 CG LYS A 111 -21.666 15.025 0.509 1.00 0.00 C ATOM 1739 CD LYS A 111 -21.857 16.529 0.401 1.00 0.00 C ATOM 1740 CE LYS A 111 -21.042 17.271 1.450 1.00 0.00 C ATOM 1741 NZ LYS A 111 -20.654 18.634 0.990 1.00 0.00 N ATOM 0 H LYS A 111 -19.206 12.918 -2.028 1.00 0.00 H new ATOM 0 HA LYS A 111 -19.845 12.978 0.858 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.676 15.147 -0.274 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -20.879 14.650 -1.448 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -22.600 14.521 0.261 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -21.426 14.762 1.539 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -21.563 16.864 -0.594 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -22.913 16.772 0.520 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -21.620 17.349 2.371 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -20.145 16.698 1.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -20.492 19.246 1.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -19.782 18.575 0.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -21.417 19.034 0.407 1.00 0.00 H new ATOM 1755 N PHE A 112 -21.921 11.590 0.701 1.00 0.00 N ATOM 1756 CA PHE A 112 -23.083 10.712 0.622 1.00 0.00 C ATOM 1757 C PHE A 112 -24.370 11.519 0.501 1.00 0.00 C ATOM 1758 O PHE A 112 -24.907 12.001 1.498 1.00 0.00 O ATOM 1759 CB PHE A 112 -23.142 9.805 1.854 1.00 0.00 C ATOM 1760 CG PHE A 112 -24.075 8.631 1.706 1.00 0.00 C ATOM 1761 CD1 PHE A 112 -23.626 7.444 1.153 1.00 0.00 C ATOM 1762 CD2 PHE A 112 -25.395 8.710 2.123 1.00 0.00 C ATOM 1763 CE1 PHE A 112 -24.471 6.359 1.017 1.00 0.00 C ATOM 1764 CE2 PHE A 112 -26.244 7.628 1.990 1.00 0.00 C ATOM 1765 CZ PHE A 112 -25.781 6.449 1.436 1.00 0.00 C ATOM 0 H PHE A 112 -21.550 11.714 1.643 1.00 0.00 H new ATOM 0 HA PHE A 112 -22.984 10.095 -0.271 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -22.139 9.435 2.068 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -23.454 10.398 2.714 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -22.601 7.365 0.823 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -25.764 9.628 2.557 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -24.105 5.441 0.582 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -27.270 7.703 2.319 1.00 0.00 H new ATOM 0 HZ PHE A 112 -26.443 5.602 1.332 1.00 0.00 H new ATOM 1775 N THR A 113 -24.859 11.662 -0.725 1.00 0.00 N ATOM 1776 CA THR A 113 -26.082 12.412 -0.973 1.00 0.00 C ATOM 1777 C THR A 113 -27.280 11.476 -1.092 1.00 0.00 C ATOM 1778 O THR A 113 -28.053 11.556 -2.046 1.00 0.00 O ATOM 1779 CB THR A 113 -25.945 13.256 -2.242 1.00 0.00 C ATOM 1780 OG1 THR A 113 -26.114 12.453 -3.402 1.00 0.00 O ATOM 1781 CG2 THR A 113 -24.612 13.975 -2.352 1.00 0.00 C ATOM 0 H THR A 113 -24.427 11.269 -1.561 1.00 0.00 H new ATOM 0 HA THR A 113 -26.248 13.076 -0.125 1.00 0.00 H new ATOM 0 HB THR A 113 -26.729 14.010 -2.172 1.00 0.00 H new ATOM 0 HG1 THR A 113 -27.014 12.065 -3.403 1.00 0.00 H new ATOM 0 HG21 THR A 113 -24.586 14.553 -3.276 1.00 0.00 H new ATOM 0 HG22 THR A 113 -24.488 14.645 -1.501 1.00 0.00 H new ATOM 0 HG23 THR A 113 -23.804 13.244 -2.359 1.00 0.00 H new ATOM 1789 N GLY A 114 -27.426 10.586 -0.115 1.00 0.00 N ATOM 1790 CA GLY A 114 -28.531 9.646 -0.127 1.00 0.00 C ATOM 1791 C GLY A 114 -28.925 9.204 1.265 1.00 0.00 C ATOM 1792 O GLY A 114 -28.814 9.970 2.221 1.00 0.00 O ATOM 0 H GLY A 114 -26.799 10.499 0.684 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -29.390 10.105 -0.617 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -28.256 8.773 -0.719 1.00 0.00 H new ATOM 1796 N GLN A 115 -29.380 7.964 1.376 1.00 0.00 N ATOM 1797 CA GLN A 115 -29.788 7.415 2.664 1.00 0.00 C ATOM 1798 C GLN A 115 -28.937 6.203 3.033 1.00 0.00 C ATOM 1799 O GLN A 115 -28.435 5.495 2.163 1.00 0.00 O ATOM 1800 CB GLN A 115 -31.269 7.031 2.633 1.00 0.00 C ATOM 1801 CG GLN A 115 -32.161 8.099 2.020 1.00 0.00 C ATOM 1802 CD GLN A 115 -33.564 8.094 2.597 1.00 0.00 C ATOM 1803 OE1 GLN A 115 -33.768 7.749 3.761 1.00 0.00 O ATOM 1804 NE2 GLN A 115 -34.540 8.476 1.782 1.00 0.00 N ATOM 0 H GLN A 115 -29.476 7.319 0.592 1.00 0.00 H new ATOM 0 HA GLN A 115 -29.638 8.182 3.423 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -31.384 6.105 2.069 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -31.605 6.829 3.650 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -31.710 9.078 2.180 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -32.216 7.946 0.942 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -34.325 8.754 0.824 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -35.504 8.492 2.114 1.00 0.00 H new ATOM 1813 N ASP A 116 -28.767 5.986 4.332 1.00 0.00 N ATOM 1814 CA ASP A 116 -27.961 4.877 4.838 1.00 0.00 C ATOM 1815 C ASP A 116 -28.500 3.533 4.376 1.00 0.00 C ATOM 1816 O ASP A 116 -27.742 2.598 4.120 1.00 0.00 O ATOM 1817 CB ASP A 116 -27.950 4.911 6.360 1.00 0.00 C ATOM 1818 CG ASP A 116 -27.501 6.250 6.907 1.00 0.00 C ATOM 1819 OD1 ASP A 116 -27.010 7.082 6.115 1.00 0.00 O ATOM 1820 OD2 ASP A 116 -27.640 6.469 8.129 1.00 0.00 O ATOM 0 H ASP A 116 -29.180 6.568 5.061 1.00 0.00 H new ATOM 0 HA ASP A 116 -26.951 4.993 4.445 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -28.950 4.687 6.732 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -27.288 4.129 6.733 1.00 0.00 H new ATOM 1825 N GLN A 117 -29.813 3.450 4.280 1.00 0.00 N ATOM 1826 CA GLN A 117 -30.481 2.222 3.856 1.00 0.00 C ATOM 1827 C GLN A 117 -29.976 1.732 2.495 1.00 0.00 C ATOM 1828 O GLN A 117 -30.341 0.645 2.053 1.00 0.00 O ATOM 1829 CB GLN A 117 -31.994 2.442 3.797 1.00 0.00 C ATOM 1830 CG GLN A 117 -32.401 3.645 2.962 1.00 0.00 C ATOM 1831 CD GLN A 117 -33.404 3.290 1.879 1.00 0.00 C ATOM 1832 OE1 GLN A 117 -34.495 2.795 2.165 1.00 0.00 O ATOM 1833 NE2 GLN A 117 -33.039 3.541 0.627 1.00 0.00 N ATOM 0 H GLN A 117 -30.447 4.221 4.490 1.00 0.00 H new ATOM 0 HA GLN A 117 -30.247 1.453 4.592 