USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 883 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 108 ASN :FLIP amide:sc= -2.05! C(o=-3.2!,f=-2!) USER MOD Set 1.2: A 117 TYR OH : rot 30:sc= 0 USER MOD Set 2.1: A 69 SER OG : rot 83:sc= 1.38 USER MOD Set 2.2: A 131 CYS SG : rot 130:sc= 0.7 USER MOD Set 3.1: A 33 CYS SG : rot 180:sc= -1.23 USER MOD Set 3.2: A 36 HIS : no HD1:sc= -8.04! C(o=-9.3!,f=-9.3!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -1.85 K(o=-1.9,f=-2.4!) USER MOD Single : A 44 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0508) USER MOD Single : A 46 GLN : amide:sc= -0.2 K(o=-0.2,f=-3.4!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0613 USER MOD Single : A 52 ASN :FLIP amide:sc= -1.63 F(o=-2.6,f=-1.6) USER MOD Single : A 54 ASN : amide:sc= -0.309 K(o=-0.31,f=-1.6) USER MOD Single : A 56 THR OG1 : rot -64:sc= 0.415 USER MOD Single : A 57 THR OG1 : rot -170:sc= -0.979 USER MOD Single : A 61 SER OG : rot 39:sc= -0.411 USER MOD Single : A 63 SER OG : rot 180:sc= 0.0192 USER MOD Single : A 64 CYS SG : rot 180:sc= -2.32 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= -2.12 X(o=-2.1,f=-1.9) USER MOD Single : A 81 HIS :FLIP no HD1:sc= -2.7! C(o=-3.5!,f=-2.7!) USER MOD Single : A 84 GLN : amide:sc= -0.414 X(o=-0.41,f=0) USER MOD Single : A 85 MET CE :methyl 166:sc= -5.54 (180deg=-6.65) USER MOD Single : A 89 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 ASN :FLIP amide:sc= -0.234 F(o=-0.82,f=-0.23) USER MOD Single : A 96 ASN :FLIP amide:sc= 0.162 F(o=-2.5,f=0.16) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 25:sc= -1.12 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 THR OG1 : rot -119:sc= 0.813 USER MOD Single : A 110 ASN :FLIP amide:sc= -0.516 F(o=-2!,f=-0.52) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 ASN : amide:sc= -15.9! C(o=-16!,f=-24!) USER MOD Single : A 129 LYS NZ :NH3+ -102:sc= 0.068 (180deg=-1.46) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 TYR OH : rot -61:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 203 N TYR A 31 11.595 -3.270 1.148 1.00 0.00 N ATOM 204 CA TYR A 31 11.158 -2.044 0.491 1.00 0.00 C ATOM 205 C TYR A 31 10.697 -1.009 1.528 1.00 0.00 C ATOM 206 O TYR A 31 11.485 -0.588 2.373 1.00 0.00 O ATOM 207 CB TYR A 31 10.047 -2.363 -0.516 1.00 0.00 C ATOM 208 CG TYR A 31 10.546 -3.030 -1.778 1.00 0.00 C ATOM 209 CD1 TYR A 31 10.647 -4.412 -1.863 1.00 0.00 C ATOM 210 CD2 TYR A 31 10.915 -2.276 -2.885 1.00 0.00 C ATOM 211 CE1 TYR A 31 11.103 -5.026 -3.015 1.00 0.00 C ATOM 212 CE2 TYR A 31 11.371 -2.881 -4.040 1.00 0.00 C ATOM 213 CZ TYR A 31 11.464 -4.255 -4.099 1.00 0.00 C ATOM 214 OH TYR A 31 11.918 -4.862 -5.248 1.00 0.00 O ATOM 0 HA TYR A 31 11.998 -1.610 -0.052 1.00 0.00 H new ATOM 0 HB2 TYR A 31 9.311 -3.011 -0.039 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.533 -1.439 -0.782 1.00 0.00 H new ATOM 0 HD1 TYR A 31 10.365 -5.018 -1.015 1.00 0.00 H new ATOM 0 HD2 TYR A 31 10.844 -1.199 -2.842 1.00 0.00 H new ATOM 0 HE1 TYR A 31 11.176 -6.102 -3.065 1.00 0.00 H new ATOM 0 HE2 TYR A 31 11.653 -2.281 -4.892 1.00 0.00 H new ATOM 0 HH TYR A 31 12.129 -4.178 -5.918 1.00 0.00 H new ATOM 224 N THR A 32 9.426 -0.606 1.471 1.00 0.00 N ATOM 225 CA THR A 32 8.895 0.369 2.418 1.00 0.00 C ATOM 226 C THR A 32 7.482 -0.009 2.842 1.00 0.00 C ATOM 227 O THR A 32 6.668 -0.437 2.023 1.00 0.00 O ATOM 228 CB THR A 32 8.907 1.779 1.816 1.00 0.00 C ATOM 229 OG1 THR A 32 7.861 2.569 2.355 1.00 0.00 O ATOM 230 CG2 THR A 32 8.765 1.799 0.308 1.00 0.00 C ATOM 0 H THR A 32 8.751 -0.939 0.783 1.00 0.00 H new ATOM 0 HA THR A 32 9.537 0.365 3.299 1.00 0.00 H new ATOM 0 HB THR A 32 9.885 2.185 2.075 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.889 3.464 1.958 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.782 2.830 -0.045 1.00 0.00 H new ATOM 0 HG22 THR A 32 9.590 1.247 -0.142 1.00 0.00 H new ATOM 0 HG23 THR A 32 7.821 1.334 0.025 1.00 0.00 H new ATOM 238 N CYS A 33 7.199 0.151 4.126 1.00 0.00 N ATOM 239 CA CYS A 33 5.885 -0.176 4.666 1.00 0.00 C ATOM 240 C CYS A 33 4.841 0.840 4.217 1.00 0.00 C ATOM 241 O CYS A 33 5.066 2.049 4.286 1.00 0.00 O ATOM 242 CB CYS A 33 5.937 -0.230 6.192 1.00 0.00 C ATOM 243 SG CYS A 33 4.614 -1.207 6.942 1.00 0.00 S ATOM 0 H CYS A 33 7.862 0.506 4.815 1.00 0.00 H new ATOM 0 HA CYS A 33 5.598 -1.156 4.284 1.00 0.00 H new ATOM 0 HB2 CYS A 33 6.898 -0.644 6.498 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.889 0.787 6.583 1.00 0.00 H new ATOM 0 HG CYS A 33 4.745 -1.194 8.235 1.00 0.00 H new ATOM 249 N LEU A 34 3.699 0.341 3.760 1.00 0.00 N ATOM 250 CA LEU A 34 2.616 1.202 3.303 1.00 0.00 C ATOM 251 C LEU A 34 1.289 0.785 3.927 1.00 0.00 C ATOM 252 O LEU A 34 0.504 1.629 4.360 1.00 0.00 O ATOM 253 CB LEU A 34 2.511 1.159 1.776 1.00 0.00 C ATOM 254 CG LEU A 34 1.998 2.445 1.127 1.00 0.00 C ATOM 255 CD1 LEU A 34 0.600 2.776 1.627 1.00 0.00 C ATOM 256 CD2 LEU A 34 2.952 3.598 1.403 1.00 0.00 C ATOM 0 H LEU A 34 3.499 -0.657 3.696 1.00 0.00 H new ATOM 0 HA LEU A 34 2.840 2.222 3.616 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.494 0.930 1.366 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.850 0.339 1.495 1.00 0.00 H new ATOM 0 HG LEU A 34 1.948 2.290 0.049 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.252 3.694 1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.078 1.960 1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.623 2.911 2.708 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.572 4.505 0.934 1.00 0.00 H new ATOM 0 HD22 LEU A 34 3.034 3.753 2.479 1.00 0.00 H new ATOM 0 HD23 LEU A 34 3.935 3.363 0.994 1.00 0.00 H new ATOM 268 N GLY A 35 1.043 -0.521 3.972 1.00 0.00 N ATOM 269 CA GLY A 35 -0.193 -1.021 4.547 1.00 0.00 C ATOM 270 C GLY A 35 -0.057 -2.436 5.075 1.00 0.00 C ATOM 271 O GLY A 35 1.021 -3.026 5.018 1.00 0.00 O ATOM 0 H GLY A 35 1.676 -1.240 3.622 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.505 -0.363 5.358 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.979 -0.992 3.792 1.00 0.00 H new ATOM 275 N HIS A 36 -1.154 -2.983 5.591 1.00 0.00 N ATOM 276 CA HIS A 36 -1.153 -4.339 6.128 1.00 0.00 C ATOM 277 C HIS A 36 -2.479 -5.034 5.848 1.00 0.00 C ATOM 278 O HIS A 36 -3.512 -4.384 5.683 1.00 0.00 O ATOM 279 CB HIS A 36 -0.889 -4.326 7.636 1.00 0.00 C ATOM 280 CG HIS A 36 0.385 -3.642 8.022 1.00 0.00 C ATOM 281 ND1 HIS A 36 0.609 -2.296 7.826 1.00 0.00 N ATOM 282 CD2 HIS A 36 1.508 -4.127 8.602 1.00 0.00 C ATOM 283 CE1 HIS A 36 1.815 -1.983 8.267 1.00 0.00 C ATOM 284 NE2 HIS A 36 2.380 -3.076 8.744 1.00 0.00 N ATOM 0 H HIS A 36 -2.055 -2.508 5.648 1.00 0.00 H new ATOM 0 HA HIS A 36 -0.354 -4.890 5.633 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -1.722 -3.832 8.137 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -0.863 -5.353 7.999 1.00 0.00 H new ATOM 0 HD2 HIS A 36 1.685 -5.150 8.898 1.00 0.00 H new ATOM 0 HE1 HIS A 36 2.262 -1.000 8.241 1.00 0.00 H new ATOM 0 HE2 HIS A 36 3.313 -3.131 9.152 1.00 0.00 H new ATOM 293 N LEU A 37 -2.444 -6.362 5.800 1.00 0.00 N ATOM 294 CA LEU A 37 -3.642 -7.153 5.543 1.00 0.00 C ATOM 295 C LEU A 37 -3.925 -8.098 6.707 1.00 0.00 C ATOM 296 O LEU A 37 -3.108 -8.957 7.036 1.00 0.00 O ATOM 297 CB LEU A 37 -3.486 -7.954 4.249 1.00 0.00 C ATOM 298 CG LEU A 37 -2.766 -7.224 3.113 1.00 0.00 C ATOM 299 CD1 LEU A 37 -1.278 -7.537 3.136 1.00 0.00 C ATOM 300 CD2 LEU A 37 -3.371 -7.599 1.768 1.00 0.00 C ATOM 0 H LEU A 37 -1.597 -6.914 5.936 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.483 -6.468 5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.942 -8.872 4.472 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.476 -8.247 3.901 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.893 -6.151 3.259 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.783 -7.009 2.321 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.853 -7.216 4.087 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.130 -8.610 3.016 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.846 -7.070 0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.276 -8.674 1.613 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.425 -7.322 1.753 1.00 0.00 H new ATOM 312 N VAL A 38 -5.088 -7.930 7.327 1.00 0.00 N ATOM 313 CA VAL A 38 -5.480 -8.767 8.455 1.00 0.00 C ATOM 314 C VAL A 38 -6.414 -9.886 8.009 1.00 0.00 C ATOM 315 O VAL A 38 -7.476 -9.633 7.439 1.00 0.00 O ATOM 316 CB VAL A 38 -6.171 -7.940 9.556 1.00 0.00 C ATOM 317 CG1 VAL A 38 -6.435 -8.797 10.785 1.00 0.00 C ATOM 318 CG2 VAL A 38 -5.333 -6.723 9.917 1.00 0.00 C ATOM 0 H VAL A 38 -5.775 -7.222 7.068 1.00 0.00 H new ATOM 0 HA VAL A 38 -4.566 -9.201 8.860 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.130 -7.592 9.172 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -6.923 -8.194 11.551 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -7.081 -9.632 10.514 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.490 -9.179 11.172 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.838 -6.152 10.696 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -4.357 -7.047 10.279 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.202 -6.096 9.035 1.00 0.00 H new ATOM 328 N ASN A 39 -6.013 -11.125 8.273 1.00 0.00 N ATOM 329 CA ASN A 39 -6.814 -12.285 7.898 1.00 0.00 C ATOM 330 C ASN A 39 -7.809 -12.636 9.000 1.00 0.00 C ATOM 331 O ASN A 39 -7.417 -12.975 10.117 1.00 0.00 O ATOM 332 CB ASN A 39 -5.909 -13.485 7.610 1.00 0.00 C ATOM 333 CG ASN A 39 -5.631 -13.658 6.130 1.00 0.00 C ATOM 334 OD1 ASN A 39 -6.540 -13.925 5.343 1.00 0.00 O ATOM 335 ND2 ASN A 39 -4.370 -13.509 5.743 1.00 0.00 N ATOM 0 H ASN A 39 -5.138 -11.352 8.745 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.371 -12.035 6.995 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -4.966 -13.361 8.142 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -6.377 -14.390 7.997 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -4.122 -13.616 4.759 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -3.649 -13.288 6.429 1.00 0.00 H new ATOM 342 N LEU A 40 -9.095 -12.556 8.676 1.00 0.00 N ATOM 343 CA LEU A 40 -10.145 -12.869 9.639 1.00 0.00 C ATOM 344 C LEU A 40 -10.424 -14.368 9.667 1.00 0.00 C ATOM 345 O LEU A 40 -11.026 -14.916 8.745 1.00 0.00 O ATOM 346 CB LEU A 40 -11.427 -12.109 9.295 1.00 0.00 C ATOM 347 CG LEU A 40 -11.263 -10.596 9.136 1.00 0.00 C ATOM 348 CD1 LEU A 40 -12.456 -10.006 8.400 1.00 0.00 C ATOM 349 CD2 LEU A 40 -11.093 -9.935 10.495 1.00 0.00 C ATOM 0 H LEU A 40 -9.435 -12.278 7.756 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.802 -12.560 10.626 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.833 -12.514 8.368 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.164 -12.299 10.076 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.367 -10.405 8.546 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -12.323 -8.929 8.296 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.534 -10.459 7.412 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -13.367 -10.206 8.964 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -10.978 -8.859 10.364 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.972 -10.134 11.109 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.208 -10.338 10.987 1.00 0.00 H new ATOM 361 N ILE A 41 -9.984 -15.025 10.735 1.00 0.00 N ATOM 362 CA ILE A 41 -10.188 -16.459 10.890 1.00 0.00 C ATOM 363 C ILE A 41 -10.909 -16.767 12.200 1.00 0.00 C ATOM 364 O ILE A 41 -10.643 -16.134 13.223 1.00 0.00 O ATOM 365 CB ILE A 41 -8.848 -17.220 10.857 1.00 0.00 C ATOM 366 CG1 ILE A 41 -8.036 -16.820 9.623 1.00 0.00 C ATOM 367 CG2 ILE A 41 -9.089 -18.721 10.872 1.00 0.00 C ATOM 368 CD1 ILE A 41 -6.566 -16.607 9.910 1.00 0.00 C ATOM 0 H ILE A 41 -9.483 -14.585 11.507 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.803 -16.790 10.053 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.277 -16.953 11.747 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -8.141 -17.594 8.862 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -8.453 -15.904 9.205 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -8.133 -19.243 10.848 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -9.629 -18.994 11.779 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -9.678 -19.004 10.000 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -6.053 -16.326 8.990 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -6.451 -15.813 10.647 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -6.134 -17.529 10.299 1.00 0.00 H new ATOM 380 N PRO A 42 -11.837 -17.741 12.193 1.00 0.00 N ATOM 381 CA PRO A 42 -12.585 -18.111 13.394 1.00 0.00 C ATOM 382 C PRO A 42 -11.719 -18.861 14.400 1.00 0.00 C ATOM 383 O PRO A 42 -11.750 -20.089 14.471 1.00 0.00 O ATOM 384 CB PRO A 42 -13.703 -19.010 12.862 1.00 0.00 C ATOM 385 CG PRO A 42 -13.175 -19.574 11.587 1.00 0.00 C ATOM 386 CD PRO A 42 -12.226 -18.551 11.022 1.00 0.00 C ATOM 0 HA PRO A 42 -12.954 -17.238 13.932 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -13.945 -19.801 13.572 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.618 -18.443 12.693 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -12.663 -20.520 11.765 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -13.986 -19.777 10.888 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -11.360 -19.023 10.558 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.706 -17.941 10.256 1.00 0.00 H new ATOM 394 N GLY A 43 -10.942 -18.107 15.172 1.00 0.00 N ATOM 395 CA GLY A 43 -10.069 -18.707 16.163 1.00 0.00 C ATOM 396 C GLY A 43 -8.800 -17.902 16.379 1.00 0.00 C ATOM 397 O GLY A 43 -8.129 -18.052 17.400 1.00 0.00 O ATOM 0 H GLY A 43 -10.902 -17.089 15.128 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -10.604 -18.797 17.108 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.806 -19.717 15.848 1.00 0.00 H new ATOM 401 N LYS A 44 -8.474 -17.043 15.416 1.00 0.00 N ATOM 402 CA LYS A 44 -7.286 -16.207 15.500 1.00 0.00 C ATOM 403 C LYS A 44 -7.190 -15.288 14.286 1.00 0.00 C ATOM 404 O LYS A 44 -7.938 -15.440 13.322 1.00 0.00 O ATOM 405 CB LYS A 44 -6.027 -17.069 15.611 1.00 0.00 C ATOM 406 CG LYS A 44 -5.759 -17.918 14.376 1.00 0.00 C ATOM 407 CD LYS A 44 -4.480 -17.495 13.671 1.00 0.00 C ATOM 408 CE LYS A 44 -3.255 -17.752 14.535 1.00 0.00 C ATOM 409 NZ LYS A 44 -2.964 -19.207 14.669 1.00 0.00 N ATOM 0 H LYS A 44 -9.021 -16.910 14.566 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.366 -15.592 16.396 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.168 -16.422 15.790 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.120 -17.723 16.478 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.686 -18.967 14.664 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.599 -17.834 13.687 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -4.384 -18.039 12.731 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.534 -16.435 13.421 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.392 -17.248 14.100 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.411 -17.321 15.