USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 967 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 107 SER OG : rot -164:sc= -0.384 USER MOD Set 1.2: A 112 LYS NZ :NH3+ 166:sc= 0.713 (180deg=1.12) USER MOD Set 2.1: A 43 ASN : amide:sc= 0.092 K(o=0.092,f=-3.8!) USER MOD Set 2.2: A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 25 ASN : amide:sc= -2.16! C(o=-0.86!,f=-18!) USER MOD Set 3.2: A 30 LYS NZ :NH3+ -132:sc= 1.3 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot -160:sc= -0.424 USER MOD Single : A 24 SER OG : rot 48:sc= 0.0806 USER MOD Single : A 36 ASN : amide:sc= -0.178 K(o=-0.18,f=-11!) USER MOD Single : A 42 ASN : amide:sc= -2.08! C(o=-2.1!,f=-6.5!) USER MOD Single : A 45 ASN : amide:sc= -0.0813 X(o=-0.081,f=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 59:sc= 1.28 USER MOD Single : A 59 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 60 CYS SG : rot -140:sc= -1.81 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -1.14 K(o=-1.1,f=-2.6!) USER MOD Single : A 66 LYS NZ :NH3+ 168:sc= 0.169 (180deg=0.123) USER MOD Single : A 67 TYR OH : rot 167:sc= -0.553 USER MOD Single : A 68 LYS NZ :NH3+ -141:sc= 0.301 (180deg=-1.95!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= -0.0206 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 170:sc= -0.159 (180deg=-0.449) USER MOD Single : A 88 THR OG1 : rot -72:sc= 0.424 USER MOD Single : A 90 ASN : amide:sc= -1.04 K(o=-1,f=-14!) USER MOD Single : A 94 SER OG : rot 180:sc= -0.957 USER MOD Single : A 96 TYR OH : rot 180:sc=-0.00875 USER MOD Single : A 103 THR OG1 : rot -18:sc= -1.84! USER MOD Single : A 105 TYR OH : rot -152:sc= 1.12 USER MOD Single : A 110 ASN : amide:sc= -0.137 X(o=-0.14,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 165:sc= -0.0415 (180deg=-0.308) USER MOD Single : A 114 ASN : amide:sc= -0.507 K(o=-0.51,f=0) USER MOD Single : A 116 LYS NZ :NH3+ -111:sc= 0.392 (180deg=-0.0273) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 32:sc= 1.04 USER MOD Single : A 125 SER OG : rot 180:sc= -0.118 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -0.333 K(o=-0.33,f=-1.7) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 184 N TYR A 15 -17.361 0.655 -3.859 1.00 0.00 N ATOM 185 CA TYR A 15 -16.935 2.048 -3.913 1.00 0.00 C ATOM 186 C TYR A 15 -18.053 2.939 -4.445 1.00 0.00 C ATOM 187 O TYR A 15 -18.859 2.516 -5.275 1.00 0.00 O ATOM 188 CB TYR A 15 -15.693 2.190 -4.793 1.00 0.00 C ATOM 189 CG TYR A 15 -15.786 1.434 -6.100 1.00 0.00 C ATOM 190 CD1 TYR A 15 -15.668 0.050 -6.135 1.00 0.00 C ATOM 191 CD2 TYR A 15 -15.995 2.104 -7.299 1.00 0.00 C ATOM 192 CE1 TYR A 15 -15.753 -0.644 -7.326 1.00 0.00 C ATOM 193 CE2 TYR A 15 -16.082 1.418 -8.495 1.00 0.00 C ATOM 194 CZ TYR A 15 -15.960 0.044 -8.503 1.00 0.00 C ATOM 195 OH TYR A 15 -16.046 -0.644 -9.692 1.00 0.00 O ATOM 0 HA TYR A 15 -16.692 2.366 -2.899 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -15.527 3.246 -5.005 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -14.823 1.836 -4.239 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -15.507 -0.492 -5.215 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -16.091 3.180 -7.296 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -15.658 -1.720 -7.335 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -16.245 1.954 -9.418 1.00 0.00 H new ATOM 0 HH TYR A 15 -16.194 -0.012 -10.426 1.00 0.00 H new ATOM 205 N LEU A 16 -18.096 4.176 -3.962 1.00 0.00 N ATOM 206 CA LEU A 16 -19.114 5.130 -4.389 1.00 0.00 C ATOM 207 C LEU A 16 -18.597 6.007 -5.524 1.00 0.00 C ATOM 208 O LEU A 16 -19.327 6.316 -6.467 1.00 0.00 O ATOM 209 CB LEU A 16 -19.548 6.004 -3.211 1.00 0.00 C ATOM 210 CG LEU A 16 -18.501 6.986 -2.682 1.00 0.00 C ATOM 211 CD1 LEU A 16 -18.588 8.309 -3.426 1.00 0.00 C ATOM 212 CD2 LEU A 16 -18.679 7.200 -1.186 1.00 0.00 C ATOM 0 H LEU A 16 -17.438 4.542 -3.274 1.00 0.00 H new ATOM 0 HA LEU A 16 -19.974 4.567 -4.752 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -20.430 6.570 -3.510 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -19.851 5.351 -2.392 1.00 0.00 H new ATOM 0 HG LEU A 16 -17.512 6.561 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -17.836 8.995 -3.037 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -18.411 8.141 -4.488 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -19.579 8.740 -3.287 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -17.926 7.901 -0.827 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -19.673 7.604 -0.992 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -18.566 6.249 -0.666 1.00 0.00 H new ATOM 224 N LYS A 17 -17.333 6.405 -5.429 1.00 0.00 N ATOM 225 CA LYS A 17 -16.715 7.244 -6.449 1.00 0.00 C ATOM 226 C LYS A 17 -15.564 6.512 -7.132 1.00 0.00 C ATOM 227 O LYS A 17 -14.986 5.583 -6.568 1.00 0.00 O ATOM 228 CB LYS A 17 -16.208 8.547 -5.828 1.00 0.00 C ATOM 229 CG LYS A 17 -14.969 8.369 -4.968 1.00 0.00 C ATOM 230 CD LYS A 17 -14.655 9.627 -4.176 1.00 0.00 C ATOM 231 CE LYS A 17 -14.190 10.756 -5.083 1.00 0.00 C ATOM 232 NZ LYS A 17 -14.551 12.093 -4.534 1.00 0.00 N ATOM 0 H LYS A 17 -16.716 6.160 -4.655 1.00 0.00 H new ATOM 0 HA LYS A 17 -17.471 7.476 -7.200 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -15.988 9.258 -6.625 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -17.001 8.983 -5.221 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -15.117 7.534 -4.283 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -14.119 8.115 -5.601 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -15.542 9.943 -3.626 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -13.883 9.410 -3.438 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -13.109 10.696 -5.212 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -14.636 10.636 -6.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -14.217 12.836 -5.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -15.584 12.160 -4.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -14.104 12.218 -3.603 1.00 0.00 H new ATOM 246 N SER A 18 -15.236 6.938 -8.348 1.00 0.00 N ATOM 247 CA SER A 18 -14.156 6.321 -9.108 1.00 0.00 C ATOM 248 C SER A 18 -13.669 7.252 -10.214 1.00 0.00 C ATOM 249 O SER A 18 -14.437 8.050 -10.750 1.00 0.00 O ATOM 250 CB SER A 18 -14.620 4.994 -9.711 1.00 0.00 C ATOM 251 OG SER A 18 -15.554 5.208 -10.756 1.00 0.00 O ATOM 0 H SER A 18 -15.703 7.708 -8.827 1.00 0.00 H new ATOM 0 HA SER A 18 -13.328 6.131 -8.425 1.00 0.00 H new ATOM 0 HB2 SER A 18 -13.760 4.445 -10.094 1.00 0.00 H new ATOM 0 HB3 SER A 18 -15.073 4.377 -8.935 1.00 0.00 H new ATOM 0 HG SER A 18 -16.067 4.387 -10.910 1.00 0.00 H new ATOM 257 N GLU A 19 -12.387 7.144 -10.549 1.00 0.00 N ATOM 258 CA GLU A 19 -11.797 7.977 -11.590 1.00 0.00 C ATOM 259 C GLU A 19 -11.859 7.279 -12.946 1.00 0.00 C ATOM 260 O GLU A 19 -12.030 6.063 -13.039 1.00 0.00 O ATOM 261 CB GLU A 19 -10.346 8.315 -11.243 1.00 0.00 C ATOM 262 CG GLU A 19 -10.196 9.583 -10.420 1.00 0.00 C ATOM 263 CD GLU A 19 -10.318 10.840 -11.259 1.00 0.00 C ATOM 264 OE1 GLU A 19 -9.345 11.182 -11.963 1.00 0.00 O ATOM 265 OE2 GLU A 19 -11.388 11.483 -11.211 1.00 0.00 O ATOM 0 H GLU A 19 -11.738 6.488 -10.115 1.00 0.00 H new ATOM 0 HA GLU A 19 -12.373 8.901 -11.650 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.909 7.481 -10.693 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -9.776 8.422 -12.166 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -10.956 9.597 -9.639 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -9.227 9.576 -9.922 1.00 0.00 H new ATOM 272 N PRO A 20 -11.716 8.065 -14.023 1.00 0.00 N ATOM 273 CA PRO A 20 -11.751 7.545 -15.393 1.00 0.00 C ATOM 274 C PRO A 20 -10.525 6.701 -15.725 1.00 0.00 C ATOM 275 O PRO A 20 -9.409 7.024 -15.317 1.00 0.00 O ATOM 276 CB PRO A 20 -11.777 8.811 -16.253 1.00 0.00 C ATOM 277 CG PRO A 20 -11.140 9.857 -15.405 1.00 0.00 C ATOM 278 CD PRO A 20 -11.508 9.522 -13.986 1.00 0.00 C ATOM 0 HA PRO A 20 -12.603 6.885 -15.556 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -11.229 8.668 -17.184 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -12.797 9.086 -16.522 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.058 9.860 -15.537 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -11.497 10.850 -15.677 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.716 9.797 -13.290 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -12.408 10.049 -13.669 1.00 0.00 H new ATOM 286 N ILE A 21 -10.740 5.620 -16.467 1.00 0.00 N ATOM 287 CA ILE A 21 -9.651 4.732 -16.854 1.00 0.00 C ATOM 288 C ILE A 21 -8.722 5.406 -17.858 1.00 0.00 C ATOM 289 O ILE A 21 -9.157 5.974 -18.860 1.00 0.00 O ATOM 290 CB ILE A 21 -10.184 3.421 -17.464 1.00 0.00 C ATOM 291 CG1 ILE A 21 -11.275 2.825 -16.573 1.00 0.00 C ATOM 292 CG2 ILE A 21 -9.048 2.427 -17.657 1.00 0.00 C ATOM 293 CD1 ILE A 21 -10.750 2.251 -15.276 1.00 0.00 C ATOM 0 H ILE A 21 -11.658 5.338 -16.812 1.00 0.00 H new ATOM 0 HA ILE A 21 -9.094 4.501 -15.946 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.618 3.641 -18.439 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.011 3.597 -16.348 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -11.794 2.041 -17.124 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -9.440 1.506 -18.089 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.302 2.853 -18.327 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -8.588 2.209 -16.693 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -11.579 1.846 -14.695 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.036 1.456 -15.492 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -10.256 3.036 -14.704 1.00 0.00 H new ATOM 305 N PRO A 22 -7.410 5.341 -17.586 1.00 0.00 N ATOM 306 CA PRO A 22 -6.391 5.937 -18.455 1.00 0.00 C ATOM 307 C PRO A 22 -6.253 5.196 -19.780 1.00 0.00 C ATOM 308 O PRO A 22 -6.665 4.043 -19.902 1.00 0.00 O ATOM 309 CB PRO A 22 -5.106 5.809 -17.634 1.00 0.00 C ATOM 310 CG PRO A 22 -5.350 4.654 -16.725 1.00 0.00 C ATOM 311 CD PRO A 22 -6.821 4.679 -16.410 1.00 0.00 C ATOM 0 HA PRO A 22 -6.638 6.963 -18.728 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -4.243 5.632 -18.275 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -4.904 6.720 -17.071 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -5.069 3.715 -17.202 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -4.755 4.740 -15.816 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -7.220 3.674 -16.273 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -7.026 5.231 -15.493 1.00 0.00 H new ATOM 319 N GLU A 23 -5.671 5.866 -20.770 1.00 0.00 N ATOM 320 CA GLU A 23 -5.480 5.269 -22.087 1.00 0.00 C ATOM 321 C GLU A 23 -4.139 4.546 -22.167 1.00 0.00 C ATOM 322 O GLU A 23 -4.032 3.480 -22.771 1.00 0.00 O ATOM 323 CB GLU A 23 -5.559 6.343 -23.174 1.00 0.00 C ATOM 324 CG GLU A 23 -4.545 7.461 -23.000 1.00 0.00 C ATOM 325 CD GLU A 23 -4.482 8.383 -24.203 1.00 0.00 C ATOM 326 OE1 GLU A 23 -5.375 9.245 -24.338 1.00 0.00 O ATOM 327 OE2 GLU A 23 -3.537 8.242 -25.008 1.00 0.00 O ATOM 0 H GLU A 23 -5.324 6.821 -20.685 1.00 0.00 H new ATOM 0 HA GLU A 23 -6.275 4.541 -22.247 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -5.408 5.875 -24.147 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.562 6.771 -23.178 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -4.799 8.043 -22.114 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -3.560 7.029 -22.826 1.00 0.00 H new ATOM 334 N SER A 24 -3.118 5.136 -21.553 1.00 0.00 N ATOM 335 CA SER A 24 -1.782 4.552 -21.558 1.00 0.00 C ATOM 336 C SER A 24 -1.096 4.753 -20.210 1.00 0.00 C ATOM 337 O SER A 24 -0.652 5.854 -19.886 1.00 0.00 O ATOM 338 CB SER A 24 -0.935 5.171 -22.672 1.00 0.00 C ATOM 339 OG SER A 24 -1.086 6.580 -22.704 1.00 0.00 O ATOM 0 H SER A 24 -3.191 6.018 -21.046 1.00 0.00 H new ATOM 0 HA SER A 24 -1.881 3.482 -21.740 1.00 0.00 H new ATOM 0 HB2 SER A 24 0.114 4.918 -22.519 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.228 4.749 -23.633 1.00 0.00 H new ATOM 0 HG SER A 24 -0.994 6.940 -21.797 1.00 0.00 H new ATOM 345 N ASN A 25 -1.013 3.681 -19.429 1.00 0.00 N ATOM 346 CA ASN A 25 -0.382 3.739 -18.116 1.00 0.00 C ATOM 347 C ASN A 25 0.762 2.734 -18.017 1.00 0.00 C ATOM 348 O ASN A 25 0.875 2.001 -17.035 1.00 0.00 O ATOM 349 CB ASN A 25 -1.413 3.464 -17.019 1.00 0.00 C ATOM 350 CG ASN A 25 -1.910 2.032 -17.039 1.00 0.00 C ATOM 351 OD1 ASN A 25 -1.289 1.156 -17.640 1.00 0.00 O ATOM 352 ND2 ASN A 25 -3.037 1.788 -16.379 1.00 0.00 N ATOM 0 H ASN A 25 -1.375 2.762 -19.683 1.00 0.00 H new ATOM 0 HA ASN A 25 0.025 4.741 -17.980 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.970 3.679 -16.046 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -2.259 4.141 -17.141 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.421 0.843 -16.357 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -3.519 2.546 -15.895 1.00 0.00 H new ATOM 359 N ASP A 26 1.608 2.707 -19.041 1.00 0.00 N ATOM 360 CA ASP A 26 2.744 1.793 -19.070 1.00 0.00 C ATOM 361 C ASP A 26 3.957 2.414 -18.384 1.00 0.00 C ATOM 362 O ASP A 26 5.089 2.260 -18.842 1.00 0.00 O ATOM 363 CB ASP A 26 3.093 1.424 -20.513 1.00 0.00 C ATOM 364 CG ASP A 26 2.137 0.401 -21.095 1.00 0.00 C ATOM 365 OD1 ASP A 26 2.122 -0.746 -20.600 1.00 0.00 O ATOM 366 OD2 ASP A 26 1.405 0.747 -22.045 1.00 0.00 O ATOM 0 H ASP A 26 1.529 3.307 -19.862 1.00 0.00 H new ATOM 0 HA ASP A 26 2.465 0.889 -18.529 1.00 0.00 H new ATOM 0 HB2 ASP A 26 3.078 2.323 -21.129 1.00 0.00 H new ATOM 0 HB3 ASP A 26 4.109 1.030 -20.549 1.00 0.00 H new ATOM 371 N GLY A 27 3.713 3.116 -17.281 1.00 0.00 N ATOM 372 CA GLY A 27 4.794 3.750 -16.550 1.00 0.00 C ATOM 373 C GLY A 27 5.365 2.855 -15.468 1.00 0.00 C ATOM 374 O GLY A 27 5.194 1.636 -15.486 1.00 0.00 O ATOM 0 H GLY A 27 2.785 3.257 -16.881 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.587 4.025 -17.246 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.431 4.674 -16.099 1.00 0.00 H new ATOM 378 N PRO A 28 6.063 3.465 -14.498 1.00 0.00 N ATOM 379 CA PRO A 28 6.676 2.734 -13.386 1.00 0.00 C ATOM 380 C PRO A 28 5.639 2.171 -12.420 1.00 0.00 C ATOM 381 O PRO A 28 5.750 1.030 -11.970 1.00 0.00 O ATOM 382 CB PRO A 28 7.532 3.797 -12.691 1.00 0.00 C ATOM 383 CG PRO A 28 6.879 5.091 -13.034 1.00 0.00 C ATOM 384 CD PRO A 28 6.307 4.915 -14.413 1.00 0.00 C ATOM 0 HA PRO A 28 7.243 1.869 -13.731 1.00 0.00 H new ATOM 0 HB2 PRO A 28 7.559 3.641 -11.613 1.00 0.00 H new ATOM 0 HB3 PRO A 28 8.563 3.768 -13.043 1.00 0.00 H new ATOM 0 HG2 PRO A 28 6.097 5.335 -12.316 1.00 0.00 H new ATOM 0 HG3 PRO A 28 7.599 5.909 -13.012 1.00 0.00 H new ATOM 0 HD2 PRO A 28 5.387 5.486 -14.543 1.00 0.00 H new ATOM 0 HD3 PRO A 28 7.002 5.251 -15.182 1.00 0.00 H new ATOM 392 N VAL A 29 4.631 2.978 -12.105 1.00 0.00 N ATOM 393 CA VAL A 29 3.573 2.559 -11.194 1.00 0.00 C ATOM 394 C VAL A 29 2.223 2.516 -11.902 1.00 0.00 C ATOM 395 O VAL A 29 1.615 3.554 -12.167 1.00 0.00 O ATOM 396 CB VAL A 29 3.473 3.500 -9.979 1.00 0.00 C ATOM 397 CG1 VAL A 29 2.586 2.892 -8.903 1.00 0.00 C ATOM 398 CG2 VAL A 29 4.858 3.808 -9.429 1.00 0.00 C ATOM 0 H VAL A 29 4.525 3.926 -12.467 1.00 0.00 H new ATOM 0 HA VAL A 29 3.831 1.558 -10.849 1.00 0.00 H new ATOM 0 HB VAL A 29 3.019 4.436 -10.303 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.528 3.572 -8.053 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.586 2.728 -9.305 1.00 0.00 H new ATOM 0 HG13 VAL A 29 3.007 1.941 -8.579 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.769 4.474 -8.571 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.341 2.881 -9.120 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.457 4.290 -10.202 1.00 0.00 H new ATOM 408 N LYS A 30 1.759 1.309 -12.206 1.00 0.00 N ATOM 409 CA LYS A 30 0.479 1.129 -12.882 1.00 0.00 C ATOM 410 C LYS A 30 -0.635 1.863 -12.143 1.00 0.00 C ATOM 411 O LYS A 30 -0.729 1.797 -10.917 1.00 0.00 O ATOM 412 CB LYS A 30 0.140 -0.360 -12.988 1.00 0.00 C ATOM 413 CG LYS A 30 0.603 -0.998 -14.286 1.00 0.00 C ATOM 414 CD LYS A 30 -0.408 -0.792 -15.401 1.00 0.00 C ATOM 415 CE LYS A 30 -0.408 -1.959 -16.377 1.00 0.00 C ATOM 416 NZ LYS A 30 -0.765 -1.527 -17.757 1.00 0.00 N ATOM 0 H LYS A 30 2.250 0.440 -11.995 1.00 0.00 H new ATOM 0 HA LYS A 30 0.564 1.549 -13.884 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.596 -0.888 -12.150 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.939 -0.486 -12.896 1.00 0.00 H new ATOM 0 HG2 LYS A 30 1.562 -0.572 -14.580 1.00 0.00 H new ATOM 0 HG3 LYS A 30 0.763 -2.065 -14.131 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.404 -0.674 -14.973 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.179 0.130 -15.935 1.00 0.00 H new ATOM 0 HE2 LYS A 30 0.577 -2.425 -16.386 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.116 -2.716 -16.