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -32.467 1.549 3.388 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -32.374 2.568 4.811 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -32.829 4.407 3.613 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -31.514 4.081 2.502 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -32.125 3.952 0.435 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -33.672 3.323 -0.142 1.00 0.00 H new ATOM 1842 N GLU A 118 -29.129 2.526 1.839 1.00 0.00 N ATOM 1843 CA GLU A 118 -28.581 2.151 0.543 1.00 0.00 C ATOM 1844 C GLU A 118 -27.279 1.371 0.704 1.00 0.00 C ATOM 1845 O GLU A 118 -26.797 0.748 -0.243 1.00 0.00 O ATOM 1846 CB GLU A 118 -28.316 3.399 -0.300 1.00 0.00 C ATOM 1847 CG GLU A 118 -27.902 3.085 -1.728 1.00 0.00 C ATOM 1848 CD GLU A 118 -28.918 3.556 -2.750 1.00 0.00 C ATOM 1849 OE1 GLU A 118 -28.978 4.777 -3.009 1.00 0.00 O ATOM 1850 OE2 GLU A 118 -29.651 2.704 -3.291 1.00 0.00 O ATOM 0 H GLU A 118 -28.810 3.431 2.186 1.00 0.00 H new ATOM 0 HA GLU A 118 -29.313 1.517 0.043 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -29.215 4.015 -0.317 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -27.534 3.991 0.176 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -26.941 3.555 -1.935 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -27.760 2.009 -1.832 1.00 0.00 H new ATOM 1857 N ILE A 119 -26.710 1.418 1.904 1.00 0.00 N ATOM 1858 CA ILE A 119 -25.462 0.725 2.184 1.00 0.00 C ATOM 1859 C ILE A 119 -25.677 -0.764 2.421 1.00 0.00 C ATOM 1860 O ILE A 119 -26.067 -1.183 3.510 1.00 0.00 O ATOM 1861 CB ILE A 119 -24.741 1.337 3.392 1.00 0.00 C ATOM 1862 CG1 ILE A 119 -24.567 2.841 3.170 1.00 0.00 C ATOM 1863 CG2 ILE A 119 -23.398 0.651 3.604 1.00 0.00 C ATOM 1864 CD1 ILE A 119 -23.719 3.521 4.217 1.00 0.00 C ATOM 0 H ILE A 119 -27.095 1.930 2.698 1.00 0.00 H new ATOM 0 HA ILE A 119 -24.838 0.846 1.299 1.00 0.00 H new ATOM 0 HB ILE A 119 -25.337 1.186 4.292 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -24.117 3.004 2.191 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -25.550 3.311 3.151 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -22.895 1.093 4.464 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -23.557 -0.412 3.784 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -22.779 0.780 2.716 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -23.643 4.584 3.990 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -24.178 3.391 5.197 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -22.723 3.079 4.221 1.00 0.00 H new ATOM 1876 N ASN A 120 -25.403 -1.557 1.395 1.00 0.00 N ATOM 1877 CA ASN A 120 -25.546 -3.003 1.479 1.00 0.00 C ATOM 1878 C ASN A 120 -24.181 -3.675 1.610 1.00 0.00 C ATOM 1879 O ASN A 120 -23.483 -3.878 0.616 1.00 0.00 O ATOM 1880 CB ASN A 120 -26.271 -3.531 0.241 1.00 0.00 C ATOM 1881 CG ASN A 120 -26.881 -4.898 0.468 1.00 0.00 C ATOM 1882 OD1 ASN A 120 -28.068 -5.018 0.772 1.00 0.00 O ATOM 1883 ND2 ASN A 120 -26.070 -5.939 0.324 1.00 0.00 N ATOM 0 H ASN A 120 -25.078 -1.220 0.489 1.00 0.00 H new ATOM 0 HA ASN A 120 -26.134 -3.239 2.366 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -27.055 -2.829 -0.044 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -25.570 -3.583 -0.592 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -26.424 -6.885 0.466 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -25.093 -5.793 0.071 1.00 0.00 H new ATOM 1890 N LEU A 121 -23.805 -4.023 2.838 1.00 0.00 N ATOM 1891 CA LEU A 121 -22.521 -4.678 3.079 1.00 0.00 C ATOM 1892 C LEU A 121 -22.522 -6.103 2.526 1.00 0.00 C ATOM 1893 O LEU A 121 -21.478 -6.751 2.459 1.00 0.00 O ATOM 1894 CB LEU A 121 -22.201 -4.708 4.577 1.00 0.00 C ATOM 1895 CG LEU A 121 -22.345 -3.375 5.316 1.00 0.00 C ATOM 1896 CD1 LEU A 121 -21.951 -3.538 6.780 1.00 0.00 C ATOM 1897 CD2 LEU A 121 -21.503 -2.296 4.649 1.00 0.00 C ATOM 0 H LEU A 121 -24.365 -3.864 3.676 1.00 0.00 H new ATOM 0 HA LEU A 121 -21.754 -4.101 2.563 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -22.854 -5.439 5.054 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -21.178 -5.064 4.704 1.00 0.00 H new ATOM 0 HG LEU A 121 -23.389 -3.065 5.271 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -22.058 -2.583 7.294 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -22.598 -4.278 7.251 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -20.915 -3.870 6.843 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -21.620 -1.357 5.190 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -20.454 -2.594 4.661 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -21.831 -2.164 3.618 1.00 0.00 H new ATOM 2016 N GLU A 130 -18.400 -8.060 2.813 1.00 0.00 N ATOM 2017 CA GLU A 130 -17.136 -7.351 2.976 1.00 0.00 C ATOM 2018 C GLU A 130 -16.989 -6.853 4.406 1.00 0.00 C ATOM 2019 O GLU A 130 -16.133 -7.322 5.157 1.00 0.00 O ATOM 2020 CB GLU A 130 -17.058 -6.170 2.007 1.00 0.00 C ATOM 2021 CG GLU A 130 -17.107 -6.579 0.545 1.00 0.00 C ATOM 2022 CD GLU A 130 -15.776 -7.096 0.038 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -14.883 -6.266 -0.238 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -15.624 -8.328 -0.082 1.00 0.00 O ATOM 0 HA GLU A 130 -16.324 -8.044 2.756 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -17.882 -5.487 2.212 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -16.135 -5.620 2.191 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -17.866 -7.350 0.413 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -17.413 -5.724 -0.057 1.00 0.00 H new ATOM 2031 N PHE A 131 -17.845 -5.911 4.779 1.00 0.00 N ATOM 2032 CA PHE A 131 -17.836 -5.351 6.124 1.00 0.00 C ATOM 2033 C PHE A 131 -18.980 -5.928 6.937 1.00 0.00 C ATOM 2034 O PHE A 131 -20.067 -6.174 6.413 1.00 0.00 O ATOM 2035 CB PHE A 131 -17.942 -3.827 6.076 1.00 0.00 C ATOM 2036 CG PHE A 131 -17.164 -3.206 4.952 1.00 0.00 C ATOM 2037 CD1 PHE A 131 -15.807 -2.961 5.083 1.00 0.00 C ATOM 2038 CD2 PHE A 131 -17.789 -2.871 3.762 1.00 0.00 C ATOM 2039 CE1 PHE A 131 -15.087 -2.392 4.049 1.00 0.00 C ATOM 2040 CE2 PHE A 131 -17.075 -2.303 2.724 1.00 0.00 C ATOM 2041 CZ PHE A 131 -15.723 -2.062 2.868 1.00 0.00 C ATOM 0 H PHE A 131 -18.558 -5.517 4.165 1.00 0.00 H new ATOM 0 HA PHE A 131 -16.892 -5.616 6.601 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -18.991 -3.547 5.979 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -17.589 -3.416 7.022 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -15.305 -3.218 6.004 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -18.847 -3.056 3.644 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.029 -2.206 4.164 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -17.574 -2.048 1.801 1.00 0.00 H new ATOM 0 HZ PHE A 131 -15.164 -1.616 2.059 1.00 0.00 H new ATOM 2051 N GLY A 132 -18.728 -6.144 8.217 1.00 0.00 N ATOM 2052 CA GLY A 132 -19.749 -6.696 9.081 1.00 0.00 C ATOM 2053 C GLY A 132 -20.651 -5.625 9.646 1.00 0.00 C ATOM 2054 O GLY A 132 -21.852 -5.832 9.814 1.00 0.00 O ATOM 0 H GLY A 132 -17.837 -5.948 8.673 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -20.347 -7.416 8.522 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -19.277 -7.241 9.898 1.00 0.00 H new ATOM 2058 N GLU A 133 -20.062 -4.472 9.940 1.00 0.00 N ATOM 2059 CA GLU A 133 -20.815 -3.349 10.492 1.00 0.00 C ATOM 2060 C GLU A 133 -20.179 -2.026 10.103 1.00 0.00 C ATOM 2061 O GLU A 133 -18.957 -1.893 10.084 1.00 0.00 O ATOM 2062 CB GLU A 133 -20.894 -3.449 12.021 1.00 0.00 C ATOM 2063 CG GLU A 133 -22.298 -3.239 12.569 1.00 0.00 C ATOM 2064 CD GLU A 133 -22.454 -3.741 13.991 1.00 0.00 C ATOM 2065 OE1 GLU A 133 -21.984 -4.862 14.281 1.00 0.00 O ATOM 2066 OE2 GLU A 133 -23.048 -3.014 14.815 1.00 0.00 O ATOM 0 H GLU A 133 -19.068 -4.289 9.806 1.00 0.00 H new ATOM 0 HA GLU A 133 -21.823 -3.391 10.078 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -20.533 -4.429 12.333 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -20.226 -2.709 12.461 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -22.542 -2.177 12.534 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -23.014 -3.751 11.927 1.00 0.00 H new ATOM 2073 N TRP A 134 -21.018 -1.043 9.809 1.00 0.00 N ATOM 2074 CA TRP A 134 -20.527 0.272 9.437 1.00 0.00 C ATOM 2075 C TRP A 134 -21.197 1.362 10.266 1.00 0.00 C ATOM 2076 O TRP A 134 -22.184 1.114 10.957 1.00 0.00 O ATOM 2077 CB TRP A 134 -20.722 0.519 7.943 1.00 0.00 C ATOM 2078 CG TRP A 134 -22.147 0.696 7.522 1.00 0.00 C ATOM 2079 CD1 TRP A 134 -22.974 -0.240 6.967 1.00 0.00 C ATOM 2080 CD2 TRP A 134 -22.906 1.901 7.607 1.00 0.00 C ATOM 2081 NE1 TRP A 134 -24.198 0.325 6.685 1.00 0.00 N ATOM 2082 CE2 TRP A 134 -24.177 1.636 7.073 1.00 0.00 C ATOM 2083 CE3 TRP A 134 -22.629 3.183 8.082 1.00 0.00 C ATOM 2084 CZ2 TRP A 134 -25.168 2.609 6.997 1.00 0.00 C ATOM 2085 CZ3 TRP A 134 -23.611 4.144 8.014 1.00 0.00 C ATOM 2086 CH2 TRP A 134 -24.869 3.856 7.474 1.00 0.00 C ATOM 0 H TRP A 134 -22.034 -1.132 9.821 1.00 0.00 H new ATOM 0 HA TRP A 134 -19.458 0.306 9.648 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -20.160 1.408 7.659 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -20.295 -0.318 7.391 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -22.707 -1.269 6.778 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -24.990 -0.155 6.257 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -21.660 3.417 8.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -26.138 2.388 6.577 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -23.407 5.138 8.384 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -25.618 4.633 7.433 1.00 0.00 H new ATOM 2097 N SER A 135 -20.634 2.564 10.207 1.00 0.00 N ATOM 2098 CA SER A 135 -21.157 3.693 10.969 1.00 0.00 C ATOM 2099 C SER A 135 -20.672 5.024 10.411 1.00 0.00 C ATOM 2100 O SER A 135 -19.894 5.073 9.459 1.00 0.00 O ATOM 2101 CB SER A 135 -20.718 3.593 12.435 1.00 0.00 C ATOM 2102 OG SER A 135 -21.317 4.610 13.219 1.00 0.00 O ATOM 0 H SER A 135 -19.815 2.782 9.639 1.00 0.00 H new ATOM 0 HA SER A 135 -22.244 3.653 10.893 1.00 0.00 H new ATOM 0 HB2 SER A 135 -20.990 2.615 12.833 1.00 0.00 H new ATOM 0 HB3 SER A 135 -19.633 3.672 12.499 1.00 0.00 H new ATOM 0 HG SER A 135 -21.022 4.522 14.149 1.00 0.00 H new ATOM 2108 N TRP A 136 -21.125 6.098 11.046 1.00 0.00 N ATOM 2109 CA TRP A 136 -20.732 7.450 10.662 1.00 0.00 C ATOM 2110 C TRP A 136 -19.914 8.080 11.779 1.00 0.00 C ATOM 2111 O TRP A 136 -20.459 8.502 12.800 1.00 0.00 O ATOM 2112 CB TRP A 136 -21.947 8.334 10.367 1.00 0.00 C ATOM 2113 CG TRP A 136 -22.849 7.802 9.292 1.00 0.00 C ATOM 2114 CD1 TRP A 136 -24.133 7.378 9.458 1.00 0.00 C ATOM 2115 CD2 TRP A 136 -22.550 7.646 7.897 1.00 0.00 C ATOM 2116 NE1 TRP A 136 -24.654 6.969 8.258 1.00 0.00 N ATOM 2117 CE2 TRP A 136 -23.702 7.123 7.281 1.00 0.00 C ATOM 2118 CE3 TRP A 136 -21.424 7.897 7.108 1.00 0.00 C ATOM 2119 CZ2 TRP A 136 -23.758 6.846 5.916 1.00 0.00 C ATOM 2120 CZ3 TRP A 136 -21.483 7.625 5.754 1.00 0.00 C ATOM 2121 CH2 TRP A 136 -22.640 7.107 5.170 1.00 0.00 C ATOM 0 H TRP A 136 -21.770 6.059 11.835 1.00 0.00 H new ATOM 0 HA TRP A 136 -20.138 7.376 9.751 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -22.525 8.455 11.283 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -21.599 9.325 10.076 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -24.663 7.366 10.399 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -25.597 6.608 8.114 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -20.523 8.297 7.549 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -24.651 6.440 5.