USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=29 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 121 ASN : amide:sc= -17.6! C(o=-16!,f=-26!) USER MOD Set 1.2: A 137 TYR OH : rot -28:sc= 1.25 USER MOD Set 2.1: A 33 CYS SG : rot 180:sc= -2.28 USER MOD Set 2.2: A 36 HIS : no HD1:sc= -6.87! C(o=-9.1!,f=-11!) USER MOD Set 2.3: A 47 LYS NZ :NH3+ 175:sc= 0 (180deg=0) USER MOD Set 3.1: A 32 THR OG1 : rot 180:sc= 0.616 USER MOD Set 3.2: A 52 ASN : amide:sc= -1.55 X(o=-0.93,f=-0.59!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 ASN :FLIP amide:sc= -1.47 F(o=-2,f=-1.5) USER MOD Single : A 44 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0148) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0129 USER MOD Single : A 54 ASN : amide:sc= -0.754 K(o=-0.75,f=-4.4!) USER MOD Single : A 56 THR OG1 : rot 140:sc= 0 USER MOD Single : A 57 THR OG1 : rot -169:sc= -0.92 USER MOD Single : A 61 SER OG : rot 180:sc= -0.146 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot 180:sc= -3.05 USER MOD Single : A 69 SER OG : rot 180:sc= -1.32 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 HE2:sc= -1.7 X(o=-1.7,f=-2) USER MOD Single : A 81 HIS :FLIP no HD1:sc= -1.27 F(o=-2.1,f=-1.3) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -0.0012 X(o=-0.0012,f=-0.19) USER MOD Single : A 91 GLN : amide:sc= -0.476 K(o=-0.48,f=-4.6!) USER MOD Single : A 93 ASN : amide:sc= -0.681 K(o=-0.68,f=-4.1!) USER MOD Single : A 96 ASN :FLIP amide:sc= -0.172 F(o=-1.8,f=-0.17) USER MOD Single : A 100 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0908) USER MOD Single : A 101 SER OG : rot 89:sc= -0.467 USER MOD Single : A 103 ASN : amide:sc= -0.0235 X(o=-0.024,f=-0.18) USER MOD Single : A 105 THR OG1 : rot -112:sc= 0.835 USER MOD Single : A 108 ASN :FLIP amide:sc= 0 F(o=-2.1,f=0) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.104) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ -154:sc= -0.313 (180deg=-0.417) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 CYS SG : rot 150:sc= 0.0464 USER MOD Single : A 132 SER OG : rot 67:sc= -0.813 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 203 N TYR A 31 11.666 -3.988 1.794 1.00 0.00 N ATOM 204 CA TYR A 31 11.296 -2.803 1.031 1.00 0.00 C ATOM 205 C TYR A 31 10.851 -1.676 1.973 1.00 0.00 C ATOM 206 O TYR A 31 11.605 -1.275 2.860 1.00 0.00 O ATOM 207 CB TYR A 31 10.195 -3.161 0.027 1.00 0.00 C ATOM 208 CG TYR A 31 10.666 -4.063 -1.091 1.00 0.00 C ATOM 209 CD1 TYR A 31 10.675 -5.443 -0.936 1.00 0.00 C ATOM 210 CD2 TYR A 31 11.101 -3.535 -2.300 1.00 0.00 C ATOM 211 CE1 TYR A 31 11.106 -6.272 -1.954 1.00 0.00 C ATOM 212 CE2 TYR A 31 11.532 -4.358 -3.322 1.00 0.00 C ATOM 213 CZ TYR A 31 11.533 -5.725 -3.145 1.00 0.00 C ATOM 214 OH TYR A 31 11.962 -6.547 -4.161 1.00 0.00 O ATOM 0 HA TYR A 31 12.163 -2.444 0.477 1.00 0.00 H new ATOM 0 HB2 TYR A 31 9.377 -3.649 0.556 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.794 -2.243 -0.402 1.00 0.00 H new ATOM 0 HD1 TYR A 31 10.340 -5.875 -0.005 1.00 0.00 H new ATOM 0 HD2 TYR A 31 11.102 -2.465 -2.443 1.00 0.00 H new ATOM 0 HE1 TYR A 31 11.108 -7.343 -1.817 1.00 0.00 H new ATOM 0 HE2 TYR A 31 11.867 -3.932 -4.256 1.00 0.00 H new ATOM 0 HH TYR A 31 12.228 -6.003 -4.932 1.00 0.00 H new ATOM 224 N THR A 32 9.629 -1.170 1.794 1.00 0.00 N ATOM 225 CA THR A 32 9.110 -0.106 2.643 1.00 0.00 C ATOM 226 C THR A 32 7.651 -0.374 2.998 1.00 0.00 C ATOM 227 O THR A 32 6.827 -0.641 2.124 1.00 0.00 O ATOM 228 CB THR A 32 9.241 1.252 1.947 1.00 0.00 C ATOM 229 OG1 THR A 32 10.056 