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.042 -19.335 15.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.706 -19.658 15.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.940 -19.645 13.726 1.00 0.00 H new ATOM 423 N GLU A 45 -6.269 -14.332 14.339 1.00 0.00 N ATOM 424 CA GLU A 45 -6.084 -13.391 13.240 1.00 0.00 C ATOM 425 C GLU A 45 -4.610 -13.247 12.880 1.00 0.00 C ATOM 426 O GLU A 45 -3.732 -13.469 13.714 1.00 0.00 O ATOM 427 CB GLU A 45 -6.666 -12.025 13.610 1.00 0.00 C ATOM 428 CG GLU A 45 -8.162 -12.052 13.870 1.00 0.00 C ATOM 429 CD GLU A 45 -8.741 -10.668 14.097 1.00 0.00 C ATOM 430 OE1 GLU A 45 -7.999 -9.787 14.579 1.00 0.00 O ATOM 431 OE2 GLU A 45 -9.935 -10.467 13.791 1.00 0.00 O ATOM 0 H GLU A 45 -5.640 -14.188 15.129 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.611 -13.783 12.370 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.158 -11.652 14.499 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.458 -11.321 12.805 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.666 -12.518 13.023 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.364 -12.674 14.742 1.00 0.00 H new ATOM 438 N GLN A 46 -4.345 -12.873 11.632 1.00 0.00 N ATOM 439 CA GLN A 46 -2.978 -12.697 11.158 1.00 0.00 C ATOM 440 C GLN A 46 -2.848 -11.417 10.336 1.00 0.00 C ATOM 441 O GLN A 46 -3.566 -11.225 9.354 1.00 0.00 O ATOM 442 CB GLN A 46 -2.546 -13.904 10.323 1.00 0.00 C ATOM 443 CG GLN A 46 -1.172 -14.439 10.691 1.00 0.00 C ATOM 444 CD GLN A 46 -0.048 -13.652 10.044 1.00 0.00 C ATOM 445 OE1 GLN A 46 -0.020 -13.475 8.827 1.00 0.00 O ATOM 446 NE2 GLN A 46 0.886 -13.178 10.860 1.00 0.00 N ATOM 0 H GLN A 46 -5.061 -12.686 10.930 1.00 0.00 H new ATOM 0 HA GLN A 46 -2.325 -12.615 12.027 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -3.281 -14.700 10.444 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -2.548 -13.625 9.269 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -1.053 -14.411 11.774 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -1.100 -15.484 10.389 1.00 0.00 H new ATOM 0 HE21 GLN A 46 0.821 -13.350 11.863 1.00 0.00 H new ATOM 0 HE22 GLN A 46 1.668 -12.642 10.483 1.00 0.00 H new ATOM 455 N LYS A 47 -1.930 -10.547 10.742 1.00 0.00 N ATOM 456 CA LYS A 47 -1.709 -9.287 10.042 1.00 0.00 C ATOM 457 C LYS A 47 -0.336 -9.266 9.377 1.00 0.00 C ATOM 458 O LYS A 47 0.684 -9.482 10.031 1.00 0.00 O ATOM 459 CB LYS A 47 -1.835 -8.111 11.012 1.00 0.00 C ATOM 460 CG LYS A 47 -1.907 -6.759 10.322 1.00 0.00 C ATOM 461 CD LYS A 47 -1.817 -5.616 11.322 1.00 0.00 C ATOM 462 CE LYS A 47 -0.433 -4.989 11.329 1.00 0.00 C ATOM 463 NZ LYS A 47 -0.156 -4.265 12.601 1.00 0.00 N ATOM 0 H LYS A 47 -1.327 -10.691 11.552 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.470 -9.194 9.267 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.729 -8.247 11.621 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -0.983 -8.118 11.691 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -1.096 -6.675 9.598 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -2.841 -6.683 9.765 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.560 -4.857 11.076 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.056 -5.985 12.320 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.318 -5.766 11.183 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -0.344 -4.297 10.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.798 -3.852 12.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.857 -3.507 12.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.216 -4.930 13.399 1.00 0.00 H new ATOM 477 N VAL A 48 -0.319 -9.004 8.075 1.00 0.00 N ATOM 478 CA VAL A 48 0.927 -8.954 7.321 1.00 0.00 C ATOM 479 C VAL A 48 1.124 -7.586 6.676 1.00 0.00 C ATOM 480 O VAL A 48 0.188 -7.009 6.125 1.00 0.00 O ATOM 481 CB VAL A 48 0.962 -10.037 6.223 1.00 0.00 C ATOM 482 CG1 VAL A 48 2.318 -10.057 5.533 1.00 0.00 C ATOM 483 CG2 VAL A 48 0.634 -11.401 6.810 1.00 0.00 C ATOM 0 H VAL A 48 -1.155 -8.823 7.520 1.00 0.00 H new ATOM 0 HA VAL A 48 1.734 -9.138 8.030 1.00 0.00 H new ATOM 0 HB VAL A 48 0.205 -9.796 5.476 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.323 -10.827 4.762 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.508 -9.086 5.077 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.096 -10.272 6.266 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.663 -12.153 6.022 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.366 -11.652 7.578 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.362 -11.377 7.252 1.00 0.00 H new ATOM 493 N GLU A 49 2.348 -7.074 6.750 1.00 0.00 N ATOM 494 CA GLU A 49 2.667 -5.773 6.174 1.00 0.00 C ATOM 495 C GLU A 49 2.904 -5.887 4.671 1.00 0.00 C ATOM 496 O GLU A 49 3.486 -6.863 4.197 1.00 0.00 O ATOM 497 CB GLU A 49 3.903 -5.179 6.852 1.00 0.00 C ATOM 498 CG GLU A 49 5.158 -6.019 6.672 1.00 0.00 C ATOM 499 CD GLU A 49 5.478 -6.858 7.893 1.00 0.00 C ATOM 500 OE1 GLU A 49 5.503 -6.298 9.009 1.00 0.00 O ATOM 501 OE2 GLU A 49 5.703 -8.076 7.732 1.00 0.00 O ATOM 0 H GLU A 49 3.135 -7.540 7.203 1.00 0.00 H new ATOM 0 HA GLU A 49 1.817 -5.112 6.342 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.083 -4.181 6.451 1.00 0.00 H new ATOM 0 HB3 GLU A 49 3.703 -5.063 7.917 1.00 0.00 H new ATOM 0 HG2 GLU A 49 5.032 -6.673 5.809 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.001 -5.364 6.455 1.00 0.00 H new ATOM 508 N ILE A 50 2.445 -4.886 3.926 1.00 0.00 N ATOM 509 CA ILE A 50 2.607 -4.876 2.478 1.00 0.00 C ATOM 510 C ILE A 50 3.557 -3.766 2.036 1.00 0.00 C ATOM 511 O ILE A 50 3.378 -2.601 2.395 1.00 0.00 O ATOM 512 CB ILE A 50 1.250 -4.711 1.759 1.00 0.00 C ATOM 513 CG1 ILE A 50 1.382 -5.077 0.280 1.00 0.00 C ATOM 514 CG2 ILE A 50 0.721 -3.291 1.917 1.00 0.00 C ATOM 515 CD1 ILE A 50 0.756 -6.411 -0.067 1.00 0.00 C ATOM 0 H ILE A 50 1.958 -4.072 4.302 1.00 0.00 H new ATOM 0 HA ILE A 50 3.035 -5.839 2.200 1.00 0.00 H new ATOM 0 HB ILE A 50 0.534 -5.391 2.221 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.916 -4.297 -0.323 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.438 -5.099 0.011 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -0.235 -3.200 1.402 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.586 -3.069 2.976 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.433 -2.587 1.486 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.886 -6.608 -1.131 1.00 0.00 H new ATOM 0 HD12 ILE A 50 1.238 -7.200 0.510 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.308 -6.387 0.170 1.00 0.00 H new ATOM 527 N THR A 51 4.568 -4.140 1.257 1.00 0.00 N ATOM 528 CA THR A 51 5.556 -3.189 0.762 1.00 0.00 C ATOM 529 C THR A 51 5.208 -2.727 -0.651 1.00 0.00 C ATOM 530 O THR A 51 4.345 -3.309 -1.310 1.00 0.00 O ATOM 531 CB THR A 51 6.949 -3.828 0.766 1.00 0.00 C ATOM 532 OG1 THR A 51 6.854 -5.237 0.860 1.00 0.00 O ATOM 533 CG2 THR A 51 7.823 -3.352 1.904 1.00 0.00 C ATOM 0 H THR A 51 4.724 -5.101 0.954 1.00 0.00 H new ATOM 0 HA THR A 51 5.552 -2.322 1.422 1.00 0.00 H new ATOM 0 HB THR A 51 7.408 -3.524 -0.175 1.00 0.00 H new ATOM 0 HG1 THR A 51 7.753 -5.626 0.859 1.00 0.00 H new ATOM 0 HG21 THR A 51 8.794 -3.844 1.847 1.00 0.00 H new ATOM 0 HG22 THR A 51 7.958 -2.273 1.832 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.348 -3.596 2.854 1.00 0.00 H new ATOM 541 N ASN A 52 5.892 -1.685 -1.110 1.00 0.00 N ATOM 542 CA ASN A 52 5.664 -1.148 -2.446 1.00 0.00 C ATOM 543 C ASN A 52 6.616 -1.794 -3.448 1.00 0.00 C ATOM 544 O ASN A 52 7.563 -1.163 -3.920 1.00 0.00 O ATOM 545 CB ASN A 52 5.850 0.371 -2.449 1.00 0.00 C ATOM 546 CG ASN A 52 4.619 1.105 -1.952 1.00 0.00 C ATOM 547 OD1 ASN A 52 4.717 1.691 -0.765 1.00 0.00 O flip ATOM 548 ND2 ASN A 52 3.592 1.144 -2.629 1.00 0.00 N flip ATOM 0 H ASN A 52 6.610 -1.195 -0.576 1.00 0.00 H new ATOM 0 HA ASN A 52 4.639 -1.376 -2.739 1.00 0.00 H new ATOM 0 HB2 ASN A 52 6.703 0.631 -1.822 1.00 0.00 H new ATOM 0 HB3 ASN A 52 6.085 0.704 -3.460 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.561 0.679 -3.536 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.772 1.641 -2.283 1.00 0.00 H new ATOM 555 N ARG A 53 6.358 -3.058 -3.763 1.00 0.00 N ATOM 556 CA ARG A 53 7.193 -3.800 -4.705 1.00 0.00 C ATOM 557 C ARG A 53 6.574 -3.843 -6.089 1.00 0.00 C ATOM 558 O ARG A 53 7.001 -4.626 -6.937 1.00 0.00 O ATOM 559 CB ARG A 53 7.458 -5.227 -4.205 1.00 0.00 C ATOM 560 CG ARG A 53 6.426 -5.747 -3.214 1.00 0.00 C ATOM 561 CD ARG A 53 6.824 -7.105 -2.659 1.00 0.00 C ATOM 562 NE ARG A 53 8.077 -7.043 -1.910 1.00 0.00 N ATOM 563 CZ ARG A 53 8.505 -8.009 -1.101 1.00 0.00 C ATOM 564 NH1 ARG A 53 7.788 -9.113 -0.937 1.00 0.00 N ATOM 565 NH2 ARG A 53 9.655 -7.871 -0.454 1.00 0.00 N ATOM 0 H ARG A 53 5.578 -3.592 -3.381 1.00 0.00 H new ATOM 0 HA ARG A 53 8.143 -3.270 -4.773 1.00 0.00 H new ATOM 0 HB2 ARG A 53 7.492 -5.899 -5.062 1.00 0.00 H new ATOM 0 HB3 ARG A 53 8.442 -5.258 -3.737 1.00 0.00 H new ATOM 0 HG2 ARG A 53 6.315 -5.036 -2.395 1.00 0.00 H new ATOM 0 HG3 ARG A 53 5.455 -5.823 -3.704 1.00 0.00 H new ATOM 0 HD2 ARG A 53 6.032 -7.478 -2.010 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.926 -7.816 -3.479 1.00 0.00 H new ATOM 0 HE ARG A 53 8.658 -6.211 -2.013 1.00 0.00 H new ATOM 0 HH11 ARG A 53 6.903 -9.225 -1.432 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.121 -9.850 -0.316 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.211 -7.025 -0.577 1.00 0.00 H new ATOM 0 HH22 ARG A 53 9.983 -8.611 0.166 1.00 0.00 H new ATOM 579 N ASN A 54 5.566 -3.009 -6.326 1.00 0.00 N ATOM 580 CA ASN A 54 4.901 -2.981 -7.620 1.00 0.00 C ATOM 581 C ASN A 54 4.114 -4.267 -7.845 1.00 0.00 C ATOM 582 O ASN A 54 3.094 -4.261 -8.531 1.00 0.00 O ATOM 583 CB ASN A 54 5.920 -2.784 -8.746 1.00 0.00 C ATOM 584 CG ASN A 54 6.916 -1.683 -8.440 1.00 0.00 C ATOM 585 OD1 ASN A 54 6.690 -0.853 -7.559 1.00 0.00 O ATOM 586 ND2 ASN A 54 8.025 -1.668 -9.171 1.00 0.00 N ATOM 0 H ASN A 54 5.195 -2.349 -5.643 1.00 0.00 H new ATOM 0 HA ASN A 54 4.207 -2.140 -7.627 1.00 0.00 H new ATOM 0 HB2 ASN A 54 6.456 -3.718 -8.914 1.00 0.00 H new ATOM 0 HB3 ASN A 54 5.394 -2.547 -9.671 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.731 -0.949 -9.012 1.00 0.00 H new ATOM 0 HD22 ASN A 54 8.171 -2.376 -9.891 1.00 0.00 H new ATOM 593 N VAL A 55 4.593 -5.371 -7.268 1.00 0.00 N ATOM 594 CA VAL A 55 3.921 -6.653 -7.418 1.00 0.00 C ATOM 595 C VAL A 55 3.867 -7.423 -6.100 1.00 0.00 C ATOM 596 O VAL A 55 4.861 -7.519 -5.380 1.00 0.00 O ATOM 597 CB VAL A 55 4.620 -7.525 -8.472 1.00 0.00 C ATOM 598 CG1 VAL A 55 3.897 -8.858 -8.632 1.00 0.00 C ATOM 599 CG2 VAL A 55 4.707 -6.790 -9.800 1.00 0.00 C ATOM 0 H VAL A 55 5.438 -5.399 -6.697 1.00 0.00 H new ATOM 0 HA VAL A 55 2.904 -6.433 -7.741 1.00 0.00 H new ATOM 0 HB VAL A 55 5.635 -7.731 -8.132 1.00 0.00 H new ATOM 0 HG11 VAL A 55 4.408 -9.461 -9.383 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.897 -9.388 -7.680 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.869 -8.679 -8.948 1.00 0.00 H new ATOM 0 HG21 VAL A 55 5.205 -7.423 -10.534 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.703 -6.550 -10.149 1.00 0.00 H new ATOM 0 HG23 VAL A 55 5.276 -5.869 -9.670 1.00 0.00 H new ATOM 609 N THR A 56 2.699 -7.981 -5.807 1.00 0.00 N ATOM 610 CA THR A 56 2.495 -8.762 -4.593 1.00 0.00 C ATOM 611 C THR A 56 1.948 -10.143 -4.949 1.00 0.00 C ATOM 612 O THR A 56 0.994 -10.257 -5.719 1.00 0.00 O ATOM 613 CB THR A 56 1.535 -8.028 -3.651 1.00 0.00 C ATOM 614 OG1 THR A 56 2.111 -6.814 -3.202 1.00 0.00 O ATOM 615 CG2 THR A 56 1.149 -8.828 -2.423 1.00 0.00 C ATOM 0 H THR A 56 1.872 -7.906 -6.399 1.00 0.00 H new ATOM 0 HA THR A 56 3.450 -8.887 -4.083 1.00 0.00 H new ATOM 0 HB THR A 56 0.636 -7.855 -4.243 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.909 -7.009 -2.667 1.00 0.00 H new ATOM 0 HG21 THR A 56 0.468 -8.242 -1.806 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.657 -9.751 -2.730 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.044 -9.068 -1.849 1.00 0.00 H new ATOM 623 N THR A 57 2.556 -11.192 -4.400 1.00 0.00 N ATOM 624 CA THR A 57 2.114 -12.555 -4.690 1.00 0.00 C ATOM 625 C THR A 57 1.355 -13.161 -3.511 1.00 0.00 C ATOM 626 O THR A 57 1.712 -12.955 -2.353 1.00 0.00 O ATOM 627 CB THR A 57 3.315 -13.431 -5.051 1.00 0.00 C ATOM 628 OG1 THR A 57 4.521 -12.840 -4.600 1.00 0.00 O ATOM 629 CG2 THR A 57 3.452 -13.672 -6.539 1.00 0.00 C ATOM 0 H THR A 57 3.347 -11.127 -3.759 1.00 0.00 H new ATOM 0 HA THR A 57 1.431 -12.512 -5.539 1.00 0.00 H new ATOM 0 HB THR A 57 3.135 -14.386 -4.558 1.00 0.00 H new ATOM 0 HG1 THR A 57 5.284 -13.328 -4.974 1.00 0.00 H new ATOM 0 HG21 THR A 57 4.323 -14.300 -6.727 1.00 0.00 H new ATOM 0 HG22 THR A 57 2.557 -14.171 -6.911 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.575 -12.718 -7.052 1.00 0.00 H new ATOM 637 N ILE A 58 0.303 -13.916 -3.820 1.00 0.00 N ATOM 638 CA ILE A 58 -0.505 -14.560 -2.790 1.00 0.00 C ATOM 639 C ILE A 58 -0.748 -16.028 -3.124 1.00 0.00 C ATOM 640 O ILE A 58 -1.229 -16.355 -4.210 1.00 0.00 O ATOM 641 CB ILE A 58 -1.862 -13.851 -2.609 1.00 0.00 C ATOM 642 CG1 ILE A 58 -1.652 -12.356 -2.371 1.00 0.00 C ATOM 643 CG2 ILE A 58 -2.638 -14.469 -1.456 1.00 0.00 C ATOM 644 CD1 ILE A 58 -1.556 -11.550 -3.647 1.00 0.00 C ATOM 0 H ILE A 58 -0.009 -14.096 -4.774 1.00 0.00 H new ATOM 0 HA ILE A 58 0.056 -14.489 -1.858 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.444 -13.979 -3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.476 -11.973 -1.770 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.740 -12.213 -1.791 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.593 -13.956 -1.343 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.816 -15.525 -1.661 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.062 -14.370 -0.536 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -1.407 -10.498 -3.403 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.714 -11.907 -4.240 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.477 -11.663 -4.219 1.00 0.00 H new ATOM 656 N GLY A 59 -0.416 -16.909 -2.183 1.00 0.00 N ATOM 657 CA GLY A 59 -0.610 -18.331 -2.400 1.00 0.00 C ATOM 658 C GLY A 59 0.119 -19.190 -1.384 1.00 0.00 C ATOM 659 O GLY A 59 0.003 -18.973 -0.176 1.00 0.00 O ATOM 0 H GLY A 59 -0.017 -16.663 -1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.676 -18.557 -2.361 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -0.266 -18.591 -3.401 1.00 0.00 H new ATOM 663 N ARG A 60 0.868 -20.174 -1.882 1.00 0.00 N ATOM 664 CA ARG A 60 1.620 -21.085 -1.025 1.00 0.00 C ATOM 665 C ARG A 60 3.123 -20.872 -1.180 1.00 0.00 C ATOM 666 O ARG A 60 3.886 -21.057 -0.231 1.00 0.00 O ATOM 667 CB ARG A 60 1.278 -22.538 -1.367 1.00 0.00 C ATOM 668 CG ARG A 60 1.372 -23.482 -0.181 1.00 0.00 C ATOM 669 CD ARG A 60 1.634 -24.913 -0.628 1.00 0.00 C ATOM 670 NE ARG A 60 2.583 -25.595 0.250 1.00 0.00 N ATOM 671 CZ ARG A 60 3.858 -25.234 0.387 1.00 0.00 C ATOM 672 NH1 ARG A 60 4.340 -24.200 -0.290 1.00 0.00 N ATOM 673 NH2 ARG A 60 4.654 -25.911 1.204 1.00 0.00 N ATOM 0 H ARG A 60 0.969 -20.359 -2.880 1.00 0.00 H new ATOM 0 HA ARG A 60 1.341 -20.876 0.008 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.267 -22.578 -1.773 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.951 -22.886 -2.151 1.00 0.00 H new ATOM 0 HG2 ARG A 60 2.172 -23.155 0.484 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.445 -23.442 0.392 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.694 -25.465 -0.645 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.021 -24.910 -1.647 1.00 0.00 H new ATOM 0 HE ARG A 60 2.250 -26.394 0.789 1.00 0.00 H new ATOM 0 HH11 ARG A 60 3.733 -23.676 -0.920 1.00 0.00 H new ATOM 0 HH12 ARG A 60 5.317 -23.929 -0.180 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.290 -26.707 1.727 1.00 0.00 H new ATOM 0 HH22 ARG A 60 5.630 -25.635 1.309 1.00 0.00 H new ATOM 687 N SER A 61 3.541 -20.492 -2.386 1.00 0.00 N ATOM 688 CA SER A 61 4.955 -20.262 -2.681 1.00 0.00 C ATOM 689 C SER A 61 5.649 -19.507 -1.549 1.00 0.00 C ATOM 690 O SER A 61 5.040 -18.676 -0.875 1.00 0.00 O ATOM 691 CB SER A 61 5.102 -19.489 -3.993 1.00 0.00 C ATOM 692 OG SER A 61 5.832 -20.240 -4.948 1.00 0.00 O ATOM 0 H SER A 61 2.918 -20.336 -3.178 1.00 0.00 H new ATOM 0 HA SER A 61 5.436 -21.235 -2.779 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.116 -19.250 -4.390 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.608 -18.542 -3.806 1.00 0.00 H new ATOM 0 HG SER A 61 5.575 -21.184 -4.888 1.00 0.00 H new ATOM 698 N ARG A 62 6.927 -19.809 -1.347 1.00 0.00 N ATOM 699 CA ARG A 62 7.709 -19.167 -0.298 1.00 0.00 C ATOM 700 C ARG A 62 8.036 -17.723 -0.669 1.00 0.00 C ATOM 701 O ARG A 62 8.134 -16.855 0.199 1.00 0.00 O ATOM 702 CB ARG A 62 9.001 -19.947 -0.049 1.00 0.00 C ATOM 703 CG ARG A 62 9.727 -19.536 1.221 1.00 0.00 C ATOM 704 CD ARG A 62 10.944 -20.410 1.474 1.00 0.00 C ATOM 705 NE ARG A 62 10.612 -21.832 1.452 1.00 0.00 N ATOM 706 CZ ARG A 62 9.940 -22.451 2.419 1.00 0.00 C ATOM 707 NH1 ARG A 62 9.528 -21.778 3.487 1.00 0.00 N ATOM 708 NH2 ARG A 62 9.678 -23.747 2.319 1.00 0.00 N ATOM 0 H ARG A 62 7.443 -20.495 -1.897 1.00 0.00 H new ATOM 0 HA ARG A 62 7.113 -19.162 0.615 1.00 0.00 H new ATOM 0 HB2 ARG A 62 8.768 -21.011 0.004 1.00 0.00 H new ATOM 0 HB3 ARG A 62 9.668 -19.808 -0.900 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.036 -18.494 1.144 1.00 0.00 H new ATOM 0 HG3 ARG A 62 9.046 -19.604 2.069 1.00 0.00 H new ATOM 0 HD2 ARG A 62 11.702 -20.203 0.718 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.379 -20.154 2.440 1.00 0.00 H new ATOM 0 HE ARG A 62 10.913 -22.383 0.648 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.726 -20.781 3.569 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.013 -22.258 4.225 1.00 0.00 H new ATOM 0 HH21 ARG A 62 9.992 -24.269 1.501 1.00 0.00 H new ATOM 0 HH22 ARG A 62 9.163 -24.222 3.060 1.00 0.00 H new ATOM 722 N SER A 63 8.207 -17.475 -1.963 1.00 0.00 N ATOM 723 CA SER A 63 8.526 -16.137 -2.452 1.00 0.00 C ATOM 724 C SER A 63 7.285 -15.246 -2.485 1.00 0.00 C ATOM 725 O SER A 63 7.394 -14.024 -2.583 1.00 0.00 O ATOM 726 CB SER A 63 9.144 -16.219 -3.849 1.00 0.00 C ATOM 727 OG SER A 63 9.831 -17.446 -4.032 1.00 0.00 O ATOM 0 H SER A 63 8.130 -18.183 -2.693 1.00 0.00 H new ATOM 0 HA SER A 63 9.245 -15.693 -1.764 1.00 0.00 H new ATOM 0 HB2 SER A 63 8.362 -16.120 -4.602 1.00 0.00 H new ATOM 0 HB3 SER A 63 9.833 -15.387 -3.994 1.00 0.00 H new ATOM 0 HG SER A 63 10.215 -17.474 -4.933 1.00 0.00 H new ATOM 733 N CYS A 64 6.107 -15.861 -2.405 1.00 0.00 N ATOM 734 CA CYS A 64 4.851 -15.116 -2.429 1.00 0.00 C ATOM 735 C CYS A 64 4.845 -14.015 -1.372 1.00 0.00 C ATOM 736 O CYS A 64 5.493 -14.137 -0.333 1.00 0.00 O ATOM 737 CB CYS A 64 3.669 -16.061 -2.202 1.00 0.00 C ATOM 738 SG CYS A 64 3.108 -16.913 -3.694 1.00 0.00 S ATOM 0 H CYS A 64 5.996 -16.872 -2.323 1.00 0.00 H new ATOM 0 HA CYS A 64 4.755 -14.651 -3.410 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.950 -16.804 -1.456 1.00 0.00 H new ATOM 0 HB3 CYS A 64 2.837 -15.492 -1.787 1.00 0.00 H new ATOM 0 HG CYS A 64 2.108 -17.690 -3.400 1.00 0.00 H new ATOM 744 N ASP A 65 4.108 -12.940 -1.643 1.00 0.00 N ATOM 745 CA ASP A 65 4.022 -11.824 -0.709 1.00 0.00 C ATOM 746 C ASP A 65 3.256 -12.226 0.544 1.00 0.00 C ATOM 747 O ASP A 65 3.757 -12.100 1.661 1.00 0.00 O ATOM 748 CB ASP A 65 3.340 -10.622 -1.357 1.00 0.00 C ATOM 749 CG ASP A 65 4.332 -9.673 -1.998 1.00 0.00 C ATOM 750 OD1 ASP A 65 5.380 -10.149 -2.483 1.00 0.00 O ATOM 751 OD2 ASP A 65 4.064 -8.453 -2.012 1.00 0.00 O ATOM 0 H ASP A 65 3.565 -12.820 -2.498 1.00 0.00 H new ATOM 0 HA ASP A 65 5.039 -11.548 -0.432 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.635 -10.971 -2.112 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.762 -10.086 -0.604 1.00 0.00 H new ATOM 756 N VAL A 66 2.032 -12.706 0.345 1.00 0.00 N ATOM 757 CA VAL A 66 1.184 -13.123 1.455 1.00 0.00 C ATOM 758 C VAL A 66 0.719 -14.566 1.287 1.00 0.00 C ATOM 759 O VAL A 66 0.150 -14.931 0.260 1.00 0.00 O ATOM 760 CB VAL A 66 -0.052 -12.213 1.587 1.00 0.00 C ATOM 761 CG1 VAL A 66 -0.819 -12.535 2.861 1.00 0.00 C ATOM 762 CG2 VAL A 66 0.358 -10.748 1.558 1.00 0.00 C ATOM 0 H VAL A 66 1.606 -12.816 -0.575 1.00 0.00 H new ATOM 0 HA VAL A 66 1.788 -13.043 2.359 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.710 -12.399 0.738 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.689 -11.882 2.937 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.147 -13.574 2.836 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.172 -12.379 3.724 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.528 -10.120 1.652 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.037 -10.544 2.386 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.859 -10.529 0.615 1.00 0.00 H new ATOM 772 N ILE A 67 0.961 -15.379 2.308 1.00 0.00 N ATOM 773 CA ILE A 67 0.561 -16.780 2.275 1.00 0.00 C ATOM 774 C ILE A 67 -0.750 -16.989 3.021 1.00 0.00 C ATOM 775 O ILE A 67 -0.860 -16.666 4.205 1.00 0.00 O ATOM 776 CB ILE A 67 1.641 -17.693 2.886 1.00 0.00 C ATOM 777 CG1 ILE A 67 2.124 -17.130 4.224 1.00 0.00 C ATOM 778 CG2 ILE A 67 2.807 -17.853 1.921 1.00 0.00 C ATOM 779 CD1 ILE A 67 2.990 -18.093 5.008 1.00 0.00 C ATOM 0 H ILE A 67 1.431 -15.093 3.167 1.00 0.00 H new ATOM 0 HA ILE A 67 0.429 -17.047 1.226 1.00 0.00 H new ATOM 0 HB ILE A 67 1.204 -18.675 3.065 1.00 0.00 H new ATOM 0 HG12 ILE A 67 2.686 -16.214 4.042 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.259 -16.858 4.828 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.562 -18.501 2.367 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.451 -18.297 0.991 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.244 -16.876 1.713 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.296 -17.627 5.945 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.424 -19.000 5.221 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.874 -18.346 4.423 1.00 0.00 H new ATOM 791 N LEU A 68 -1.744 -17.530 2.326 1.00 0.00 N ATOM 792 CA LEU A 68 -3.048 -17.779 2.931 1.00 0.00 C ATOM 793 C LEU A 68 -3.044 -19.122 3.671 1.00 0.00 C ATOM 794 O LEU A 68 -2.248 -19.317 4.588 1.00 0.00 O ATOM 795 CB LEU A 68 -4.144 -17.735 1.861 1.00 0.00 C ATOM 796 CG LEU A 68 -4.223 -16.429 1.069 1.00 0.00 C ATOM 797 CD1 LEU A 68 -5.112 -16.599 -0.153 1.00 0.00 C ATOM 798 CD2 LEU A 68 -4.736 -15.301 1.951 1.00 0.00 C ATOM 0 H LEU A 68 -1.673 -17.804 1.346 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.258 -16.996 3.660 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.982 -18.556 1.163 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.107 -17.910 2.341 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.220 -16.171 0.730 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.156 -15.660 -0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.702 -17.378 -0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -6.116 -16.881 0.164 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.786 -14.379 1.371 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.730 -15.551 2.320 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.060 -15.163 2.795 1.00 0.00 H new ATOM 810 N SER A 69 -3.918 -20.052 3.275 1.00 0.00 N ATOM 811 CA SER A 69 -3.968 -21.357 3.922 1.00 0.00 C ATOM 812 C SER A 69 -2.598 -22.035 3.845 1.00 0.00 C ATOM 813 O SER A 69 -1.721 -21.739 4.654 1.00 0.00 O ATOM 814 CB SER A 69 -5.050 -22.233 3.279 1.00 0.00 C ATOM 815 OG SER A 69 -6.304 -22.042 3.913 1.00 0.00 O ATOM 0 H SER A 69 -4.591 -19.924 2.519 1.00 0.00 H new ATOM 0 HA SER A 69 -4.225 -21.220 4.972 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.134 -21.993 2.219 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.761 -23.282 3.346 1.00 0.00 H new ATOM 0 HG SER A 69 -6.743 -21.250 3.538 1.00 0.00 H new ATOM 821 N GLU A 70 -2.414 -22.923 2.858 1.00 0.00 N ATOM 822 CA GLU A 70 -1.141 -23.626 2.659 1.00 0.00 C ATOM 823 C GLU A 70 -1.355 -24.958 1.937 1.00 0.00 C ATOM 824 O GLU A 70 -0.913 -25.134 0.804 1.00 0.00 O ATOM 825 CB GLU A 70 -0.413 -23.876 3.987 1.00 0.00 C ATOM 826 CG GLU A 70 0.726 -22.900 4.249 1.00 0.00 C ATOM 827 CD GLU A 70 1.926 -23.150 3.358 1.00 0.00 C ATOM 828 OE1 GLU A 70 2.562 -24.216 3.503 1.00 0.00 O ATOM 829 OE2 GLU A 70 2.232 -22.280 2.517 1.00 0.00 O ATOM 0 H GLU A 70 -3.136 -23.172 2.182 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.519 -22.978 2.041 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.132 -23.811 4.804 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -0.018 -24.892 3.990 1.00 0.00 H new ATOM 0 HG2 GLU A 70 0.369 -21.882 4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 70 1.031 -22.976 5.293 1.00 0.00 H new ATOM 836 N PRO A 71 -2.028 -25.921 2.592 1.00 0.00 N ATOM 837 CA PRO A 71 -2.278 -27.244 2.007 1.00 0.00 C ATOM 838 C PRO A 71 -3.232 -27.210 0.816 1.00 0.00 C ATOM 839 O PRO A 71 -3.277 -28.153 0.026 1.00 0.00 O ATOM 840 CB PRO A 71 -2.900 -28.035 3.162 1.00 0.00 C ATOM 841 CG PRO A 71 -3.487 -27.002 4.059 1.00 0.00 C ATOM 842 CD PRO A 71 -2.585 -25.806 3.952 1.00 0.00 C ATOM 0 HA PRO A 71 -1.360 -27.678 1.610 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -3.663 -28.726 2.803 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -2.150 -28.631 3.682 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -4.504 -26.753 3.756 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.540 -27.361 5.087 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -3.135 -24.874 4.084 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.802 -25.824 4.710 1.00 0.00 H new ATOM 850 N ASP A 72 -4.003 -26.134 0.690 1.00 0.00 N ATOM 851 CA ASP A 72 -4.957 -26.019 -0.409 1.00 0.00 C ATOM 852 C ASP A 72 -4.927 -24.633 -1.047 1.00 0.00 C ATOM 853 O ASP A 72 -5.915 -24.196 -1.638 1.00 0.00 O ATOM 854 CB ASP A 72 -6.370 -26.329 0.086 1.00 0.00 C ATOM 855 CG ASP A 72 -6.786 -25.441 1.241 1.00 0.00 C ATOM 856 OD1 ASP A 72 -7.126 -24.264 0.993 1.00 0.00 O ATOM 