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -20.618 7.817 5.137 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -22.654 6.908 4.109 1.00 0.00 H new ATOM 2132 N VAL A 137 -18.609 8.140 11.578 1.00 0.00 N ATOM 2133 CA VAL A 137 -17.711 8.719 12.562 1.00 0.00 C ATOM 2134 C VAL A 137 -16.982 9.911 11.956 1.00 0.00 C ATOM 2135 O VAL A 137 -17.021 10.104 10.746 1.00 0.00 O ATOM 2136 CB VAL A 137 -16.695 7.668 13.056 1.00 0.00 C ATOM 2137 CG1 VAL A 137 -17.422 6.442 13.599 1.00 0.00 C ATOM 2138 CG2 VAL A 137 -15.738 7.272 11.938 1.00 0.00 C ATOM 0 H VAL A 137 -18.146 7.793 10.738 1.00 0.00 H new ATOM 0 HA VAL A 137 -18.298 9.055 13.417 1.00 0.00 H new ATOM 0 HB VAL A 137 -16.109 8.110 13.862 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -16.692 5.709 13.944 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -18.061 6.737 14.431 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -18.033 6.002 12.811 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -15.031 6.530 12.310 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -16.304 6.850 11.107 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -15.194 8.152 11.596 1.00 0.00 H new ATOM 2148 N THR A 138 -16.299 10.703 12.777 1.00 0.00 N ATOM 2149 CA THR A 138 -15.564 11.844 12.248 1.00 0.00 C ATOM 2150 C THR A 138 -14.316 11.357 11.539 1.00 0.00 C ATOM 2151 O THR A 138 -13.953 10.185 11.641 1.00 0.00 O ATOM 2152 CB THR A 138 -15.187 12.842 13.347 1.00 0.00 C ATOM 2153 OG1 THR A 138 -14.123 12.356 14.142 1.00 0.00 O ATOM 2154 CG2 THR A 138 -16.334 13.182 14.259 1.00 0.00 C ATOM 0 H THR A 138 -16.240 10.580 13.788 1.00 0.00 H new ATOM 0 HA THR A 138 -16.213 12.364 11.544 1.00 0.00 H new ATOM 0 HB THR A 138 -14.886 13.746 12.817 1.00 0.00 H new ATOM 0 HG1 THR A 138 -13.507 13.090 14.348 1.00 0.00 H new ATOM 0 HG21 THR A 138 -16.000 13.893 15.014 1.00 0.00 H new ATOM 0 HG22 THR A 138 -17.143 13.624 13.677 1.00 0.00 H new ATOM 0 HG23 THR A 138 -16.692 12.275 14.747 1.00 0.00 H new ATOM 2162 N PRO A 139 -13.631 12.246 10.817 1.00 0.00 N ATOM 2163 CA PRO A 139 -12.412 11.883 10.110 1.00 0.00 C ATOM 2164 C PRO A 139 -11.349 11.415 11.088 1.00 0.00 C ATOM 2165 O PRO A 139 -10.816 10.316 10.962 1.00 0.00 O ATOM 2166 CB PRO A 139 -11.993 13.168 9.383 1.00 0.00 C ATOM 2167 CG PRO A 139 -13.180 14.079 9.451 1.00 0.00 C ATOM 2168 CD PRO A 139 -13.976 13.664 10.656 1.00 0.00 C ATOM 0 HA PRO A 139 -12.556 11.057 9.414 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -11.124 13.622 9.859 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -11.718 12.961 8.349 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -12.865 15.119 9.535 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -13.781 14.000 8.545 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -13.705 14.246 11.537 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -15.046 13.802 10.499 1.00 0.00 H new ATOM 2176 N GLU A 140 -11.077 12.245 12.082 1.00 0.00 N ATOM 2177 CA GLU A 140 -10.105 11.902 13.109 1.00 0.00 C ATOM 2178 C GLU A 140 -10.578 10.696 13.923 1.00 0.00 C ATOM 2179 O GLU A 140 -9.768 9.940 14.457 1.00 0.00 O ATOM 2180 CB GLU A 140 -9.849 13.102 14.023 1.00 0.00 C ATOM 2181 CG GLU A 140 -8.429 13.629 13.926 1.00 0.00 C ATOM 2182 CD GLU A 140 -8.295 15.048 14.445 1.00 0.00 C ATOM 2183 OE1 GLU A 140 -9.197 15.868 14.172 1.00 0.00 O ATOM 2184 OE2 GLU A 140 -7.288 15.339 15.124 1.00 0.00 O ATOM 0 H GLU A 140 -11.514 13.159 12.200 1.00 0.00 H new ATOM 0 HA GLU A 140 -9.169 11.634 12.619 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -10.545 13.901 13.768 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -10.055 12.817 15.055 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -7.764 12.976 14.491 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -8.103 13.594 12.886 1.00 0.00 H new ATOM 2191 N GLN A 141 -11.898 10.524 14.007 1.00 0.00 N ATOM 2192 CA GLN A 141 -12.484 9.409 14.749 1.00 0.00 C ATOM 2193 C GLN A 141 -12.296 8.106 13.988 1.00 0.00 C ATOM 2194 O GLN A 141 -11.932 7.081 14.567 1.00 0.00 O ATOM 2195 CB GLN A 141 -13.972 9.656 15.018 1.00 0.00 C ATOM 2196 CG GLN A 141 -14.248 10.380 16.332 1.00 0.00 C ATOM 2197 CD GLN A 141 -13.299 11.539 16.584 1.00 0.00 C ATOM 2198 OE1 GLN A 141 -12.079 11.379 16.555 1.00 0.00 O ATOM 2199 NE2 GLN A 141 -13.859 12.717 16.835 1.00 0.00 N ATOM 0 H GLN A 141 -12.581 11.143 13.570 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.970 9.332 15.707 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -14.388 10.241 14.197 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -14.494 8.699 15.024 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -15.273 10.752 16.327 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -14.171 9.669 17.155 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -14.875 12.806 16.850 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -13.273 13.533 17.013 1.00 0.00 H new ATOM 2208 N LEU A 142 -12.545 8.148 12.682 1.00 0.00 N ATOM 2209 CA LEU A 142 -12.397 6.967 11.844 1.00 0.00 C ATOM 2210 C LEU A 142 -10.967 6.460 11.928 1.00 0.00 C ATOM 2211 O LEU A 142 -10.723 5.255 11.959 1.00 0.00 O ATOM 2212 CB LEU A 142 -12.759 7.298 10.391 1.00 0.00 C ATOM 2213 CG LEU A 142 -12.449 6.202 9.364 1.00 0.00 C ATOM 2214 CD1 LEU A 142 -13.632 5.261 9.219 1.00 0.00 C ATOM 2215 CD2 LEU A 142 -12.086 6.818 8.018 1.00 0.00 C ATOM 0 H LEU A 142 -12.849 8.985 12.185 1.00 0.00 H new ATOM 0 HA LEU A 142 -13.073 6.189 12.199 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -13.824 7.524 10.343 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -12.227 8.204 10.100 1.00 0.00 H new ATOM 0 HG LEU A 142 -11.594 5.627 9.720 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -13.395 4.489 8.487 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -13.846 4.795 10.181 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -14.505 5.822 8.885 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -11.869 6.025 7.302 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -12.921 7.417 7.655 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -11.208 7.453 8.133 1.00 0.00 H new ATOM 2227 N ILE A 143 -10.022 7.392 11.977 1.00 0.00 N ATOM 2228 CA ILE A 143 -8.615 7.029 12.075 1.00 0.00 C ATOM 2229 C ILE A 143 -8.341 6.304 13.384 1.00 0.00 C ATOM 2230 O ILE A 143 -7.540 5.376 13.438 