1.151 0.793 1.00 0.00 O ATOM 230 CG2 THR A 32 9.837 2.321 2.837 1.00 0.00 C ATOM 0 H THR A 32 8.984 -1.482 1.068 1.00 0.00 H new ATOM 0 HA THR A 32 9.697 -0.084 3.561 1.00 0.00 H new ATOM 0 HB THR A 32 8.223 1.542 1.685 1.00 0.00 H new ATOM 0 HG1 THR A 32 10.125 2.029 0.363 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.903 3.259 2.285 1.00 0.00 H new ATOM 0 HG22 THR A 32 9.204 2.460 3.713 1.00 0.00 H new ATOM 0 HG23 THR A 32 10.834 2.016 3.154 1.00 0.00 H new ATOM 238 N CYS A 33 7.341 -0.307 4.287 1.00 0.00 N ATOM 239 CA CYS A 33 5.983 -0.550 4.758 1.00 0.00 C ATOM 240 C CYS A 33 5.003 0.442 4.141 1.00 0.00 C ATOM 241 O CYS A 33 5.339 1.604 3.911 1.00 0.00 O ATOM 242 CB CYS A 33 5.929 -0.455 6.282 1.00 0.00 C ATOM 243 SG CYS A 33 4.668 -1.505 7.043 1.00 0.00 S ATOM 0 H CYS A 33 8.011 -0.087 5.024 1.00 0.00 H new ATOM 0 HA CYS A 33 5.693 -1.555 4.450 1.00 0.00 H new ATOM 0 HB2 CYS A 33 6.904 -0.725 6.687 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.743 0.581 6.564 1.00 0.00 H new ATOM 0 HG CYS A 33 4.701 -1.356 8.334 1.00 0.00 H new ATOM 249 N LEU A 34 3.788 -0.027 3.874 1.00 0.00 N ATOM 250 CA LEU A 34 2.754 0.815 3.282 1.00 0.00 C ATOM 251 C LEU A 34 1.366 0.378 3.746 1.00 0.00 C ATOM 252 O LEU A 34 0.538 1.206 4.124 1.00 0.00 O ATOM 253 CB LEU A 34 2.839 0.759 1.755 1.00 0.00 C ATOM 254 CG LEU A 34 3.040 2.110 1.066 1.00 0.00 C ATOM 255 CD1 LEU A 34 3.249 1.921 -0.428 1.00 0.00 C ATOM 256 CD2 LEU A 34 1.852 3.022 1.331 1.00 0.00 C ATOM 0 H LEU A 34 3.495 -0.986 4.058 1.00 0.00 H new ATOM 0 HA LEU A 34 2.919 1.841 3.611 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.662 0.101 1.476 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.925 0.306 1.372 1.00 0.00 H new ATOM 0 HG LEU A 34 3.933 2.580 1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 34 3.390 2.893 -0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.131 1.303 -0.597 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.376 1.431 -0.858 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.010 3.979 0.834 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.944 2.558 0.945 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.749 3.183 2.404 1.00 0.00 H new ATOM 268 N GLY A 35 1.121 -0.927 3.713 1.00 0.00 N ATOM 269 CA GLY A 35 -0.165 -1.454 4.131 1.00 0.00 C ATOM 270 C GLY A 35 -0.042 -2.786 4.844 1.00 0.00 C ATOM 271 O GLY A 35 1.060 -3.313 5.003 1.00 0.00 O ATOM 0 H GLY A 35 1.791 -1.631 3.404 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.651 -0.736 4.791 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.807 -1.571 3.258 1.00 0.00 H new ATOM 275 N HIS A 36 -1.174 -3.334 5.269 1.00 0.00 N ATOM 276 CA HIS A 36 -1.189 -4.617 5.962 1.00 0.00 C ATOM 277 C HIS A 36 -2.458 -5.391 5.631 1.00 0.00 C ATOM 278 O HIS A 36 -3.464 -4.810 5.226 1.00 0.00 O ATOM 279 CB HIS A 36 -1.082 -4.420 7.475 1.00 0.00 C ATOM 280 CG HIS A 36 0.199 -3.785 7.914 1.00 0.00 C ATOM 281 ND1 HIS A 36 0.532 -2.478 7.630 1.00 0.00 N ATOM 282 CD2 HIS A 36 1.231 -4.288 8.627 1.00 0.00 C ATOM 283 CE1 HIS A 36 1.716 -2.206 8.148 1.00 0.00 C ATOM 284 NE2 HIS A 36 2.162 -3.288 8.759 1.00 0.00 N ATOM 0 H HIS A 36 -2.094 -2.910 5.146 1.00 0.00 H new ATOM 0 HA HIS A 36 -0.326 -5.190 5.622 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -1.916 -3.803 7.811 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -1.183 -5.388 7.966 1.00 0.00 H new ATOM 0 HD2 HIS A 36 1.309 -5.291 9.020 1.00 0.00 H new ATOM 0 HE1 HIS A 36 2.232 -1.259 8.083 1.00 0.00 H new ATOM 0 HE2 HIS A 36 3.053 -3.368 9.249 1.00 