857 OD2 ASP A 72 -6.773 -25.921 2.394 1.00 0.00 O ATOM 0 H ASP A 72 -3.987 -25.338 1.327 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.667 -26.743 -1.170 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -7.075 -26.205 -0.736 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -6.422 -27.373 0.397 1.00 0.00 H new ATOM 862 N ILE A 73 -3.798 -23.943 -0.933 1.00 0.00 N ATOM 863 CA ILE A 73 -3.665 -22.614 -1.509 1.00 0.00 C ATOM 864 C ILE A 73 -2.815 -22.636 -2.775 1.00 0.00 C ATOM 865 O ILE A 73 -1.680 -23.112 -2.770 1.00 0.00 O ATOM 866 CB ILE A 73 -3.081 -21.612 -0.488 1.00 0.00 C ATOM 867 CG1 ILE A 73 -3.580 -20.205 -0.798 1.00 0.00 C ATOM 868 CG2 ILE A 73 -1.559 -21.654 -0.472 1.00 0.00 C ATOM 869 CD1 ILE A 73 -5.049 -20.017 -0.492 1.00 0.00 C ATOM 0 H ILE A 73 -2.966 -24.281 -0.449 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.668 -22.282 -1.778 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.424 -21.899 0.506 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.000 -19.485 -0.222 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -3.403 -19.987 -1.851 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.183 -20.937 0.257 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.225 -22.656 -0.201 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.178 -21.400 -1.461 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.343 -18.996 -0.734 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.637 -20.715 -1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -5.227 -20.205 0.567 1.00 0.00 H new ATOM 881 N SER A 74 -3.384 -22.124 -3.860 1.00 0.00 N ATOM 882 CA SER A 74 -2.696 -22.084 -5.141 1.00 0.00 C ATOM 883 C SER A 74 -1.489 -21.154 -5.090 1.00 0.00 C ATOM 884 O SER A 74 -1.556 -20.059 -4.532 1.00 0.00 O ATOM 885 CB SER A 74 -3.654 -21.631 -6.245 1.00 0.00 C ATOM 886 OG SER A 74 -4.462 -22.706 -6.692 1.00 0.00 O ATOM 0 H SER A 74 -4.325 -21.730 -3.876 1.00 0.00 H new ATOM 0 HA SER A 74 -2.344 -23.092 -5.362 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.288 -20.826 -5.873 1.00 0.00 H new ATOM 0 HB3 SER A 74 -3.084 -21.228 -7.082 1.00 0.00 H new ATOM 0 HG SER A 74 -5.066 -22.390 -7.396 1.00 0.00 H new ATOM 892 N THR A 75 -0.389 -21.601 -5.676 1.00 0.00 N ATOM 893 CA THR A 75 0.841 -20.816 -5.707 1.00 0.00 C ATOM 894 C THR A 75 0.662 -19.559 -6.555 1.00 0.00 C ATOM 895 O THR A 75 1.159 -18.487 -6.209 1.00 0.00 O ATOM 896 CB THR A 75 1.995 -21.655 -6.258 1.00 0.00 C ATOM 897 OG1 THR A 75 2.206 -22.805 -5.458 1.00 0.00 O ATOM 898 CG2 THR A 75 3.304 -20.899 -6.330 1.00 0.00 C ATOM 0 H THR A 75 -0.320 -22.507 -6.139 1.00 0.00 H new ATOM 0 HA THR A 75 1.076 -20.516 -4.686 1.00 0.00 H new ATOM 0 HB THR A 75 1.696 -21.928 -7.270 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.947 -23.329 -5.828 1.00 0.00 H new ATOM 0 HG21 THR A 75 4.080 -21.552 -6.729 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.188 -20.033 -6.981 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.588 -20.567 -5.331 1.00 0.00 H new ATOM 906 N PHE A 76 -0.051 -19.701 -7.666 1.00 0.00 N ATOM 907 CA PHE A 76 -0.300 -18.583 -8.572 1.00 0.00 C ATOM 908 C PHE A 76 -1.654 -17.946 -8.318 1.00 0.00 C ATOM 909 O PHE A 76 -2.160 -17.177 -9.135 1.00 0.00 O ATOM 910 CB PHE A 76 -0.175 -19.022 -10.033 1.00 0.00 C ATOM 911 CG PHE A 76 1.197 -18.814 -10.607 1.00 0.00 C ATOM 912 CD1 PHE A 76 2.257 -19.615 -10.211 1.00 0.00 C ATOM 913 CD2 PHE A 76 1.427 -17.818 -11.543 1.00 0.00 C ATOM 914 CE1 PHE A 76 3.521 -19.425 -10.738 1.00 0.00 C ATOM 915 CE2 PHE A 76 2.688 -17.624 -12.073 1.00 0.00 C ATOM 916 CZ PHE A 76 3.737 -18.429 -11.670 1.00 0.00 C ATOM 0 H PHE A 76 -0.469 -20.583 -7.963 1.00 0.00 H new ATOM 0 HA PHE A 76 0.462 -17.830 -8.373 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -0.436 -20.077 -10.110 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.898 -18.470 -10.633 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.094 -20.396 -9.483 1.00 0.00 H new ATOM 0 HD2 PHE A 76 0.611 -17.186 -11.862 1.00 0.00 H new ATOM 0 HE1 PHE A 76 4.339 -20.055 -10.421 1.00 0.00 H new ATOM 0 HE2 PHE A 76 2.854 -16.844 -12.801 1.00 0.00 H new ATOM 0 HZ PHE A 76 4.724 -18.279 -12.083 1.00 0.00 H new ATOM 926 N HIS A 77 -2.227 -18.297 -7.183 1.00 0.00 N ATOM 927 CA HIS A 77 -3.541 -17.803 -6.759 1.00 0.00 C ATOM 928 C HIS A 77 -3.877 -16.439 -7.360 1.00 0.00 C ATOM 929 O HIS A 77 -4.772 -16.327 -8.197 1.00 0.00 O ATOM 930 CB HIS A 77 -3.613 -17.719 -5.234 1.00 0.00 C ATOM 931 CG HIS A 77 -4.949 -18.107 -4.681 1.00 0.00 C ATOM 932 ND1 HIS A 77 -5.146 -18.471 -3.367 1.00 0.00 N ATOM 933 CD2 HIS A 77 -6.163 -18.188 -5.278 1.00 0.00 C ATOM 934 CE1 HIS A 77 -6.422 -18.759 -3.178 1.00 0.00 C ATOM 935 NE2 HIS A 77 -7.060 -18.594 -4.323 1.00 0.00 N ATOM 0 H HIS A 77 -1.797 -18.939 -6.517 1.00 0.00 H new ATOM 0 HA HIS A 77 -4.277 -18.518 -7.127 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -2.848 -18.367 -4.805 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -3.380 -16.701 -4.922 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -6.383 -17.973 -6.313 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -6.867 -19.075 -2.246 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -8.058 -18.744 -4.473 1.00 0.00 H new ATOM 944 N ALA A 78 -3.165 -15.403 -6.926 1.00 0.00 N ATOM 945 CA ALA A 78 -3.418 -14.058 -7.432 1.00 0.00 C ATOM 946 C ALA A 78 -2.199 -13.154 -7.296 1.00 0.00 C ATOM 947 O ALA A 78 -1.305 -13.406 -6.487 1.00 0.00 O ATOM 948 CB ALA A 78 -4.605 -13.444 -6.708 1.00 0.00 C ATOM 0 H ALA A 78 -2.418 -15.467 -6.234 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.642 -14.146 -8.495 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -4.786 -12.440 -7.092 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -5.489 -14.060 -6.871 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.392 -13.391 -5.640 1.00 0.00 H new ATOM 954 N GLU A 79 -2.186 -12.087 -8.090 1.00 0.00 N ATOM 955 CA GLU A 79 -1.100 -11.116 -8.068 1.00 0.00 C ATOM 956 C GLU A 79 -1.663 -9.710 -7.887 1.00 0.00 C ATOM 957 O GLU A 79 -2.623 -9.329 -8.556 1.00 0.00 O ATOM 958 CB GLU A 79 -0.283 -11.199 -9.361 1.00 0.00 C ATOM 959 CG GLU A 79 1.076 -11.852 -9.180 1.00 0.00 C ATOM 960 CD GLU A 79 0.995 -13.366 -9.131 1.00 0.00 C ATOM 961 OE1 GLU A 79 0.548 -13.903 -8.095 1.00 0.00 O ATOM 962 OE2 GLU A 79 1.376 -14.013 -10.128 1.00 0.00 O ATOM 0 H GLU A 79 -2.923 -11.873 -8.762 1.00 0.00 H new ATOM 0 HA GLU A 79 -0.442 -11.344 -7.229 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.850 -11.760 -10.104 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.144 -10.194 -9.758 1.00 0.00 H new ATOM 0 HG2 GLU A 79 1.730 -11.553 -9.999 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.531 -11.486 -8.259 1.00 0.00 H new ATOM 969 N PHE A 80 -1.071 -8.945 -6.977 1.00 0.00 N ATOM 970 CA PHE A 80 -1.534 -7.586 -6.713 1.00 0.00 C ATOM 971 C PHE A 80 -0.437 -6.569 -6.998 1.00 0.00 C ATOM 972 O PHE A 80 0.680 -6.695 -6.506 1.00 0.00 O ATOM 973 CB PHE A 80 -2.005 -7.458 -5.264 1.00 0.00 C ATOM 974 CG PHE A 80 -3.282 -8.197 -4.984 1.00 0.00 C ATOM 975 CD1 PHE A 80 -3.350 -9.572 -5.137 1.00 0.00 C ATOM 976 CD2 PHE A 80 -4.415 -7.516 -4.567 1.00 0.00 C ATOM 977 CE1 PHE A 80 -4.523 -10.256 -4.880 1.00 0.00 C ATOM 978 CE2 PHE A 80 -5.592 -8.194 -4.308 1.00 0.00 C ATOM 979 CZ PHE A 80 -5.645 -9.565 -4.465 1.00 0.00 C ATOM 0 H PHE A 80 -0.274 -9.239 -6.412 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.372 -7.380 -7.379 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -1.225 -7.833 -4.602 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -2.145 -6.403 -5.027 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -2.475 -10.116 -5.461 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -4.378 -6.444 -4.443 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -4.562 -11.328 -5.003 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -6.468 -7.652 -3.984 1.00 0.00 H new ATOM 0 HZ PHE A 80 -6.563 -10.097 -4.263 1.00 0.00 H new ATOM 989 N HIS A 81 -0.762 -5.557 -7.793 1.00 0.00 N ATOM 990 CA HIS A 81 0.209 -4.525 -8.134 1.00 0.00 C ATOM 991 C HIS A 81 0.079 -3.325 -7.202 1.00 0.00 C ATOM 992 O HIS A 81 -0.950 -2.652 -7.181 1.00 0.00 O ATOM 993 CB HIS A 81 0.025 -4.082 -9.586 1.00 0.00 C ATOM 994 CG HIS A 81 0.530 -5.078 -10.583 1.00 0.00 C ATOM 995 ND1 HIS A 81 0.059 -6.298 -10.933 1.00 0.00 N flip ATOM 996 CD2 HIS A 81 1.655 -4.869 -11.353 1.00 0.00 C flip ATOM 997 CE1 HIS A 81 0.899 -6.797 -11.898 1.00 0.00 C flip ATOM 998 NE2 HIS A 81 1.854 -5.916 -12.133 1.00 0.00 N flip ATOM 0 H HIS A 81 -1.684 -5.429 -8.211 1.00 0.00 H new ATOM 0 HA HIS A 81 1.207 -4.947 -8.015 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -1.034 -3.900 -9.771 1.00 0.00 H new ATOM 0 HB3 HIS A 81 0.542 -3.135 -9.737 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.277 -3.986 -11.323 1.00 0.00 H new ATOM 0 HE1 HIS A 81 0.795 -7.755 -12.386 1.00 0.00 H new ATOM 0 HE2 HIS A 81 2.616 -6.025 -12.803 1.00 0.00 H new ATOM 1007 N LEU A 82 1.133 -3.061 -6.435 1.00 0.00 N ATOM 1008 CA LEU A 82 1.138 -1.937 -5.505 1.00 0.00 C ATOM 1009 C LEU A 82 2.017 -0.804 -6.024 1.00 0.00 C ATOM 1010 O LEU A 82 3.245 -0.922 -6.055 1.00 0.00 O ATOM 1011 CB LEU A 82 1.629 -2.390 -4.128 1.00 0.00 C ATOM 1012 CG LEU A 82 1.471 -1.354 -3.013 1.00 0.00 C ATOM 1013 CD1 LEU A 82 0.018 -0.923 -2.887 1.00 0.00 C ATOM 1014 CD2 LEU A 82 1.981 -1.914 -1.692 1.00 0.00 C ATOM 0 H LEU A 82 1.993 -3.609 -6.439 1.00 0.00 H new ATOM 0 HA LEU A 82 0.117 -1.567 -5.416 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.087 -3.292 -3.844 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.682 -2.661 -4.205 1.00 0.00 H new ATOM 0 HG LEU A 82 2.066 -0.477 -3.268 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -0.075 -0.186 -2.089 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.314 -0.483 -3.828 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.600 -1.790 -2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.862 -1.165 -0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.411 -2.806 -1.431 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.035 -2.172 -1.789 1.00 0.00 H new ATOM 1026 N LEU A 83 1.381 0.290 -6.429 1.00 0.00 N ATOM 1027 CA LEU A 83 2.101 1.449 -6.947 1.00 0.00 C ATOM 1028 C LEU A 83 1.782 2.700 -6.133 1.00 0.00 C ATOM 1029 O LEU A 83 0.636 2.923 -5.742 1.00 0.00 O ATOM 1030 CB LEU A 83 1.747 1.680 -8.417 1.00 0.00 C ATOM 1031 CG LEU A 83 2.617 0.921 -9.421 1.00 0.00 C ATOM 1032 CD1 LEU A 83 4.086 1.255 -9.212 1.00 0.00 C ATOM 1033 CD2 LEU A 83 2.386 -0.578 -9.298 1.00 0.00 C ATOM 0 H LEU A 83 0.367 0.399 -6.409 1.00 0.00 H new ATOM 0 HA LEU A 83 3.169 1.247 -6.864 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.707 1.395 -8.573 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.821 2.747 -8.629 1.00 0.00 H new ATOM 0 HG LEU A 83 2.335 1.231 -10.427 1.00 0.00 H new ATOM 0 HD11 LEU A 83 4.690 0.706 -9.935 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.239 2.325 -9.349 1.00 0.00 H new ATOM 0 HD13 LEU A 83 4.383 0.973 -8.202 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.012 -1.103 -10.019 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.642 -0.904 -8.290 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.338 -0.802 -9.497 1.00 0.00 H new ATOM 1045 N GLN A 84 2.803 3.515 -5.887 1.00 0.00 N ATOM 1046 CA GLN A 84 2.632 4.747 -5.126 1.00 0.00 C ATOM 1047 C GLN A 84 2.988 5.962 -5.976 1.00 0.00 C ATOM 1048 O GLN A 84 4.111 6.082 -6.465 1.00 0.00 O ATOM 1049 CB GLN A 84 3.500 4.719 -3.866 1.00 0.00 C ATOM 1050 CG GLN A 84 3.120 5.775 -2.841 1.00 0.00 C ATOM 1051 CD GLN A 84 4.267 6.709 -2.511 1.00 0.00 C ATOM 1052 OE1 GLN A 84 4.749 6.743 -1.378 1.00 0.00 O ATOM 1053 NE2 GLN A 84 4.710 7.475 -3.500 1.00 0.00 N ATOM 0 H GLN A 84 3.757 3.344 -6.204 1.00 0.00 H new ATOM 0 HA GLN A 84 1.585 4.823 -4.834 1.00 0.00 H new ATOM 0 HB2 GLN A 84 3.425 3.734 -3.405 1.00 0.00 H new ATOM 0 HB3 GLN A 84 4.543 4.859 -4.150 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.280 6.357 -3.220 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.782 5.284 -1.928 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.281 7.414 -4.423 1.00 0.00 H new ATOM 0 HE22 GLN A 84 5.479 8.125 -3.337 1.00 0.00 H new ATOM 1062 N MET A 85 2.025 6.862 -6.150 1.00 0.00 N ATOM 1063 CA MET A 85 2.238 8.067 -6.942 1.00 0.00 C ATOM 1064 C MET A 85 1.928 9.317 -6.127 1.00 0.00 C ATOM 1065 O MET A 85 1.089 9.293 -5.227 1.00 0.00 O ATOM 1066 CB MET A 85 1.365 8.034 -8.197 1.00 0.00 C ATOM 1067 CG MET A 85 -0.080 7.643 -7.928 1.00 0.00 C ATOM 1068 SD MET A 85 -0.526 6.061 -8.670 1.00 0.00 S ATOM 1069 CE MET A 85 0.465 4.936 -7.691 1.00 0.00 C ATOM 0 H MET A 85 1.089 6.779 -5.753 1.00 0.00 H new ATOM 0 HA MET A 85 3.287 8.099 -7.235 1.00 0.00 H new ATOM 0 HB2 MET A 85 1.384 9.017 -8.668 1.00 0.00 H new ATOM 0 HB3 MET A 85 1.796 7.331 -8.910 1.00 0.00 H new ATOM 0 HG2 MET A 85 -0.244 7.593 -6.852 1.00 0.00 H new ATOM 0 HG3 MET A 85 -0.740 8.420 -8.315 1.00 0.00 H new ATOM 0 HE1 MET A 85 0.122 3.914 -7.853 1.00 0.00 H new ATOM 0 HE2 MET A 85 1.510 5.019 -7.988 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.367 5.189 -6.635 1.00 0.00 H new ATOM 1079 N ASP A 86 2.611 10.411 -6.450 1.00 0.00 N ATOM 1080 CA ASP A 86 2.411 11.674 -5.749 1.00 0.00 C ATOM 1081 C ASP A 86 1.655 12.669 -6.624 1.00 0.00 C ATOM 1082 O ASP A 86 2.144 13.083 -7.676 1.00 0.00 O ATOM 1083 CB ASP A 86 3.756 12.266 -5.328 1.00 0.00 C ATOM 1084 CG ASP A 86 4.694 12.462 -6.503 1.00 0.00 C ATOM 1085 OD1 ASP A 86 5.209 11.453 -7.027 1.00 0.00 O ATOM 1086 OD2 ASP A 86 4.914 13.627 -6.898 1.00 0.00 O ATOM 0 H ASP A 86 