1.00 0.00 O ATOM 2231 CB ILE A 143 -7.695 8.260 11.985 1.00 0.00 C ATOM 2232 CG1 ILE A 143 -8.024 9.077 10.734 1.00 0.00 C ATOM 2233 CG2 ILE A 143 -6.229 7.831 11.994 1.00 0.00 C ATOM 2234 CD1 ILE A 143 -7.529 8.451 9.453 1.00 0.00 C ATOM 0 H ILE A 143 -10.203 8.396 11.951 1.00 0.00 H new ATOM 0 HA ILE A 143 -8.399 6.372 11.232 1.00 0.00 H new ATOM 0 HB ILE A 143 -7.865 8.892 12.856 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -9.104 9.208 10.670 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -7.588 10.071 10.835 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -5.591 8.713 11.930 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -6.013 7.293 12.917 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -6.035 7.180 11.141 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -7.799 9.086 8.610 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -6.445 8.345 9.495 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -7.985 7.469 9.328 1.00 0.00 H new ATOM 2246 N ASP A 144 -9.009 6.735 14.440 1.00 0.00 N ATOM 2247 CA ASP A 144 -8.836 6.118 15.745 1.00 0.00 C ATOM 2248 C ASP A 144 -9.430 4.719 15.747 1.00 0.00 C ATOM 2249 O ASP A 144 -8.795 3.755 16.176 1.00 0.00 O ATOM 2250 CB ASP A 144 -9.497 6.976 16.829 1.00 0.00 C ATOM 2251 CG ASP A 144 -8.565 7.255 17.992 1.00 0.00 C ATOM 2252 OD1 ASP A 144 -8.308 6.326 18.785 1.00 0.00 O ATOM 2253 OD2 ASP A 144 -8.094 8.406 18.108 1.00 0.00 O ATOM 0 H ASP A 144 -9.675 7.508 14.420 1.00 0.00 H new ATOM 0 HA ASP A 144 -7.770 6.046 15.959 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -9.823 7.920 16.393 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -10.390 6.469 17.196 1.00 0.00 H new ATOM 2258 N LEU A 145 -10.662 4.629 15.275 1.00 0.00 N ATOM 2259 CA LEU A 145 -11.385 3.364 15.220 1.00 0.00 C ATOM 2260 C LEU A 145 -10.878 2.441 14.112 1.00 0.00 C ATOM 2261 O LEU A 145 -11.115 1.234 14.157 1.00 0.00 O ATOM 2262 CB LEU A 145 -12.877 3.630 15.028 1.00 0.00 C ATOM 2263 CG LEU A 145 -13.625 4.054 16.297 1.00 0.00 C ATOM 2264 CD1 LEU A 145 -14.152 5.478 16.169 1.00 0.00 C ATOM 2265 CD2 LEU A 145 -14.760 3.084 16.593 1.00 0.00 C ATOM 0 H LEU A 145 -11.190 5.426 14.920 1.00 0.00 H new ATOM 0 HA LEU A 145 -11.211 2.854 16.167 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -12.999 4.408 14.275 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -13.344 2.728 14.632 1.00 0.00 H new ATOM 0 HG LEU A 145 -12.923 4.030 17.131 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -14.679 5.755 17.082 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -13.318 6.162 16.010 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -14.837 5.538 15.323 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -15.281 3.399 17.497 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -15.458 3.075 15.756 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -14.354 2.083 16.738 1.00 0.00 H new ATOM 2277 N THR A 146 -10.191 2.994 13.115 1.00 0.00 N ATOM 2278 CA THR A 146 -9.683 2.175 12.014 1.00 0.00 C ATOM 2279 C THR A 146 -8.449 1.380 12.431 1.00 0.00 C ATOM 2280 O THR A 146 -7.923 1.558 13.530 1.00 0.00 O ATOM 2281 CB THR A 146 -9.380 3.025 10.771 1.00 0.00 C ATOM 2282 OG1 THR A 146 -9.134 2.202 9.646 1.00 0.00 O ATOM 2283 CG2 THR A 146 -8.185 3.930 10.924 1.00 0.00 C ATOM 0 H THR A 146 -9.975 3.988 13.045 1.00 0.00 H new ATOM 0 HA THR A 146 -10.470 1.467 11.755 1.00 0.00 H new ATOM 0 HB THR A 146 -10.269 3.642 10.637 1.00 0.00 H new ATOM 0 HG1 THR A 146 -9.718 1.416 9.682 1.00 0.00 H new ATOM 0 HG21 THR A 146 -8.037 4.496 10.004 1.00 0.00 H new ATOM 0 HG22 THR A 146 -8.354 4.619 11.751 1.00 0.00 H new ATOM 0 HG23 THR A 146 -7.298 3.330 11.127 1.00 0.00 H new ATOM 2291 N VAL A 147 -7.998 0.498 11.544 1.00 0.00 N ATOM 2292 CA VAL A 147 -6.832 -0.339 11.807 1.00 0.00 C ATOM 2293 C VAL A 147 -5.534 0.428 11.564 1.00 0.00 C ATOM 2294 O VAL A 147 -5.468 1.287 10.687 1.00 0.00 O ATOM 2295 CB VAL A 147 -6.836 -1.603 10.921 1.00 0.00 C ATOM 2296 CG1 VAL A 147 -8.053 -2.465 11.219 1.00 0.00 C ATOM 2297 CG2 VAL A 147 -6.788 -1.230 9.447 1.00 0.00 C ATOM 0 H VAL A 147 -8.426 0.344 10.631 1.00 0.00 H new ATOM 0 HA VAL A 147 -6.887 -0.634 12.855 1.00 0.00 H new ATOM 0 HB VAL A 147 -5.943 -2.183 11.153 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -8.036 -3.350 10.584 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -8.036 -2.769 12.266 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -8.960 -1.894 11.022 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.792 -2.137 8.842 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.658 -0.623 9.197 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -5.880 -0.662 9.245 1.00 0.00 H new ATOM 2307 N GLU A 148 -4.504 0.103 12.344 1.00 0.00 N ATOM 2308 CA GLU A 148 -3.202 0.756 12.215 1.00 0.00 C ATOM 2309 C GLU A 148 -2.703 0.715 10.773 1.00 0.00 C ATOM 2310 O GLU A 148 -2.265 1.725 10.230 1.00 0.00 O ATOM 2311 CB GLU A 148 -2.184 0.086 13.142 1.00 0.00 C ATOM 2312 CG GLU A 148 -1.924 0.861 14.425 1.00 0.00 C ATOM 2313 CD GLU A 148 -0.721 0.337 15.186 1.00 0.00 C ATOM 2314 OE1 GLU A 148 0.406 0.443 14.660 1.00 0.00 O ATOM 2315 OE2 GLU A 148 -0.906 -0.181 16.308 1.00 0.00 O ATOM 0 H GLU A 148 -4.546 -0.609 13.073 1.00 0.00 H new ATOM 0 HA GLU A 148 -3.318 1.801 12.503 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -2.539 -0.912 13.397 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -1.243 -0.038 12.605 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -1.768 1.913 14.185 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -2.806 0.807 15.064 1.00 0.00 H new ATOM 2322 N PHE A 149 -2.775 -0.461 10.160 1.00 0.00 N ATOM 2323 CA PHE A 149 -2.332 -0.641 8.775 1.00 0.00 C ATOM 2324 C PHE A 149 -2.964 0.381 7.822 1.00 0.00 C ATOM 2325 O PHE A 149 -2.563 0.476 6.663 1.00 0.00 O ATOM 2326 CB PHE A 149 -2.649 -2.057 8.281 1.00 0.00 C ATOM 2327 CG PHE A 149 -2.595 -3.109 9.354 1.00 0.00 C ATOM 2328 CD1 PHE A 149 -1.385 -3.657 9.745 1.00 0.00 C ATOM 2329 CD2 PHE A 149 -3.755 -3.543 9.974 1.00 0.00 C ATOM 2330 CE1 PHE A 149 -1.333 -4.620 10.736 1.00 0.00 C ATOM 2331 CE2 PHE A 149 -3.710 -4.504 10.964 1.00 0.00 C ATOM 2332 CZ PHE A 149 -2.497 -5.044 11.345 1.00 0.00 C ATOM 0 H PHE A 149 -3.136 -1.308 10.598 1.00 0.00 H new ATOM 0 HA PHE A 149 -1.253 -0.483 8.773 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -3.643 -2.060 7.834 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -1.944 -2.321 7.493 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -0.472 -3.329 9.271 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -4.706 -3.125 9.679 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.383 -5.040 11.033 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -4.622 -4.833 11.440 1.00 0.00 H new ATOM 0 HZ PHE A 149 -2.459 -5.797 12.118 1.00 0.00 H new ATOM 2342 N LYS A 150 -3.965 1.124 8.293 1.00 0.00 N ATOM 2343 CA LYS A 150 -4.642 2.101 7.445 1.00 0.00 C ATOM 2344 C LYS A 150 -4.873 3.436 8.158 1.00 0.00 C ATOM 2345 O LYS A 150 -5.334 4.399 7.542 1.00 0.00 O ATOM 2346 CB LYS A 150 -5.981 1.533 6.988 1.00 0.00 C ATOM 2347 CG LYS A 150 -5.860 0.199 6.272 1.00 0.00 C ATOM 2348 CD LYS A 150 -7.218 -0.449 6.069 1.00 0.00 C ATOM 2349 CE LYS A 150 -7.163 -1.543 5.019 1.00 0.00 C ATOM 2350 NZ LYS A 150 -8.248 -1.393 4.014 1.00 0.00 N ATOM 0 H LYS A 150 -4.321 1.069 9.247 1.00 0.00 H new ATOM 0 HA LYS A 150 -3.994 2.295 6.590 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.631 1.414 7.855 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.464 2.250 6.324 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -5.378 0.346 5.306 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -5.220 -0.468 6.849 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -7.567 -0.867 7.013 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -7.942 0.308 5.769 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -6.196 -1.518 4.517 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -7.246 -2.516 5.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -8.712 -2.312 3.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -8.947 -0.704 4.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -7.845 -1.058 3.116 1.00 0.00 H new ATOM 2364 N LYS A 151 -4.548 3.500 9.445 1.00 0.00 N ATOM 2365 CA LYS A 151 -4.723 4.733 10.212 1.00 0.00 C ATOM 2366 C LYS A 151 -3.934 5.888 9.589 1.00 0.00 C ATOM 2367 O LYS A 151 -4.519 6.885 9.167 1.00 0.00 O ATOM 2368 CB LYS A 151 -4.286 4.524 11.669 1.00 0.00 C ATOM 2369 CG LYS A 151 -5.315 3.799 12.524 1.00 0.00 C ATOM 2370 CD LYS A 151 -5.090 4.038 14.011 1.00 0.00 C ATOM 2371 CE LYS A 151 -4.494 2.816 14.695 1.00 0.00 C ATOM 2372 NZ LYS A 151 -5.447 2.193 15.654 1.00 0.00 N ATOM 0 H LYS A 151 -4.164 2.720 9.978 1.00 0.00 H new ATOM 0 HA LYS A 151 -5.782 4.992 10.192 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -3.355 3.958 11.681 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -4.075 5.495 12.117 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -6.315 4.134 12.250 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -5.270 2.730 12.318 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -4.425 4.891 14.146 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -6.037 4.295 14.486 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -4.207 2.083 13.941 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -3.585 3.103 15.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -5.008 1.355 16.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.689 2.878 16.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -6.312 1.910 15.150 1.00 0.00 H new ATOM 2386 N PRO A 152 -2.594 5.765 9.509 1.00 0.00 N ATOM 2387 CA PRO A 152 -1.738 6.803 8.922 1.00 0.00 C ATOM 2388 C PRO A 152 -2.013 6.987 7.440 1.00 0.00 C ATOM 2389 O PRO A 152 -1.811 8.070 6.890 1.00 0.00 O ATOM 2390 CB PRO A 152 -0.318 6.277 9.142 1.00 0.00 C ATOM 2391 CG PRO A 152 -0.477 4.805 9.310 1.00 0.00 C ATOM 2392 CD PRO A 152 -1.812 4.607 9.970 1.00 0.00 C ATOM 0 HA PRO A 152 -1.910 7.779 9.376 1.00 0.00 H new ATOM 0 HB2 PRO A 152 0.326 6.511 8.294 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.139 6.728 10.023 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -0.438 4.296 8.347 1.00 0.00 H new ATOM 0 HG3 PRO A 152 0.326 4.393 9.921 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -2.273 3.666 9.671 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -1.725 4.588 11.056 1.00 0.00 H new ATOM 2400 N VAL A 153 -2.502 5.929 6.798 1.00 0.00 N ATOM 2401 CA VAL A 153 -2.835 5.997 5.385 1.00 0.00 C ATOM 2402 C VAL A 153 -4.030 6.913 5.214 1.00 0.00 C ATOM 2403 O VAL A 153 -4.011 7.848 4.415 1.00 0.00 O ATOM 2404 CB VAL A 153 -3.175 4.608 4.807 1.00 0.00 C ATOM 2405 CG1 VAL A 153 -3.361 4.687 3.301 1.00 0.00 C ATOM 2406 CG2 VAL A 153 -2.095 3.599 5.164 1.00 0.00 C ATOM 0 H VAL A 153 -2.674 5.023 7.233 1.00 0.00 H new ATOM 0 HA VAL A 153 -1.968 6.378 4.846 1.00 0.00 H new ATOM 0 HB VAL A 153 -4.113 4.273 5.250 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -3.600 3.697 2.912 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -4.175 5.374 3.070 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -2.441 5.046 2.839 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -2.354 2.626 4.747 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.140 3.927 4.753 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -2.015 3.519 6.248 1.00 0.00 H new ATOM 2416 N TYR A 154 -5.063 6.643 6.000 1.00 0.00 N ATOM 2417 CA TYR A 154 -6.278 7.437 5.986 1.00 0.00 C ATOM 2418 C TYR A 154 -5.983 8.836 6.503 1.00 0.00 C ATOM 2419 O TYR A 154 -6.516 9.828 6.007 1.00 0.00 O ATOM 2420 CB TYR A 154 -7.325 6.761 6.876 1.00 0.00 C ATOM 2421 CG TYR A 154 -7.835 5.440 6.338 1.00 0.00 C ATOM 2422 CD1 TYR A 154 -7.252 4.838 5.228 1.00 0.00 C ATOM 2423 CD2 TYR A 154 -8.898 4.795 6.950 1.00 0.00 C ATOM 2424 CE1 TYR A 154 -7.718 3.632 4.745 1.00 0.00 C ATOM 2425 