0.00 H new ATOM 293 N LEU A 37 -2.403 -6.705 5.806 1.00 0.00 N ATOM 294 CA LEU A 37 -3.549 -7.562 5.523 1.00 0.00 C ATOM 295 C LEU A 37 -3.966 -8.346 6.763 1.00 0.00 C ATOM 296 O LEU A 37 -3.212 -9.179 7.266 1.00 0.00 O ATOM 297 CB LEU A 37 -3.220 -8.526 4.382 1.00 0.00 C ATOM 298 CG LEU A 37 -2.659 -7.865 3.121 1.00 0.00 C ATOM 299 CD1 LEU A 37 -1.580 -8.735 2.495 1.00 0.00 C ATOM 300 CD2 LEU A 37 -3.774 -7.594 2.122 1.00 0.00 C ATOM 0 H LEU A 37 -1.578 -7.201 6.142 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.381 -6.925 5.224 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.498 -9.259 4.742 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.124 -9.073 4.116 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.209 -6.913 3.403 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.194 -8.248 1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.769 -8.878 3.209 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.003 -9.703 2.227 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.358 -7.124 1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.252 -8.534 1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.512 -6.930 2.572 1.00 0.00 H new ATOM 312 N VAL A 38 -5.174 -8.076 7.246 1.00 0.00 N ATOM 313 CA VAL A 38 -5.694 -8.758 8.425 1.00 0.00 C ATOM 314 C VAL A 38 -6.666 -9.864 8.032 1.00 0.00 C ATOM 315 O VAL A 38 -7.673 -9.614 7.369 1.00 0.00 O ATOM 316 CB VAL A 38 -6.407 -7.777 9.373 1.00 0.00 C ATOM 317 CG1 VAL A 38 -6.765 -8.464 10.682 1.00 0.00 C ATOM 318 CG2 VAL A 38 -5.540 -6.553 9.625 1.00 0.00 C ATOM 0 H VAL A 38 -5.811 -7.390 6.840 1.00 0.00 H new ATOM 0 HA VAL A 38 -4.839 -9.194 8.943 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.331 -7.448 8.898 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -7.268 -7.755 11.339 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -7.427 -9.306 10.482 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.856 -8.824 11.164 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.060 -5.871 10.297 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -4.598 -6.861 10.079 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.339 -6.048 8.680 1.00 0.00 H new ATOM 328 N ASN A 39 -6.358 -11.089 8.443 1.00 0.00 N ATOM 329 CA ASN A 39 -7.204 -12.234 8.135 1.00 0.00 C ATOM 330 C ASN A 39 -8.253 -12.443 9.221 1.00 0.00 C ATOM 331 O ASN A 39 -7.920 -12.719 10.374 1.00 0.00 O ATOM 332 CB ASN A 39 -6.354 -13.497 7.979 1.00 0.00 C ATOM 333 CG ASN A 39 -5.997 -13.779 6.533 1.00 0.00 C ATOM 334 OD1 ASN A 39 -5.092 -12.981 5.980 1.00 0.00 O flip ATOM 335 ND2 ASN A 39 -6.528 -14.705 5.920 1.00 0.00 N flip ATOM 0 H ASN A 39 -5.528 -11.314 8.991 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.717 -12.032 7.194 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -5.439 -13.390 8.562 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -6.896 -14.349 8.389 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -7.219 -15.294 6.384 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -6.277 -14.883 4.948 1.00 0.00 H new ATOM 342 N LEU A 40 -9.522 -12.309 8.846 1.00 0.00 N ATOM 343 CA LEU A 40 -10.618 -12.486 9.790 1.00 0.00 C ATOM 344 C LEU A 40 -10.763 -13.952 10.183 1.00 0.00 C ATOM 345 O LEU A 40 -11.229 -14.773 9.394 1.00 0.00 O ATOM 346 CB LEU A 40 -11.928 -11.975 9.185 1.00 0.00 C ATOM 347 CG LEU A 40 -12.051 -10.453 9.092 1.00 0.00 C ATOM 348 CD1 LEU A 40 -11.508 -9.953 7.763 1.00 0.00 C ATOM 349 CD2 LEU A 40 -13.500 -10.024 9.273 1.00 0.00 C ATOM 0 H LEU A 40 -9.815 -12.079 7.897 