3.308 10.448 -7.193 1.00 0.00 H new ATOM 0 HA ASP A 86 1.815 11.476 -4.858 1.00 0.00 H new ATOM 0 HB2 ASP A 86 3.590 13.224 -4.835 1.00 0.00 H new ATOM 0 HB3 ASP A 86 4.226 11.609 -4.597 1.00 0.00 H new ATOM 1091 N VAL A 87 0.461 13.052 -6.183 1.00 0.00 N ATOM 1092 CA VAL A 87 -0.360 14.001 -6.926 1.00 0.00 C ATOM 1093 C VAL A 87 -0.511 15.311 -6.160 1.00 0.00 C ATOM 1094 O VAL A 87 -1.012 15.328 -5.035 1.00 0.00 O ATOM 1095 CB VAL A 87 -1.761 13.427 -7.216 1.00 0.00 C ATOM 1096 CG1 VAL A 87 -1.691 12.373 -8.309 1.00 0.00 C ATOM 1097 CG2 VAL A 87 -2.377 12.854 -5.948 1.00 0.00 C ATOM 0 H VAL A 87 0.041 12.720 -5.315 1.00 0.00 H new ATOM 0 HA VAL A 87 0.150 14.189 -7.871 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.400 14.237 -7.567 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.690 11.980 -8.500 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -1.297 12.821 -9.221 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.036 11.562 -7.991 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.366 12.454 -6.173 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.741 12.057 -5.563 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.466 13.641 -5.199 1.00 0.00 H new ATOM 1107 N ASP A 88 -0.072 16.407 -6.773 1.00 0.00 N ATOM 1108 CA ASP A 88 -0.158 17.727 -6.149 1.00 0.00 C ATOM 1109 C ASP A 88 0.828 17.848 -4.989 1.00 0.00 C ATOM 1110 O ASP A 88 1.729 18.686 -5.012 1.00 0.00 O ATOM 1111 CB ASP A 88 -1.584 17.999 -5.659 1.00 0.00 C ATOM 1112 CG ASP A 88 -2.227 19.172 -6.374 1.00 0.00 C ATOM 1113 OD1 ASP A 88 -1.960 19.350 -7.580 1.00 0.00 O ATOM 1114 OD2 ASP A 88 -2.999 19.910 -5.727 1.00 0.00 O ATOM 0 H ASP A 88 0.348 16.408 -7.703 1.00 0.00 H new ATOM 0 HA ASP A 88 0.103 18.471 -6.901 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -2.193 17.108 -5.809 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -1.566 18.196 -4.587 1.00 0.00 H new ATOM 1119 N ASN A 89 0.652 17.003 -3.978 1.00 0.00 N ATOM 1120 CA ASN A 89 1.521 17.010 -2.814 1.00 0.00 C ATOM 1121 C ASN A 89 1.316 15.751 -1.977 1.00 0.00 C ATOM 1122 O ASN A 89 2.278 15.145 -1.505 1.00 0.00 O ATOM 1123 CB ASN A 89 1.269 18.257 -1.964 1.00 0.00 C ATOM 1124 CG ASN A 89 2.220 18.357 -0.789 1.00 0.00 C ATOM 1125 OD1 ASN A 89 3.327 17.819 -0.824 1.00 0.00 O ATOM 1126 ND2 ASN A 89 1.793 19.048 0.262 1.00 0.00 N ATOM 0 H ASN A 89 -0.089 16.303 -3.945 1.00 0.00 H new ATOM 0 HA ASN A 89 2.554 17.027 -3.163 1.00 0.00 H new ATOM 0 HB2 ASN A 89 1.372 19.145 -2.588 1.00 0.00 H new ATOM 0 HB3 ASN A 89 0.243 18.242 -1.597 1.00 0.00 H new ATOM 0 HD21 ASN A 89 2.390 19.149 1.083 1.00 0.00 H new ATOM 0 HD22 ASN A 89 0.868 19.478 0.248 1.00 0.00 H new ATOM 1133 N PHE A 90 0.058 15.361 -1.799 1.00 0.00 N ATOM 1134 CA PHE A 90 -0.270 14.172 -1.022 1.00 0.00 C ATOM 1135 C PHE A 90 0.198 12.912 -1.742 1.00 0.00 C ATOM 1136 O PHE A 90 0.911 12.985 -2.743 1.00 0.00 O ATOM 1137 CB PHE A 90 -1.778 14.100 -0.771 1.00 0.00 C ATOM 1138 CG PHE A 90 -2.351 15.365 -0.197 1.00 0.00 C ATOM 1139 CD1 PHE A 90 -2.821 16.369 -1.031 1.00 0.00 C ATOM 1140 CD2 PHE A 90 -2.421 15.549 1.174 1.00 0.00 C ATOM 1141 CE1 PHE A 90 -3.348 17.533 -0.505 1.00 0.00 C ATOM 1142 CE2 PHE A 90 -2.948 16.712 1.704 1.00 0.00 C ATOM 1143 CZ PHE A 90 -3.413 17.705 0.864 1.00 0.00 C ATOM 0 H PHE A 90 -0.750 15.851 -2.182 1.00 0.00 H new ATOM 0 HA PHE A 90 0.246 14.238 -0.064 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.284 13.874 -1.710 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.986 13.275 -0.090 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.775 16.240 -2.102 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.060 14.776 1.836 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.709 18.308 -1.164 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.996 16.844 2.775 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.826 18.614 1.277 1.00 0.00 H new ATOM 1153 N GLN A 91 -0.204 11.755 -1.226 1.00 0.00 N ATOM 1154 CA GLN A 91 0.178 10.480 -1.822 1.00 0.00 C ATOM 1155 C GLN A 91 -1.049 9.617 -2.100 1.00 0.00 C ATOM 1156 O GLN A 91 -1.876 9.390 -1.215 1.00 0.00 O ATOM 1157 CB GLN A 91 1.143 9.732 -0.902 1.00 0.00 C ATOM 1158 CG GLN A 91 0.602 9.516 0.503 1.00 0.00 C ATOM 1159 CD GLN A 91 1.637 9.789 1.576 1.00 0.00 C ATOM 1160 OE1 GLN A 91 2.008 10.937 1.820 1.00 0.00 O ATOM 1161 NE2 GLN A 91 2.111 8.731 2.224 1.00 0.00 N ATOM 0 H GLN A 91 -0.793 11.674 -0.397 1.00 0.00 H new ATOM 0 HA GLN A 91 0.676 10.687 -2.770 1.00 0.00 H new ATOM 0 HB2 GLN A 91 1.377 8.764 -1.345 1.00 0.00 H new ATOM 0 HB3 GLN A 91 2.078 10.289 -0.841 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -0.259 10.166 0.660 1.00 0.00 H new ATOM 0 HG3 GLN A 91 0.248 8.489 0.598 1.00 0.00 H new ATOM 0 HE21 GLN A 91 1.775 7.797 1.989 1.00 0.00 H new ATOM 0 HE22 GLN A 91 2.811 8.853 2.956 1.00 0.00 H new ATOM 1170 N ARG A 92 -1.161 9.138 -3.335 1.00 0.00 N ATOM 1171 CA ARG A 92 -2.284 8.297 -3.732 1.00 0.00 C ATOM 1172 C ARG A 92 -1.819 6.874 -4.022 1.00 0.00 C ATOM 1173 O ARG A 92 -0.963 6.653 -4.880 1.00 0.00 O ATOM 1174 CB ARG A 92 -2.978 8.886 -4.963 1.00 0.00 C ATOM 1175 CG ARG A 92 -4.477 9.070 -4.786 1.00 0.00 C ATOM 1176 CD ARG A 92 -4.991 10.254 -5.588 1.00 0.00 C ATOM 1177 NE ARG A 92 -5.193 9.916 -6.995 1.00 0.00 N ATOM 1178 CZ ARG A 92 -5.302 10.819 -7.966 1.00 0.00 C ATOM 1179 NH1 ARG A 92 -5.231 12.116 -7.687 1.00 0.00 N ATOM 1180 NH2 ARG A 92 -5.483 10.427 -9.220 1.00 0.00 N ATOM 0 H ARG A 92 -0.487 9.318 -4.079 1.00 0.00 H new ATOM 0 HA ARG A 92 -2.995 8.265 -2.906 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -2.527 9.850 -5.198 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.799 8.234 -5.818 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -4.995 8.164 -5.100 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.704 9.218 -3.730 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -5.931 10.601 -5.160 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.282 11.079 -5.511 1.00 0.00 H new ATOM 0 HE ARG A 92 -5.254 8.930 -7.248 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -5.092 12.424 -6.724 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -5.315 12.804 -8.435 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -5.539 9.433 -9.441 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -5.567 11.120 -9.964 1.00 0.00 H new ATOM 1194 N ASN A 93 -2.383 5.912 -3.301 1.00 0.00 N ATOM 1195 CA ASN A 93 -2.021 4.510 -3.479 1.00 0.00 C ATOM 1196 C ASN A 93 -3.147 3.734 -4.154 1.00 0.00 C ATOM 1197 O ASN A 93 -4.303 3.805 -3.736 1.00 0.00 O ATOM 1198 CB ASN A 93 -1.686 3.873 -2.130 1.00 0.00 C ATOM 1199 CG ASN A 93 -0.733 4.721 -1.310 1.00 0.00 C ATOM 1200 OD1 ASN A 93 0.549 4.378 -1.350 1.00 0.00 O flip ATOM 1201 ND2 ASN A 93 -1.144 5.674 -0.649 1.00 0.00 N flip ATOM 0 H ASN A 93 -3.093 6.077 -2.587 1.00 0.00 H new ATOM 0 HA ASN A 93 -1.142 4.469 -4.122 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -2.606 3.717 -1.566 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -1.243 2.891 -2.295 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -2.138 5.902 -0.647 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -0.491 6.236 -0.103 1.00 0.00 H new ATOM 1208 N LEU A 94 -2.799 2.988 -5.198 1.00 0.00 N ATOM 1209 CA LEU A 94 -3.776 2.190 -5.931 1.00 0.00 C ATOM 1210 C LEU A 94 -3.260 0.771 -6.140 1.00 0.00 C ATOM 1211 O LEU A 94 -2.092 0.570 -6.475 1.00 0.00 O ATOM 1212 CB LEU A 94 -4.085 2.838 -7.283 1.00 0.00 C ATOM 1213 CG LEU A 94 -5.135 3.950 -7.245 1.00 0.00 C ATOM 1214 CD1 LEU A 94 -4.530 5.236 -6.702 1.00 0.00 C ATOM 1215 CD2 LEU A 94 -5.719 4.177 -8.631 1.00 0.00 C ATOM 0 H LEU A 94 -1.846 2.919 -5.556 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.692 2.145 -5.342 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.161 3.246 -7.692 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.424 2.063 -7.971 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.941 3.642 -6.579 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.291 6.016 -6.682 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.159 5.065 -5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.706 5.549 -7.343 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.464 4.971 -8.586 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.923 4.464 -9.318 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.188 3.258 -8.983 1.00 0.00 H new ATOM 1227 N ILE A 95 -4.131 -0.213 -5.936 1.00 0.00 N ATOM 1228 CA ILE A 95 -3.747 -1.610 -6.101 1.00 0.00 C ATOM 1229 C ILE A 95 -4.553 -2.281 -7.209 1.00 0.00 C ATOM 1230 O ILE A 95 -5.751 -2.039 -7.354 1.00 0.00 O ATOM 1231 CB ILE A 95 -3.928 -2.400 -4.792 1.00 0.00 C ATOM 1232 CG1 ILE A 95 -3.255 -1.666 -3.631 1.00 0.00 C ATOM 1233 CG2 ILE A 95 -3.361 -3.804 -4.937 1.00 0.00 C ATOM 1234 CD1 ILE A 95 -4.163 -0.679 -2.930 1.00 0.00 C ATOM 0 H ILE A 95 -5.102 -0.070 -5.658 1.00 0.00 H new ATOM 0 HA ILE A 95 -2.692 -1.616 -6.376 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.994 -2.480 -4.578 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.900 -2.399 -2.906 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.378 -1.138 -4.006 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.497 -4.349 -4.003 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.881 -4.325 -5.741 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.298 -3.745 -5.171 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.618 -0.197 -2.118 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.498 0.076 -3.641 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.028 -1.204 -2.525 1.00 0.00 H new ATOM 1246 N ASN A 96 -3.884 -3.127 -7.985 1.00 0.00 N ATOM 1247 CA ASN A 96 -4.531 -3.841 -9.082 1.00 0.00 C ATOM 1248 C ASN A 96 -4.547 -5.343 -8.811 1.00 0.00 C ATOM 1249 O ASN A 96 -3.502 -5.948 -8.576 1.00 0.00 O ATOM 1250 CB ASN A 96 -3.807 -3.553 -10.399 1.00 0.00 C ATOM 1251 CG ASN A 96 -4.764 -3.366 -11.559 1.00 0.00 C ATOM 1252 OD1 ASN A 96 -5.610 -4.361 -11.795 1.00 0.00 O flip ATOM 1253 ND2 ASN A 96 -4.744 -2.338 -12.236 1.00 0.00 N flip ATOM 0 H ASN A 96 -2.892 -3.336 -7.875 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.561 -3.492 -9.160 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.198 -2.656 -10.286 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.126 -4.374 -10.623 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -4.077 -1.598 -12.019 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -5.395 -2.227 -13.013 1.00 0.00 H new ATOM 1260 N VAL A 97 -5.736 -5.937 -8.841 1.00 0.00 N ATOM 1261 CA VAL A 97 -5.880 -7.368 -8.590 1.00 0.00 C ATOM 1262 C VAL A 97 -5.933 -8.163 -9.889 1.00 0.00 C ATOM 1263 O VAL A 97 -6.634 -7.790 -10.832 1.00 0.00 O ATOM 1264 CB VAL A 97 -7.147 -7.677 -7.772 1.00 0.00 C ATOM 1265 CG1 VAL A 97 -7.136 -9.121 -7.297 1.00 0.00 C ATOM 1266 CG2 VAL A 97 -7.272 -6.721 -6.595 1.00 0.00 C ATOM 0 H VAL A 97 -6.612 -5.452 -9.036 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.001 -7.667 -8.019 1.00 0.00 H new ATOM 0 HB VAL A 97 -8.015 -7.537 -8.416 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.039 -9.321 -6.721 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.100 -9.787 -8.159 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.260 -9.291 -6.670 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.174 -6.956 -6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.401 -6.824 -5.948 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.331 -5.697 -6.963 1.00 0.00 H new ATOM 1276 N ILE A 98 -5.195 -9.267 -9.925 1.00 0.00 N ATOM 1277 CA ILE A 98 -5.158 -10.128 -11.100 1.00 0.00 C ATOM 1278 C ILE A 98 -5.598 -11.544 -10.742 1.00 0.00 C ATOM 1279 O ILE A 98 -4.994 -12.194 -9.888 1.00 0.00 O ATOM 1280 CB ILE A 98 -3.748 -10.180 -11.719 1.00 0.00 C ATOM 1281 CG1 ILE A 98 -3.206 -8.765 -11.932 1.00 0.00 C ATOM 1282 CG2 ILE A 98 -3.773 -10.947 -13.033 1.00 0.00 C ATOM 1283 CD1 ILE A 98 -1.696 -8.685 -11.898 1.00 0.00 C ATOM 0 H ILE A 98 -4.613 -9.587 -9.151 1.00 0.00 H new ATOM 0 HA ILE A 98 -5.846 -9.703 -11.831 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.085 -10.702 -11.029 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -3.560 -8.390 -12.892 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.614 -8.109 -11.163 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.769 -10.975 -13.457 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -4.119 -11.965 -12.854 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -4.448 -10.452 -13.731 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.383 -7.653 -12.056 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -1.335 -9.030 -10.929 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.280 -9.315 -12.685 1.00 0.00 H new ATOM 1295 N ASP A 99 -6.655 -12.015 -11.394 1.00 0.00 N ATOM 1296 CA ASP A 99 -7.175 -13.353 -11.136 1.00 0.00 C ATOM 1297 C ASP A 99 -6.778 -14.319 -12.248 1.00 0.00 C ATOM 1298 O ASP A 99 -7.161 -14.142 -13.405 1.00 0.00 O ATOM 1299 CB ASP A 99 -8.699 -13.312 -10.997 1.00 0.00 C ATOM 1300 CG ASP A 99 -9.190 -14.092 -9.793 1.00 0.00 C ATOM 1301 OD1 ASP A 99 -8.573 -15.126 -9.462 1.00 0.00 O ATOM 1302 OD2 ASP A 99 -10.193 -13.668 -9.180 1.00 0.00 O ATOM 0 H ASP A 99 -7.168 -11.492 -12.104 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.741 -13.709 -10.202 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.026 -12.276 -10.913 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.155 -13.718 -11.900 1.00 0.00 H new ATOM 1307 N LYS A 100 -6.010 -15.342 -11.889 1.00 0.00 N ATOM 1308 CA LYS A 100 -5.561 -16.339 -12.854 1.00 0.00 C ATOM 1309 C LYS A 100 -5.429 -17.710 -12.196 1.00 0.00 C ATOM 1310 O LYS A 100 -4.379 -18.350 -12.272 1.00 0.00 O ATOM 1311 CB LYS A 100 -4.223 -15.919 -13.467 1.00 0.00 C ATOM 1312 CG LYS A 100 -3.129 -15.685 -12.438 1.00 0.00 C ATOM 1313 CD LYS A 100 -1.754 -16.020 -12.998 1.00 0.00 C ATOM 1314 CE LYS A 100 -0.762 -14.891 -12.759 1.00 0.00 C ATOM 1315 NZ LYS A 100 -0.437 -14.162 -14.015 1.00 0.00 N ATOM 0 H LYS A 100 -5.685 -15.503 -10.936 1.00 0.00 H new ATOM 0 HA LYS A 100 -6.307 -16.407 -13.645 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.895 -16.689 -14.165 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -4.368 -15.006 -14.045 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -3.148 -14.644 -12.116 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -3.322 -16.295 -11.556 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -1.384 -16.934 -12.534 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -1.834 -16.215 -14.067 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.175 -14.193 -12.031 1.00 0.00 H new ATOM 0 HE3 LYS A 100 0.153 -15.297 -12.