CE2 TYR A 154 -9.369 3.588 6.474 1.00 0.00 C ATOM 2426 CZ TYR A 154 -8.775 3.010 5.370 1.00 0.00 C ATOM 2427 OH TYR A 154 -9.245 1.808 4.891 1.00 0.00 O ATOM 0 H TYR A 154 -5.080 5.868 6.663 1.00 0.00 H new ATOM 0 HA TYR A 154 -6.658 7.512 4.967 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -6.895 6.597 7.864 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -8.169 7.439 7.005 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -6.421 5.322 4.736 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -9.366 5.244 7.814 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -7.256 3.178 3.881 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -10.198 3.098 6.963 1.00 0.00 H new ATOM 0 HH TYR A 154 -8.720 1.540 4.108 1.00 0.00 H new ATOM 2437 N LYS A 155 -5.124 8.893 7.513 1.00 0.00 N ATOM 2438 CA LYS A 155 -4.735 10.152 8.126 1.00 0.00 C ATOM 2439 C LYS A 155 -4.124 11.092 7.102 1.00 0.00 C ATOM 2440 O LYS A 155 -4.421 12.288 7.087 1.00 0.00 O ATOM 2441 CB LYS A 155 -3.751 9.895 9.271 1.00 0.00 C ATOM 2442 CG LYS A 155 -4.267 10.356 10.622 1.00 0.00 C ATOM 2443 CD LYS A 155 -4.692 11.811 10.588 1.00 0.00 C ATOM 2444 CE LYS A 155 -4.367 12.515 11.892 1.00 0.00 C ATOM 2445 NZ LYS A 155 -3.922 13.918 11.670 1.00 0.00 N ATOM 0 H LYS A 155 -4.681 8.072 7.926 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.629 10.629 8.527 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.531 8.829 9.319 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.812 10.405 9.055 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -5.112 9.736 10.921 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -3.490 10.220 11.375 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -4.190 12.319 9.764 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -5.763 11.874 10.396 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -5.247 12.511 12.536 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -3.586 11.965 12.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -3.710 14.364 12.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -3.068 13.922 11.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -4.677 14.450 11.193 1.00 0.00 H new ATOM 2459 N GLU A 156 -3.283 10.547 6.236 1.00 0.00 N ATOM 2460 CA GLU A 156 -2.658 11.345 5.202 1.00 0.00 C ATOM 2461 C GLU A 156 -3.708 11.737 4.186 1.00 0.00 C ATOM 2462 O GLU A 156 -3.665 12.823 3.608 1.00 0.00 O ATOM 2463 CB GLU A 156 -1.522 10.569 4.533 1.00 0.00 C ATOM 2464 CG GLU A 156 -0.782 11.371 3.476 1.00 0.00 C ATOM 2465 CD GLU A 156 0.614 11.767 3.914 1.00 0.00 C ATOM 2466 OE1 GLU A 156 1.556 10.982 3.678 1.00 0.00 O ATOM 2467 OE2 GLU A 156 0.765 12.863 4.494 1.00 0.00 O ATOM 0 H GLU A 156 -3.021 9.561 6.231 1.00 0.00 H new ATOM 0 HA GLU A 156 -2.228 12.243 5.646 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -0.813 10.247 5.296 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.929 9.667 4.075 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.718 10.785 2.559 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -1.353 12.269 3.241 1.00 0.00 H new ATOM 2474 N VAL A 157 -4.669 10.846 3.996 1.00 0.00 N ATOM 2475 CA VAL A 157 -5.754 11.097 3.077 1.00 0.00 C ATOM 2476 C VAL A 157 -6.625 12.235 3.606 1.00 0.00 C ATOM 2477 O VAL A 157 -7.055 13.103 2.846 1.00 0.00 O ATOM 2478 CB VAL A 157 -6.613 9.836 2.853 1.00 0.00 C ATOM 2479 CG1 VAL A 157 -7.787 10.135 1.930 1.00 0.00 C ATOM 2480 CG2 VAL A 157 -5.760 8.711 2.285 1.00 0.00 C ATOM 0 H VAL A 157 -4.714 9.944 4.469 1.00 0.00 H new ATOM 0 HA VAL A 157 -5.323 11.380 2.117 1.00 0.00 H new ATOM 0 HB VAL A 157 -7.013 9.519 3.816 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -8.378 9.230 1.788 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -8.412 10.910 2.375 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -7.413 10.480 0.966 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -6.379 7.827 2.132 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -5.332 9.024 1.333 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -4.957 8.475 2.983 1.00 0.00 H new ATOM 2490 N LEU A 158 -6.874 12.230 4.920 1.00 0.00 N ATOM 2491 CA LEU A 158 -7.685 13.273 5.545 1.00 0.00 C ATOM 2492 C LEU A 158 -6.995 14.621 5.419 1.00 0.00 C ATOM 2493 O LEU A 158 -7.637 15.638 5.169 1.00 0.00 O ATOM 2494 CB LEU A 158 -7.934 12.957 7.022 1.00 0.00 C ATOM 2495 CG LEU A 158 -8.886 11.793 7.295 1.00 0.00 C ATOM 2496 CD1 LEU A 158 -9.110 11.633 8.792 1.00 0.00 C ATOM 2497 CD2 LEU A 158 -10.208 12.012 6.575 1.00 0.00 C ATOM 0 H LEU A 158 -6.527 11.520 5.565 1.00 0.00 H new ATOM 0 HA LEU A 158 -8.645 13.310 5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.977 12.739 7.495 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -8.332 13.850 7.504 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.435 10.876 6.915 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -9.790 10.800 8.971 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -8.157 11.436 9.283 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -9.543 12.548 9.195 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -10.876 11.175 6.778 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -10.666 12.936 6.928 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -10.031 12.082 5.502 1.00 0.00 H new ATOM 2509 N SER A 159 -5.674 14.615 5.579 1.00 0.00 N ATOM 2510 CA SER A 159 -4.896 15.840 5.463 1.00 0.00 C ATOM 2511 C SER A 159 -5.165 16.473 4.111 1.00 0.00 C ATOM 2512 O SER A 159 -5.342 17.685 3.997 1.00 0.00 O ATOM 2513 CB SER A 159 -3.403 15.545 5.629 1.00 0.00 C ATOM 2514 OG SER A 159 -3.157 14.820 6.822 1.00 0.00 O ATOM 0 H SER A 159 -5.125 13.781 5.788 1.00 0.00 H new ATOM 0 HA SER A 159 -5.192 16.532 6.252 1.00 0.00 H new ATOM 0 HB2 SER A 159 -3.044 14.975 4.772 1.00 0.00 H new ATOM 0 HB3 SER A 159 -2.844 16.480 5.646 1.00 0.00 H new ATOM 0 HG SER A 159 -3.511 13.911 6.731 1.00 0.00 H new ATOM 2520 N VAL A 160 -5.234 15.627 3.094 1.00 0.00 N ATOM 2521 CA VAL A 160 -5.531 