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.489 -2.165 -18.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.137 -0.556 -17.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 0.082 -1.558 -18.360 1.00 0.00 H new ATOM 430 N VAL A 31 -1.478 2.562 -12.896 1.00 0.00 N ATOM 431 CA VAL A 31 -2.588 3.306 -12.313 1.00 0.00 C ATOM 432 C VAL A 31 -3.797 2.406 -12.090 1.00 0.00 C ATOM 433 O VAL A 31 -4.327 1.816 -13.032 1.00 0.00 O ATOM 434 CB VAL A 31 -3.000 4.491 -13.207 1.00 0.00 C ATOM 435 CG1 VAL A 31 -4.159 5.253 -12.582 1.00 0.00 C ATOM 436 CG2 VAL A 31 -1.815 5.412 -13.450 1.00 0.00 C ATOM 0 H VAL A 31 -1.413 2.629 -13.912 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.243 3.688 -11.352 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.330 4.100 -14.170 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.437 6.087 -13.227 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.012 4.585 -12.465 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.860 5.634 -11.606 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.124 6.243 -14.083 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.452 5.797 -12.497 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.018 4.857 -13.944 1.00 0.00 H new ATOM 446 N VAL A 32 -4.231 2.305 -10.838 1.00 0.00 N ATOM 447 CA VAL A 32 -5.380 1.477 -10.491 1.00 0.00 C ATOM 448 C VAL A 32 -6.493 2.314 -9.872 1.00 0.00 C ATOM 449 O VAL A 32 -6.331 2.882 -8.792 1.00 0.00 O ATOM 450 CB VAL A 32 -4.989 0.357 -9.509 1.00 0.00 C ATOM 451 CG1 VAL A 32 -6.117 -0.654 -9.374 1.00 0.00 C ATOM 452 CG2 VAL A 32 -3.704 -0.323 -9.960 1.00 0.00 C ATOM 0 H VAL A 32 -3.804 2.786 -10.047 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.738 1.029 -11.418 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.814 0.802 -8.530 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -5.822 -1.437 -8.676 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.011 -0.154 -9.001 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.328 -1.096 -10.348 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.443 -1.112 -9.254 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.849 -0.755 -10.950 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -2.899 0.410 -9.999 1.00 0.00 H new ATOM 462 N VAL A 33 -7.626 2.386 -10.564 1.00 0.00 N ATOM 463 CA VAL A 33 -8.769 3.153 -10.082 1.00 0.00 C ATOM 464 C VAL A 33 -9.923 2.235 -9.695 1.00 0.00 C ATOM 465 O VAL A 33 -10.180 1.231 -10.358 1.00 0.00 O ATOM 466 CB VAL A 33 -9.259 4.156 -11.143 1.00 0.00 C ATOM 467 CG1 VAL A 33 -8.207 5.226 -11.393 1.00 0.00 C ATOM 468 CG2 VAL A 33 -9.616 3.435 -12.433 1.00 0.00 C ATOM 0 H VAL A 33 -7.777 1.923 -11.460 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.434 3.701 -9.202 1.00 0.00 H new ATOM 0 HB VAL A 33 -10.158 4.645 -10.767 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -8.571 5.925 -12.146 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -8.006 5.763 -10.466 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -7.289 4.758 -11.747 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -9.960 4.159 -13.171 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -8.737 2.917 -12.816 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.407 2.711 -12.238 1.00 0.00 H new ATOM 478 N ALA A 34 -10.616 2.587 -8.617 1.00 0.00 N ATOM 479 CA ALA A 34 -11.745 1.796 -8.142 1.00 0.00 C ATOM 480 C ALA A 34 -12.449 1.095 -9.299 1.00 0.00 C ATOM 481 O ALA A 34 -12.884 -0.048 -9.171 1.00 0.00 O ATOM 482 CB ALA A 34 -12.724 2.678 -7.382 1.00 0.00 C ATOM 0 H ALA A 34 -10.415 3.415 -8.056 1.00 0.00 H new ATOM 0 HA ALA A 34 -11.363 1.031 -7.467 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -13.562 2.075 -7.033 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.220 3.128 -6.527 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.093 3.464 -8.041 1.00 0.00 H new ATOM 488 N GLU A 35 -12.557 1.789 -10.428 1.00 0.00 N ATOM 489 CA GLU A 35 -13.210 1.232 -11.607 1.00 0.00 C ATOM 490 C GLU A 35 -12.557 -0.084 -12.020 1.00 0.00 C ATOM 491 O GLU A 35 -13.235 -1.094 -12.206 1.00 0.00 O ATOM 492 CB GLU A 35 -13.154 2.228 -12.767 1.00 0.00 C ATOM 493 CG GLU A 35 -14.318 3.205 -12.787 1.00 0.00 C ATOM 494 CD GLU A 35 -14.667 3.667 -14.189 1.00 0.00 C ATOM 495 OE1 GLU A 35 -13.757 4.144 -14.899 1.00 0.00 O ATOM 496 OE2 GLU A 35 -15.848 3.553 -14.575 1.00 0.00 O ATOM 0 H GLU A 35 -12.201 2.737 -10.551 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.252 1.037 -11.355 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.221 2.789 -12.709 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.137 1.677 -13.707 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.191 2.734 -12.336 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -14.071 4.072 -12.174 1.00 0.00 H new ATOM 503 N ASN A 36 -11.236 -0.063 -12.162 1.00 0.00 N ATOM 504 CA ASN A 36 -10.490 -1.253 -12.554 1.00 0.00 C ATOM 505 C ASN A 36 -9.643 -1.771 -11.396 1.00 0.00 C ATOM 506 O ASN A 36 -8.633 -2.444 -11.603 1.00 0.00 O ATOM 507 CB ASN A 36 -9.596 -0.947 -13.758 1.00 0.00 C ATOM 508 CG ASN A 36 -8.544 0.099 -13.445 1.00 0.00 C ATOM 509 OD1 ASN A 36 -8.523 0.667 -12.353 1.00 0.00 O ATOM 510 ND2 ASN A 36 -7.664 0.358 -14.405 1.00 0.00 N ATOM 0 H ASN A 36 -10.660 0.765 -12.011 1.00 0.00 H new ATOM 0 HA ASN A 36 -11.207 -2.026 -12.830 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -9.107 -1.864 -14.086 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -10.213 -0.601 -14.587 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -6.932 1.052 -14.253 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -7.720 -0.137 -15.295 1.00 0.00 H new ATOM 517 N PHE A 37 -10.061 -1.452 -10.175 1.00 0.00 N ATOM 518 CA PHE A 37 -9.341 -1.884 -8.983 1.00 0.00 C ATOM 519 C PHE A 37 -9.339 -3.406 -8.870 1.00 0.00 C ATOM 520 O PHE A 37 -8.290 -4.025 -8.695 1.00 0.00 O ATOM 521 CB PHE A 37 -9.970 -1.269 -7.731 1.00 0.00 C ATOM 522 CG PHE A 37 -9.408 -1.814 -6.449 1.00 0.00 C ATOM 523 CD1 PHE A 37 -9.812 -3.050 -5.970 1.00 0.00 C ATOM 524 CD2 PHE A 37 -8.476 -1.090 -5.723 1.00 0.00 C ATOM 525 CE1 PHE A 37 -9.296 -3.554 -4.791 1.00 0.00 C ATOM 526 CE2 PHE A 37 -7.957 -1.590 -4.543 1.00 0.00 C ATOM 527 CZ PHE A 37 -8.368 -2.823 -4.076 1.00 0.00 C ATOM 0 H PHE A 37 -10.895 -0.896 -9.985 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.309 -1.543 -9.068 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -9.823 -0.189 -7.753 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -11.046 -1.445 -7.751 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -10.538 -3.626 -6.524 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -8.151 -0.125 -6.083 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -9.618 -4.519 -4.429 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -7.230 -1.016 -3.987 1.00 0.00 H new ATOM 0 HZ PHE A 37 -7.965 -3.215 -3.154 1.00 0.00 H new ATOM 537 N ASP A 38 -10.522 -4.002 -8.971 1.00 0.00 N ATOM 538 CA ASP A 38 -10.659 -5.451 -8.881 1.00 0.00 C ATOM 539 C ASP A 38 -10.040 -6.131 -10.098 1.00 0.00 C ATOM 540 O ASP A 38 -9.975 -7.358 -10.169 1.00 0.00 O ATOM 541 CB ASP A 38 -12.133 -5.839 -8.758 1.00 0.00 C ATOM 542 CG ASP A 38 -12.406 -7.243 -9.260 1.00 0.00 C ATOM 543 OD1 ASP A 38 -12.490 -7.427 -10.493 1.00 0.00 O ATOM 544 OD2 ASP A 38 -12.533 -8.159 -8.421 1.00 0.00 O ATOM 0 H ASP A 38 -11.400 -3.504 -9.115 1.00 0.00 H new ATOM 0 HA ASP A 38 -10.128 -5.787 -7.990 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -12.440 -5.763 -7.715 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -12.740 -5.130 -9.321 1.00 0.00 H new ATOM 549 N GLU A 39 -9.589 -5.326 -11.055 1.00 0.00 N ATOM 550 CA GLU A 39 -8.978 -5.852 -12.270 1.00 0.00 C ATOM 551 C GLU A 39 -7.464 -5.966 -12.112 1.00 0.00 C ATOM 552 O GLU A 39 -6.863 -6.967 -12.502 1.00 0.00 O ATOM 553 CB GLU A 39 -9.311 -4.955 -13.464 1.00 0.00 C ATOM 554 CG GLU A 39 -8.301 -5.048 -14.595 1.00 0.00 C ATOM 555 CD GLU A 39 -8.924 -4.800 -15.956 1.00 0.00 C ATOM 556 OE1 GLU A 39 -9.471 -3.698 -16.167 1.00 0.00 O ATOM 557 OE2 GLU A 39 -8.863 -5.710 -16.809 1.00 0.00 O ATOM 0 H GLU A 39 -9.635 -4.308 -11.012 1.00 0.00 H new ATOM 0 HA GLU A 39 -9.383 -6.848 -12.449 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -10.296 -5.223 -13.845 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -9.370 -3.921 -13.125 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -7.505 -4.323 -14.427 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -7.840 -6.036 -14.585 1.00 0.00 H new ATOM 564 N ILE A 40 -6.856 -4.933 -11.539 1.00 0.00 N ATOM 565 CA ILE A 40 -5.413 -4.918 -11.330 1.00 0.00 C ATOM 566 C ILE A 40 -5.059 -5.351 -9.911 1.00 0.00 C ATOM 567 O ILE A 40 -4.368 -6.350 -9.709 1.00 0.00 O ATOM 568 CB ILE A 40 -4.822 -3.520 -11.590 1.00 0.00 C ATOM 569 CG1 ILE A 40 -5.428 -2.914 -12.858 1.00 0.00 C ATOM 570 CG2 ILE A 40 -3.307 -3.599 -11.707 1.00 0.00 C ATOM 571 CD1 ILE A 40 -4.976 -1.495 -13.125 1.00 0.00 C ATOM 0 H ILE A 40 -7.339 -4.096 -11.211 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.983 -5.624 -12.041 1.00 0.00 H new ATOM 0 HB ILE A 40 -5.069 -2.875 -10.747 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -5.163 -3.538 -13.712 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -6.515 -2.931 -12.776 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.904 -2.603 -11.891 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.891 -3.994 -10.780 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -3.040 -4.257 -12.534 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.445 -1.130 -14.039 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.265 -0.858 -12.289 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.892 -1.474 -13.240 1.00 0.00 H new ATOM 583 N VAL A 41 -5.538 -4.593 -8.930 1.00 0.00 N ATOM 584 CA VAL A 41 -5.275 -4.899 -7.529 1.00 0.00 C ATOM 585 C VAL A 41 -5.660 -6.337 -7.199 1.00 0.00 C ATOM 586 O VAL A 41 -4.814 -7.146 -6.820 1.00 0.00 O ATOM 587 CB VAL A 41 -6.042 -3.947 -6.592 1.00 0.00 C ATOM 588 CG1 VAL A 41 -5.905 -4.396 -5.145 1.00 0.00 C ATOM 589 CG2 VAL A 41 -5.547 -2.519 -6.765 1.00 0.00 C ATOM 0 H VAL A 41 -6.110 -3.762 -9.080 1.00 0.00 H new ATOM 0 HA VAL A 41 -4.204 -4.767 -7.372 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.099 -3.977 -6.857 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.453 -3.711 -4.498 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.311 -5.402 -5.036 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.852 -4.397 -4.863 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.099 -1.859 -6.096 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.484 -2.471 -6.527 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.702 -2.203 -7.796 1.00 0.00 H new ATOM 599 N ASN A 42 -6.944 -6.649 -7.347 1.00 0.00 N ATOM 600 CA ASN A 42 -7.441 -7.991 -7.065 1.00 0.00 C ATOM 601 C ASN A 42 -6.855 -9.005 -8.042 1.00 0.00 C ATOM 602 O ASN A 42 -7.044 -8.896 -9.253 1.00 0.00 O ATOM 603 CB ASN A 42 -8.969 -8.017 -7.141 1.00 0.00 C ATOM 604 CG ASN A 42 -9.616 -7.166 -6.066 1.00 0.00 C ATOM 605 OD1 ASN A 42 -8.935 -6.446 -5.335 1.00 0.00 O ATOM 606 ND2 ASN A 42 -10.938 -7.245 -5.964 1.00 0.00 N ATOM 0 H ASN A 42 -7.658 -5.992 -7.660 1.00 0.00 H new ATOM 0 HA ASN A 42 -7.129 -8.263 -6.057 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -9.287 -7.663 -8.121 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.317 -9.045 -7.045 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.429 -6.696 -5.259 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -11.462 -7.855 -6.591 1.00 0.00 H new ATOM 613 N ASN A 43 -6.144 -9.992 -7.507 1.00 0.00 N ATOM 614 CA ASN A 43 -5.530 -11.026 -8.331 1.00 0.00 C ATOM 615 C ASN A 43 -4.881 -12.100 -7.463 1.00 0.00 C ATOM 616 O ASN A 43 -3.977 -11.815 -6.678 1.00 0.00 O ATOM 617 CB ASN A 43 -4.486 -10.411 -9.265 1.00 0.00 C ATOM 618 CG ASN A 43 -4.310 -11.209 -10.542 1.00 0.00 C ATOM 619 OD1 ASN A 43 -3.854 -12.352 -10.515 1.00 0.00 O ATOM 620 ND2 ASN A 43 -4.672 -10.608 -11.670 1.00 0.00 N ATOM 0 H ASN A 43 -5.979 -10.097 -6.506 1.00 0.00 H new ATOM 0 HA ASN A 43 -6.314 -11.491 -8.929 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -4.781 -9.392 -9.515 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -3.530 -10.347 -8.745 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -4.577 -11.095 -12.561 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -5.045 -9.659 -11.645 1.00 0.00 H new ATOM 627 N GLU A 44 -5.350 -13.336 -7.611 1.00 0.00 N ATOM 628 CA GLU A 44 -4.816 -14.452 -6.840 1.00 0.00 C ATOM 629 C GLU A 44 -3.919 -15.332 -7.706 1.00 0.00 C ATOM 630 O GLU A 44 -3.847 -16.544 -7.511 1.00 0.00 O ATOM 631 CB GLU A 44 -5.956 -15.288 -6.253 1.00 0.00 C ATOM 632 CG GLU A 44 -7.129 -15.468 -7.202 1.00 0.00 C ATOM 633 CD GLU A 44 -6.747 -16.213 -8.466 1.00 0.00 C ATOM 634 OE1 GLU A 44 -6.134 -15.593 -9.359 1.00 