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.391 -11.908 10.686 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -12.036 -12.394 8.185 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.758 -12.355 9.781 1.00 0.00 H new ATOM 0 HG LEU A 40 -11.458 -10.010 9.892 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.604 -8.868 7.716 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.457 -10.228 7.672 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -12.073 -10.403 6.947 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -13.569 -8.938 9.204 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -14.114 -10.477 8.494 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.856 -10.349 10.251 1.00 0.00 H new ATOM 361 N ILE A 41 -10.359 -14.272 11.407 1.00 0.00 N ATOM 362 CA ILE A 41 -10.441 -15.639 11.909 1.00 0.00 C ATOM 363 C ILE A 41 -11.242 -15.697 13.208 1.00 0.00 C ATOM 364 O ILE A 41 -11.095 -14.832 14.072 1.00 0.00 O ATOM 365 CB ILE A 41 -9.040 -16.227 12.151 1.00 0.00 C ATOM 366 CG1 ILE A 41 -8.154 -16.000 10.928 1.00 0.00 C ATOM 367 CG2 ILE A 41 -9.133 -17.711 12.472 1.00 0.00 C ATOM 368 CD1 ILE A 41 -8.701 -16.616 9.658 1.00 0.00 C ATOM 0 H ILE A 41 -9.971 -13.602 12.071 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.948 -16.232 11.148 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.592 -15.719 13.005 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -8.027 -14.928 10.776 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -7.165 -16.413 11.125 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -8.133 -18.110 12.640 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -9.736 -17.852 13.369 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -9.597 -18.236 11.637 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.019 -16.414 8.832 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.802 -17.693 9.790 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.677 -16.185 9.436 1.00 0.00 H new ATOM 380 N PRO A 42 -12.105 -16.718 13.369 1.00 0.00 N ATOM 381 CA PRO A 42 -12.927 -16.873 14.574 1.00 0.00 C ATOM 382 C PRO A 42 -12.137 -16.633 15.858 1.00 0.00 C ATOM 383 O PRO A 42 -12.691 -16.195 16.867 1.00 0.00 O ATOM 384 CB PRO A 42 -13.390 -18.326 14.489 1.00 0.00 C ATOM 385 CG PRO A 42 -13.454 -18.609 13.027 1.00 0.00 C ATOM 386 CD PRO A 42 -12.352 -17.799 12.393 1.00 0.00 C ATOM 0 HA PRO A 42 -13.741 -16.149 14.612 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -12.693 -18.995 14.993 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.362 -18.462 14.963 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -13.318 -19.672 12.830 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -14.426 -18.331 12.619 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -11.458 -18.400 12.227 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.654 -17.402 11.424 1.00 0.00 H new ATOM 394 N GLY A 43 -10.840 -16.919 15.813 1.00 0.00 N ATOM 395 CA GLY A 43 -9.994 -16.724 16.976 1.00 0.00 C ATOM 396 C GLY A 43 -8.892 -15.714 16.723 1.00 0.00 C ATOM 397 O GLY A 43 -9.162 -14.567 16.366 1.00 0.00 O ATOM 0 H GLY A 43 -10.359 -17.283 14.990 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -10.605 -16.390 17.815 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.551 -17.677 17.264 1.00 0.00 H new ATOM 401 N LYS A 44 -7.646 -16.139 16.909 1.00 0.00 N ATOM 402 CA LYS A 44 -6.499 -15.266 16.700 1.00 0.00 C ATOM 403 C LYS A 44 -6.528 -14.647 15.305 1.00 0.00 C ATOM 404 O LYS A 44 -6.849 -15.316 14.325 1.00 0.00 O ATOM 405 CB LYS A 44 -5.197 -16.045 16.897 1.00 0.00 C ATOM 406 CG LYS A 44 -4.654 -15.972 18.316 1.00 0.00 C ATOM 407 CD LYS A 44 -4.253 -17.343 18.834 1.00 0.00 C ATOM 408 CE LYS A 44 -5.344 -17.955 19.699 1.00 0.00 C ATOM 409 NZ LYS A 44 -6.111 -19.001 18.970 1.00 0.00 N ATOM 0 H LYS A 44 -7.406 -17.085 17.205 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.550 -14.462 17.434 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.365 -17.089 16.634 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -4.445 -15.660 16.209 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.791 -15.306 18.342 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.409 -15.541 18.973 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -4.042 -18.003 17.993 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.333 -17.259 19.413 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.897 -18.390 20.593 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -6.025 -17.172 20.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.927 -19.296 19.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -6.446 -18.617 18.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.497 -19.822 18.793 1.00 0.00 H new ATOM 423 N GLU A 45 -6.193 -13.363 15.226 1.00 0.00 N ATOM 424 CA GLU A 45 -6.182 -12.654 13.951 1.00 0.00 C ATOM 425 C GLU A 45 -4.816 -12.760 13.279 1.00 0.00 C ATOM 426 O GLU A 45 -3.790 -12.864 13.950 1.00 0.00 O ATOM 427 CB GLU A 45 -6.547 -11.184 14.159 1.00 0.00 C ATOM 428 CG GLU A 45 -8.038 -10.906 14.047 1.00 0.00 C ATOM 429 CD GLU A 45 -8.367 -9.433 14.182 1.00 0.00 C ATOM 430 OE1 GLU A 45 -8.297 -8.713 13.164 1.00 0.00 O ATOM 431 OE2 GLU A 45 -8.695 -8.998 15.306 1.00 0.00 O ATOM 0 H GLU A 45 -5.926 -12.793 16.028 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.923 -13.118 13.300 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.200 -10.868 15.143 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.017 -10.579 13.424 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.400 -11.269 13.085 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.567 -11.465 14.819 1.00 0.00 H new ATOM 438 N GLN A 46 -4.812 -12.733 11.950 1.00 0.00 N ATOM 439 CA GLN A 46 -3.571 -12.825 11.188 1.00 0.00 C ATOM 440 C GLN A 46 -3.279 -11.515 10.463 1.00 0.00 C ATOM 441 O GLN A 46 -3.949 -11.168 9.492 1.00 0.00 O ATOM 442 CB GLN A 46 -3.650 -13.976 10.183 1.00 0.00 C ATOM 443 CG GLN A 46 -2.761 -15.157 10.540 1.00 0.00 C ATOM 444 CD GLN A 46 -3.547 -16.433 10.773 1.00 0.00 C ATOM 445 OE1 GLN A 46 -3.587 -16.956 11.887 1.00 0.00 O ATOM 446 NE2 GLN A 46 -4.176 -16.940 9.720 1.00 0.00 N ATOM 0 H GLN A 46 -5.653 -12.648 11.379 1.00 0.00 H new ATOM 0 HA GLN A 46 -2.757 -13.019 11.886 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -4.683 -14.317 10.114 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -3.370 -13.606 9.197 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -2.041 -15.320 9.738 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -2.190 -14.918 11.437 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -4.115 -16.472 8.816 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -4.721 -17.797 9.815 1.00 0.00 H new ATOM 455 N LYS A 47 -2.273 -10.790 10.944 1.00 0.00 N ATOM 456 CA LYS A 47 -1.891 -9.519 10.342 1.00 0.00 C ATOM 457 C LYS A 47 -0.597 -9.659 9.548 1.00 0.00 C ATOM 458 O LYS A 47 0.412 -10.138 10.064 1.00 0.00 O ATOM 459 CB LYS A 47 -1.724 -8.448 11.424 1.00 0.00 C ATOM 460 CG LYS A 47 -1.645 -7.033 10.873 1.00 0.00 C ATOM 461 CD LYS A 47 -0.263 -6.431 11.074 1.00 0.00 C ATOM 462 CE LYS