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 0.242 -13.401 -13.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -0.019 -14.822 -14.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -1.306 -13.752 -14.413 1.00 0.00 H new ATOM 1329 N SER A 101 -6.502 -18.157 -11.552 1.00 0.00 N ATOM 1330 CA SER A 101 -6.507 -19.452 -10.880 1.00 0.00 C ATOM 1331 C SER A 101 -7.834 -20.173 -11.098 1.00 0.00 C ATOM 1332 O SER A 101 -8.769 -19.614 -11.670 1.00 0.00 O ATOM 1333 CB SER A 101 -6.248 -19.278 -9.384 1.00 0.00 C ATOM 1334 OG SER A 101 -4.862 -19.333 -9.095 1.00 0.00 O ATOM 0 H SER A 101 -7.379 -17.642 -11.481 1.00 0.00 H new ATOM 0 HA SER A 101 -5.709 -20.058 -11.310 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.654 -18.323 -9.050 1.00 0.00 H new ATOM 0 HB3 SER A 101 -6.769 -20.058 -8.829 1.00 0.00 H new ATOM 0 HG SER A 101 -4.351 -19.079 -9.892 1.00 0.00 H new ATOM 1340 N ARG A 102 -7.907 -21.419 -10.639 1.00 0.00 N ATOM 1341 CA ARG A 102 -9.119 -22.218 -10.786 1.00 0.00 C ATOM 1342 C ARG A 102 -9.745 -22.530 -9.427 1.00 0.00 C ATOM 1343 O ARG A 102 -10.943 -22.799 -9.336 1.00 0.00 O ATOM 1344 CB ARG A 102 -8.807 -23.521 -11.525 1.00 0.00 C ATOM 1345 CG ARG A 102 -7.961 -23.323 -12.773 1.00 0.00 C ATOM 1346 CD ARG A 102 -6.480 -23.479 -12.472 1.00 0.00 C ATOM 1347 NE ARG A 102 -5.645 -22.841 -13.486 1.00 0.00 N ATOM 1348 CZ ARG A 102 -4.369 -22.514 -13.297 1.00 0.00 C ATOM 1349 NH1 ARG A 102 -3.777 -22.765 -12.135 1.00 0.00 N ATOM 1350 NH2 ARG A 102 -3.681 -21.935 -14.271 1.00 0.00 N ATOM 0 H ARG A 102 -7.142 -21.897 -10.163 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.835 -21.636 -11.367 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.287 -24.198 -10.847 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.743 -24.005 -11.803 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.257 -24.046 -13.533 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -8.147 -22.332 -13.186 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -6.261 -23.045 -11.496 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.232 -24.539 -12.412 1.00 0.00 H new ATOM 0 HE ARG A 102 -6.064 -22.634 -14.392 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -4.301 -23.211 -11.382 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -2.799 -22.512 -11.996 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.130 -21.740 -15.166 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -2.703 -21.685 -14.125 1.00 0.00 H new ATOM 1364 N ASN A 103 -8.931 -22.497 -8.374 1.00 0.00 N ATOM 1365 CA ASN A 103 -9.412 -22.780 -7.025 1.00 0.00 C ATOM 1366 C ASN A 103 -10.627 -21.926 -6.674 1.00 0.00 C ATOM 1367 O ASN A 103 -11.525 -22.373 -5.959 1.00 0.00 O ATOM 1368 CB ASN A 103 -8.305 -22.554 -6.013 1.00 0.00 C ATOM 1369 CG ASN A 103 -7.755 -23.851 -5.453 1.00 0.00 C ATOM 1370 OD1 ASN A 103 -7.296 -24.718 -6.197 1.00 0.00 O ATOM 1371 ND2 ASN A 103 -7.800 -23.992 -4.133 1.00 0.00 N ATOM 0 H ASN A 103 -7.936 -22.277 -8.429 1.00 0.00 H new ATOM 0 HA ASN A 103 -9.717 -23.826 -6.994 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -7.497 -21.994 -6.483 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.684 -21.941 -5.195 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -7.446 -24.844 -3.699 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -8.189 -23.248 -3.554 1.00 0.00 H new ATOM 1378 N GLY A 104 -10.650 -20.697 -7.180 1.00 0.00 N ATOM 1379 CA GLY A 104 -11.761 -19.803 -6.907 1.00 0.00 C ATOM 1380 C GLY A 104 -11.352 -18.605 -6.073 1.00 0.00 C ATOM 1381 O GLY A 104 -10.770 -18.757 -4.998 1.00 0.00 O ATOM 0 H GLY A 104 -9.920 -20.304 -7.774 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.185 -19.457 -7.850 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -12.546 -20.352 -6.387 1.00 0.00 H new ATOM 1385 N THR A 105 -11.656 -17.409 -6.568 1.00 0.00 N ATOM 1386 CA THR A 105 -11.317 -16.179 -5.862 1.00 0.00 C ATOM 1387 C THR A 105 -12.518 -15.238 -5.803 1.00 0.00 C ATOM 1388 O THR A 105 -13.077 -14.865 -6.834 1.00 0.00 O ATOM 1389 CB THR A 105 -10.136 -15.486 -6.544 1.00 0.00 C ATOM 1390 OG1 THR A 105 -8.976 -16.299 -6.477 1.00 0.00 O ATOM 1391 CG2 THR A 105 -9.791 -14.143 -5.935 1.00 0.00 C ATOM 0 H THR A 105 -12.137 -17.266 -7.456 1.00 0.00 H new ATOM 0 HA THR A 105 -11.034 -16.437 -4.842 1.00 0.00 H new ATOM 0 HB THR A 105 -10.451 -15.325 -7.575 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.277 -15.830 -5.976 1.00 0.00 H new ATOM 0 HG21 THR A 105 -8.945 -13.709 -6.468 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.650 -13.477 -6.013 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.529 -14.276 -4.885 1.00 0.00 H new ATOM 1399 N PHE A 106 -12.906 -14.857 -4.590 1.00 0.00 N ATOM 1400 CA PHE A 106 -14.039 -13.959 -4.395 1.00 0.00 C ATOM 1401 C PHE A 106 -13.612 -12.696 -3.654 1.00 0.00 C ATOM 1402 O PHE A 106 -13.054 -12.765 -2.559 1.00 0.00 O ATOM 1403 CB PHE A 106 -15.150 -14.666 -3.617 1.00 0.00 C ATOM 1404 CG PHE A 106 -15.899 -15.683 -4.429 1.00 0.00 C ATOM 1405 CD1 PHE A 106 -15.379 -16.952 -4.625 1.00 0.00 C ATOM 1406 CD2 PHE A 106 -17.124 -15.370 -4.996 1.00 0.00 C ATOM 1407 CE1 PHE A 106 -16.066 -17.891 -5.372 1.00 0.00 C ATOM 1408 CE2 PHE A 106 -17.816 -16.303 -5.744 1.00 0.00 C ATOM 1409 CZ PHE A 106 -17.286 -17.565 -5.932 1.00 0.00 C ATOM 0 H PHE A 106 -12.452 -15.156 -3.727 1.00 0.00 H new ATOM 0 HA PHE A 106 -14.416 -13.674 -5.377 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -14.716 -15.157 -2.746 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -15.853 -13.920 -3.246 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -14.425 -17.211 -4.189 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -17.543 -14.385 -4.852 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -15.650 -18.877 -5.517 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -18.770 -16.046 -6.181 1.00 0.00 H new ATOM 0 HZ PHE A 106 -17.825 -18.296 -6.516 1.00 0.00 H new ATOM 1419 N ILE A 107 -13.877 -11.542 -4.259 1.00 0.00 N ATOM 1420 CA ILE A 107 -13.522 -10.264 -3.654 1.00 0.00 C ATOM 1421 C ILE A 107 -14.742 -9.373 -3.496 1.00 0.00 C ATOM 1422 O ILE A 107 -15.586 -9.275 -4.388 1.00 0.00 O ATOM 1423 CB ILE A 107 -12.430 -9.532 -4.458 1.00 0.00 C ATOM 1424 CG1 ILE A 107 -12.215 -8.096 -3.953 1.00 0.00 C ATOM 1425 CG2 ILE A 107 -12.765 -9.534 -5.940 1.00 0.00 C ATOM 1426 CD1 ILE A 107 -11.019 -7.954 -3.038 1.00 0.00 C ATOM 0 H ILE A 107 -14.336 -11.466 -5.167 1.00 0.00 H new ATOM 0 HA ILE A 107 -13.120 -10.484 -2.665 1.00 0.00 H new ATOM 0 HB ILE A 107 -11.496 -10.074 -4.310 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -12.089 -7.433 -4.809 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -13.109 -7.767 -3.424 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -11.982 -9.013 -6.491 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -12.836 -10.562 -6.296 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -13.718 -9.029 -6.098 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -10.926 -6.916 -2.719 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -11.152 -8.592 -2.164 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -10.116 -8.252 -3.571 1.00 0.00 H new ATOM 1438 N ASN A 108 -14.818 -8.737 -2.343 1.00 0.00 N ATOM 1439 CA ASN A 108 -15.929 -7.846 -2.021 1.00 0.00 C ATOM 1440 C ASN A 108 -17.254 -8.603 -2.055 1.00 0.00 C ATOM 1441 O ASN A 108 -18.304 -8.022 -2.327 1.00 0.00 O ATOM 1442 CB ASN A 108 -15.980 -6.670 -3.002 1.00 0.00 C ATOM 1443 CG ASN A 108 -14.649 -5.952 -3.128 1.00 0.00 C ATOM 1444 OD1 ASN A 108 -13.931 -5.825 -2.017 1.00 0.00 O flip ATOM 1445 ND2 ASN A 108 -14.270 -5.516 -4.215 1.00 0.00 N flip ATOM 0 H ASN A 108 -14.120 -8.819 -1.604 1.00 0.00 H new ATOM 0 HA ASN A 108 -15.769 -7.460 -1.014 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -16.286 -7.034 -3.983 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -16.740 -5.961 -2.674 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -14.853 -5.635 -5.044 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -13.373 -5.036 -4.287 1.00 0.00 H new ATOM 1452 N GLY A 109 -17.196 -9.900 -1.774 1.00 0.00 N ATOM 1453 CA GLY A 109 -18.390 -10.712 -1.775 1.00 0.00 C ATOM 1454 C GLY A 109 -18.933 -10.962 -3.170 1.00 0.00 C ATOM 1455 O GLY A 109 -20.063 -11.424 -3.328 1.00 0.00 O ATOM 0 H GLY A 109 -16.338 -10.402 -1.545 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -18.174 -11.668 -1.298 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -19.157 -10.223 -1.174 1.00 0.00 H new ATOM 1459 N ASN A 110 -18.128 -10.654 -4.185 1.00 0.00 N ATOM 1460 CA ASN A 110 -18.538 -10.848 -5.569 1.00 0.00 C ATOM 1461 C ASN A 110 -17.448 -11.575 -6.354 1.00 0.00 C ATOM 1462 O ASN A 110 -16.262 -11.278 -6.211 1.00 0.00 O ATOM 1463 CB ASN A 110 -18.858 -9.489 -6.212 1.00 0.00 C ATOM 1464 CG ASN A 110 -18.747 -9.502 -7.726 1.00 0.00 C ATOM 1465 OD1 ASN A 110 -17.516 -9.469 -8.224 1.00 0.00 O flip ATOM 1466 ND2 ASN A 110 -19.752 -9.541 -8.436 1.00 0.00 N flip ATOM 0 H ASN A 110 -17.190 -10.270 -4.072 1.00 0.00 H new ATOM 0 HA ASN A 110 -19.436 -11.466 -5.590 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -19.868 -9.190 -5.931 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -18.180 -8.736 -5.811 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -20.678 -9.565 -8.009 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -19.659 -9.549 -9.452 1.00 0.00 H new ATOM 1473 N ARG A 111 -17.860 -12.528 -7.183 1.00 0.00 N ATOM 1474 CA ARG A 111 -16.921 -13.298 -7.991 1.00 0.00 C ATOM 1475 C ARG A 111 -16.221 -12.404 -9.010 1.00 0.00 C ATOM 1476 O ARG A 111 -16.864 -11.616 -9.705 1.00 0.00 O ATOM 1477 CB ARG A 111 -17.643 -14.441 -8.707 1.00 0.00 C ATOM 1478 CG ARG A 111 -18.889 -14.000 -9.459 1.00 0.00 C ATOM 1479 CD ARG A 111 -20.150 -14.236 -8.640 1.00 0.00 C ATOM 1480 NE ARG A 111 -20.947 -13.018 -8.506 1.00 0.00 N ATOM 1481 CZ ARG A 111 -21.738 -12.757 -7.466 1.00 0.00 C ATOM 1482 NH1 ARG A 111 -21.854 -13.627 -6.470 1.00 0.00 N ATOM 1483 NH2 ARG A 111 -22.419 -11.619 -7.425 1.00 0.00 N ATOM 0 H ARG A 111 -18.838 -12.786 -7.313 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.168 -13.718 -7.324 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -16.954 -14.912 -9.408 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -17.920 -15.199 -7.975 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -18.809 -12.942 -9.708 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -18.959 -14.545 -10.400 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -20.750 -15.013 -9.113 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -19.877 -14.602 -7.650 1.00 0.00 H new ATOM 0 HE ARG A 111 -20.894 -12.326 -9.254 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -21.335 -14.505 -6.496 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -22.462 -13.418 -5.678 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -22.336 -10.947 -8.188 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -23.025 -11.416 -6.630 1.00 0.00 H new ATOM 1497 N LEU A 112 -14.901 -12.528 -9.091 1.00 0.00 N ATOM 1498 CA LEU A 112 -14.113 -11.729 -10.023 1.00 0.00 C ATOM 1499 C LEU A 112 -13.992 -12.427 -11.374 1.00 0.00 C ATOM 1500 O LEU A 112 -13.709 -13.623 -11.443 1.00 0.00 O ATOM 1501 CB LEU A 112 -12.720 -11.463 -9.447 1.00 0.00 C ATOM 1502 CG LEU A 112 -12.053 -10.177 -9.935 1.00 0.00 C ATOM 1503 CD1 LEU A 112 -11.046 -9.679 -8.911 1.00 0.00 C ATOM 1504 CD2 LEU A 112 -11.379 -10.405 -11.280 1.00 0.00 C ATOM 0 H LEU A 112 -14.354 -13.174 -8.523 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.626 -10.779 -10.171 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -12.794 -11.426 -8.360 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -12.074 -12.306 -9.694 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.822 -9.415 -10.060 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.580 -8.763 -9.274 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -11.555 -9.478 -7.968 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.280 -10.438 -8.755 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.909 -9.480 -11.613 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.621 -11.182 -11.180 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -12.124 -10.717 -12.012 1.00 0.00 H new ATOM 1516 N VAL A 113 -14.208 -11.672 -12.445 1.00 0.00 N ATOM 1517 CA VAL A 113 -14.122 -12.217 -13.795 1.00 0.00 C ATOM 1518 C VAL A 113 -13.410 -11.250 -14.735 1.00 0.00 C ATOM 1519 O VAL A 113 -12.525 -11.646 -15.495 1.00 0.00 O ATOM 1520 CB VAL A 113 -15.518 -12.531 -14.365 1.00 0.00 C ATOM 1521 CG1 VAL A 113 -16.089 -13.787 -13.725 1.00 0.00 C ATOM 1522 CG2 VAL A 113 -16.454 -11.349 -14.167 1.00 0.00 C ATOM 0 H VAL A 113 -14.444 -10.680 -12.405 1.00 0.00 H new ATOM 0 HA VAL A 113 -13.549 -13.141 -13.725 1.00 0.00 H new ATOM 0 HB VAL A 113 -15.420 -12.712 -15.435 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -17.075 -13.991 -14.141 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -15.428 -14.630 -13.926 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -16.173 -13.641 -12.648 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -17.435 -11.589 -14.576 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -16.547 -11.133 -13.103 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -16.051 -10.476 -14.680 1.00 0.00 H new ATOM 1532 N LYS A 114 -13.801 -9.981 -14.679 1.00 0.00 N ATOM 1533 CA LYS A 114 -13.199 -8.958 -15.526 1.00 0.00 C ATOM 1534 C LYS A 114 -11.699 -8.850 -15.270 1.00 0.00 C ATOM 1535 O LYS A 114 -11.208 -9.261 -14.220 1.00 0.00 O ATOM 1536 CB LYS A 114 -13.870 -7.603 -15.281 1.00 0.00 C ATOM 1537 CG LYS A 114 -14.187 -6.840 -16.558 1.00 0.00 C ATOM 1538 CD LYS A 114 -13.160 -5.753 -16.828 1.00 0.00 C ATOM 1539 CE LYS A 114 -13.702 -4.699 -17.780 1.00 0.00 C ATOM 1540 NZ LYS A 114 -14.500 -3.662 -17.069 1.00 0.00 N ATOM 0 H LYS A 114 -14.532 -9.637 -14.056 1.00 0.00 H new ATOM 0 HA LYS A 114 -13.350 -9.248 -16.566 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -14.793 -7.760 -14.723 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -13.219 -6.993 -14.655 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -14.215 -7.533 -17.399 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -15.178 -6.394 -16.480 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -12.871 -5.282 -15.888 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -12.260 -6.199 -17.251 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -12.873 -4.223 -18.303 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -14.323 -5.179 -18.