0.00 O ATOM 635 OE2 GLU A 44 -7.062 -17.418 -8.562 1.00 0.00 O ATOM 0 H GLU A 44 -6.098 -13.589 -8.257 1.00 0.00 H new ATOM 0 HA GLU A 44 -4.218 -14.044 -6.025 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -5.570 -16.269 -5.975 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -6.309 -14.813 -5.338 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -7.925 -16.010 -6.691 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -7.530 -14.490 -7.468 1.00 0.00 H new ATOM 642 N ASN A 45 -3.237 -14.711 -8.663 1.00 0.00 N ATOM 643 CA ASN A 45 -2.346 -15.437 -9.560 1.00 0.00 C ATOM 644 C ASN A 45 -0.961 -14.798 -9.585 1.00 0.00 C ATOM 645 O ASN A 45 0.047 -15.480 -9.770 1.00 0.00 O ATOM 646 CB ASN A 45 -2.930 -15.471 -10.974 1.00 0.00 C ATOM 647 CG ASN A 45 -2.362 -16.605 -11.806 1.00 0.00 C ATOM 648 OD1 ASN A 45 -1.764 -16.379 -12.858 1.00 0.00 O ATOM 649 ND2 ASN A 45 -2.549 -17.834 -11.337 1.00 0.00 N ATOM 0 H ASN A 45 -3.284 -13.707 -8.837 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.249 -16.457 -9.189 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.013 -15.575 -10.914 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -2.727 -14.522 -11.471 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -2.191 -18.637 -11.854 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -3.051 -17.974 -10.460 1.00 0.00 H new ATOM 656 N LYS A 46 -0.918 -13.483 -9.398 1.00 0.00 N ATOM 657 CA LYS A 46 0.342 -12.750 -9.397 1.00 0.00 C ATOM 658 C LYS A 46 0.363 -11.705 -8.286 1.00 0.00 C ATOM 659 O LYS A 46 -0.622 -11.000 -8.065 1.00 0.00 O ATOM 660 CB LYS A 46 0.564 -12.074 -10.752 1.00 0.00 C ATOM 661 CG LYS A 46 -0.545 -11.112 -11.140 1.00 0.00 C ATOM 662 CD LYS A 46 -0.022 -9.980 -12.008 1.00 0.00 C ATOM 663 CE LYS A 46 -1.155 -9.252 -12.716 1.00 0.00 C ATOM 664 NZ LYS A 46 -2.071 -8.582 -11.752 1.00 0.00 N ATOM 0 H LYS A 46 -1.743 -12.903 -9.245 1.00 0.00 H new ATOM 0 HA LYS A 46 1.147 -13.462 -9.217 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.510 -11.534 -10.728 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.654 -12.841 -11.521 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -1.326 -11.652 -11.676 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.002 -10.700 -10.240 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.536 -9.275 -11.392 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.674 -10.378 -12.746 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.740 -8.510 -13.398 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.720 -9.961 -13.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.829 -8.097 -12.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.487 -9.293 -11.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.537 -7.887 -11.192 1.00 0.00 H new ATOM 678 N ASP A 47 1.491 -11.610 -7.590 1.00 0.00 N ATOM 679 CA ASP A 47 1.640 -10.649 -6.504 1.00 0.00 C ATOM 680 C ASP A 47 1.376 -9.229 -6.994 1.00 0.00 C ATOM 681 O ASP A 47 1.803 -8.847 -8.084 1.00 0.00 O ATOM 682 CB ASP A 47 3.043 -10.741 -5.902 1.00 0.00 C ATOM 683 CG ASP A 47 3.590 -12.155 -5.923 1.00 0.00 C ATOM 684 OD1 ASP A 47 2.780 -13.104 -5.890 1.00 0.00 O ATOM 685 OD2 ASP A 47 4.829 -12.311 -5.972 1.00 0.00 O ATOM 0 H ASP A 47 2.315 -12.187 -7.759 1.00 0.00 H new ATOM 0 HA ASP A 47 0.906 -10.891 -5.735 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.716 -10.086 -6.455 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.019 -10.379 -4.874 1.00 0.00 H new ATOM 690 N VAL A 48 0.667 -8.450 -6.183 1.00 0.00 N ATOM 691 CA VAL A 48 0.345 -7.072 -6.534 1.00 0.00 C ATOM 692 C VAL A 48 0.524 -6.144 -5.337 1.00 0.00 C ATOM 693 O VAL A 48 0.517 -6.587 -4.188 1.00 0.00 O ATOM 694 CB VAL A 48 -1.099 -6.948 -7.054 1.00 0.00 C ATOM 695 CG1 VAL A 48 -1.378 -5.528 -7.522 1.00 0.00 C ATOM 696 CG2 VAL A 48 -1.348 -7.946 -8.175 1.00 0.00 C ATOM 0 H VAL A 48 0.305 -8.750 -5.278 1.00 0.00 H new ATOM 0 HA VAL A 48 1.035 -6.777 -7.325 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.782 -7.176 -6.236 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.403 -5.460 -7.886 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.242 -4.837 -6.690 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.689 -5.268 -8.326 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.373 -7.845 -8.531 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.658 -7.751 -8.996 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.191 -8.958 -7.802 1.00 0.00 H new ATOM 706 N LEU A 49 0.683 -4.855 -5.614 1.00 0.00 N ATOM 707 CA LEU A 49 0.864 -3.862 -4.561 1.00 0.00 C ATOM 708 C LEU A 49 0.099 -2.582 -4.882 1.00 0.00 C ATOM 709 O LEU A 49 0.183 -2.060 -5.994 1.00 0.00 O ATOM 710 CB LEU A 49 2.350 -3.550 -4.376 1.00 0.00 C ATOM 711 CG LEU A 49 2.719 -2.765 -3.116 1.00 0.00 C ATOM 712 CD1 LEU A 49 2.630 -3.657 -1.887 1.00 0.00 C ATOM 713 CD2 LEU A 49 4.114 -2.172 -3.247 1.00 0.00 C ATOM 0 H LEU A 49 0.690 -4.472 -6.560 1.00 0.00 H new ATOM 0 HA LEU A 49 0.469 -4.276 -3.634 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.900 -4.491 -4.368 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.694 -2.987 -5.244 1.00 0.00 H new ATOM 0 HG LEU A 49 2.008 -1.947 -2.999 1.00 0.00 H new ATOM 0 HD11 LEU A 49 2.896 -3.082 -1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.612 -4.034 -1.784 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.318 -4.496 -1.995 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.360 -1.617 -2.342 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.838 -2.974 -3.389 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.144 -1.500 -4.104 1.00 0.00 H new ATOM 725 N ILE A 50 -0.644 -2.081 -3.901 1.00 0.00 N ATOM 726 CA ILE A 50 -1.420 -0.860 -4.078 1.00 0.00 C ATOM 727 C ILE A 50 -0.925 0.246 -3.153 1.00 0.00 C ATOM 728 O ILE A 50 -0.569 -0.008 -2.003 1.00 0.00 O ATOM 729 CB ILE A 50 -2.918 -1.102 -3.815 1.00 0.00 C ATOM 730 CG1 ILE A 50 -3.719 0.172 -4.090 1.00 0.00 C ATOM 731 CG2 ILE A 50 -3.135 -1.571 -2.384 1.00 0.00 C ATOM 732 CD1 ILE A 50 -4.088 0.350 -5.547 1.00 0.00 C ATOM 0 H ILE A 50 -0.725 -2.502 -2.975 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.287 -0.550 -5.114 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.269 -1.882 -4.490 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.630 0.155 -3.492 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.139 1.035 -3.762 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.199 -1.738 -2.213 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -2.591 -2.501 -2.219 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.771 -0.811 -1.693 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.654 1.273 -5.669 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.181 0.399 -6.149 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -4.695 -0.494 -5.874 1.00 0.00 H new ATOM 744 N GLU A 51 -0.907 1.474 -3.663 1.00 0.00 N ATOM 745 CA GLU A 51 -0.456 2.619 -2.881 1.00 0.00 C ATOM 746 C GLU A 51 -1.517 3.715 -2.860 1.00 0.00 C ATOM 747 O GLU A 51 -1.889 4.255 -3.903 1.00 0.00 O ATOM 748 CB GLU A 51 0.852 3.170 -3.451 1.00 0.00 C ATOM 749 CG GLU A 51 1.755 3.799 -2.403 1.00 0.00 C ATOM 750 CD GLU A 51 2.589 4.937 -2.958 1.00 0.00 C ATOM 751 OE1 GLU A 51 2.116 5.620 -3.890 1.00 0.00 O ATOM 752 OE2 GLU A 51 3.715 5.146 -2.459 1.00 0.00 O ATOM 0 H GLU A 51 -1.199 1.701 -4.614 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.285 2.284 -1.858 1.00 0.00 H new ATOM 0 HB2 GLU A 51 1.392 2.363 -3.946 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.621 3.914 -4.214 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.145 4.169 -1.579 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.416 3.035 -1.993 1.00 0.00 H new ATOM 759 N PHE A 52 -2.002 4.039 -1.666 1.00 0.00 N ATOM 760 CA PHE A 52 -3.021 5.070 -1.508 1.00 0.00 C ATOM 761 C PHE A 52 -2.394 6.395 -1.086 1.00 0.00 C ATOM 762 O PHE A 52 -1.941 6.546 0.049 1.00 0.00 O ATOM 763 CB PHE A 52 -4.063 4.633 -0.476 1.00 0.00 C ATOM 764 CG PHE A 52 -4.710 3.317 -0.798 1.00 0.00 C ATOM 765 CD1 PHE A 52 -5.612 3.211 -1.845 1.00 0.00 C ATOM 766 CD2 PHE A 52 -4.418 2.186 -0.053 1.00 0.00 C ATOM 767 CE1 PHE A 52 -6.209 2.001 -2.144 1.00 0.00 C ATOM 768 CE2 PHE A 52 -5.012 0.973 -0.348 1.00 0.00 C ATOM 769 CZ PHE A 52 -5.910 0.881 -1.393 1.00 0.00 C ATOM 0 H PHE A 52 -1.706 3.602 -0.793 1.00 0.00 H new ATOM 0 HA PHE A 52 -3.511 5.212 -2.471 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -3.587 4.565 0.502 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -4.834 5.400 -0.403 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.851 4.084 -2.434 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.719 2.253 0.767 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.908 1.931 -2.964 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.774 0.098 0.238 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.378 -0.065 -1.623 1.00 0.00 H new ATOM 779 N TYR A 53 -2.371 7.352 -2.006 1.00 0.00 N ATOM 780 CA TYR A 53 -1.797 8.664 -1.731 1.00 0.00 C ATOM 781 C TYR A 53 -2.865 9.751 -1.800 1.00 0.00 C ATOM 782 O TYR A 53 -4.038 9.470 -2.044 1.00 0.00 O ATOM 783 CB TYR A 53 -0.676 8.972 -2.725 1.00 0.00 C ATOM 784 CG TYR A 53 -1.164 9.194 -4.139 1.00 0.00 C ATOM 785 CD1 TYR A 53 -1.769 10.390 -4.506 1.00 0.00 C ATOM 786 CD2 TYR A 53 -1.018 8.209 -5.107 1.00 0.00 C ATOM 787 CE1 TYR A 53 -2.216 10.597 -5.796 1.00 0.00 C ATOM 788 CE2 TYR A 53 -1.462 8.408 -6.401 1.00 0.00 C ATOM 789 CZ TYR A 53 -2.061 9.603 -6.740 1.00 0.00 C ATOM 790 OH TYR A 53 -2.504 9.806 -8.027 1.00 0.00 O ATOM 0 H TYR A 53 -2.743 7.244 -2.949 1.00 0.00 H new ATOM 0 HA TYR A 53 -1.385 8.648 -0.722 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -0.140 9.860 -2.391 1.00 0.00 H new ATOM 0 HB3 TYR A 53 0.038 8.148 -2.721 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -1.892 11.171 -3.770 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.550 7.272 -4.845 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -2.685 11.532 -6.065 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -1.340 7.632 -7.142 1.00 0.00 H new ATOM 0 HH TYR A 53 -2.318 9.009 -8.566 1.00 0.00 H new ATOM 800 N ALA A 54 -2.449 10.995 -1.582 1.00 0.00 N ATOM 801 CA ALA A 54 -3.368 12.125 -1.622 1.00 0.00 C ATOM 802 C ALA A 54 -2.787 13.276 -2.436 1.00 0.00 C ATOM 803 O ALA A 54 -1.630 13.662 -2.273 1.00 0.00 O ATOM 804 CB ALA A 54 -3.696 12.588 -0.210 1.00 0.00 C ATOM 0 H ALA A 54 -1.482 11.245 -1.376 1.00 0.00 H new ATOM 0 HA ALA A 54 -4.287 11.798 -2.108 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -4.383 13.433 -0.255 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -4.160 11.771 0.342 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -2.779 12.892 0.295 1.00 0.00 H new ATOM 810 N PRO A 55 -3.608 13.839 -3.336 1.00 0.00 N ATOM 811 CA PRO A 55 -3.197 14.954 -4.194 1.00 0.00 C ATOM 812 C PRO A 55 -3.008 16.249 -3.411 1.00 0.00 C ATOM 813 O PRO A 55 -2.645 17.280 -3.977 1.00 0.00 O ATOM 814 CB PRO A 55 -4.360 15.091 -5.180 1.00 0.00 C ATOM 815 CG PRO A 55 -5.536 14.530 -4.458 1.00 0.00 C ATOM 816 CD PRO A 55 -5.001 13.430 -3.584 1.00 0.00 C ATOM 0 HA PRO A 55 -2.235 14.767 -4.671 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -4.525 16.133 -5.456 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -4.164 14.544 -6.102 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -6.029 15.297 -3.861 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -6.277 14.146 -5.159 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.566 13.344 -2.656 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.053 12.461 -4.080 1.00 0.00 H new ATOM 824 N TRP A 56 -3.256 16.188 -2.107 1.00 0.00 N ATOM 825 CA TRP A 56 -3.112 17.357 -1.247 1.00 0.00 C ATOM 826 C TRP A 56 -2.198 17.053 -0.065 1.00 0.00 C ATOM 827 O TRP A 56 -2.035 17.880 0.833 1.00 0.00 O ATOM 828 CB TRP A 56 -4.482 17.817 -0.744 1.00 0.00 C ATOM 829 CG TRP A 56 -5.464 16.696 -0.589 1.00 0.00 C ATOM 830 CD1 TRP A 56 -6.415 16.309 -1.490 1.00 0.00 C ATOM 831 CD2 TRP A 56 -5.594 15.819 0.536 1.00 0.00 C ATOM 832 NE1 TRP A 56 -7.128 15.244 -0.993 1.00 0.00 N ATOM 833 CE2 TRP A 56 -6.643 14.924 0.247 1.00 0.00 C ATOM 834 CE3 TRP A 56 -4.925 15.701 1.757 1.00 0.00 C ATOM 835 CZ2 TRP A 56 -7.037 13.928 1.137 1.00 0.00 C ATOM 836 CZ3 TRP A 56 -5.317 14.712 2.638 1.00 0.00 C ATOM 837 CH2 TRP A 56 -6.365 13.836 2.325 1.00 0.00 C ATOM 0 H TRP A 56 -3.557 15.342 -1.623 1.00 0.00 H new ATOM 0 HA TRP A 56 -2.661 18.157 -1.834 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -4.359 18.318 0.216 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -4.888 18.553 -1.438 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -6.582 16.772 -2.451 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -7.894 14.769 -1.470 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -4.116 16.371 2.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.845 13.252 0.898 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -4.807 14.612 3.585 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.648 13.073 3.036 1.00 0.00 H new ATOM 848 N CYS A 57 -1.605 15.865 -0.071 1.00 0.00 N ATOM 849 CA CYS A 57 -0.708 15.453 1.003 1.00 0.00 C ATOM 850 C CYS A 57 0.750 15.632 0.591 1.00 0.00 C ATOM 851 O CYS A 57 1.165 15.182 -0.476 1.00 0.00 O ATOM 852 CB CYS A 57 -0.967 13.994 1.381 1.00 0.00 C ATOM 853 SG CYS A 57 -2.090 13.783 2.783 1.00 0.00 S ATOM 0 H CYS A 57 -1.729 15.170 -0.807 1.00 0.00 H new ATOM 0 HA CYS A 57 -0.904 16.085 1.869 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -1.380 13.474 0.517 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -0.016 13.516 1.616 1.00 0.00 H new ATOM 0 HG CYS A 57 -3.237 14.329 2.507 1.00 0.00 H new ATOM 859 N GLY A 58 1.523 16.295 1.446 1.00 0.00 N ATOM 860 CA GLY A 58 2.926 16.525 1.153 1.00 0.00 C ATOM 861 C GLY A 58 3.772 15.285 1.362 1.00 0.00 C ATOM 862 O GLY A 58 4.607 14.945 0.523 1.00 0.00 O ATOM 0 H GLY A 58 1.203 16.677 2.336 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.028 16.861 0.121 1.00 0.00 H new ATOM 0 HA3 GLY A 58 3.300 17.328 1.788 1.00 0.00 H new ATOM 866 N HIS A 59 3.559 14.607 2.485 1.00 0.00 N ATOM 867 CA HIS A 59 4.310 13.397 2.803 1.00 0.00 C ATOM 868 C HIS A 59 4.331 12.443 1.613 1.00 0.00 C ATOM 869 O HIS A 59 5.262 11.652 1.455 1.00 0.00 O ATOM 870 CB HIS A 59 3.703 12.700 4.021 1.00 0.00 C ATOM 871 CG HIS A 59 4.020 13.377 5.318 1.00 0.00 C ATOM 872 ND1 HIS A 59 4.817 12.807 6.289 1.00 0.00 N ATOM 873 CD2 HIS A 59 3.644 14.584 5.803 1.00 0.00 C ATOM 874 CE1 HIS A 59 4.916 13.634 7.315 1.00 0.00 C ATOM 875 NE2 HIS A 59 4.214 14.719 7.045 1.00 0.00 N ATOM 0 H HIS A 59 2.873 14.875 3.190 1.00 0.00 H new ATOM 0 HA HIS A 59 5.336 13.685 3.033 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.621 12.653 3.900 1.00 0.00 H new ATOM 0 HB3 HIS A 59 4.065 11.672 4.059 1.00 0.00 H new ATOM 0 HD2 HIS A 59 3.013 15.306 5.306 1.00 0.00 H new ATOM 0 HE1 HIS A 59 5.476 13.453 8.221 1.00 0.00 H new ATOM 0 HE2 HIS A 59 4.112 15.527 7.659 1.00 0.00 H new ATOM 884 N CYS A 60 3.299 12.521 0.780 1.00 0.00 N ATOM 885 CA CYS A 60 3.198 11.663 -0.395 1.00 0.00 C ATOM 886 C CYS A 60 4.059 12.198 -1.535 1.00 0.00 C ATOM 887 O CYS A 60 4.762 11.442 -2.205 1.00 0.00 O ATOM 888 CB CYS A 60 1.742 11.552 -0.848 1.00 0.00 C ATOM 889 SG CYS A 60 0.570 11.264 0.498 1.00 0.00 S ATOM 0 H CYS A 60 2.520 13.170 0.897 1.00 0.00 H new ATOM 0 HA CYS A 60 3.562 10.672 -0.123 1.00 0.00 H new ATOM 0 HB2 CYS A 60 1.464 12.469 -1.368 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.658 10.739 -1.569 1.00 0.00 H new ATOM 0 HG CYS A 60 -0.332 10.411 0.113 1.00 0.00 H new ATOM 895 N LYS A 61 3.998 13.508 -1.751 1.00 0.00 N ATOM 896 CA LYS A 61 4.771 14.146 -2.810 1.00 0.00 C ATOM 897 C LYS A 61 6.256 13.828 -2.667 1.00 0.00 C ATOM 898 O LYS A 61 6.937 13.548 -3.652 1.00 0.00 O ATOM 899 CB LYS A 61 4.557 15.661 -2.782 1.00 0.00 C ATOM 900 CG LYS A 61 3.146 16.084 -3.151 1.00 0.00 C ATOM 901 CD LYS A 61 3.095 17.538 -3.588 1.00 0.00 C ATOM 902 CE LYS A 61 3.344 17.680 -5.082 1.00 0.00 C ATOM 903 NZ LYS A 61 2.754 18.935 -5.625 1.00 0.00 N ATOM 0 H LYS A 61 3.421 14.149 -1.206 1.00 0.00 H new ATOM 0 HA LYS A 61 4.425 13.754 -3.766 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.790 16.034 -1.784 1.00 0.00 H new ATOM 0 HB3 LYS A 61 5.260 16.131 -3.470 1.00 0.00 H new ATOM 0 HG2 LYS A 61 2.773 15.449 -3.954 1.00 0.00 H new ATOM 0 HG3 LYS A 61 2.486 15.937 -2.296 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.121 17.960 -3.339 1.00 0.00 H new ATOM 0 HD3 LYS A 61 3.841 18.111 -3.038 1.00 0.00 H new ATOM 0 HE2 LYS A 61 4.417 17.670 -5.274 1.00 0.00 H new ATOM 0 HE3 LYS A 61 2.919 16.823 -5.