A 47 -0.338 -4.933 11.317 1.00 0.00 C ATOM 463 NZ LYS A 47 0.935 -4.399 11.876 1.00 0.00 N ATOM 0 H LYS A 47 -1.708 -11.062 11.749 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.685 -9.217 9.659 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.561 -8.512 12.119 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -0.819 -8.658 11.995 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -1.888 -7.041 9.810 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -2.390 -6.408 11.365 1.00 0.00 H new ATOM 0 HD2 LYS A 47 0.226 -6.914 11.920 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.352 -6.628 10.196 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.566 -4.424 10.381 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.156 -4.717 12.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.875 -3.363 11.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.096 -4.804 12.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.724 -4.657 11.250 1.00 0.00 H new ATOM 477 N VAL A 48 -0.636 -9.240 8.287 1.00 0.00 N ATOM 478 CA VAL A 48 0.532 -9.317 7.419 1.00 0.00 C ATOM 479 C VAL A 48 0.945 -7.934 6.928 1.00 0.00 C ATOM 480 O VAL A 48 0.112 -7.038 6.793 1.00 0.00 O ATOM 481 CB VAL A 48 0.265 -10.224 6.202 1.00 0.00 C ATOM 482 CG1 VAL A 48 1.536 -10.420 5.391 1.00 0.00 C ATOM 483 CG2 VAL A 48 -0.301 -11.563 6.649 1.00 0.00 C ATOM 0 H VAL A 48 -1.465 -8.844 7.844 1.00 0.00 H new ATOM 0 HA VAL A 48 1.341 -9.744 8.012 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.473 -9.737 5.565 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.327 -11.063 4.536 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.895 -9.453 5.038 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.299 -10.884 6.016 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.483 -12.190 5.777 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.412 -12.057 7.309 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.238 -11.402 7.182 1.00 0.00 H new ATOM 493 N GLU A 49 2.237 -7.768 6.661 1.00 0.00 N ATOM 494 CA GLU A 49 2.763 -6.494 6.184 1.00 0.00 C ATOM 495 C GLU A 49 2.996 -6.533 4.677 1.00 0.00 C ATOM 496 O GLU A 49 3.575 -7.484 4.153 1.00 0.00 O ATOM 497 CB GLU A 49 4.069 -6.158 6.906 1.00 0.00 C ATOM 498 CG GLU A 49 4.589 -4.761 6.605 1.00 0.00 C ATOM 499 CD GLU A 49 6.069 -4.747 6.280 1.00 0.00 C ATOM 500 OE1 GLU A 49 6.767 -5.718 6.642 1.00 0.00 O ATOM 501 OE2 GLU A 49 6.533 -3.764 5.664 1.00 0.00 O ATOM 0 H GLU A 49 2.939 -8.500 6.767 1.00 0.00 H new ATOM 0 HA GLU A 49 2.027 -5.720 6.399 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.916 -6.256 7.981 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.828 -6.888 6.624 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.033 -4.343 5.766 1.00 0.00 H new ATOM 0 HG3 GLU A 49 4.403 -4.116 7.463 1.00 0.00 H new ATOM 508 N ILE A 50 2.540 -5.493 3.984 1.00 0.00 N ATOM 509 CA ILE A 50 2.699 -5.411 2.537 1.00 0.00 C ATOM 510 C ILE A 50 3.617 -4.254 2.149 1.00 0.00 C ATOM 511 O ILE A 50 3.467 -3.134 2.640 1.00 0.00 O ATOM 512 CB ILE A 50 1.334 -5.256 1.830 1.00 0.00 C ATOM 513 CG1 ILE A 50 1.476 -5.535 0.332 1.00 0.00 C ATOM 514 CG2 ILE A 50 0.749 -3.870 2.066 1.00 0.00 C ATOM 515 CD1 ILE A 50 0.357 -6.385 -0.230 1.00 0.00 C ATOM 0 H ILE A 50 2.058 -4.697 4.401 1.00 0.00 H new ATOM 0 HA ILE A 50 3.155 -6.345 2.210 1.00 0.00 H new ATOM 0 HB ILE A 50 0.645 -5.986 2.256 1.00 0.00 H new ATOM 0 HG12 ILE A 50 1.507 -4.587 -0.205 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.428 -6.035 0.152 