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -14.851 -2.963 -17.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.306 -4.112 -16.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.901 -3.186 -16.365 1.00 0.00 H new ATOM 1554 N LYS A 115 -10.976 -8.299 -16.240 1.00 0.00 N ATOM 1555 CA LYS A 115 -9.531 -8.139 -16.120 1.00 0.00 C ATOM 1556 C LYS A 115 -9.175 -6.734 -15.644 1.00 0.00 C ATOM 1557 O LYS A 115 -9.964 -5.800 -15.791 1.00 0.00 O ATOM 1558 CB LYS A 115 -8.853 -8.422 -17.463 1.00 0.00 C ATOM 1559 CG LYS A 115 -9.225 -7.431 -18.554 1.00 0.00 C ATOM 1560 CD LYS A 115 -9.090 -8.048 -19.937 1.00 0.00 C ATOM 1561 CE LYS A 115 -10.055 -7.413 -20.927 1.00 0.00 C ATOM 1562 NZ LYS A 115 -10.772 -8.436 -21.737 1.00 0.00 N ATOM 0 H LYS A 115 -11.367 -7.956 -17.117 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.172 -8.855 -15.380 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -7.772 -8.408 -17.325 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -9.120 -9.427 -17.790 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -10.250 -7.091 -18.404 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -8.584 -6.552 -18.482 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -8.067 -7.924 -20.294 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -9.280 -9.120 -19.879 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -10.780 -6.804 -20.387 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -9.507 -6.744 -21.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -11.420 -7.963 -22.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -10.082 -9.001 -22.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -11.316 -9.059 -21.107 1.00 0.00 H new ATOM 1576 N ASP A 116 -7.983 -6.593 -15.073 1.00 0.00 N ATOM 1577 CA ASP A 116 -7.523 -5.302 -14.576 1.00 0.00 C ATOM 1578 C ASP A 116 -8.466 -4.763 -13.504 1.00 0.00 C ATOM 1579 O ASP A 116 -9.103 -3.725 -13.687 1.00 0.00 O ATOM 1580 CB ASP A 116 -7.407 -4.299 -15.727 1.00 0.00 C ATOM 1581 CG ASP A 116 -6.761 -2.997 -15.297 1.00 0.00 C ATOM 1582 OD1 ASP A 116 -5.627 -3.041 -14.776 1.00 0.00 O ATOM 1583 OD2 ASP A 116 -7.391 -1.933 -15.478 1.00 0.00 O ATOM 0 H ASP A 116 -7.319 -7.356 -14.943 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.539 -5.443 -14.128 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -6.823 -4.742 -16.534 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -8.400 -4.094 -16.128 1.00 0.00 H new ATOM 1588 N TYR A 117 -8.551 -5.477 -12.387 1.00 0.00 N ATOM 1589 CA TYR A 117 -9.416 -5.071 -11.285 1.00 0.00 C ATOM 1590 C TYR A 117 -8.720 -4.052 -10.388 1.00 0.00 C ATOM 1591 O TYR A 117 -7.536 -4.187 -10.083 1.00 0.00 O ATOM 1592 CB TYR A 117 -9.832 -6.292 -10.462 1.00 0.00 C ATOM 1593 CG TYR A 117 -11.149 -6.118 -9.742 1.00 0.00 C ATOM 1594 CD1 TYR A 117 -12.347 -6.466 -10.352 1.00 0.00 C ATOM 1595 CD2 TYR A 117 -11.194 -5.606 -8.451 1.00 0.00 C ATOM 1596 CE1 TYR A 117 -13.553 -6.308 -9.697 1.00 0.00 C ATOM 1597 CE2 TYR A 117 -12.395 -5.446 -7.789 1.00 0.00 C ATOM 1598 CZ TYR A 117 -13.573 -5.798 -8.416 1.00 0.00 C ATOM 1599 OH TYR A 117 -14.771 -5.640 -7.760 1.00 0.00 O ATOM 0 H TYR A 117 -8.032 -6.339 -12.221 1.00 0.00 H new ATOM 0 HA TYR A 117 -10.305 -4.604 -11.709 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -9.900 -7.158 -11.121 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -9.054 -6.509 -9.730 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -12.336 -6.867 -11.355 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -10.274 -5.329 -7.957 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -14.476 -6.583 -10.186 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -12.413 -5.047 -6.785 1.00 0.00 H new ATOM 0 HH TYR A 117 -15.407 -6.318 -8.072 1.00 0.00 H new ATOM 1609 N ILE A 118 -9.466 -3.035 -9.967 1.00 0.00 N ATOM 1610 CA ILE A 118 -8.923 -1.996 -9.107 1.00 0.00 C ATOM 1611 C ILE A 118 -9.285 -2.254 -7.647 1.00 0.00 C ATOM 1612 O ILE A 118 -10.461 -2.356 -7.296 1.00 0.00 O ATOM 1613 CB ILE A 118 -9.432 -0.602 -9.534 1.00 0.00 C ATOM 1614 CG1 ILE A 118 -8.556 0.485 -8.922 1.00 0.00 C ATOM 1615 CG2 ILE A 118 -10.891 -0.406 -9.143 1.00 0.00 C ATOM 1616 CD1 ILE A 118 -7.094 0.334 -9.271 1.00 0.00 C ATOM 0 H ILE A 118 -10.449 -2.911 -10.209 1.00 0.00 H new ATOM 0 HA ILE A 118 -7.838 -2.018 -9.209 1.00 0.00 H new ATOM 0 HB ILE A 118 -9.370 -0.531 -10.620 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -8.906 1.460 -9.262 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -8.668 0.467 -7.838 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -11.222 0.584 -9.456 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -11.503 -1.164 -9.631 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -10.993 -0.497 -8.062 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.524 1.138 -8.805 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -6.730 -0.627 -8.907 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.971 0.382 -10.353 1.00 0.00 H new ATOM 1628 N LEU A 119 -8.266 -2.372 -6.803 1.00 0.00 N ATOM 1629 CA LEU A 119 -8.479 -2.631 -5.384 1.00 0.00 C ATOM 1630 C LEU A 119 -8.286 -1.374 -4.544 1.00 0.00 C ATOM 1631 O LEU A 119 -7.330 -0.617 -4.737 1.00 0.00 O ATOM 1632 CB LEU A 119 -7.528 -3.730 -4.898 1.00 0.00 C ATOM 1633 CG LEU A 119 -7.520 -3.970 -3.385 1.00 0.00 C ATOM 1634 CD1 LEU A 119 -7.211 -5.426 -3.077 1.00 0.00 C ATOM 1635 CD2 LEU A 119 -6.513 -3.058 -2.701 1.00 0.00 C ATOM 0 H LEU A 119 -7.286 -2.293 -7.076 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.511 -2.960 -5.263 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.794 -4.663 -5.395 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.516 -3.477 -5.214 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.512 -3.737 -2.998 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.210 -5.577 -1.998 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -7.970 -6.063 -3.532 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -6.232 -5.683 -3.481 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.524 -3.245 -1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.516 -3.257 -3.094 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.777 -2.018 -2.891 1.00 0.00 H new ATOM 1647 N LYS A 120 -9.192 -1.181 -3.593 1.00 0.00 N ATOM 1648 CA LYS A 120 -9.139 -0.045 -2.684 1.00 0.00 C ATOM 1649 C LYS A 120 -8.995 -0.549 -1.254 1.00 0.00 C ATOM 1650 O LYS A 120 -9.356 -1.686 -0.950 1.00 0.00 O ATOM 1651 CB LYS A 120 -10.397 0.815 -2.819 1.00 0.00 C ATOM 1652 CG LYS A 120 -10.674 1.269 -4.244 1.00 0.00 C ATOM 1653 CD LYS A 120 -11.486 2.555 -4.271 1.00 0.00 C ATOM 1654 CE LYS A 120 -11.450 3.209 -5.643 1.00 0.00 C ATOM 1655 NZ LYS A 120 -10.527 4.378 -5.677 1.00 0.00 N ATOM 0 H LYS A 120 -9.982 -1.806 -3.431 1.00 0.00 H new ATOM 0 HA LYS A 120 -8.278 0.573 -2.939 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -11.254 0.250 -2.453 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -10.298 1.692 -2.180 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -9.731 1.422 -4.768 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -11.212 0.486 -4.778 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -12.519 2.340 -3.996 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -11.096 3.248 -3.526 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -11.136 2.476 -6.386 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -12.454 3.531 -5.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -10.531 4.796 -6.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -10.841 5.089 -4.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -9.564 4.067 -5.440 1.00 0.00 H new ATOM 1669 N ASN A 121 -8.450 0.287 -0.387 1.00 0.00 N ATOM 1670 CA ASN A 121 -8.242 -0.094 1.001 1.00 0.00 C ATOM 1671 C ASN A 121 -9.540 -0.041 1.796 1.00 0.00 C ATOM 1672 O ASN A 121 -10.428 0.764 1.513 1.00 0.00 O ATOM 1673 CB ASN A 121 -7.182 0.800 1.632 1.00 0.00 C ATOM 1674 CG ASN A 121 -5.778 0.386 1.225 1.00 0.00 C ATOM 1675 OD1 ASN A 121 -4.894 0.239 2.064 1.00 0.00 O ATOM 1676 ND2 ASN A 121 -5.565 0.188 -0.073 1.00 0.00 N ATOM 0 H ASN A 121 -8.144 1.232 -0.618 1.00 0.00 H new ATOM 0 HA ASN A 121 -7.892 -1.126 1.022 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -7.356 1.834 1.336 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -7.272 0.760 2.718 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -4.642 -0.096 -0.401 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -6.325 0.320 -0.740 1.00 0.00 H new ATOM 1683 N GLY A 122 -9.644 -0.924 2.782 1.00 0.00 N ATOM 1684 CA GLY A 122 -10.836 -0.995 3.603 1.00 0.00 C ATOM 1685 C GLY A 122 -11.875 -1.910 2.993 1.00 0.00 C ATOM 1686 O GLY A 122 -13.073 -1.632 3.053 1.00 0.00 O ATOM 0 H GLY A 122 -8.918 -1.596 3.028 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -10.573 -1.354 4.598 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.255 0.004 3.725 1.00 0.00 H new ATOM 1690 N ASP A 123 -11.409 -3.001 2.395 1.00 0.00 N ATOM 1691 CA ASP A 123 -12.302 -3.963 1.756 1.00 0.00 C ATOM 1692 C ASP A 123 -11.961 -5.391 2.166 1.00 0.00 C ATOM 1693 O ASP A 123 -10.882 -5.657 2.698 1.00 0.00 O ATOM 1694 CB ASP A 123 -12.224 -3.826 0.234 1.00 0.00 C ATOM 1695 CG ASP A 123 -13.064 -2.677 -0.286 1.00 0.00 C ATOM 1696 OD1 ASP A 123 -12.836 -1.529 0.149 1.00 0.00 O ATOM 1697 OD2 ASP A 123 -13.953 -2.925 -1.129 1.00 0.00 O ATOM 0 H ASP A 123 -10.419 -3.242 2.339 1.00 0.00 H new ATOM 0 HA ASP A 123 -13.318 -3.747 2.086 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.186 -3.676 -0.062 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -12.557 -4.755 -0.229 1.00 0.00 H new ATOM 1702 N ARG A 124 -12.891 -6.307 1.915 1.00 0.00 N ATOM 1703 CA ARG A 124 -12.696 -7.711 2.256 1.00 0.00 C ATOM 1704 C ARG A 124 -12.303 -8.522 1.025 1.00 0.00 C ATOM 1705 O ARG A 124 -12.985 -8.483 0.001 1.00 0.00 O ATOM 1706 CB ARG A 124 -13.972 -8.286 2.876 1.00 0.00 C ATOM 1707 CG ARG A 124 -13.761 -8.893 4.253 1.00 0.00 C ATOM 1708 CD ARG A 124 -15.082 -9.120 4.969 1.00 0.00 C ATOM 1709 NE ARG A 124 -15.736 -7.863 5.322 1.00 0.00 N ATOM 1710 CZ ARG A 124 -17.034 -7.753 5.596 1.00 0.00 C ATOM 1711 NH1 ARG A 124 -17.820 -8.821 5.560 1.00 0.00 N ATOM 1712 NH2 ARG A 124 -17.547 -6.571 5.907 1.00 0.00 N ATOM 0 H ARG A 124 -13.788 -6.101 1.476 1.00 0.00 H new ATOM 0 HA ARG A 124 -11.885 -7.775 2.982 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -14.719 -7.495 2.948 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -14.377 -9.048 2.211 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -13.230 -9.840 4.157 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -13.131 -8.234 4.850 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -15.744 -9.706 4.332 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -14.909 -9.705 5.872 1.00 0.00 H new ATOM 0 HE ARG A 124 -15.164 -7.019 5.361 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -17.431 -9.733 5.321 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -18.814 -8.730 5.771 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -16.947 -5.746 5.936 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -18.542 -6.486 6.117 1.00 0.00 H new ATOM 1726 N ILE A 125 -11.202 -9.258 1.135 1.00 0.00 N ATOM 1727 CA ILE A 125 -10.721 -10.082 0.033 1.00 0.00 C ATOM 1728 C ILE A 125 -10.705 -11.555 0.423 1.00 0.00 C ATOM 1729 O ILE A 125 -10.055 -11.943 1.394 1.00 0.00 O ATOM 1730 CB ILE A 125 -9.304 -9.663 -0.405 1.00 0.00 C ATOM 1731 CG1 ILE A 125 -9.223 -8.143 -0.569 1.00 0.00 C ATOM 1732 CG2 ILE A 125 -8.922 -10.363 -1.701 1.00 0.00 C ATOM 1733 CD1 ILE A 125 -8.574 -7.443 0.604 1.00 0.00 C ATOM 0 H ILE A 125 -10.626 -9.300 1.976 1.00 0.00 H new ATOM 0 HA ILE A 125 -11.408 -9.934 -0.800 1.00 0.00 H new ATOM 0 HB ILE A 125 -8.598 -9.962 0.369 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -8.662 -7.913 -1.475 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -10.229 -7.746 -0.707 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -7.919 -10.057 -1.998 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -8.943 -11.442 -1.551 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -9.630 -10.092 -2.484 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -8.551 -6.369 0.419 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -9.147 -7.643 1.509 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -7.556 -7.812 0.730 1.00 0.00 H new ATOM 1745 N VAL A 126 -11.426 -12.373 -0.336 1.00 0.00 N ATOM 1746 CA VAL A 126 -11.494 -13.803 -0.066 1.00 0.00 C ATOM 1747 C VAL A 126 -10.791 -14.606 -1.154 1.00 0.00 C ATOM 1748 O VAL A 126 -11.117 -14.490 -2.335 1.00 0.00 O ATOM 1749 CB VAL A 126 -12.951 -14.286 0.052 1.00 0.00 C ATOM 1750 CG1 VAL A 126 -12.999 -15.725 0.542 1.00 0.00 C ATOM 1751 CG2 VAL A 126 -13.743 -13.374 0.977 1.00 0.00 C ATOM 0 H VAL A 126 -11.971 -12.070 -1.143 1.00 0.00 H new ATOM 0 HA VAL A 126 -10.987 -13.966 0.885 1.00 0.00 H new ATOM 0 HB VAL A 126 -13.408 -14.248 -0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -14.037 -16.049 0.619 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -12.470 -16.367 -0.162 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -12.524 -15.792 1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -14.770 -13.731 1.048 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -13.288 -13.377 1.968 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -13.738 -12.359 0.579 1.00 0.00 H new ATOM 1761 N PHE A 127 -9.826 -15.423 -0.745 1.00 0.00 N ATOM 1762 CA PHE A 127 -9.075 -16.251 -1.680 1.00 0.00 C ATOM 1763 C PHE A 127 -9.219 -17.728 -1.332 1.00 0.00 C ATOM 1764 O PHE A 127 -9.070 -18.120 -0.175 1.00 0.00 O ATOM 1765 CB PHE A 127 -7.598 -15.854 -1.675 1.00 0.00 C ATOM 1766 CG PHE A 127 -7.259 -14.790 -2.679 1.00 0.00 C ATOM 1767 CD1 PHE A 127 -7.290 -15.066 -4.036 1.00 0.00 C ATOM 1768 CD2 PHE A 127 -6.911 -13.515 -2.266 1.00 0.00 C ATOM 1769 CE1 PHE A 127 -6.979 -14.091 -4.963 1.00 0.00 C ATOM 1770 CE2 PHE A 127 -6.598 -12.534 -3.188 1.00 0.00 C ATOM 1771 CZ PHE A 127 -6.633 -12.823 -4.539 1.00 0.00 C ATOM 0 H PHE A 127 -9.546 -15.529 0.230 1.00 0.00 H new ATOM 0 HA PHE A 127 -9.482 -16.090 -2.678 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -7.328 -15.502 -0.679 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -6.992 -16.738 -1.876 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -7.561 -16.056 -4.373 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -6.884 -13.284 -1.211 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -7.006 -14.320 -6.018 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -6.327 -11.544 -2.853 1.00 0.00 H new ATOM 0 HZ PHE A 127 -6.390 -12.058 -5.262 1.00 0.00 H new ATOM 1781 N GLY A 128 -9.513 -18.542 -2.338 1.00 0.00 N ATOM 1782 CA GLY A 128 -9.674 -19.966 -2.115 1.00 0.00 C ATOM 1783 C GLY A 128 -11.116 -20.346 -1.848 1.00 0.00 C ATOM 1784 O GLY A 128 -11.760 -20.985 -2.679 1.00 0.00 O ATOM 0 H GLY A 128 -9.643 -18.242 -3.304 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -9.312 -20.511 -2.987 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -9.057 -20.271 -1.270 1.00 0.00 H new ATOM 1788 N LYS A 129 -11.626 -19.949 -0.684 1.00 0.00 N ATOM 1789 CA LYS A 129 -13.006 -20.250 -0.310 1.00 0.00 C ATOM 1790 C LYS A 129 -13.315 -19.768 1.105 1.00 0.00 C ATOM 1791 O LYS A 129 -14.438 -19.356 1.396 1.00 0.00 O ATOM 1792 CB LYS A 129 -13.273 -21.755 -0.411 1.00 0.00 C ATOM 1793 CG LYS A 129 -12.247 -22.607 0.320 1.00 0.00 C ATOM 1794 CD LYS A 129 -11.419 -23.436 -0.648 1.00 0.00 C ATOM 1795 CE LYS A 129 -10.168 -23.984 0.018 1.00 0.00 C ATOM 1796 NZ LYS A 129 -9.348 -24.798 -0.921 1.00 0.00 N ATOM 0 H LYS A 129 -11.106 -19.419 0.015 1.00 0.00 H new ATOM 0 HA LYS A 129 -13.658 -19.721 -1.005 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.263 -21.968 -0.007 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.289 -22.043 -1.462 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -11.589 -21.964 0.905 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -12.755 -23.267 1.023 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -12.021 -24.261 -1.029 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -11.138 -22.824 -1.505 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -9.569 -23.157 0.400 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -10.451 -24.595 0.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -9.504 -25.809 -0.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -9.625 -24.582 -1.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -8.342 -24.572 -0.788 1.00 0.00 H new ATOM 1810 N SER A 130 -12.320 -19.829 1.987 1.00 0.00 N ATOM 1811 CA SER A 130 -12.503 -19.406 3.371 1.00 0.00 C ATOM 1812 C SER A 130 -11.546 -18.279 3.746 1.00 0.00 C ATOM 1813 O SER A 130 -11.913 -17.362 4.481 1.00 0.00 O ATOM 1814 CB SER A 130 -12.302 -20.592 4.316 1.00 0.00 C ATOM 1815 OG SER A 130 -11.003 -21.140 4.178 1.00 0.00 O ATOM 0 H SER A 130 -11.383 -20.166 1.768 1.00 0.00 H new ATOM 0 HA SER A 130 -13.521 -19.030 3.469 1.00 0.00 H new ATOM 0 HB2 SER A 130 -12.457 -20.271 5.346 1.00 0.00 H new ATOM 0 HB3 SER A 130 -13.048 -21.359 4.106 1.00 0.00 H new ATOM 0 HG SER A 130 -10.899 -21.895 4.794 1.00 0.00 H new ATOM 1821 N CYS A 131 -10.315 -18.351 3.246 1.00 0.00 N ATOM 1822 CA CYS A 131 -9.310 -17.333 3.545 1.00 0.00 C ATOM 1823 C CYS A 131 -9.831 -15.934 3.234 1.00 0.00 C ATOM 1824 O CYS A 131 -9.926 -15.537 2.073 1.00 0.00 O ATOM 1825 CB CYS A 131 -8.027 -17.595 2.757 1.00 0.00 C ATOM 1826 SG CYS A 131 -7.418 -19.293 2.876 1.00 0.00 S ATOM 0 H CYS A 131 -9.990 -19.100 2.635 1.00 0.00 H new ATOM 0 HA CYS A 131 -9.091 -17.390 4.611 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -8.203 -17.357 1.708 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -7.251 -16.917 3.112 1.00 0.00 H new ATOM 0 HG CYS A 131 -7.178 -19.752 1.684 1.00 0.00 H new ATOM 1832 N SER A 132 -10.167 -15.192 4.284 1.00 0.00 N ATOM 1833 CA SER A 132 -10.678 -13.833 4.135 1.00 0.00 C ATOM 1834 C SER A 132 -9.835 -12.843 4.935 1.00 0.00 C ATOM 1835 O SER A 132 -9.493 -13.098 6.090 1.00 0.00 O ATOM 1836 CB SER A 132 -12.137 -13.762 4.589 1.00 0.00 C ATOM 1837 OG SER A 132 -12.280 -14.224 5.923 1.00 0.00 O ATOM 0 H SER A 132 -10.094 -15.510 5.251 1.00 0.00 H new ATOM 0 HA SER A 132 -10.619 -13.563 3.081 1.00 0.00 H new ATOM 0 HB2 SER A 132 -12.494 -12.735 4.516 1.00 0.00 H new ATOM 0 HB3 SER A 132 -12.758 -14.363 3.924 1.00 0.00 H new ATOM 0 HG SER A 132 -13.221 -14.167 6.190 1.00 0.00 H new ATOM 1843 N PHE A 133 -9.504 -11.714 4.316 1.00 0.00 N ATOM 1844 CA PHE A 133 -8.701 -10.690 4.978 1.00 0.00 C ATOM 1845 C PHE A 133 -9.175 -9.290 4.603 1.00 0.00 C ATOM 1846 O PHE A 133 -9.780 -9.088 3.550 1.00 0.00 O ATOM 1847 CB PHE A 133 -7.225 -10.850 4.615 1.00 0.00 C ATOM 1848 CG PHE A 133 -6.984 -11.032 3.143 1.00 0.00 C ATOM 1849 CD1 PHE A 133 -7.352 -12.205 2.507 1.00 0.00 C ATOM 1850 CD2 PHE A 133 -6.389 -10.027 2.398 1.00 0.00 C ATOM 1851 CE1 PHE A 133 -7.132 -12.373 1.153 1.00 0.00 C ATOM 1852 CE2 PHE A 133 -6.166 -10.189 1.044 1.00 0.00 C ATOM 1853 CZ PHE A 133 -6.539 -11.363 0.420 1.00 0.00 C ATOM 0 H PHE A 133 -9.778 -11.485 3.361 1.00 0.00 H new ATOM 0 HA PHE A 133 -8.821 -10.819 6.054 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.678 -9.972 4.958 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -6.819 -11.708 5.150 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -7.816 -12.998 3.075 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -6.096 -9.106 2.881 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -7.423 -13.293 0.668 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.700 -9.398 0.474 1.00 0.00 H new ATOM 0 HZ PHE A 133 -6.368 -11.491 -0.639 1.00 0.00 H new ATOM 1863 N LEU A 134 -8.886 -8.326 5.471 1.00 0.00 N ATOM 1864 CA LEU A 134 -9.271 -6.940 5.233 1.00 0.00 C ATOM 1865 C LEU A 134 -8.037 -6.063 5.063 1.00 0.00 C ATOM 1866 O LEU A 134 -7.275 -5.856 6.007 1.00 0.00 O ATOM 1867 CB LEU A 134 -10.126 -6.412 6.389 1.00 0.00 C ATOM 1868 CG LEU A 134 -11.057 -5.250 6.036 1.00 0.00 C ATOM 1869 CD1 LEU A 134 -10.284 -4.132 5.353 1.00 0.00 C ATOM 1870 CD2 LEU A 134 -12.198 -5.730 5.153 1.00 0.00 C ATOM 0 H LEU A 134 -8.386 -8.480 6.347 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.858 -6.906 4.315 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -10.728 -7.233 6.778 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -9.463 -6.093 7.193 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.480 -4.857 6.960 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -10.964 -3.315 5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -9.504 -3.768 6.021 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.830 -4.510 4.437 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.850 -4.890 4.912 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -11.793 -6.151 4.233 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -12.770 -6.493 5.680 1.00 0.00 H new ATOM 1882 N PHE A 135 -7.848 -5.545 3.855 1.00 0.00 N ATOM 1883 CA PHE A 135 -6.708 -4.687 3.565 1.00 0.00 C ATOM 1884 C PHE A 135 -7.055 -3.234 3.780 1.00 0.00 C ATOM 1885 O PHE A 135 -8.156 -2.780 3.468 1.00 0.00 O ATOM 1886 CB PHE A 135 -6.202 -4.880 2.149 1.00 0.00 C ATOM 1887 CG PHE A 135 -5.049 -3.991 1.778 1.00 0.00 C ATOM 1888 CD1 PHE A 135 -3.952 -3.868 2.613 1.00 0.00 C ATOM 1889 CD2 PHE A 135 -5.065 -3.280 0.588 1.00 0.00 C ATOM 1890 CE1 PHE A 135 -2.891 -3.052 2.270 1.00 0.00 C ATOM 1891 CE2 PHE A 135 -4.008 -2.463 0.239 1.00 0.00 C ATOM 1892 CZ PHE A 135 -2.919 -2.348 1.081 1.00 0.00 C ATOM 0 H PHE A 135 -8.469 -5.705 3.062 1.00 0.00 H new ATOM 0 HA PHE A 135 -5.916 -4.974 4.256 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -5.900 -5.920 2.022 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -7.023 -4.700 1.455 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -3.925 -4.416 3.543 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -5.914 -3.366 -0.074 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -2.041 -2.964 2.930 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -4.033 -1.915 -0.691 1.00 0.00 H new ATOM 0 HZ PHE A 135 -2.091 -1.709 0.811 1.00 0.00 H new ATOM 1902 N LYS A 136 -6.091 -2.530 4.326 1.00 0.00 N ATOM 1903 CA LYS A 136 -6.229 -1.105 4.620 1.00 0.00 C ATOM 1904 C LYS A 136 -4.867 -0.411 4.654 1.00 0.00 C ATOM 1905 O LYS A 136 -3.840 -1.056 4.867 1.00 0.00 O ATOM 1906 CB LYS A 136 -6.945 -0.909 5.956 1.00 0.00 C ATOM 1907 CG LYS A 136 -8.460 -0.931 5.844 1.00 0.00 C ATOM 1908 CD LYS A 136 -9.123 -0.460 7.127 1.00 0.00 C ATOM 1909 CE LYS A 136 -9.635 -1.628 7.954 1.00 0.00 C ATOM 1910 NZ LYS A 136 -10.989 -1.361 8.515 1.00 0.00 N ATOM 0 H LYS A 136 -5.184 -2.921 4.583 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.821 -0.655 3.823 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -6.629 -1.691 6.646 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -6.635 0.042 6.389 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -8.773 -0.294 5.017 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -8.793 -1.942 5.612 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -8.410 0.118 7.715 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -9.951 0.206 6.886 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -9.669 -2.524 7.334 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -8.938 -1.830 8.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -11.302 -2.182 9.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -10.952 -0.521 9.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -11.660 -1.194 7.738 1.00 0.00 H new ATOM 1924 N TYR A 137 -4.865 0.908 4.457 1.00 0.00 N ATOM 1925 CA TYR A 137 -3.625 1.682 4.483 1.00 0.00 C ATOM 1926 C TYR A 137 -3.157 1.883 5.916 1.00 0.00 C ATOM 1927 O TYR A 137 -3.958 2.109 6.822 1.00 0.00 O ATOM 1928 CB TYR A 137 -3.775 3.049 3.821 1.00 0.00 C ATOM 1929 CG TYR A 137 -4.269 3.016 2.388 1.00 0.00 C ATOM 1930 CD1 TYR A 137 -3.498 2.450 1.380 1.00 0.00 C ATOM 1931 CD2 TYR A 137 -5.496 3.569 2.040 1.00 0.00 C ATOM 1932 CE1 TYR A 137 -3.936 2.430 0.069 1.00 0.00 C ATOM 1933 CE2 TYR A 137 -5.941 3.555 0.730 1.00 0.00 C ATOM 1934 CZ TYR A 137 -5.159 2.983 -0.253 1.00 0.00 C ATOM 1935 OH TYR A 137 -5.597 2.968 -1.557 1.00 0.00 O ATOM 0 H TYR A 137 -5.704 1.460 4.279 1.00 0.00 H new ATOM 0 HA TYR A 137 -2.890 1.108 3.918 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -4.465 3.649 4.414 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -2.810 3.556 3.845 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -2.539 2.018 1.625 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -6.112 4.017 2.805 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -3.324 1.983 -0.700 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -6.897 3.990 0.478 1.00 0.00 H new ATOM 0 HH TYR A 137 -4.969 3.468 -2.119 1.00 0.00 H new ATOM 1945 N ALA A 138 -1.855 1.798 6.103 1.00 0.00 N ATOM 1946 CA ALA A 138 -1.252 1.968 7.421 1.00 0.00 C ATOM 1947 C ALA A 138 -0.312 3.168 7.445 1.00 0.00 C ATOM 1948 O ALA A 138 0.682 3.176 8.173 1.00 0.00 O ATOM 1949 CB ALA A 138 -0.508 0.706 7.826 1.00 0.00 C ATOM 0 H ALA A 138 -1.186 1.611 5.357 1.00 0.00 H new ATOM 0 HA ALA A 138 -2.052 2.152 8.138 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -0.063 0.846 8.811 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -1.204 -0.132 7.858 1.00 0.00 H new ATOM 0 HB3 ALA A 138 0.277 0.498 7.099 1.00 0.00 H new