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.945 18.995 -6.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 1.726 18.933 -5.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.178 19.754 -5.145 1.00 0.00 H new ATOM 917 N ASN A 62 6.750 13.873 -1.434 1.00 0.00 N ATOM 918 CA ASN A 62 8.154 13.589 -1.162 1.00 0.00 C ATOM 919 C ASN A 62 8.457 12.106 -1.359 1.00 0.00 C ATOM 920 O ASN A 62 9.610 11.717 -1.550 1.00 0.00 O ATOM 921 CB ASN A 62 8.515 14.009 0.264 1.00 0.00 C ATOM 922 CG ASN A 62 9.940 13.644 0.631 1.00 0.00 C ATOM 923 OD1 ASN A 62 10.782 13.429 -0.241 1.00 0.00 O ATOM 924 ND2 ASN A 62 10.216 13.571 1.928 1.00 0.00 N ATOM 0 H ASN A 62 6.199 14.103 -0.607 1.00 0.00 H new ATOM 0 HA ASN A 62 8.757 14.162 -1.866 1.00 0.00 H new ATOM 0 HB2 ASN A 62 8.380 15.086 0.368 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.829 13.533 0.965 1.00 0.00 H new ATOM 0 HD21 ASN A 62 11.158 13.329 2.236 1.00 0.00 H new ATOM 0 HD22 ASN A 62 9.486 13.757 2.616 1.00 0.00 H new ATOM 931 N LEU A 63 7.415 11.284 -1.311 1.00 0.00 N ATOM 932 CA LEU A 63 7.568 9.843 -1.485 1.00 0.00 C ATOM 933 C LEU A 63 7.339 9.443 -2.939 1.00 0.00 C ATOM 934 O LEU A 63 7.816 8.401 -3.387 1.00 0.00 O ATOM 935 CB LEU A 63 6.591 9.094 -0.578 1.00 0.00 C ATOM 936 CG LEU A 63 6.341 7.626 -0.928 1.00 0.00 C ATOM 937 CD1 LEU A 63 7.465 6.752 -0.394 1.00 0.00 C ATOM 938 CD2 LEU A 63 4.998 7.168 -0.377 1.00 0.00 C ATOM 0 H LEU A 63 6.455 11.590 -1.153 1.00 0.00 H new ATOM 0 HA LEU A 63 8.588 9.575 -1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 63 6.964 9.144 0.445 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.636 9.619 -0.595 1.00 0.00 H new ATOM 0 HG LEU A 63 6.318 7.529 -2.013 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.270 5.711 -0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.411 7.065 -0.836 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.521 6.853 0.690 1.00 0.00 H new ATOM 0 HD21 LEU A 63 4.837 6.121 -0.635 1.00 0.00 H new ATOM 0 HD22 LEU A 63 4.993 7.279 0.707 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.202 7.775 -0.808 1.00 0.00 H new ATOM 950 N GLU A 64 6.608 10.279 -3.670 1.00 0.00 N ATOM 951 CA GLU A 64 6.319 10.011 -5.074 1.00 0.00 C ATOM 952 C GLU A 64 7.487 9.293 -5.743 1.00 0.00 C ATOM 953 O GLU A 64 7.342 8.203 -6.297 1.00 0.00 O ATOM 954 CB GLU A 64 6.017 11.317 -5.813 1.00 0.00 C ATOM 955 CG GLU A 64 6.425 11.295 -7.276 1.00 0.00 C ATOM 956 CD GLU A 64 5.850 12.460 -8.059 1.00 0.00 C ATOM 957 OE1 GLU A 64 6.046 13.617 -7.632 1.00 0.00 O ATOM 958 OE2 GLU A 64 5.204 12.213 -9.099 1.00 0.00 O ATOM 0 H GLU A 64 6.206 11.146 -3.314 1.00 0.00 H new ATOM 0 HA GLU A 64 5.443 9.364 -5.121 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.949 11.525 -5.745 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.534 12.136 -5.312 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.513 11.316 -7.347 1.00 0.00 H new ATOM 0 HG3 GLU A 64 6.094 10.360 -7.728 1.00 0.00 H new ATOM 965 N PRO A 65 8.673 9.917 -5.692 1.00 0.00 N ATOM 966 CA PRO A 65 9.889 9.357 -6.288 1.00 0.00 C ATOM 967 C PRO A 65 10.392 8.131 -5.534 1.00 0.00 C ATOM 968 O PRO A 65 11.044 7.259 -6.109 1.00 0.00 O ATOM 969 CB PRO A 65 10.898 10.503 -6.179 1.00 0.00 C ATOM 970 CG PRO A 65 10.418 11.323 -5.032 1.00 0.00 C ATOM 971 CD PRO A 65 8.917 11.219 -5.048 1.00 0.00 C ATOM 0 HA PRO A 65 9.722 9.014 -7.309 1.00 0.00 H new ATOM 0 HB2 PRO A 65 11.906 10.127 -6.003 1.00 0.00 H new ATOM 0 HB3 PRO A 65 10.932 11.089 -7.098 1.00 0.00 H new ATOM 0 HG2 PRO A 65 10.825 10.953 -4.091 1.00 0.00 H new ATOM 0 HG3 PRO A 65 10.738 12.360 -5.132 1.00 0.00 H new ATOM 0 HD2 PRO A 65 8.501 11.254 -4.041 1.00 0.00 H new ATOM 0 HD3 PRO A 65 8.463 12.036 -5.609 1.00 0.00 H new ATOM 979 N LYS A 66 10.084 8.068 -4.243 1.00 0.00 N ATOM 980 CA LYS A 66 10.503 6.948 -3.409 1.00 0.00 C ATOM 981 C LYS A 66 9.705 5.692 -3.744 1.00 0.00 C ATOM 982 O LYS A 66 10.208 4.575 -3.624 1.00 0.00 O ATOM 983 CB LYS A 66 10.331 7.295 -1.928 1.00 0.00 C ATOM 984 CG LYS A 66 11.157 8.489 -1.483 1.00 0.00 C ATOM 985 CD LYS A 66 12.533 8.066 -0.999 1.00 0.00 C ATOM 986 CE LYS A 66 13.339 7.412 -2.112 1.00 0.00 C ATOM 987 NZ LYS A 66 14.804 7.492 -1.857 1.00 0.00 N ATOM 0 H LYS A 66 9.545 8.781 -3.751 1.00 0.00 H new ATOM 0 HA LYS A 66 11.556 6.752 -3.610 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.278 7.498 -1.731 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.606 6.429 -1.326 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.261 9.189 -2.312 1.00 0.00 H new ATOM 0 HG3 LYS A 66 10.635 9.016 -0.684 1.00 0.00 H new ATOM 0 HD2 LYS A 66 13.071 8.936 -0.622 1.00 0.00 H new ATOM 0 HD3 LYS A 66 12.429 7.370 -0.166 1.00 0.00 H new ATOM 0 HE2 LYS A 66 13.044 6.367 -2.208 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.109 7.897 -3.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 15.306 6.868 -2.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 15.127 8.471 -1.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.003 7.192 -0.881 1.00 0.00 H new ATOM 1001 N TYR A 67 8.460 5.883 -4.165 1.00 0.00 N ATOM 1002 CA TYR A 67 7.592 4.765 -4.517 1.00 0.00 C ATOM 1003 C TYR A 67 7.621 4.505 -6.020 1.00 0.00 C ATOM 1004 O TYR A 67 7.632 3.356 -6.463 1.00 0.00 O ATOM 1005 CB TYR A 67 6.158 5.044 -4.064 1.00 0.00 C ATOM 1006 CG TYR A 67 5.273 3.818 -4.067 1.00 0.00 C ATOM 1007 CD1 TYR A 67 5.287 2.924 -3.004 1.00 0.00 C ATOM 1008 CD2 TYR A 67 4.423 3.553 -5.134 1.00 0.00 C ATOM 1009 CE1 TYR A 67 4.480 1.802 -3.003 1.00 0.00 C ATOM 1010 CE2 TYR A 67 3.613 2.435 -5.141 1.00 0.00 C ATOM 1011 CZ TYR A 67 3.645 1.562 -4.073 1.00 0.00 C ATOM 1012 OH TYR A 67 2.840 0.446 -4.077 1.00 0.00 O ATOM 0 H TYR A 67 8.029 6.801 -4.271 1.00 0.00 H new ATOM 0 HA TYR A 67 7.961 3.876 -4.006 1.00 0.00 H new ATOM 0 HB2 TYR A 67 6.179 5.464 -3.059 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.720 5.800 -4.716 1.00 0.00 H new ATOM 0 HD1 TYR A 67 5.940 3.109 -2.164 1.00 0.00 H new ATOM 0 HD2 TYR A 67 4.396 4.233 -5.972 1.00 0.00 H new ATOM 0 HE1 TYR A 67 4.504 1.117 -2.168 1.00 0.00 H new ATOM 0 HE2 TYR A 67 2.958 2.245 -5.978 1.00 0.00 H new ATOM 0 HH TYR A 67 2.173 0.526 -4.791 1.00 0.00 H new ATOM 1022 N LYS A 68 7.633 5.581 -6.800 1.00 0.00 N ATOM 1023 CA LYS A 68 7.663 5.472 -8.253 1.00 0.00 C ATOM 1024 C LYS A 68 8.852 4.634 -8.712 1.00 0.00 C ATOM 1025 O LYS A 68 8.723 3.789 -9.597 1.00 0.00 O ATOM 1026 CB LYS A 68 7.731 6.863 -8.888 1.00 0.00 C ATOM 1027 CG LYS A 68 8.167 6.847 -10.343 1.00 0.00 C ATOM 1028 CD LYS A 68 9.664 7.072 -10.478 1.00 0.00 C ATOM 1029 CE LYS A 68 9.989 7.951 -11.676 1.00 0.00 C ATOM 1030 NZ LYS A 68 11.351 7.677 -12.212 1.00 0.00 N ATOM 0 H LYS A 68 7.622 6.539 -6.449 1.00 0.00 H new ATOM 0 HA LYS A 68 6.747 4.977 -8.574 1.00 0.00 H new ATOM 0 HB2 LYS A 68 6.751 7.334 -8.816 1.00 0.00 H new ATOM 0 HB3 LYS A 68 8.424 7.481 -8.317 1.00 0.00 H new ATOM 0 HG2 LYS A 68 7.900 5.891 -10.794 1.00 0.00 H new ATOM 0 HG3 LYS A 68 7.631 7.620 -10.893 1.00 0.00 H new ATOM 0 HD2 LYS A 68 10.047 7.537 -9.569 1.00 0.00 H new ATOM 0 HD3 LYS A 68 10.170 6.112 -10.582 1.00 0.00 H new ATOM 0 HE2 LYS A 68 9.250 7.784 -12.460 1.00 0.00 H new ATOM 0 HE3 LYS A 68 9.917 9.000 -11.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 11.799 8.572 -12.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 11.927 7.219 -11.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 11.279 7.049 -13.038 1.00 0.00 H new ATOM 1044 N GLU A 69 10.010 4.873 -8.103 1.00 0.00 N ATOM 1045 CA GLU A 69 11.221 4.139 -8.450 1.00 0.00 C ATOM 1046 C GLU A 69 10.987 2.634 -8.368 1.00 0.00 C ATOM 1047 O GLU A 69 11.249 1.900 -9.322 1.00 0.00 O ATOM 1048 CB GLU A 69 12.369 4.539 -7.522 1.00 0.00 C ATOM 1049 CG GLU A 69 13.205 5.693 -8.050 1.00 0.00 C ATOM 1050 CD GLU A 69 14.047 6.346 -6.970 1.00 0.00 C ATOM 1051 OE1 GLU A 69 14.837 5.629 -6.321 1.00 0.00 O ATOM 1052 OE2 GLU A 69 13.915 7.572 -6.775 1.00 0.00 O ATOM 0 H GLU A 69 10.134 5.569 -7.368 1.00 0.00 H new ATOM 0 HA GLU A 69 11.488 4.392 -9.476 1.00 0.00 H new ATOM 0 HB2 GLU A 69 11.960 4.813 -6.549 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.015 3.676 -7.364 1.00 0.00 H new ATOM 0 HG2 GLU A 69 13.857 5.330 -8.844 1.00 0.00 H new ATOM 0 HG3 GLU A 69 12.547 6.440 -8.494 1.00 0.00 H new ATOM 1059 N LEU A 70 10.492 2.180 -7.221 1.00 0.00 N ATOM 1060 CA LEU A 70 10.223 0.761 -7.013 1.00 0.00 C ATOM 1061 C LEU A 70 9.548 0.149 -8.237 1.00 0.00 C ATOM 1062 O LEU A 70 9.834 -0.986 -8.613 1.00 0.00 O ATOM 1063 CB LEU A 70 9.340 0.565 -5.779 1.00 0.00 C ATOM 1064 CG LEU A 70 9.188 -0.873 -5.284 1.00 0.00 C ATOM 1065 CD1 LEU A 70 10.481 -1.359 -4.648 1.00 0.00 C ATOM 1066 CD2 LEU A 70 8.034 -0.979 -4.298 1.00 0.00 C ATOM 0 H LEU A 70 10.269 2.773 -6.422 1.00 0.00 H new ATOM 0 HA LEU A 70 11.176 0.255 -6.855 1.00 0.00 H new ATOM 0 HB2 LEU A 70 9.747 1.167 -4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 70 8.348 0.958 -6.001 1.00 0.00 H new ATOM 0 HG LEU A 70 8.967 -1.510 -6.141 1.00 0.00 H new ATOM 0 HD11 LEU A 70 10.353 -2.385 -4.302 1.00 0.00 H new ATOM 0 HD12 LEU A 70 11.285 -1.322 -5.383 1.00 0.00 H new ATOM 0 HD13 LEU A 70 10.733 -0.719 -3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.941 -2.010 -3.956 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.225 -0.329 -3.444 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.109 -0.674 -4.787 1.00 0.00 H new ATOM 1078 N GLY A 71 8.651 0.912 -8.855 1.00 0.00 N ATOM 1079 CA GLY A 71 7.951 0.429 -10.031 1.00 0.00 C ATOM 1080 C GLY A 71 8.887 0.156 -11.191 1.00 0.00 C ATOM 1081 O GLY A 71 9.032 -0.987 -11.624 1.00 0.00 O ATOM 0 H GLY A 71 8.397 1.855 -8.562 1.00 0.00 H new ATOM 0 HA2 GLY A 71 7.413 -0.485 -9.780 1.00 0.00 H new ATOM 0 HA3 GLY A 71 7.206 1.165 -10.334 1.00 0.00 H new ATOM 1085 N GLU A 72 9.523 1.208 -11.697 1.00 0.00 N ATOM 1086 CA GLU A 72 10.448 1.076 -12.816 1.00 0.00 C ATOM 1087 C GLU A 72 11.640 0.201 -12.437 1.00 0.00 C ATOM 1088 O GLU A 72 12.319 -0.353 -13.302 1.00 0.00 O ATOM 1089 CB GLU A 72 10.936 2.453 -13.269 1.00 0.00 C ATOM 1090 CG GLU A 72 11.147 3.431 -12.125 1.00 0.00 C ATOM 1091 CD GLU A 72 12.009 4.614 -12.520 1.00 0.00 C ATOM 1092 OE1 GLU A 72 11.803 5.157 -13.626 1.00 0.00 O ATOM 1093 OE2 GLU A 72 12.891 4.997 -11.723 1.00 0.00 O ATOM 0 H GLU A 72 9.414 2.161 -11.350 1.00 0.00 H new ATOM 0 HA GLU A 72 9.916 0.599 -13.639 1.00 0.00 H new ATOM 0 HB2 GLU A 72 11.873 2.336 -13.813 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.212 2.874 -13.967 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.179 3.792 -11.777 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.613 2.910 -11.288 1.00 0.00 H new ATOM 1100 N LYS A 73 11.889 0.082 -11.137 1.00 0.00 N ATOM 1101 CA LYS A 73 12.997 -0.725 -10.641 1.00 0.00 C ATOM 1102 C LYS A 73 12.636 -2.207 -10.645 1.00 0.00 C ATOM 1103 O LYS A 73 13.428 -3.048 -11.073 1.00 0.00 O ATOM 1104 CB LYS A 73 13.379 -0.287 -9.225 1.00 0.00 C ATOM 1105 CG LYS A 73 13.843 1.157 -9.140 1.00 0.00 C ATOM 1106 CD LYS A 73 15.348 1.271 -9.320 1.00 0.00 C ATOM 1107 CE LYS A 73 16.077 1.188 -7.987 1.00 0.00 C ATOM 1108 NZ LYS A 73 16.245 2.529 -7.362 1.00 0.00 N ATOM 0 H LYS A 73 11.338 0.535 -10.408 1.00 0.00 H new ATOM 0 HA LYS A 73 13.849 -0.575 -11.305 1.00 0.00 H new ATOM 0 HB2 LYS A 73 12.521 -0.423 -8.567 1.00 0.00 H new ATOM 0 HB3 LYS A 73 14.171 -0.937 -8.854 1.00 0.00 H new ATOM 0 HG2 LYS A 73 13.338 1.748 -9.905 1.00 0.00 H new ATOM 0 HG3 LYS A 73 13.558 1.575 -8.175 1.00 0.00 H new ATOM 0 HD2 LYS A 73 15.698 0.475 -9.978 1.00 0.00 H new ATOM 0 HD3 LYS A 73 15.587 2.216 -9.808 1.00 0.00 H new ATOM 0 HE2 LYS A 73 15.522 0.539 -7.310 1.00 0.00 H new ATOM 0 HE3 LYS A 73 17.056 0.732 -8.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 16.746 2.429 -6.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 16.796 3.141 -7.