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -0.211 -3.789 1.557 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.608 -3.712 3.135 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.432 -3.116 1.675 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.521 -6.544 -1.296 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.339 -7.347 0.282 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.596 -5.877 -0.081 1.00 0.00 H new ATOM 527 N THR A 51 4.575 -4.535 1.274 1.00 0.00 N ATOM 528 CA THR A 51 5.526 -3.522 0.826 1.00 0.00 C ATOM 529 C THR A 51 5.217 -3.065 -0.596 1.00 0.00 C ATOM 530 O THR A 51 4.419 -3.683 -1.300 1.00 0.00 O ATOM 531 CB THR A 51 6.951 -4.071 0.893 1.00 0.00 C ATOM 532 OG1 THR A 51 6.960 -5.470 0.667 1.00 0.00 O ATOM 533 CG2 THR A 51 7.630 -3.815 2.219 1.00 0.00 C ATOM 0 H THR A 51 4.715 -5.456 0.860 1.00 0.00 H new ATOM 0 HA THR A 51 5.437 -2.662 1.490 1.00 0.00 H new ATOM 0 HB THR A 51 7.501 -3.542 0.115 1.00 0.00 H new ATOM 0 HG1 THR A 51 7.881 -5.803 0.712 1.00 0.00 H new ATOM 0 HG21 THR A 51 8.637 -4.230 2.198 1.00 0.00 H new ATOM 0 HG22 THR A 51 7.684 -2.741 2.399 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.059 -4.288 3.018 1.00 0.00 H new ATOM 541 N ASN A 52 5.866 -1.982 -1.015 1.00 0.00 N ATOM 542 CA ASN A 52 5.671 -1.443 -2.357 1.00 0.00 C ATOM 543 C ASN A 52 6.554 -2.183 -3.358 1.00 0.00 C ATOM 544 O ASN A 52 7.511 -1.624 -3.895 1.00 0.00 O ATOM 545 CB ASN A 52 5.984 0.054 -2.382 1.00 0.00 C ATOM 546 CG ASN A 52 7.408 0.354 -1.958 1.00 0.00 C ATOM 547 OD1 ASN A 52 8.307 0.460 -2.792 1.00 0.00 O ATOM 548 ND2 ASN A 52 7.620 0.493 -0.655 1.00 0.00 N ATOM 0 H ASN A 52 6.531 -1.461 -0.444 1.00 0.00 H new ATOM 0 HA ASN A 52 4.628 -1.585 -2.639 1.00 0.00 H new ATOM 0 HB2 ASN A 52 5.818 0.440 -3.388 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.293 0.578 -1.721 1.00 0.00 H new ATOM 0 HD21 ASN A 52 8.558 0.696 -0.310 1.00 0.00 H new ATOM 0 HD22 ASN A 52 6.845 0.397 0.001 1.00 0.00 H new ATOM 555 N ARG A 53 6.228 -3.447 -3.590 1.00 0.00 N ATOM 556 CA ARG A 53 6.988 -4.286 -4.510 1.00 0.00 C ATOM 557 C ARG A 53 6.477 -4.177 -5.936 1.00 0.00 C ATOM 558 O ARG A 53 6.940 -4.902 -6.815 1.00 0.00 O ATOM 559 CB ARG A 53 6.929 -5.744 -4.049 1.00 0.00 C ATOM 560 CG ARG A 53 8.010 -6.624 -4.653 1.00 0.00 C ATOM 561 CD ARG A 53 7.621 -8.093 -4.610 1.00 0.00 C ATOM 562 NE ARG A 53 8.790 -8.969 -4.639 1.00 0.00 N ATOM 563 CZ ARG A 53 8.743 -10.258 -4.966 1.00 0.00 C ATOM 564 NH1 ARG A 53 7.588 -10.827 -5.288 1.00 0.00 N ATOM 565 NH2 ARG A 53 9.856 -10.980 -4.970 1.00 0.00 N ATOM 0 H ARG A 53 5.437 -3.918 -3.151 1.00 0.00 H new ATOM 0 HA ARG A 53 8.020 -3.934 -4.502 1.00 0.00 H new ATOM 0 HB2 ARG A 53 7.014 -5.775 -2.963 1.00 0.00 H new ATOM 0 HB3 ARG A 53 5.953 -6.157 -4.305 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.190 -6.324 -5.685 1.00 0.00 H new ATOM 0 HG3 ARG A 53 8.944 -6.478 -4.111 1.00 0.00 H new ATOM 0 HD2 ARG A 53 7.043 -8.289 -3.707 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.975 -8.322 -5.457 1.00 0.00 H new ATOM 0 HE ARG A 53 9.696 -8.569 -4.394 1.00 0.00 H new ATOM 0 HH11 ARG A 53 6.730 -10.276 -5.286 1.00 0.00 H new ATOM 0 HH12 ARG A 53 7.559 -11.816 -5.538 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.746 -10.547 -4.723 1.00 0.00 H new ATOM 0 HH22 ARG A 53 9.822 -11.968 -5.220 1.00 0.00 H new ATOM 579 N ASN A 54 5.511 -3.295 -6.177 1.00 0.00 N ATOM 580 CA ASN A 54 4.949 -3.151 -7.512 1.00 0.00 C ATOM 581 C ASN A 54 4.096 -4.371 -7.838 1.00 0.00 C ATOM 582 O ASN A 54 3.046 -4.258 -8.467 1.00 0.00 O ATOM 583 