16.083 1.749 1.00 0.00 C ATOM 2522 C VAL A 160 -6.960 16.604 1.702 1.00 0.00 C ATOM 2523 O VAL A 160 -7.242 17.650 1.118 1.00 0.00 O ATOM 2524 CB VAL A 160 -5.382 14.942 0.724 1.00 0.00 C ATOM 2525 CG1 VAL A 160 -5.791 15.405 -0.665 1.00 0.00 C ATOM 2526 CG2 VAL A 160 -3.959 14.403 0.718 1.00 0.00 C ATOM 0 H VAL A 160 -5.088 14.621 3.177 1.00 0.00 H new ATOM 0 HA VAL A 160 -4.824 16.872 1.493 1.00 0.00 H new ATOM 0 HB VAL A 160 -6.049 14.133 1.020 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -5.677 14.582 -1.371 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -6.832 15.728 -0.649 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -5.158 16.237 -0.972 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -3.878 13.599 -0.013 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -3.268 15.204 0.455 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.711 14.020 1.708 1.00 0.00 H new ATOM 2536 N PHE A 161 -7.856 15.835 2.312 1.00 0.00 N ATOM 2537 CA PHE A 161 -9.273 16.163 2.353 1.00 0.00 C ATOM 2538 C PHE A 161 -9.606 17.190 3.433 1.00 0.00 C ATOM 2539 O PHE A 161 -10.774 17.505 3.647 1.00 0.00 O ATOM 2540 CB PHE A 161 -10.073 14.882 2.586 1.00 0.00 C ATOM 2541 CG PHE A 161 -9.977 13.909 1.448 1.00 0.00 C ATOM 2542 CD1 PHE A 161 -9.714 14.347 0.159 1.00 0.00 C ATOM 2543 CD2 PHE A 161 -10.142 12.555 1.669 1.00 0.00 C ATOM 2544 CE1 PHE A 161 -9.618 13.450 -0.887 1.00 0.00 C ATOM 2545 CE2 PHE A 161 -10.046 11.652 0.628 1.00 0.00 C ATOM 2546 CZ PHE A 161 -9.785 12.101 -0.652 1.00 0.00 C ATOM 0 H PHE A 161 -7.618 14.967 2.792 1.00 0.00 H new ATOM 0 HA PHE A 161 -9.540 16.613 1.397 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -9.719 14.401 3.498 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -11.120 15.140 2.748 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -9.583 15.402 -0.029 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -10.348 12.199 2.667 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -9.413 13.804 -1.886 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -10.175 10.596 0.815 1.00 0.00 H new ATOM 0 HZ PHE A 161 -9.712 11.397 -1.468 1.00 0.00 H new ATOM 2556 N ALA A 162 -8.593 17.722 4.108 1.00 0.00 N ATOM 2557 CA ALA A 162 -8.835 18.712 5.148 1.00 0.00 C ATOM 2558 C ALA A 162 -9.559 19.927 4.579 1.00 0.00 C ATOM 2559 O ALA A 162 -10.599 20.334 5.098 1.00 0.00 O ATOM 2560 CB ALA A 162 -7.527 19.120 5.801 1.00 0.00 C ATOM 0 H ALA A 162 -7.612 17.489 3.957 1.00 0.00 H new ATOM 0 HA ALA A 162 -9.475 18.265 5.909 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -7.723 19.861 6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -7.054 18.245 6.246 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -6.863 19.548 5.050 1.00 0.00 H new ATOM 2566 N PRO A 163 -9.037 20.518 3.489 1.00 0.00 N ATOM 2567 CA PRO A 163 -9.669 21.676 2.849 1.00 0.00 C ATOM 2568 C PRO A 163 -11.095 21.369 2.392 1.00 0.00 C ATOM 2569 O PRO A 163 -11.850 22.274 2.039 1.00 0.00 O ATOM 2570 CB PRO A 163 -8.770 21.964 1.638 1.00 0.00 C ATOM 2571 CG PRO A 163 -7.989 20.712 1.424 1.00 0.00 C ATOM 2572 CD PRO A 163 -7.810 20.105 2.784 1.00 0.00 C ATOM 0 HA PRO A 163 -9.757 22.520 3.533 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -9.363 22.213 0.758 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -8.111 22.811 1.829 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -8.518 20.030 0.758 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -7.026 20.926 0.961 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -7.718 19.020 2.734 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -6.914 20.479 3.279 1.00 0.00 H new ATOM 2580 N HIS A 164 -11.456 20.086 2.400 1.00 0.00 N ATOM 2581 CA HIS A 164 -12.791 19.661 1.982 1.00 0.00 C ATOM 2582 C HIS A 164 -13.609 19.160 3.169 1.00 0.00 C ATOM 2583 O HIS A 164 -14.839 19.116 3.110 1.00 0.00 O ATOM 2584 CB HIS A 164 -12.683 18.561 0.925 1.00 0.00 C ATOM 2585 CG HIS A 164 -11.830 18.939 -0.245 1.00 0.00 C ATOM 2586 ND1 HIS A 164 -12.245 19.818 -1.223 1.00 0.00 N ATOM 2587 CD2 HIS A 164 -10.578 18.559 -0.592 1.00 0.00 C ATOM 2588 CE1 HIS A 164 -11.283 19.963 -2.119 1.00 0.00 C ATOM 2589 NE2 HIS A 164 -10.262 19.210 -1.759 1.00 0.00 N ATOM 0 H HIS A 164 -10.843 19.324 2.691 1.00 0.00 H new ATOM 0 HA HIS A 164 -13.302 20.525 1.557 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -12.274 17.663 1.387 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -13.682 18.310 0.570 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -9.945 17.871 -0.051 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -11.326 20.591 -2.996 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -9.381 19.125 -2.265 1.00 0.00 H new ATOM 2598 N LEU A 165 -12.925 18.776 4.241 1.00 0.00 N ATOM 2599 CA LEU A 165 -13.595 18.274 5.434 1.00 0.00 C ATOM 2600 C LEU A 165 -13.784 19.385 6.461 1.00 0.00 C ATOM 2601 O LEU A 165 -12.781 19.790 7.085 1.00 0.00 O ATOM 2602 CB LEU A 165 -12.793 17.127 6.050 1.00 0.00 C ATOM 2603 CG LEU A 165 -12.619 15.903 5.149 1.00 0.00 C ATOM 2604 CD1 LEU A 165 -11.666 14.908 5.789 1.00 0.00 C ATOM 2605 CD2 LEU A 165 -13.963 15.253 4.865 1.00 0.00 C ATOM 2606 OXT LEU A 165 -14.934 19.837 6.633 1.00 0.00 O ATOM 0 H LEU A 165 -11.908 18.803 4.308 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.577 17.905 5.140 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -11.806 17.500 6.325 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -13.284 16.814 6.972 1.00 0.00 H new ATOM 0 HG LEU A 165 -12.192 16.229 4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -11.552 14.042 5.137 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.695 15.379 5.940 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -12.067 14.587 6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.819 14.384 4.223 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -14.421 14.939 5.803 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -14.615 15.969 4.365 1.00 0.00 H new