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 15.311 2.954 -7.196 1.00 0.00 H new ATOM 1122 N LEU A 74 11.436 -2.520 -10.169 1.00 0.00 N ATOM 1123 CA LEU A 74 10.969 -3.901 -10.121 1.00 0.00 C ATOM 1124 C LEU A 74 10.370 -4.322 -11.459 1.00 0.00 C ATOM 1125 O LEU A 74 9.893 -5.446 -11.611 1.00 0.00 O ATOM 1126 CB LEU A 74 9.932 -4.071 -9.009 1.00 0.00 C ATOM 1127 CG LEU A 74 10.450 -3.912 -7.579 1.00 0.00 C ATOM 1128 CD1 LEU A 74 9.321 -4.107 -6.578 1.00 0.00 C ATOM 1129 CD2 LEU A 74 11.580 -4.895 -7.308 1.00 0.00 C ATOM 0 H LEU A 74 10.769 -1.836 -9.811 1.00 0.00 H new ATOM 0 HA LEU A 74 11.826 -4.541 -9.911 1.00 0.00 H new ATOM 0 HB2 LEU A 74 9.135 -3.345 -9.168 1.00 0.00 H new ATOM 0 HB3 LEU A 74 9.485 -5.061 -9.104 1.00 0.00 H new ATOM 0 HG LEU A 74 10.840 -2.901 -7.465 1.00 0.00 H new ATOM 0 HD11 LEU A 74 9.708 -3.990 -5.566 1.00 0.00 H new ATOM 0 HD12 LEU A 74 8.544 -3.364 -6.757 1.00 0.00 H new ATOM 0 HD13 LEU A 74 8.901 -5.106 -6.693 1.00 0.00 H new ATOM 0 HD21 LEU A 74 11.936 -4.767 -6.286 1.00 0.00 H new ATOM 0 HD22 LEU A 74 11.216 -5.914 -7.441 1.00 0.00 H new ATOM 0 HD23 LEU A 74 12.399 -4.709 -8.003 1.00 0.00 H new ATOM 1141 N SER A 75 10.400 -3.411 -12.427 1.00 0.00 N ATOM 1142 CA SER A 75 9.859 -3.686 -13.752 1.00 0.00 C ATOM 1143 C SER A 75 10.201 -5.106 -14.195 1.00 0.00 C ATOM 1144 O SER A 75 9.473 -5.718 -14.977 1.00 0.00 O ATOM 1145 CB SER A 75 10.402 -2.679 -14.768 1.00 0.00 C ATOM 1146 OG SER A 75 9.542 -1.559 -14.884 1.00 0.00 O ATOM 0 H SER A 75 10.793 -2.476 -12.318 1.00 0.00 H new ATOM 0 HA SER A 75 8.774 -3.591 -13.701 1.00 0.00 H new ATOM 0 HB2 SER A 75 11.395 -2.349 -14.463 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.511 -3.160 -15.740 1.00 0.00 H new ATOM 0 HG SER A 75 9.911 -0.929 -15.538 1.00 0.00 H new ATOM 1152 N LYS A 76 11.314 -5.625 -13.688 1.00 0.00 N ATOM 1153 CA LYS A 76 11.755 -6.972 -14.028 1.00 0.00 C ATOM 1154 C LYS A 76 11.080 -8.007 -13.134 1.00 0.00 C ATOM 1155 O LYS A 76 11.615 -9.094 -12.913 1.00 0.00 O ATOM 1156 CB LYS A 76 13.275 -7.082 -13.897 1.00 0.00 C ATOM 1157 CG LYS A 76 13.926 -7.887 -15.008 1.00 0.00 C ATOM 1158 CD LYS A 76 14.121 -9.339 -14.605 1.00 0.00 C ATOM 1159 CE LYS A 76 15.164 -9.477 -13.507 1.00 0.00 C ATOM 1160 NZ LYS A 76 15.518 -10.901 -13.254 1.00 0.00 N ATOM 0 H LYS A 76 11.928 -5.132 -13.039 1.00 0.00 H new ATOM 0 HA LYS A 76 11.471 -7.170 -15.062 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.704 -6.080 -13.887 1.00 0.00 H new ATOM 0 HB3 LYS A 76 13.516 -7.541 -12.938 1.00 0.00 H new ATOM 0 HG2 LYS A 76 13.308 -7.837 -15.904 1.00 0.00 H new ATOM 0 HG3 LYS A 76 14.890 -7.446 -15.261 1.00 0.00 H new ATOM 0 HD2 LYS A 76 13.173 -9.753 -14.262 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.427 -9.921 -15.474 1.00 0.00 H new ATOM 0 HE2 LYS A 76 16.061 -8.924 -13.786 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.786 -9.028 -12.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 16.232 -10.953 -12.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 14.667 -11.424 -12.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 15.903 -11.323 -14.123 1.00 0.00 H new ATOM 1174 N ASP A 77 9.904 -7.663 -12.622 1.00 0.00 N ATOM 1175 CA ASP A 77 9.155 -8.563 -11.753 1.00 0.00 C ATOM 1176 C ASP A 77 7.990 -9.200 -12.505 1.00 0.00 C ATOM 1177 O ASP A 77 6.894 -8.645 -12.587 1.00 0.00 O ATOM 1178 CB ASP A 77 8.635 -7.810 -10.528 1.00 0.00 C ATOM 1179 CG ASP A 77 7.761 -6.629 -10.902 1.00 0.00 C ATOM 1180 OD1 ASP A 77 7.573 -6.390 -12.113 1.00 0.00 O ATOM 1181 OD2 ASP A 77 7.264 -5.945 -9.983 1.00 0.00 O ATOM 0 H ASP A 77 9.448 -6.767 -12.794 1.00 0.00 H new ATOM 0 HA ASP A 77 9.829 -9.354 -11.424 1.00 0.00 H new ATOM 0 HB2 ASP A 77 8.066 -8.495 -9.899 1.00 0.00 H new ATOM 0 HB3 ASP A 77 9.480 -7.460 -9.935 1.00 0.00 H new ATOM 1186 N PRO A 78 8.231 -10.394 -13.068 1.00 0.00 N ATOM 1187 CA PRO A 78 7.215 -11.132 -13.824 1.00 0.00 C ATOM 1188 C PRO A 78 6.103 -11.669 -12.929 1.00 0.00 C ATOM 1189 O PRO A 78 5.174 -12.322 -13.402 1.00 0.00 O ATOM 1190 CB PRO A 78 8.005 -12.285 -14.447 1.00 0.00 C ATOM 1191 CG PRO A 78 9.171 -12.479 -13.541 1.00 0.00 C ATOM 1192 CD PRO A 78 9.514 -11.114 -13.011 1.00 0.00 C ATOM 0 HA PRO A 78 6.711 -10.500 -14.555 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.400 -13.189 -14.513 1.00 0.00 H new ATOM 0 HB3 PRO A 78 8.327 -12.043 -15.460 1.00 0.00 H new ATOM 0 HG2 PRO A 78 8.925 -13.163 -12.729 1.00 0.00 H new ATOM 0 HG3 PRO A 78 10.015 -12.913 -14.078 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.902 -11.164 -11.994 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.276 -10.626 -13.619 1.00 0.00 H new ATOM 1200 N ASN A 79 6.205 -11.389 -11.634 1.00 0.00 N ATOM 1201 CA ASN A 79 5.208 -11.845 -10.673 1.00 0.00 C ATOM 1202 C ASN A 79 4.608 -10.667 -9.911 1.00 0.00 C ATOM 1203 O ASN A 79 3.393 -10.587 -9.727 1.00 0.00 O ATOM 1204 CB ASN A 79 5.833 -12.837 -9.690 1.00 0.00 C ATOM 1205 CG ASN A 79 6.565 -13.964 -10.393 1.00 0.00 C ATOM 1206 OD1 ASN A 79 6.055 -14.551 -11.347 1.00 0.00 O ATOM 1207 ND2 ASN A 79 7.769 -14.270 -9.923 1.00 0.00 N ATOM 0 H ASN A 79 6.968 -10.849 -11.226 1.00 0.00 H new ATOM 0 HA ASN A 79 4.410 -12.343 -11.224 1.00 0.00 H new ATOM 0 HB2 ASN A 79 6.527 -12.308 -9.037 1.00 0.00 H new ATOM 0 HB3 ASN A 79 5.052 -13.255 -9.054 1.00 0.00 H new ATOM 0 HD21 ASN A 79 8.310 -15.019 -10.356 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.152 -13.756 -9.130 1.00 0.00 H new ATOM 1214 N ILE A 80 5.469 -9.755 -9.470 1.00 0.00 N ATOM 1215 CA ILE A 80 5.024 -8.581 -8.730 1.00 0.00 C ATOM 1216 C ILE A 80 4.667 -7.438 -9.675 1.00 0.00 C ATOM 1217 O ILE A 80 5.302 -7.256 -10.714 1.00 0.00 O ATOM 1218 CB ILE A 80 6.101 -8.097 -7.741 1.00 0.00 C ATOM 1219 CG1 ILE A 80 6.140 -9.006 -6.511 1.00 0.00 C ATOM 1220 CG2 ILE A 80 5.837 -6.655 -7.333 1.00 0.00 C ATOM 1221 CD1 ILE A 80 7.416 -8.881 -5.708 1.00 0.00 C ATOM 0 H ILE A 80 6.478 -9.807 -9.612 1.00 0.00 H new ATOM 0 HA ILE A 80 4.137 -8.878 -8.171 1.00 0.00 H new ATOM 0 HB ILE A 80 7.072 -8.142 -8.234 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.291 -8.771 -5.869 1.00 0.00 H new ATOM 0 HG13 ILE A 80 6.021 -10.041 -6.830 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.607 -6.328 -6.634 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.855 -6.018 -8.217 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.860 -6.585 -6.855 1.00 0.00 H new ATOM 0 HD11 ILE A 80 7.374 -9.554 -4.851 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.268 -9.144 -6.335 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.527 -7.855 -5.358 1.00 0.00 H new ATOM 1233 N VAL A 81 3.648 -6.669 -9.306 1.00 0.00 N ATOM 1234 CA VAL A 81 3.208 -5.541 -10.118 1.00 0.00 C ATOM 1235 C VAL A 81 2.934 -4.315 -9.255 1.00 0.00 C ATOM 1236 O VAL A 81 1.942 -4.265 -8.527 1.00 0.00 O ATOM 1237 CB VAL A 81 1.937 -5.887 -10.917 1.00 0.00 C ATOM 1238 CG1 VAL A 81 1.457 -4.678 -11.706 1.00 0.00 C ATOM 1239 CG2 VAL A 81 2.194 -7.068 -11.841 1.00 0.00 C ATOM 0 H VAL A 81 3.111 -6.807 -8.450 1.00 0.00 H new ATOM 0 HA VAL A 81 4.017 -5.318 -10.814 1.00 0.00 H new ATOM 0 HB VAL A 81 1.152 -6.168 -10.215 1.00 0.00 H new ATOM 0 HG11 VAL A 81 0.558 -4.941 -12.264 1.00 0.00 H new ATOM 0 HG12 VAL A 81 1.232 -3.862 -11.020 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.236 -4.364 -12.400 1.00 0.00 H new ATOM 0 HG21 VAL A 81 1.286 -7.299 -12.398 1.00 0.00 H new ATOM 0 HG22 VAL A 81 2.993 -6.817 -12.538 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.487 -7.935 -11.250 1.00 0.00 H new ATOM 1249 N ILE A 82 3.819 -3.328 -9.340 1.00 0.00 N ATOM 1250 CA ILE A 82 3.672 -2.101 -8.568 1.00 0.00 C ATOM 1251 C ILE A 82 2.603 -1.196 -9.172 1.00 0.00 C ATOM 1252 O ILE A 82 2.599 -0.942 -10.376 1.00 0.00 O ATOM 1253 CB ILE A 82 4.999 -1.325 -8.485 1.00 0.00 C ATOM 1254 CG1 ILE A 82 6.089 -2.199 -7.861 1.00 0.00 C ATOM 1255 CG2 ILE A 82 4.815 -0.045 -7.683 1.00 0.00 C ATOM 1256 CD1 ILE A 82 5.690 -2.805 -6.533 1.00 0.00 C ATOM 0 H ILE A 82 4.646 -3.354 -9.936 1.00 0.00 H new ATOM 0 HA ILE A 82 3.370 -2.395 -7.563 1.00 0.00 H new ATOM 0 HB ILE A 82 5.309 -1.057 -9.495 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.343 -3.000 -8.555 1.00 0.00 H new ATOM 0 HG13 ILE A 82 6.989 -1.600 -7.722 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.762 0.493 -7.633 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.066 0.583 -8.166 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.485 -0.292 -6.674 1.00 0.00 H new ATOM 0 HD11 ILE A 82 6.510 -3.412 -6.149 1.00 0.00 H new ATOM 0 HD12 ILE A 82 5.464 -2.009 -5.823 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.808 -3.431 -6.669 1.00 0.00 H new ATOM 1268 N ALA A 83 1.700 -0.711 -8.327 1.00 0.00 N ATOM 1269 CA ALA A 83 0.628 0.169 -8.776 1.00 0.00 C ATOM 1270 C ALA A 83 0.283 1.203 -7.710 1.00 0.00 C ATOM 1271 O ALA A 83 0.801 1.156 -6.594 1.00 0.00 O ATOM 1272 CB ALA A 83 -0.604 -0.644 -9.144 1.00 0.00 C ATOM 0 H ALA A 83 1.689 -0.913 -7.327 1.00 0.00 H new ATOM 0 HA ALA A 83 0.976 0.701 -9.661 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.396 0.026 -9.477 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.355 -1.339 -9.946 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.945 -1.203 -8.272 1.00 0.00 H new ATOM 1278 N LYS A 84 -0.594 2.137 -8.060 1.00 0.00 N ATOM 1279 CA LYS A 84 -1.010 3.183 -7.133 1.00 0.00 C ATOM 1280 C LYS A 84 -2.450 3.608 -7.402 1.00 0.00 C ATOM 1281 O LYS A 84 -2.968 3.418 -8.502 1.00 0.00 O ATOM 1282 CB LYS A 84 -0.080 4.394 -7.248 1.00 0.00 C ATOM 1283 CG LYS A 84 0.091 4.896 -8.671 1.00 0.00 C ATOM 1284 CD LYS A 84 1.084 6.045 -8.742 1.00 0.00 C ATOM 1285 CE LYS A 84 1.115 6.670 -10.128 1.00 0.00 C ATOM 1286 NZ LYS A 84 1.491 8.110 -10.078 1.00 0.00 N ATOM 0 H LYS A 84 -1.031 2.191 -8.980 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.951 2.781 -6.121 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.472 5.203 -6.631 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.898 4.130 -6.845 1.00 0.00 H new ATOM 0 HG2 LYS A 84 0.432 4.079 -9.307 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.873 5.223 -9.061 1.00 0.00 H new ATOM 0 HD2 LYS A 84 0.818 6.803 -8.006 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.079 5.684 -8.482 1.00 0.00 H new ATOM 0 HE2 LYS A 84 1.826 6.130 -10.754 1.00 0.00 H new ATOM 0 HE3 LYS A 84 0.136 6.566 -10.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 1.501 8.500 -11.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 0.799 8.630 -9.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 2.436 8.208 -9.655 1.00 0.00 H new ATOM 1300 N MET A 85 -3.091 4.184 -6.391 1.00 0.00 N ATOM 1301 CA MET A 85 -4.471 4.638 -6.520 1.00 0.00 C ATOM 1302 C MET A 85 -4.733 5.844 -5.623 1.00 0.00 C ATOM 1303 O MET A 85 -4.142 5.972 -4.551 1.00 0.00 O ATOM 1304 CB MET A 85 -5.438 3.506 -6.168 1.00 0.00 C ATOM 1305 CG MET A 85 -6.901 3.909 -6.249 1.00 0.00 C ATOM 1306 SD MET A 85 -7.527 4.567 -4.691 1.00 0.00 S ATOM 1307 CE MET A 85 -8.811 3.377 -4.313 1.00 0.00 C ATOM 0 H MET A 85 -2.677 4.348 -5.473 1.00 0.00 H new ATOM 0 HA MET A 85 -4.634 4.936 -7.556 1.00 0.00 H new ATOM 0 HB2 MET A 85 -5.263 2.667 -6.842 1.00 0.00 H new ATOM 0 HB3 MET A 85 -5.222 3.155 -5.159 1.00 0.00 H new ATOM 0 HG2 MET A 85 -7.025 4.658 -7.031 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.497 3.044 -6.539 1.00 0.00 H new ATOM 0 HE1 MET A 85 -9.172 3.541 -3.298 1.00 0.00 H new ATOM 0 HE2 MET A 85 -9.636 3.497 -5.015 1.00 0.00 H new ATOM 0 HE3 MET A 85 -8.408 2.368 -4.396 1.00 0.00 H new ATOM 1317 N ASP A 86 -5.622 6.725 -6.069 1.00 0.00 N ATOM 1318 CA ASP A 86 -5.962 7.920 -5.306 1.00 0.00 C ATOM 1319 C ASP A 86 -7.244 7.707 -4.506 1.00 0.00 C ATOM 1320 O ASP A 86 -8.347 7.807 -5.044 1.00 0.00 O ATOM 1321 CB ASP A 86 -6.123 9.119 -6.241 1.00 0.00 C ATOM 1322 CG ASP A 86 -6.188 10.434 -5.489 1.00 0.00 C ATOM 1323 OD1 ASP A 86 -6.044 10.417 -4.249 1.00 0.00 O ATOM 1324 OD2 ASP A 86 -6.383 11.481 -6.142 1.00 0.00 O ATOM 0 H ASP A 86 -6.120 6.634 -6.955 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.149 8.120 -4.609 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -5.288 9.145 -6.941 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.031 8.996 -6.832 1.00 0.00 H new ATOM 1329 N ALA A 87 -7.091 7.412 -3.220 1.00 0.00 N ATOM 1330 CA ALA A 87 -8.236 7.186 -2.346 1.00 0.00 C ATOM 1331 C ALA A 87 -9.120 8.426 -2.268 1.00 0.00 C ATOM 1332 O ALA A 87 -10.346 8.325 -2.206 1.00 0.00 O ATOM 1333 CB ALA A 87 -7.768 6.781 -0.956 1.00 0.00 C ATOM 0 H ALA A 87 -6.185 7.324 -2.760 1.00 0.00 H new ATOM 0 HA ALA A 87 -8.829 6.375 -2.768 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -8.634 6.616 -0.314 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -7.184 5.863 -1.022 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -7.150 7.574 -0.535 1.00 0.00 H new ATOM 1339 N THR A 88 -8.491 9.597 -2.272 1.00 0.00 N ATOM 1340 CA THR A 88 -9.220 10.857 -2.199 1.00 0.00 C ATOM 1341 C THR A 88 -10.064 11.077 -3.450 1.00 0.00 C ATOM 1342 O THR A 88 -10.979 11.899 -3.456 1.00 0.00 O ATOM 1343 CB THR A 88 -8.263 12.051 -2.023 1.00 0.00 C ATOM 1344 OG1 THR A 88 -7.756 12.465 -3.297 1.00 0.00 O ATOM 1345 CG2 THR A 88 -7.106 11.686 -1.106 1.00 0.00 C ATOM 0 H THR A 88 -7.477 9.699 -2.325 1.00 0.00 H new ATOM 0 HA THR A 88 -9.874 10.794 -1.329 1.00 0.00 H new ATOM 0 HB THR A 88 -8.820 12.871 -1.570 1.00 0.00 H new ATOM 0 HG1 THR A 88 -7.121 11.797 -3.629 1.00 0.00 H new ATOM 0 HG21 THR A 88 -6.444 12.545 -0.997 1.00 0.00 H new ATOM 0 HG22 THR A 88 -7.493 11.400 -0.128 1.00 0.00 H new ATOM 0 HG23 THR A 88 -6.551 10.852 -1.535 1.00 0.00 H new ATOM 1353 N ALA A 89 -9.750 10.336 -4.508 1.00 0.00 N ATOM 1354 CA ALA A 89 -10.481 10.448 -5.763 1.00 0.00 C ATOM 1355 C ALA A 89 -11.166 9.133 -6.119 1.00 0.00 C ATOM 1356 O ALA A 89 -11.991 9.078 -7.030 1.00 0.00 O ATOM 1357 CB ALA A 89 -9.544 10.877 -6.883 1.00 0.00 C ATOM 0 H ALA A 89 -8.994 9.652 -4.520 1.00 0.00 H new ATOM 0 HA ALA A 89 -11.253 11.207 -5.638 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -10.104 10.957 -7.815 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.105 11.844 -6.639 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.752 10.137 -6.998 1.00 0.00 H new ATOM 1363 N ASN A 90 -10.818 8.074 -5.394 1.00 0.00 N ATOM 1364 CA ASN A 90 -11.399 6.759 -5.635 1.00 0.00 C ATOM 1365 C ASN A 90 -11.692 6.044 -4.319 1.00 0.00 C ATOM 1366 O ASN A 90 -10.778 5.596 -3.627 1.00 0.00 O ATOM 1367 CB ASN A 90 -10.455 5.910 -6.490 1.00 0.00 C ATOM 1368 CG ASN A 90 -9.916 6.671 -7.685 1.00 0.00 C ATOM 1369 OD1 ASN A 90 -10.588 6.796 -8.710 1.00 0.00 O ATOM 1370 ND2 ASN A 90 -8.698 7.183 -7.560 1.00 0.00 N ATOM 0 H ASN A 90 -10.137 8.102 -4.635 1.00 0.00 H new ATOM 0 HA ASN A 90 -12.338 6.897 -6.170 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -9.623 5.567 -5.876 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -10.983 5.022 -6.836 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -8.282 7.705 -8.332 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -8.177 7.055 -6.692 1.00 0.00 H new ATOM 1377 N ASP A 91 -12.972 5.942 -3.980 1.00 0.00 N ATOM 1378 CA ASP A 91 -13.387 5.281 -2.748 1.00 0.00 C ATOM 1379 C ASP A 91 -12.589 4.000 -2.524 1.00 0.00 C ATOM 1380 O ASP A 91 -12.348 3.235 -3.458 1.00 0.00 O ATOM 1381 CB ASP A 91 -14.882 4.964 -2.793 1.00 0.00 C ATOM 1382 CG ASP A 91 -15.513 4.950 -1.414 1.00 0.00 C ATOM 1383 OD1 ASP A 91 -15.104 5.772 -0.567 1.00 0.00 O ATOM 1384 OD2 ASP A 91 -16.413 4.117 -1.181 1.00 0.00 O ATOM 0 H ASP A 91 -13.741 6.309 -4.541 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.193 5.959 -1.917 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -15.389 5.703 -3.414 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.031 3.994 -3.267 1.00 0.00 H new ATOM 1389 N VAL A 92 -12.181 3.774 -1.279 1.00 0.00 N ATOM 1390 CA VAL A 92 -11.410 2.586 -0.932 1.00 0.00 C ATOM 1391 C VAL A 92 -12.317 1.373 -0.761 1.00 0.00 C ATOM 1392 O VAL A 92 -13.305 1.404 -0.027 1.00 0.00 O ATOM 1393 CB VAL A 92 -10.605 2.798 0.364 1.00 0.00 C ATOM 1394 CG1 VAL A 92 -9.822 1.543 0.718 1.00 0.00 C ATOM 1395 CG2 VAL A 92 -9.676 3.995 0.223 1.00 0.00 C ATOM 0 H VAL A 92 -12.371 4.398 -0.495 1.00 0.00 H new ATOM 0 HA VAL A 92 -10.718 2.406 -1.755 1.00 0.00 H new ATOM 0 HB VAL A 92 -11.303 3.002 1.176 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -9.260 1.712 1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -10.512 0.712 0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -9.132 1.304 -0.091 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -9.115 4.131 1.147 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -8.983 3.823 -0.600 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -10.264 4.890 0.021 1.00 0.00 H new ATOM 1405 N PRO A 93 -11.976 0.276 -1.453 1.00 0.00 N ATOM 1406 CA PRO A 93 -12.746 -0.970 -1.393 1.00 0.00 C ATOM 1407 C PRO A 93 -12.621 -1.664 -0.042 1.00 0.00 C ATOM 1408 O PRO A 93 -12.161 -1.069 0.933 1.00 0.00 O ATOM 1409 CB PRO A 93 -12.120 -1.827 -2.496 1.00 0.00 C ATOM 1410 CG PRO A 93 -10.732 -1.306 -2.639 1.00 0.00 C ATOM 1411 CD PRO A 93 -10.811 0.167 -2.347 1.00 0.00 C ATOM 0 HA PRO A 93 -13.814 -0.796 -1.524 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.121 -2.883 -2.225 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.675 -1.737 -3.430 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -10.054 -1.805 -1.947 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -10.350 -1.485 -3.644 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -9.902 0.531 -1.868 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -10.947 0.750 -3.258 1.00 0.00 H new ATOM 1419 N SER A 94 -13.033 -2.927 0.010 1.00 0.00 N ATOM 1420 CA SER A 94 -12.970 -3.702 1.244 1.00 0.00 C ATOM 1421 C SER A 94 -12.244 -5.025 1.018 1.00 0.00 C ATOM 1422 O SER A 94 -12.199 -5.556 -0.092 1.00 0.00 O ATOM 1423 CB SER A 94 -14.379 -3.965 1.778 1.00 0.00 C ATOM 1424 OG SER A 94 -14.456 -5.231 2.411 1.00 0.00 O ATOM 0 H SER A 94 -13.414 -3.435 -0.788 1.00 0.00 H new ATOM 0 HA SER A 94 -12.412 -3.123 1.980 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.655 -3.183 2.486 1.00 0.00 H new ATOM 0 HB3 SER A 94 -15.096 -3.920 0.958 1.00 0.00 H new ATOM 0 HG SER A 94 -15.366 -5.375 2.745 1.00 0.00 H new ATOM 1430 N PRO A 95 -11.661 -5.570 2.095 1.00 0.00 N ATOM 1431 CA PRO A 95 -11.707 -4.947 3.421 1.00 0.00 C ATOM 1432 C PRO A 95 -10.872 -3.673 3.493 1.00 0.00 C ATOM 1433 O PRO A 95 -10.888 -2.965 4.499 1.00 0.00 O ATOM 1434 CB PRO A 95 -11.122 -6.023 4.340 1.00 0.00 C ATOM 1435 CG PRO A 95 -10.251 -6.844 3.454 1.00 0.00 C ATOM 1436 CD PRO A 95 -10.911 -6.838 2.102 1.00 0.00 C ATOM 0 HA PRO A 95 -12.717 -4.640 3.691 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -10.551 -5.579 5.156 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -11.908 -6.627 4.793 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -9.246 -6.426 3.399 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.153 -7.860 3.836 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.178 -6.876 1.296 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -11.571 -7.696 1.973 1.00 0.00 H new ATOM 1444 N TYR A 96 -10.144 -3.388 2.419 1.00 0.00 N ATOM 1445 CA TYR A 96 -9.300 -2.201 2.361 1.00 0.00 C ATOM 1446 C TYR A 96 -9.920 -1.052 3.151 1.00 0.00 C ATOM 1447 O TYR A 96 -11.126 -0.816 3.078 1.00 0.00 O ATOM 1448 CB TYR A 96 -9.081 -1.775 0.908 1.00 0.00 C ATOM 1449 CG TYR A 96 -8.004 -2.567 0.201 1.00 0.00 C ATOM 1450 CD1 TYR A 96 -8.252 -3.852 -0.265 1.00 0.00 C ATOM 1451 CD2 TYR A 96 -6.739 -2.030 -0.001 1.00 0.00 C ATOM 1452 CE1 TYR A 96 -7.272 -4.580 -0.911 1.00 0.00 C ATOM 1453 CE2 TYR A 96 -5.753 -2.749 -0.648 1.00 0.00 C ATOM 1454 CZ TYR A 96 -6.024 -4.024 -1.100 1.00 0.00 C ATOM 1455 OH TYR A 96 -5.043 -4.744 -1.743 1.00 0.00 O ATOM 0 H TYR A 96 -10.122 -3.963 1.577 1.00 0.00 H new ATOM 0 HA TYR A 96 -8.338 -2.449 2.809 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -10.018 -1.883 0.361 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -8.818 -0.718 0.884 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -9.229 -4.290 -0.120 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -6.523 -1.033 0.354 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -7.482 -5.578 -1.266 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -4.775 -2.316 -0.799 1.00 0.00 H new ATOM 0 HH TYR A 96 -4.224 -4.208 -1.795 1.00 0.00 H new ATOM 1465 N GLU A 97 -9.086 -0.343 3.905 1.00 0.00 N ATOM 1466 CA GLU A 97 -9.553 0.781 4.709 1.00 0.00 C ATOM 1467 C GLU A 97 -8.443 1.811 4.899 1.00 0.00 C ATOM 1468 O GLU A 97 -7.379 1.503 5.436 1.00 0.00 O ATOM 1469 CB GLU A 97 -10.048 0.291 6.071 1.00 0.00 C ATOM 1470 CG GLU A 97 -11.529 -0.044 6.096 1.00 0.00 C ATOM 1471 CD GLU A 97 -11.881 -1.055 7.170 1.00 0.00 C ATOM 1472 OE1 GLU A 97 -11.913 -0.670 8.358 1.00 0.00 O ATOM 1473 OE2 GLU A 97 -12.123 -2.230 6.824 1.00 0.00 O ATOM 0 H GLU A 97 -8.085 -0.526 3.976 1.00 0.00 H new ATOM 0 HA GLU A 97 -10.379 1.256 4.180 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -9.479 -0.593 6.358 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.845 1.057 6.819 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -12.101 0.869 6.260 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.826 -0.435 5.123 1.00 0.00 H new ATOM 1480 N VAL A 98 -8.700 3.037 4.453 1.00 0.00 N ATOM 1481 CA VAL A 98 -7.724 4.114 4.574 1.00 0.00 C ATOM 1482 C VAL A 98 -8.214 5.194 5.532 1.00 0.00 C ATOM 1483 O VAL A 98 -9.153 5.930 5.227 1.00 0.00 O ATOM 1484 CB VAL A 98 -7.424 4.755 3.206 1.00 0.00 C ATOM 1485 CG1 VAL A 98 -6.316 5.789 3.333 1.00 0.00 C ATOM 1486 CG2 VAL A 98 -7.054 3.687 2.187 1.00 0.00 C ATOM 0 H VAL A 98 -9.575 3.309 4.005 1.00 0.00 H new ATOM 0 HA VAL A 98 -6.810 3.670 4.968 1.00 0.00 H new ATOM 0 HB VAL A 98 -8.323 5.262 2.856 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -6.118 6.231 2.357 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -6.624 6.569 4.029 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -5.411 5.309 3.704 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.845 4.158 1.226 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -6.169 3.150 2.528 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -7.883 2.987 2.076 1.00 0.00 H new ATOM 1496 N ARG A 99 -7.571 5.284 6.692 1.00 0.00 N ATOM 1497 CA ARG A 99 -7.941 6.274 7.696 1.00 0.00 C ATOM 1498 C ARG A 99 -6.988 7.465 7.663 1.00 0.00 C ATOM 1499 O ARG A 99 -7.416 8.617 7.702 1.00 0.00 O ATOM 1500 CB ARG A 99 -7.938 5.643 9.090 1.00 0.00 C ATOM 1501 CG ARG A 99 -8.887 6.319 10.066 1.00 0.00 C ATOM 1502 CD ARG A 99 -8.276 7.580 10.656 1.00 0.00 C ATOM 1503 NE ARG A 99 -8.869 7.925 11.945 1.00 0.00 N ATOM 1504 CZ ARG A 99 -8.250 8.654 12.867 1.00 0.00 C ATOM 1505 NH1 ARG A 99 -7.027 9.113 12.643 1.00 0.00 N ATOM 1506 NH2 ARG A 99 -8.855 8.925 14.016 1.00 0.00 N ATOM 0 H ARG A 99 -6.791 4.683 6.959 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.946 6.629 7.467 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.208 4.590 9.004 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -6.927 5.681 9.495 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.818 6.569 9.556 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.139 5.626 10.869 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -7.202 7.440 10.777 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -8.413 8.408 9.961 1.00 0.00 H new ATOM 0 HE ARG A 99 -9.810 7.588 12.149 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -6.559 8.907 11.761 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -6.554 9.673 13.353 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -9.796 8.574 14.192 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -8.379 9.485 14.723 1.00 0.00 H new ATOM 1520 N GLY A 100 -5.692 7.177 7.590 1.00 0.00 N ATOM 1521 CA GLY A 100 -4.698 8.235 7.553 1.00 0.00 C ATOM 1522 C GLY A 100 -3.671 8.027 6.459 1.00 0.00 C ATOM 1523 O GLY A 100 -3.121 6.935 6.312 1.00 0.00 O ATOM 0 H GLY A 100 -5.313 6.231 7.556 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -5.196 9.192 7.402 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.192 8.288 8.517 1.00 0.00 H new ATOM 1527 N PHE A 101 -3.411 9.076 5.686 1.00 0.00 N ATOM 1528 CA PHE A 101 -2.445 9.003 4.597 1.00 0.00 C ATOM 1529 C PHE A 101 -1.086 9.539 5.038 1.00 0.00 C ATOM 1530 O PHE A 101 -0.979 10.352 5.957 1.00 0.00 O ATOM 1531 CB PHE A 101 -2.948 9.793 3.386 1.00 0.00 C ATOM 1532 CG PHE A 101 -4.445 9.871 3.302 1.00 0.00 C ATOM 1533 CD1 PHE A 101 -5.148 10.788 4.067 1.00 0.00 C ATOM 1534 CD2 PHE A 101 -5.150 9.029 2.458 1.00 0.00 C ATOM 1535 CE1 PHE A 101 -6.526 10.862 3.992 1.00 0.00 C ATOM 1536 CE2 PHE A 101 -6.528 9.098 2.378 1.00 0.00 C ATOM 1537 CZ PHE A 101 -7.217 10.016 3.146 1.00 0.00 C ATOM 0 H PHE A 101 -3.856 9.987 5.794 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.330 7.956 4.317 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.541 10.803 3.427 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.564 9.331 2.476 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.613 11.452 4.729 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -4.616 8.310 1.855 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -7.062 11.581 4.594 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -7.065 8.435 1.716 1.00 0.00 H new ATOM 0 HZ PHE A 101 -8.294 10.072 3.085 1.00 0.00 H new ATOM 1547 N PRO A 102 -0.021 9.073 4.369 1.00 0.00 N ATOM 1548 CA PRO A 102 -0.135 8.105 3.275 1.00 0.00 C ATOM 1549 C PRO A 102 -0.555 6.723 3.764 1.00 0.00 C ATOM 1550 O PRO A 102 -0.402 6.397 4.942 1.00 0.00 O ATOM 1551 CB PRO A 102 1.280 8.059 2.693 1.00 0.00 C ATOM 1552 CG PRO A 102 2.166 8.465 3.819 1.00 0.00 C ATOM 1553 CD PRO A 102 1.377 9.455 4.631 1.00 0.00 C ATOM 0 HA PRO A 102 -0.899 8.395 2.553 1.00 0.00 H new ATOM 0 HB2 PRO A 102 1.528 7.060 2.334 1.00 0.00 H new ATOM 0 HB3 PRO A 102 1.382 8.737 1.845 1.00 0.00 H new ATOM 0 HG2 PRO A 102 2.449 7.603 4.423 1.00 0.00 H new ATOM 0 HG3 PRO A 102 3.089 8.912 3.448 1.00 0.00 H new ATOM 0 HD2 PRO A 102 1.620 9.389 5.692 1.00 0.00 H new ATOM 0 HD3 PRO A 102 1.578 10.480 4.321 1.00 0.00 H new ATOM 1561 N THR A 103 -1.085 5.914 2.853 1.00 0.00 N ATOM 1562 CA THR A 103 -1.528 4.567 3.192 1.00 0.00 C ATOM 1563 C THR A 103 -1.126 3.568 2.113 1.00 0.00 C ATOM 1564 O THR A 103 -1.645 3.604 0.997 1.00 0.00 O ATOM 1565 CB THR A 103 -3.055 4.510 3.385 1.00 0.00 C ATOM 1566 OG1 THR A 103 -3.449 5.394 4.441 1.00 0.00 O ATOM 1567 CG2 THR A 103 -3.507 3.094 3.708 1.00 0.00 C ATOM 0 H THR A 103 -1.218 6.168 1.874 1.00 0.00 H new ATOM 0 HA THR A 103 -1.040 4.301 4.130 1.00 0.00 H new ATOM 0 HB THR A 103 -3.528 4.823 2.454 1.00 0.00 H new ATOM 0 HG1 THR A 103 -2.668 5.618 4.989 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.589 3.079 3.840 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.232 2.429 2.890 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.025 2.759 4.626 1.00 0.00 H new ATOM 1575 N ILE A 104 -0.200 2.678 2.453 1.00 0.00 N ATOM 1576 CA ILE A 104 0.269 1.668 1.513 1.00 0.00 C ATOM 1577 C ILE A 104 -0.212 0.277 1.914 1.00 0.00 C ATOM 1578 O ILE A 104 -0.090 -0.123 3.071 1.00 0.00 O ATOM 1579 CB ILE A 104 1.806 1.659 1.417 1.00 0.00 C ATOM 1580 CG1 ILE A 104 2.318 3.023 0.951 1.00 0.00 C ATOM 1581 CG2 ILE A 104 2.272 0.561 0.472 1.00 0.00 C ATOM 1582 CD1 ILE A 104 3.824 3.155 1.007 1.00 0.00 C ATOM 0 H ILE A 104 0.240 2.636 3.372 1.00 0.00 H new ATOM 0 HA ILE A 104 -0.147 1.927 0.539 1.00 0.00 H new ATOM 0 HB ILE A 104 2.215 1.457 2.407 1.00 0.00 H new ATOM 0 HG12 ILE A 104 1.984 3.197 -0.072 1.00 0.00 H new ATOM 0 HG13 ILE A 104 1.870 3.801 1.569 1.00 0.00 H new ATOM 0 HG21 ILE A 104 3.360 0.568 0.415 1.00 0.00 H new ATOM 0 HG22 ILE A 104 1.934 -0.406 0.844 1.00 0.00 H new ATOM 0 HG23 ILE A 104 1.856 0.734 -0.520 1.00 0.00 H new ATOM 0 HD11 ILE A 104 4.115 4.147 0.662 1.00 0.00 H new ATOM 0 HD12 ILE A 104 4.164 3.013 2.033 1.00 0.00 H new ATOM 0 HD13 ILE A 104 4.279 2.400 0.366 1.00 0.00 H new ATOM 1594 N TYR A 105 -0.758 -0.454 0.949 1.00 0.00 N ATOM 1595 CA TYR A 105 -1.259 -1.800 1.201 1.00 0.00 C ATOM 1596 C TYR A 105 -0.584 -2.814 0.281 1.00 0.00 C ATOM 1597 O TYR A 105 0.308 -2.469 -0.494 1.00 0.00 O ATOM 1598 CB TYR A 105 -2.775 -1.848 1.006 1.00 0.00 C ATOM 1599 CG TYR A 105 -3.557 -1.548 2.264 1.00 0.00 C ATOM 1600 CD1 TYR A 105 -3.893 -2.560 3.155 1.00 0.00 C ATOM 1601 CD2 TYR A 105 -3.961 -0.252 2.562 1.00 0.00 C ATOM 1602 CE1 TYR A 105 -4.609 -2.291 4.306 1.00 0.00 C ATOM 1603 CE2 TYR A 105 -4.675 0.027 3.712 1.00 0.00 C ATOM 1604 CZ TYR A 105 -4.997 -0.996 4.580 1.00 0.00 C ATOM 1605 OH TYR A 105 -5.709 -0.722 5.725 1.00 0.00 O ATOM 0 H TYR A 105 -0.865 -0.137 -0.015 1.00 0.00 H new ATOM 0 HA TYR A 105 -1.024 -2.060 2.233 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -3.056 -1.132 0.234 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -3.055 -2.836 0.641 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -3.589 -3.575 2.944 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -3.713 0.551 1.883 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -4.863 -3.090 4.987 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -4.979 1.040 3.930 1.00 0.00 H new ATOM 0 HH TYR A 105 -6.271 0.068 5.580 1.00 0.00 H new ATOM 1615 N PHE A 106 -1.019 -4.066 0.372 1.00 0.00 N ATOM 1616 CA PHE A 106 -0.458 -5.131 -0.451 1.00 0.00 C ATOM 1617 C PHE A 106 -1.481 -6.241 -0.676 1.00 0.00 C ATOM 1618 O PHE A 106 -2.125 -6.706 0.264 1.00 0.00 O ATOM 1619 CB PHE A 106 0.798 -5.706 0.208 1.00 0.00 C ATOM 1620 CG PHE A 106 1.427 -6.824 -0.574 1.00 0.00 C ATOM 1621 CD1 PHE A 106 1.729 -6.663 -1.917 1.00 0.00 C ATOM 1622 CD2 PHE A 106 1.716 -8.035 0.033 1.00 0.00 C ATOM 1623 CE1 PHE A 106 2.307 -7.690 -2.639 1.00 0.00 C ATOM 1624 CE2 PHE A 106 2.294 -9.066 -0.683 1.00 0.00 C ATOM 1625 CZ PHE A 106 2.591 -8.893 -2.021 1.00 0.00 C ATOM 0 H PHE A 106 -1.758 -4.368 1.007 1.00 0.00 H new ATOM 0 HA PHE A 106 -0.191 -4.706 -1.418 1.00 0.00 H new ATOM 0 HB2 PHE A 106 1.529 -4.908 0.337 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.543 -6.069 1.204 1.00 0.00 H new ATOM 0 HD1 PHE A 106 1.510 -5.725 -2.405 1.00 0.00 H new ATOM 0 HD2 PHE A 106 1.487 -8.175 1.079 1.00 0.00 H new ATOM 0 HE1 PHE A 106 2.537 -7.553 -3.685 1.00 0.00 H new ATOM 0 HE2 PHE A 106 2.513 -10.005 -0.197 1.00 0.00 H new ATOM 0 HZ PHE A 106 3.044 -9.696 -2.583 1.00 0.00 H new ATOM 1635 N SER A 107 -1.625 -6.660 -1.929 1.00 0.00 N ATOM 1636 CA SER A 107 -2.572 -7.712 -2.279 1.00 0.00 C ATOM 1637 C SER A 107 -1.851 -9.033 -2.525 1.00 0.00 C ATOM 1638 O SER A 107 -1.342 -9.299 -3.614 1.00 0.00 O ATOM 1639 CB SER A 107 -3.371 -7.315 -3.523 1.00 0.00 C ATOM 1640 OG SER A 107 -4.238 -8.359 -3.927 1.00 0.00 O ATOM 0 H SER A 107 -1.098 -6.287 -2.719 1.00 0.00 H new ATOM 0 HA SER A 107 -3.257 -7.843 -1.441 1.00 0.00 H new ATOM 0 HB2 SER A 107 -3.951 -6.416 -3.315 1.00 0.00 H new ATOM 0 HB3 SER A 107 -2.687 -7.071 -4.336 1.00 0.00 H new ATOM 0 HG SER A 107 -4.544 -8.194 -4.843 1.00 0.00 H new ATOM 1646 N PRO A 108 -1.805 -9.883 -1.488 1.00 0.00 N ATOM 1647 CA PRO A 108 -1.150 -11.192 -1.565 1.00 0.00 C ATOM 1648 C PRO A 108 -1.908 -12.168 -2.459 1.00 0.00 C ATOM 1649 O PRO A 108 -3.046 -11.912 -2.848 1.00 0.00 O ATOM 1650 CB PRO A 108 -1.157 -11.678 -0.114 1.00 0.00 C ATOM 1651 CG PRO A 108 -2.307 -10.972 0.517 1.00 0.00 C ATOM 1652 CD PRO A 108 -2.391 -9.632 -0.161 1.00 0.00 C ATOM 0 HA PRO A 108 -0.153 -11.124 -2.001 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -1.279 -12.760 -0.060 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -0.220 -11.437 0.389 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -3.231 -11.535 0.385 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -2.154 -10.858 1.590 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -3.421 -9.284 -0.236 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -1.836 -8.870 0.386 1.00 0.00 H new ATOM 1660 N ALA A 109 -1.268 -13.288 -2.779 1.00 0.00 N ATOM 1661 CA ALA A 109 -1.883 -14.304 -3.624 1.00 0.00 C ATOM 1662 C ALA A 109 -2.707 -15.283 -2.795 1.00 0.00 C ATOM 1663 O ALA A 109 -2.265 -15.746 -1.744 1.00 0.00 O ATOM 1664 CB ALA A 109 -0.818 -15.047 -4.417 1.00 0.00 C ATOM 0 H ALA A 109 -0.324 -13.515 -2.466 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.555 -13.803 -4.320 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.292 -15.803 -5.044 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.275 -14.342 -5.047 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.123 -15.529 -3.730 1.00 0.00 H new ATOM 1670 N ASN A 110 -3.908 -15.593 -3.274 1.00 0.00 N ATOM 1671 CA ASN A 110 -4.794 -16.516 -2.575 1.00 0.00 C ATOM 1672 C ASN A 110 -5.023 -16.066 -1.135 1.00 0.00 C ATOM 1673 O ASN A 110 -5.322 -16.878 -0.259 1.00 0.00 O ATOM 1674 CB ASN A 110 -4.208 -17.930 -2.592 1.00 0.00 C ATOM 1675 CG ASN A 110 -3.699 -18.328 -3.963 1.00 0.00 C ATOM 1676 OD1 ASN A 110 -4.452 -18.837 -4.794 1.00 0.00 O ATOM 1677 ND2 ASN A 110 -2.414 -18.097 -4.207 1.00 0.00 N ATOM 0 H ASN A 110 -4.289 -15.219 -4.143 1.00 0.00 H new ATOM 0 HA ASN A 110 -5.753 -16.521 -3.092 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -3.391 -17.991 -1.873 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -4.970 -18.640 -2.270 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -2.015 -18.343 -5.113 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -1.827 -17.673 -3.489 1.00 0.00 H new ATOM 1684 N LYS A 111 -4.883 -14.766 -0.898 1.00 0.00 N ATOM 1685 CA LYS A 111 -5.076 -14.205 0.434 1.00 0.00 C ATOM 1686 C LYS A 111 -6.027 -13.014 0.390 1.00 0.00 C ATOM 1687 O LYS A 111 -6.024 -12.170 1.287 1.00 0.00 O ATOM 1688 CB LYS A 111 -3.733 -13.778 1.029 1.00 0.00 C ATOM 1689 CG LYS A 111 -3.064 -14.859 1.860 1.00 0.00 C ATOM 1690 CD LYS A 111 -1.555 -14.679 1.899 1.00 0.00 C ATOM 1691 CE LYS A 111 -0.877 -15.412 0.752 1.00 0.00 C ATOM 1692 NZ LYS A 111 0.548 -15.720 1.056 1.00 0.00 N ATOM 0 H LYS A 111 -4.636 -14.081 -1.612 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.517 -14.976 1.066 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.063 -13.487 0.220 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.885 -12.896 1.651 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.460 -14.836 2.875 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -3.304 -15.838 1.446 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.313 -13.618 1.848 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.168 -15.049 2.848 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.413 -16.339 0.546 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.933 -14.804 -0.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.902 -16.427 0.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 1.115 -14.852 0.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.623 -16.096 2.023 1.00 0.00 H new ATOM 1706 N LYS A 112 -6.841 -12.950 -0.659 1.00 0.00 N ATOM 1707 CA LYS A 112 -7.800 -11.864 -0.819 1.00 0.00 C ATOM 1708 C LYS A 112 -8.607 -11.658 0.459 1.00 0.00 C ATOM 1709 O LYS A 112 -8.857 -10.524 0.872 1.00 0.00 O ATOM 1710 CB LYS A 112 -8.742 -12.156 -1.989 1.00 0.00 C ATOM 1711 CG LYS A 112 -8.166 -11.781 -3.343 1.00 0.00 C ATOM 1712 CD LYS A 112 -6.878 -12.535 -3.629 1.00 0.00 C ATOM 1713 CE LYS A 112 -6.121 -11.923 -4.797 1.00 0.00 C ATOM 1714 NZ LYS A 112 -5.180 -10.858 -4.352 1.00 0.00 N ATOM 0 H LYS A 112 -6.855 -13.639 -1.411 1.00 0.00 H new ATOM 0 HA LYS A 112 -7.244 -10.950 -1.028 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -8.988 -13.218 -1.990 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -9.675 -11.613 -1.838 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.896 -11.998 -4.123 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.975 -10.708 -3.374 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -6.246 -12.528 -2.741 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.107 -13.578 -3.849 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -5.566 -12.703 -5.319 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.831 -11.505 -5.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -4.521 -10.633 -5.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -5.717 -10.005 -4.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -4.644 -11.191 -3.525 1.00 0.00 H new ATOM 1728 N LEU A 113 -9.012 -12.759 1.082 1.00 0.00 N ATOM 1729 CA LEU A 113 -9.790 -12.699 2.314 1.00 0.00 C ATOM 1730 C LEU A 113 -9.100 -11.818 3.351 1.00 0.00 C ATOM 1731 O LEU A 113 -9.752 -11.058 4.066 1.00 0.00 O ATOM 1732 CB LEU A 113 -9.996 -14.106 2.879 1.00 0.00 C ATOM 1733 CG LEU A 113 -11.255 -14.838 2.414 1.00 0.00 C ATOM 1734 CD1 LEU A 113 -12.501 -14.060 2.808 1.00 0.00 C ATOM 1735 CD2 LEU A 113 -11.217 -15.062 0.910 1.00 0.00 C ATOM 0 H LEU A 113 -8.814 -13.704 0.754 1.00 0.00 H new ATOM 0 HA LEU A 113 -10.761 -12.262 2.081 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -9.129 -14.712 2.616 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -10.020 -14.039 3.967 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.289 -15.811 2.905 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -13.387 -14.596 2.469 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -12.535 -13.952 3.892 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -12.475 -13.073 2.346 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -12.121 -15.584 0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -11.159 -14.100 0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -10.344 -15.662 0.653 1.00 0.00 H new ATOM 1747 N ASN A 114 -7.778 -11.924 3.425 1.00 0.00 N ATOM 1748 CA ASN A 114 -6.999 -11.136 4.373 1.00 0.00 C ATOM 1749 C ASN A 114 -5.768 -10.536 3.700 1.00 0.00 C ATOM 1750 O ASN A 114 -4.737 -11.189 3.542 1.00 0.00 O ATOM 1751 CB ASN A 114 -6.575 -12.001 5.561 1.00 0.00 C ATOM 1752 CG ASN A 114 -7.712 -12.246 6.534 1.00 0.00 C ATOM 1753 OD1 ASN A 114 -7.751 -11.666 7.619 1.00 0.00 O ATOM 1754 ND2 ASN A 114 -8.644 -13.109 6.148 1.00 0.00 N ATOM 0 H ASN A 114 -7.223 -12.548 2.840 1.00 0.00 H new ATOM 0 HA ASN A 114 -7.628 -10.321 4.732 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -6.201 -12.957 5.195 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -5.751 -11.516 6.084 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -9.434 -13.315 6.760 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -8.571 -13.566 5.239 1.00 0.00 H new ATOM 1761 N PRO A 115 -5.877 -9.262 3.295 1.00 0.00 N ATOM 1762 CA PRO A 115 -4.782 -8.545 2.635 1.00 0.00 C ATOM 1763 C PRO A 115 -3.627 -8.248 3.585 1.00 0.00 C ATOM 1764 O PRO A 115 -3.593 -8.742 4.712 1.00 0.00 O ATOM 1765 CB PRO A 115 -5.440 -7.244 2.169 1.00 0.00 C ATOM 1766 CG PRO A 115 -6.587 -7.045 3.099 1.00 0.00 C ATOM 1767 CD PRO A 115 -7.076 -8.422 3.452 1.00 0.00 C ATOM 0 HA PRO A 115 -4.341 -9.129 1.827 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -4.742 -6.408 2.217 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -5.777 -7.319 1.135 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -6.277 -6.500 3.991 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -7.376 -6.460 2.626 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -7.464 -8.462 4.470 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -7.881 -8.744 2.791 1.00 0.00 H new ATOM 1775 N LYS A 116 -2.681 -7.436 3.123 1.00 0.00 N ATOM 1776 CA LYS A 116 -1.525 -7.071 3.932 1.00 0.00 C ATOM 1777 C LYS A 116 -1.229 -5.579 3.816 1.00 0.00 C ATOM 1778 O LYS A 116 -1.309 -5.002 2.731 1.00 0.00 O ATOM 1779 CB LYS A 116 -0.299 -7.879 3.501 1.00 0.00 C ATOM 1780 CG LYS A 116 -0.434 -9.370 3.755 1.00 0.00 C ATOM 1781 CD LYS A 116 -0.183 -9.712 5.214 1.00 0.00 C ATOM 1782 CE LYS A 116 -0.597 -11.141 5.531 1.00 0.00 C ATOM 1783 NZ LYS A 116 -2.077 -11.280 5.632 1.00 0.00 N ATOM 0 H LYS A 116 -2.693 -7.019 2.192 1.00 0.00 H new ATOM 0 HA LYS A 116 -1.755 -7.299 4.973 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.121 -7.715 2.438 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.577 -7.506 4.032 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -1.433 -9.700 3.470 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.272 -9.913 3.126 1.00 0.00 H new ATOM 0 HD2 LYS A 116 0.874 -9.579 5.443 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -0.736 -9.022 5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -0.222 -11.809 4.755 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -0.138 -11.453 6.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -2.341 -11.469 6.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -2.531 -10.400 5.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -2.393 -12.069 5.032 1.00 0.00 H new ATOM 1797 N LYS A 117 -0.887 -4.959 4.940 1.00 0.00 N ATOM 1798 CA LYS A 117 -0.576 -3.534 4.965 1.00 0.00 C ATOM 1799 C LYS A 117 0.921 -3.307 5.146 1.00 0.00 C ATOM 1800 O LYS A 117 1.566 -3.971 5.958 1.00 0.00 O ATOM 1801 CB LYS A 117 -1.348 -2.843 6.091 1.00 0.00 C ATOM 1802 CG LYS A 117 -1.009 -1.370 6.245 1.00 0.00 C ATOM 1803 CD LYS A 117 -1.197 -0.902 7.679 1.00 0.00 C ATOM 1804 CE LYS A 117 -2.665 -0.672 8.002 1.00 0.00 C ATOM 1805 NZ LYS A 117 -2.939 -0.799 9.460 1.00 0.00 N ATOM 0 H LYS A 117 -0.818 -5.421 5.847 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.877 -3.105 4.010 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.417 -2.944 5.903 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.140 -3.355 7.030 1.00 0.00 H new ATOM 0 HG2 LYS A 117 0.023 -1.199 5.938 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -1.641 -0.779 5.582 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -0.785 -1.645 8.362 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -0.639 0.021 7.838 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -2.960 0.321 7.662 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -3.274 -1.391 7.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.950 -0.635 9.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.681 -1.754 9.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -2.377 -0.096 9.981 1.00 0.00 H new ATOM 1819 N TYR A 118 1.468 -2.365 4.386 1.00 0.00 N ATOM 1820 CA TYR A 118 2.890 -2.051 4.462 1.00 0.00 C ATOM 1821 C TYR A 118 3.190 -1.175 5.675 1.00 0.00 C ATOM 1822 O TYR A 118 2.849 0.008 5.699 1.00 0.00 O ATOM 1823 CB TYR A 118 3.347 -1.346 3.184 1.00 0.00 C ATOM 1824 CG TYR A 118 4.826 -1.030 3.163 1.00 0.00 C ATOM 1825 CD1 TYR A 118 5.308 0.170 3.670 1.00 0.00 C ATOM 1826 CD2 TYR A 118 5.741 -1.933 2.636 1.00 0.00 C ATOM 1827 CE1 TYR A 118 6.657 0.463 3.652 1.00 0.00 C ATOM 1828 CE2 TYR A 118 7.093 -1.650 2.615 1.00 0.00 C ATOM 1829 CZ TYR A 118 7.546 -0.450 3.123 1.00 0.00 C ATOM 1830 OH TYR A 118 8.892 -0.163 3.105 1.00 0.00 O ATOM 0 H TYR A 118 0.948 -1.805 3.710 1.00 0.00 H new ATOM 0 HA TYR A 118 3.438 -2.987 4.568 1.00 0.00 H new ATOM 0 HB2 TYR A 118 3.106 -1.974 2.326 1.00 0.00 H new ATOM 0 HB3 TYR A 118 2.784 -0.420 3.069 1.00 0.00 H new ATOM 0 HD1 TYR A 118 4.615 0.887 4.086 1.00 0.00 H new ATOM 0 HD2 TYR A 118 5.389 -2.872 2.236 1.00 0.00 H new ATOM 0 HE1 TYR A 118 7.014 1.401 4.050 1.00 0.00 H new ATOM 0 HE2 TYR A 118 7.791 -2.364 2.203 1.00 0.00 H new ATOM 0 HH TYR A 118 9.118 0.394 3.879 1.00 0.00 H new ATOM 1840 N GLU A 119 3.831 -1.765 6.679 1.00 0.00 N ATOM 1841 CA GLU A 119 4.177 -1.039 7.895 1.00 0.00 C ATOM 1842 C GLU A 119 5.676 -1.118 8.169 1.00 0.00 C ATOM 1843 O GLU A 119 6.159 -2.079 8.767 1.00 0.00 O ATOM 1844 CB GLU A 119 3.399 -1.598 9.089 1.00 0.00 C ATOM 1845 CG GLU A 119 1.891 -1.481 8.942 1.00 0.00 C ATOM 1846 CD GLU A 119 1.380 -0.090 9.265 1.00 0.00 C ATOM 1847 OE1 GLU A 119 1.909 0.884 8.690 1.00 0.00 O ATOM 1848 OE2 GLU A 119 0.451 0.024 10.092 1.00 0.00 O ATOM 0 H GLU A 119 4.121 -2.743 6.674 1.00 0.00 H new ATOM 0 HA GLU A 119 3.906 0.007 7.752 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.662 -2.647 9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 119 3.709 -1.073 9.992 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.608 -1.740 7.922 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.408 -2.203 9.600 1.00 0.00 H new ATOM 1855 N GLY A 120 6.407 -0.101 7.725 1.00 0.00 N ATOM 1856 CA GLY A 120 7.844 -0.075 7.930 1.00 0.00 C ATOM 1857 C GLY A 120 8.471 1.227 7.472 1.00 0.00 C ATOM 1858 O GLY A 120 7.914 2.303 7.687 1.00 0.00 O ATOM 0 H GLY A 120 6.030 0.706 7.227 1.00 0.00 H new ATOM 0 HA2 GLY A 120 8.060 -0.227 8.988 1.00 0.00 H new ATOM 0 HA3 GLY A 120 8.300 -0.904 7.390 1.00 0.00 H new ATOM 1862 N GLY A 121 9.637 1.130 6.840 1.00 0.00 N ATOM 1863 CA GLY A 121 10.323 2.317 6.362 1.00 0.00 C ATOM 1864 C GLY A 121 9.906 2.701 4.957 1.00 0.00 C ATOM 1865 O GLY A 121 9.924 1.871 4.048 1.00 0.00 O ATOM 0 H GLY A 121 10.119 0.251 6.650 1.00 0.00 H new ATOM 0 HA2 GLY A 121 10.119 3.148 7.038 1.00 0.00 H new ATOM 0 HA3 GLY A 121 11.399 2.145 6.384 1.00 0.00 H new ATOM 1869 N ARG A 122 9.527 3.962 4.778 1.00 0.00 N ATOM 1870 CA ARG A 122 9.101 4.454 3.473 1.00 0.00 C ATOM 1871 C ARG A 122 10.305 4.762 2.588 1.00 0.00 C ATOM 1872 O ARG A 122 10.393 5.838 1.997 1.00 0.00 O ATOM 1873 CB ARG A 122 8.238 5.707 3.633 1.00 0.00 C ATOM 1874 CG ARG A 122 6.922 5.453 4.350 1.00 0.00 C ATOM 1875 CD ARG A 122 6.271 6.753 4.796 1.00 0.00 C ATOM 1876 NE ARG A 122 7.058 7.437 5.818 1.00 0.00 N ATOM 1877 CZ ARG A 122 7.151 7.019 7.075 1.00 0.00 C ATOM 1878 NH1 ARG A 122 6.510 5.926 7.463 1.00 0.00 N ATOM 1879 NH2 ARG A 122 7.887 7.696 7.948 1.00 0.00 N ATOM 0 H ARG A 122 9.506 4.662 5.520 1.00 0.00 H new ATOM 0 HA ARG A 122 8.510 3.673 2.994 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.803 6.459 4.184 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.030 6.123 2.647 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.244 4.914 3.688 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.096 4.816 5.217 1.00 0.00 H new ATOM 0 HD2 ARG A 122 6.146 7.410 3.935 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.274 6.544 5.185 1.00 0.00 H new ATOM 0 HE ARG A 122 7.564 8.282 5.552 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.943 5.403 6.795 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.584 5.608 8.429 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.382 8.538 7.653 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.958 7.374 8.913 1.00 0.00 H new ATOM 1893 N GLU A 123 11.229 3.810 2.502 1.00 0.00 N ATOM 1894 CA GLU A 123 12.428 3.981 1.690 1.00 0.00 C ATOM 1895 C GLU A 123 12.420 3.027 0.499 1.00 0.00 C ATOM 1896 O GLU A 123 12.152 1.834 0.647 1.00 0.00 O ATOM 1897 CB GLU A 123 13.681 3.747 2.536 1.00 0.00 C ATOM 1898 CG GLU A 123 14.937 4.371 1.950 1.00 0.00 C ATOM 1899 CD GLU A 123 14.892 5.887 1.955 1.00 0.00 C ATOM 1900 OE1 GLU A 123 14.275 6.465 1.037 1.00 0.00 O ATOM 1901 OE2 GLU A 123 15.475 6.494 2.878 1.00 0.00 O ATOM 0 H GLU A 123 11.170 2.913 2.984 1.00 0.00 H new ATOM 0 HA GLU A 123 12.438 5.004 1.314 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.516 4.152 3.534 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.837 2.674 2.649 1.00 0.00 H new ATOM 0 HG2 GLU A 123 15.804 4.035 2.518 1.00 0.00 H new ATOM 0 HG3 GLU A 123 15.070 4.019 0.927 1.00 0.00 H new ATOM 1908 N LEU A 124 12.713 3.561 -0.681 1.00 0.00 N ATOM 1909 CA LEU A 124 12.740 2.758 -1.899 1.00 0.00 C ATOM 1910 C LEU A 124 13.239 1.347 -1.610 1.00 0.00 C ATOM 1911 O LEU A 124 12.599 0.363 -1.980 1.00 0.00 O ATOM 1912 CB LEU A 124 13.630 3.421 -2.951 1.00 0.00 C ATOM 1913 CG LEU A 124 13.630 2.773 -4.336 1.00 0.00 C ATOM 1914 CD1 LEU A 124 14.440 1.486 -4.323 1.00 0.00 C ATOM 1915 CD2 LEU A 124 12.205 2.504 -4.798 1.00 0.00 C ATOM 0 H LEU A 124 12.935 4.547 -0.821 1.00 0.00 H new ATOM 0 HA LEU A 124 11.722 2.691 -2.283 1.00 0.00 H new ATOM 0 HB2 LEU A 124 13.319 4.460 -3.058 1.00 0.00 H new ATOM 0 HB3 LEU A 124 14.654 3.432 -2.577 1.00 0.00 H new ATOM 0 HG LEU A 124 14.095 3.463 -5.040 1.00 0.00 H new ATOM 0 HD11 LEU A 124 14.429 1.039 -5.317 1.00 0.00 H new ATOM 0 HD12 LEU A 124 15.468 1.706 -4.036 1.00 0.00 H new ATOM 0 HD13 LEU A 124 14.004 0.789 -3.607 1.00 0.00 H new ATOM 0 HD21 LEU A 124 12.224 2.043 -5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 124 11.715 1.833 -4.093 1.00 0.00 H new ATOM 0 HD23 LEU A 124 11.655 3.444 -4.847 1.00 0.00 H new ATOM 1927 N SER A 125 14.386 1.255 -0.944 1.00 0.00 N ATOM 1928 CA SER A 125 14.973 -0.036 -0.606 1.00 0.00 C ATOM 1929 C SER A 125 14.060 -0.819 0.332 1.00 0.00 C ATOM 1930 O SER A 125 13.713 -1.970 0.062 1.00 0.00 O ATOM 1931 CB SER A 125 16.345 0.157 0.043 1.00 0.00 C ATOM 1932 OG SER A 125 16.253 0.977 1.195 1.00 0.00 O ATOM 0 H SER A 125 14.927 2.060 -0.628 1.00 0.00 H new ATOM 0 HA SER A 125 15.092 -0.605 -1.528 1.00 0.00 H new ATOM 0 HB2 SER A 125 16.762 -0.813 0.315 1.00 0.00 H new ATOM 0 HB3 SER A 125 17.030 0.608 -0.675 1.00 0.00 H new ATOM 0 HG SER A 125 17.142 1.084 1.592 1.00 0.00 H new ATOM 1938 N ASP A 126 13.674 -0.188 1.435 1.00 0.00 N ATOM 1939 CA ASP A 126 12.799 -0.823 2.414 1.00 0.00 C ATOM 1940 C ASP A 126 11.650 -1.551 1.724 1.00 0.00 C ATOM 1941 O ASP A 126 11.221 -2.616 2.168 1.00 0.00 O ATOM 1942 CB ASP A 126 12.248 0.218 3.389 1.00 0.00 C ATOM 1943 CG ASP A 126 13.200 0.500 4.534 1.00 0.00 C ATOM 1944 OD1 ASP A 126 14.286 1.062 4.279 1.00 0.00 O ATOM 1945 OD2 ASP A 126 12.859 0.160 5.686 1.00 0.00 O ATOM 0 H ASP A 126 13.953 0.763 1.674 1.00 0.00 H new ATOM 0 HA ASP A 126 13.387 -1.554 2.970 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.047 1.144 2.851 1.00 0.00 H new ATOM 0 HB3 ASP A 126 11.296 -0.131 3.789 1.00 0.00 H new ATOM 1950 N PHE A 127 11.155 -0.969 0.637 1.00 0.00 N ATOM 1951 CA PHE A 127 10.054 -1.562 -0.114 1.00 0.00 C ATOM 1952 C PHE A 127 10.500 -2.840 -0.817 1.00 0.00 C ATOM 1953 O PHE A 127 9.790 -3.846 -0.810 1.00 0.00 O ATOM 1954 CB PHE A 127 9.513 -0.564 -1.139 1.00 0.00 C ATOM 1955 CG PHE A 127 8.755 0.578 -0.523 1.00 0.00 C ATOM 1956 CD1 PHE A 127 7.580 0.350 0.175 1.00 0.00 C ATOM 1957 CD2 PHE A 127 9.218 1.878 -0.643 1.00 0.00 C ATOM 1958 CE1 PHE A 127 6.881 1.398 0.743 1.00 0.00 C ATOM 1959 CE2 PHE A 127 8.523 2.930 -0.076 1.00 0.00 C ATOM 1960 CZ PHE A 127 7.353 2.690 0.616 1.00 0.00 C ATOM 0 H PHE A 127 11.499 -0.087 0.256 1.00 0.00 H new ATOM 0 HA PHE A 127 9.261 -1.815 0.590 1.00 0.00 H new ATOM 0 HB2 PHE A 127 10.345 -0.166 -1.720 1.00 0.00 H new ATOM 0 HB3 PHE A 127 8.860 -1.089 -1.836 1.00 0.00 H new ATOM 0 HD1 PHE A 127 7.206 -0.658 0.276 1.00 0.00 H new ATOM 0 HD2 PHE A 127 10.132 2.072 -1.185 1.00 0.00 H new ATOM 0 HE1 PHE A 127 5.967 1.207 1.286 1.00 0.00 H new ATOM 0 HE2 PHE A 127 8.895 3.939 -0.174 1.00 0.00 H new ATOM 0 HZ PHE A 127 6.808 3.511 1.057 1.00 0.00 H new ATOM 1970 N ILE A 128 11.681 -2.792 -1.425 1.00 0.00 N ATOM 1971 CA ILE A 128 12.223 -3.945 -2.133 1.00 0.00 C ATOM 1972 C ILE A 128 12.302 -5.163 -1.219 1.00 0.00 C ATOM 1973 O ILE A 128 11.638 -6.173 -1.455 1.00 0.00 O ATOM 1974 CB ILE A 128 13.624 -3.650 -2.699 1.00 0.00 C ATOM 1975 CG1 ILE A 128 13.625 -2.318 -3.451 1.00 0.00 C ATOM 1976 CG2 ILE A 128 14.074 -4.780 -3.614 1.00 0.00 C ATOM 1977 CD1 ILE A 128 14.922 -2.033 -4.176 1.00 0.00 C ATOM 0 H ILE A 128 12.280 -1.967 -1.441 1.00 0.00 H new ATOM 0 HA ILE A 128 11.544 -4.157 -2.959 1.00 0.00 H new ATOM 0 HB ILE A 128 14.327 -3.578 -1.869 1.00 0.00 H new ATOM 0 HG12 ILE A 128 12.808 -2.317 -4.172 1.00 0.00 H new ATOM 0 HG13 ILE A 128 13.428 -1.511 -2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 128 15.066 -4.557 -4.007 1.00 0.00 H new ATOM 0 HG22 ILE A 128 14.108 -5.713 -3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 128 13.371 -4.881 -4.441 1.00 0.00 H new ATOM 0 HD11 ILE A 128 14.850 -1.073 -4.687 1.00 0.00 H new ATOM 0 HD12 ILE A 128 15.741 -2.002 -3.458 1.00 0.00 H new ATOM 0 HD13 ILE A 128 15.111 -2.819 -4.907 1.00 0.00 H new ATOM 1989 N SER A 129 13.117 -5.061 -0.174 1.00 0.00 N ATOM 1990 CA SER A 129 13.284 -6.155 0.775 1.00 0.00 C ATOM 1991 C SER A 129 11.937 -6.595 1.340 1.00 0.00 C ATOM 1992 O SER A 129 11.708 -7.782 1.577 1.00 0.00 O ATOM 1993 CB SER A 129 14.214 -5.733 1.914 1.00 0.00 C ATOM 1994 OG SER A 129 14.101 -6.614 3.018 1.00 0.00 O ATOM 0 H SER A 129 13.672 -4.232 0.037 1.00 0.00 H new ATOM 0 HA SER A 129 13.729 -6.997 0.245 1.00 0.00 H new ATOM 0 HB2 SER A 129 15.245 -5.719 1.560 1.00 0.00 H new ATOM 0 HB3 SER A 129 13.971 -4.718 2.229 1.00 0.00 H new ATOM 0 HG SER A 129 14.706 -6.323 3.732 1.00 0.00 H new ATOM 2000 N TYR A 130 11.049 -5.631 1.553 1.00 0.00 N ATOM 2001 CA TYR A 130 9.725 -5.917 2.093 1.00 0.00 C ATOM 2002 C TYR A 130 9.002 -6.956 1.241 1.00 0.00 C ATOM 2003 O TYR A 130 8.494 -7.953 1.755 1.00 0.00 O ATOM 2004 CB TYR A 130 8.894 -4.635 2.168 1.00 0.00 C ATOM 2005 CG TYR A 130 7.476 -4.860 2.643 1.00 0.00 C ATOM 2006 CD1 TYR A 130 6.474 -5.226 1.753 1.00 0.00 C ATOM 2007 CD2 TYR A 130 7.139 -4.707 3.982 1.00 0.00 C ATOM 2008 CE1 TYR A 130 5.177 -5.431 2.183 1.00 0.00 C ATOM 2009 CE2 TYR A 130 5.845 -4.911 4.422 1.00 0.00 C ATOM 2010 CZ TYR A 130 4.868 -5.273 3.518 1.00 0.00 C ATOM 2011 OH TYR A 130 3.578 -5.478 3.950 1.00 0.00 O ATOM 0 H TYR A 130 11.222 -4.644 1.360 1.00 0.00 H new ATOM 0 HA TYR A 130 9.850 -6.321 3.098 1.00 0.00 H new ATOM 0 HB2 TYR A 130 9.386 -3.932 2.840 1.00 0.00 H new ATOM 0 HB3 TYR A 130 8.869 -4.170 1.182 1.00 0.00 H new ATOM 0 HD1 TYR A 130 6.713 -5.352 0.707 1.00 0.00 H new ATOM 0 HD2 TYR A 130 7.902 -4.424 4.692 1.00 0.00 H new ATOM 0 HE1 TYR A 130 4.409 -5.713 1.478 1.00 0.00 H new ATOM 0 HE2 TYR A 130 5.600 -4.788 5.467 1.00 0.00 H new ATOM 0 HH TYR A 130 3.529 -5.327 4.917 1.00 0.00 H new ATOM 2021 N LEU A 131 8.962 -6.716 -0.065 1.00 0.00 N ATOM 2022 CA LEU A 131 8.302 -7.630 -0.991 1.00 0.00 C ATOM 2023 C LEU A 131 9.103 -8.919 -1.147 1.00 0.00 C ATOM 2024 O LEU A 131 8.539 -10.012 -1.172 1.00 0.00 O ATOM 2025 CB LEU A 131 8.119 -6.962 -2.355 1.00 0.00 C ATOM 2026 CG LEU A 131 7.383 -5.621 -2.352 1.00 0.00 C ATOM 2027 CD1 LEU A 131 7.412 -4.994 -3.737 1.00 0.00 C ATOM 2028 CD2 LEU A 131 5.949 -5.802 -1.876 1.00 0.00 C ATOM 0 H LEU A 131 9.379 -5.896 -0.507 1.00 0.00 H new ATOM 0 HA LEU A 131 7.323 -7.879 -0.581 1.00 0.00 H new ATOM 0 HB2 LEU A 131 9.103 -6.813 -2.799 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.577 -7.650 -3.004 1.00 0.00 H new ATOM 0 HG LEU A 131 7.892 -4.949 -1.661 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.884 -4.041 -3.716 1.00 0.00 H new ATOM 0 HD12 LEU A 131 8.446 -4.829 -4.040 1.00 0.00 H new ATOM 0 HD13 LEU A 131 6.927 -5.662 -4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 131 5.440 -4.838 -1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.429 -6.490 -2.542 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.950 -6.208 -0.864 1.00 0.00 H new ATOM 2040 N GLN A 132 10.421 -8.781 -1.250 1.00 0.00 N ATOM 2041 CA GLN A 132 11.299 -9.935 -1.402 1.00 0.00 C ATOM 2042 C GLN A 132 10.891 -11.058 -0.454 1.00 0.00 C ATOM 2043 O GLN A 132 10.889 -12.231 -0.830 1.00 0.00 O ATOM 2044 CB GLN A 132 12.753 -9.535 -1.141 1.00 0.00 C ATOM 2045 CG GLN A 132 13.368 -8.714 -2.262 1.00 0.00 C ATOM 2046 CD GLN A 132 13.370 -9.447 -3.589 1.00 0.00 C ATOM 2047 OE1 GLN A 132 13.255 -10.672 -3.635 1.00 0.00 O ATOM 2048 NE2 GLN A 132 13.502 -8.699 -4.678 1.00 0.00 N ATOM 0 H GLN A 132 10.904 -7.883 -1.231 1.00 0.00 H new ATOM 0 HA GLN A 132 11.207 -10.297 -2.426 1.00 0.00 H new ATOM 0 HB2 GLN A 132 12.803 -8.964 -0.214 1.00 0.00 H new ATOM 0 HB3 GLN A 132 13.348 -10.436 -0.993 1.00 0.00 H new ATOM 0 HG2 GLN A 132 12.816 -7.780 -2.368 1.00 0.00 H new ATOM 0 HG3 GLN A 132 14.392 -8.451 -1.995 1.00 0.00 H new ATOM 0 HE21 GLN A 132 13.594 -7.687 -4.593 1.00 0.00 H new ATOM 0 HE22 GLN A 132 13.511 -9.137 -5.599 1.00 0.00 H new ATOM 2057 N ARG A 133 10.547 -10.692 0.776 1.00 0.00 N ATOM 2058 CA ARG A 133 10.138 -11.669 1.778 1.00 0.00 C ATOM 2059 C ARG A 133 8.625 -11.868 1.758 1.00 0.00 C ATOM 2060 O ARG A 133 8.140 -12.994 1.653 1.00 0.00 O ATOM 2061 CB ARG A 133 10.586 -11.221 3.171 1.00 0.00 C ATOM 2062 CG ARG A 133 9.906 -9.949 3.649 1.00 0.00 C ATOM 2063 CD ARG A 133 10.578 -9.392 4.894 1.00 0.00 C ATOM 2064 NE ARG A 133 10.494 -10.317 6.021 1.00 0.00 N ATOM 2065 CZ ARG A 133 10.749 -9.969 7.278 1.00 0.00 C ATOM 2066 NH1 ARG A 133 11.103 -8.724 7.566 1.00 0.00 N ATOM 2067 NH2 ARG A 133 10.650 -10.868 8.249 1.00 0.00 N ATOM 0 H ARG A 133 10.543 -9.726 1.103 1.00 0.00 H new ATOM 0 HA ARG A 133 10.615 -12.619 1.538 1.00 0.00 H new ATOM 0 HB2 ARG A 133 10.384 -12.021 3.883 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.665 -11.066 3.164 1.00 0.00 H new ATOM 0 HG2 ARG A 133 9.931 -9.202 2.856 1.00 0.00 H new ATOM 0 HG3 ARG A 133 8.857 -10.154 3.861 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.625 -9.179 4.677 1.00 0.00 H new ATOM 0 HD3 ARG A 133 10.110 -8.446 5.166 1.00 0.00 H new ATOM 0 HE ARG A 133 10.225 -11.283 5.833 1.00 0.00 H new ATOM 0 HH11 ARG A 133 11.180 -8.031 6.822 1.00 0.00 H new ATOM 0 HH12 ARG A 133 11.298 -8.460 8.532 1.00 0.00 H new ATOM 0 HH21 ARG A 133 10.378 -11.827 8.031 1.00 0.00 H new ATOM 0 HH22 ARG A 133 10.846 -10.600 9.214 1.00 0.00 H new ATOM 2081 N GLU A 134 7.887 -10.767 1.860 1.00 0.00 N ATOM 2082 CA GLU A 134 6.430 -10.822 1.855 1.00 0.00 C ATOM 2083 C GLU A 134 5.919 -11.614 0.654 1.00 0.00 C ATOM 2084 O GLU A 134 5.282 -12.655 0.809 1.00 0.00 O ATOM 2085 CB GLU A 134 5.844 -9.409 1.835 1.00 0.00 C ATOM 2086 CG GLU A 134 5.827 -8.737 3.197 1.00 0.00 C ATOM 2087 CD GLU A 134 4.624 -9.135 4.029 1.00 0.00 C ATOM 2088 OE1 GLU A 134 3.574 -9.459 3.435 1.00 0.00 O ATOM 2089 OE2 GLU A 134 4.731 -9.123 5.273 1.00 0.00 O ATOM 0 H GLU A 134 8.274 -9.827 1.947 1.00 0.00 H new ATOM 0 HA GLU A 134 6.108 -11.328 2.765 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.422 -8.795 1.144 1.00 0.00 H new ATOM 0 HB3 GLU A 134 4.826 -9.453 1.448 1.00 0.00 H new ATOM 0 HG2 GLU A 134 6.738 -8.995 3.736 1.00 0.00 H new ATOM 0 HG3 GLU A 134 5.830 -7.655 3.064 1.00 0.00 H new ATOM 2096 N ALA A 135 6.204 -11.111 -0.543 1.00 0.00 N ATOM 2097 CA ALA A 135 5.776 -11.770 -1.770 1.00 0.00 C ATOM 2098 C ALA A 135 5.863 -13.287 -1.637 1.00 0.00 C ATOM 2099 O ALA A 135 6.951 -13.862 -1.666 1.00 0.00 O ATOM 2100 CB ALA A 135 6.614 -11.292 -2.946 1.00 0.00 C ATOM 0 H ALA A 135 6.730 -10.249 -0.688 1.00 0.00 H new ATOM 0 HA ALA A 135 4.734 -11.506 -1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 135 6.283 -11.793 -3.856 1.00 0.00 H new ATOM 0 HB2 ALA A 135 6.497 -10.214 -3.062 1.00 0.00 H new ATOM 0 HB3 ALA A 135 7.663 -11.526 -2.764 1.00 0.00 H new ATOM 2106 N THR A 136 4.709 -13.931 -1.491 1.00 0.00 N ATOM 2107 CA THR A 136 4.655 -15.381 -1.352 1.00 0.00 C ATOM 2108 C THR A 136 5.468 -16.068 -2.443 1.00 0.00 C ATOM 2109 O THR A 136 6.328 -16.901 -2.158 1.00 0.00 O ATOM 2110 CB THR A 136 3.205 -15.897 -1.406 1.00 0.00 C ATOM 2111 OG1 THR A 136 3.196 -17.323 -1.527 1.00 0.00 O ATOM 2112 CG2 THR A 136 2.453 -15.278 -2.575 1.00 0.00 C ATOM 0 H THR A 136 3.799 -13.471 -1.466 1.00 0.00 H new ATOM 0 HA THR A 136 5.082 -15.621 -0.378 1.00 0.00 H new ATOM 0 HB THR A 136 2.706 -15.609 -0.481 1.00 0.00 H new ATOM 0 HG1 THR A 136 2.270 -17.643 -1.559 1.00 0.00 H new ATOM 0 HG21 THR A 136 1.431 -15.658 -2.592 1.00 0.00 H new ATOM 0 HG22 THR A 136 2.435 -14.194 -2.463 1.00 0.00 H new ATOM 0 HG23 THR A 136 2.953 -15.538 -3.508 1.00 0.00 H new ATOM 2120 N SER A 137 5.190 -15.714 -3.694 1.00 0.00 N ATOM 2121 CA SER A 137 5.893 -16.300 -4.828 1.00 0.00 C ATOM 2122 C SER A 137 7.307 -15.737 -4.941 1.00 0.00 C ATOM 2123 O SER A 137 8.259 -16.468 -5.211 1.00 0.00 O ATOM 2124 CB SER A 137 5.123 -16.038 -6.124 1.00 0.00 C ATOM 2125 OG SER A 137 5.355 -17.066 -7.072 1.00 0.00 O ATOM 0 H SER A 137 4.483 -15.024 -3.947 1.00 0.00 H new ATOM 0 HA SER A 137 5.961 -17.376 -4.665 1.00 0.00 H new ATOM 0 HB2 SER A 137 4.056 -15.971 -5.910 1.00 0.00 H new ATOM 0 HB3 SER A 137 5.425 -15.078 -6.543 1.00 0.00 H new ATOM 0 HG SER A 137 4.851 -16.876 -7.890 1.00 0.00 H new ATOM 2131 N GLY A 138 7.434 -14.430 -4.731 1.00 0.00 N ATOM 2132 CA GLY A 138 8.734 -13.789 -4.813 1.00 0.00 C ATOM 2133 C GLY A 138 9.349 -13.901 -6.194 1.00 0.00 C ATOM 2134 O GLY A 138 8.956 -14.739 -7.006 1.00 0.00 O ATOM 0 H GLY A 138 6.661 -13.804 -4.506 1.00 0.00 H new ATOM 0 HA2 GLY A 138 8.634 -12.737 -4.547 1.00 0.00 H new ATOM 0 HA3 GLY A 138 9.405 -14.240 -4.082 1.00 0.00 H new