CB ASN A 54 6.060 -2.983 -8.556 1.00 0.00 C ATOM 584 CG ASN A 54 5.927 -1.691 -9.339 1.00 0.00 C ATOM 585 OD1 ASN A 54 4.881 -1.041 -9.314 1.00 0.00 O ATOM 586 ND2 ASN A 54 6.988 -1.312 -10.041 1.00 0.00 N ATOM 0 H ASN A 54 5.107 -2.677 -5.473 1.00 0.00 H new ATOM 0 HA ASN A 54 4.326 -2.257 -7.538 1.00 0.00 H new ATOM 0 HB2 ASN A 54 7.029 -3.005 -8.058 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.037 -3.827 -9.246 1.00 0.00 H new ATOM 0 HD21 ASN A 54 6.957 -0.452 -10.588 1.00 0.00 H new ATOM 0 HD22 ASN A 54 7.834 -1.881 -10.033 1.00 0.00 H new ATOM 593 N VAL A 55 4.558 -5.539 -7.390 1.00 0.00 N ATOM 594 CA VAL A 55 3.843 -6.784 -7.612 1.00 0.00 C ATOM 595 C VAL A 55 3.848 -7.638 -6.348 1.00 0.00 C ATOM 596 O VAL A 55 4.864 -7.752 -5.665 1.00 0.00 O ATOM 597 CB VAL A 55 4.463 -7.589 -8.763 1.00 0.00 C ATOM 598 CG1 VAL A 55 3.707 -8.896 -8.971 1.00 0.00 C ATOM 599 CG2 VAL A 55 4.481 -6.765 -10.041 1.00 0.00 C ATOM 0 H VAL A 55 5.429 -5.643 -6.869 1.00 0.00 H new ATOM 0 HA VAL A 55 2.818 -6.525 -7.876 1.00 0.00 H new ATOM 0 HB VAL A 55 5.493 -7.831 -8.500 1.00 0.00 H new ATOM 0 HG11 VAL A 55 4.161 -9.453 -9.791 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.752 -9.492 -8.059 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.666 -8.680 -9.212 1.00 0.00 H new ATOM 0 HG21 VAL A 55 4.924 -7.352 -10.846 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.461 -6.490 -10.311 1.00 0.00 H new ATOM 0 HG23 VAL A 55 5.071 -5.862 -9.883 1.00 0.00 H new ATOM 609 N THR A 56 2.705 -8.237 -6.049 1.00 0.00 N ATOM 610 CA THR A 56 2.564 -9.084 -4.873 1.00 0.00 C ATOM 611 C THR A 56 2.040 -10.459 -5.281 1.00 0.00 C ATOM 612 O THR A 56 1.046 -10.560 -5.997 1.00 0.00 O ATOM 613 CB THR A 56 1.611 -8.422 -3.870 1.00 0.00 C ATOM 614 OG1 THR A 56 2.192 -7.246 -3.335 1.00 0.00 O ATOM 615 CG2 THR A 56 1.224 -9.308 -2.702 1.00 0.00 C ATOM 0 H THR A 56 1.856 -8.151 -6.608 1.00 0.00 H new ATOM 0 HA THR A 56 3.538 -9.211 -4.401 1.00 0.00 H new ATOM 0 HB THR A 56 0.710 -8.206 -4.444 1.00 0.00 H new ATOM 0 HG1 THR A 56 1.508 -6.549 -3.258 1.00 0.00 H new ATOM 0 HG21 THR A 56 0.549 -8.764 -2.041 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.725 -10.203 -3.074 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.119 -9.595 -2.150 1.00 0.00 H new ATOM 623 N THR A 57 2.708 -11.516 -4.825 1.00 0.00 N ATOM 624 CA THR A 57 2.288 -12.872 -5.157 1.00 0.00 C ATOM 625 C THR A 57 1.582 -13.519 -3.972 1.00 0.00 C ATOM 626 O THR A 57 2.061 -13.455 -2.840 1.00 0.00 O ATOM 627 CB THR A 57 3.494 -13.715 -5.582 1.00 0.00 C ATOM 628 OG1 THR A 57 4.701 -12.994 -5.404 1.00 0.00 O ATOM 629 CG2 THR A 57 3.433 -14.154 -7.029 1.00 0.00 C ATOM 0 H THR A 57 3.535 -11.460 -4.230 1.00 0.00 H new ATOM 0 HA THR A 57 1.587 -12.821 -5.990 1.00 0.00 H new ATOM 0 HB THR A 57 3.466 -14.600 -4.946 1.00 0.00 H new ATOM 0 HG1 THR A 57 5.436 -13.475 -5.838 1.00 0.00 H new ATOM 0 HG21 THR A 57 4.316 -14.747 -7.267 1.00 0.00 H new ATOM 0 HG22 THR A 57 2.538 -14.755 -7.189 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.401 -13.276 -7.674 1.00 0.00 H new ATOM 637 N ILE A 58 0.434 -14.137 -4.237 1.00 0.00 N ATOM 638 CA ILE A 58 -0.339 -14.785 -3.187 1.00 0.00 C ATOM 639 C ILE A 58 -0.447 -16.289 -3.413 1.00 0.00 C ATOM 640 O ILE A 58 -0.828 -16.742 -4.495 1.00 0.00 O ATOM 641 CB ILE A 58 -1.753 -14.182 -3.080 1.00 0.00 C ATOM 642 CG1 ILE A 58 -1.663 -12.664 -2.907 1.00 0.00 C ATOM 643 CG2 ILE A 58 -2.514 -14.810 -1.920 1.00 0.00 C ATOM 644 CD1 ILE A 58 -3.008 -11.989 -2.754 1.00 0.00 C ATOM 0 H ILE A 58 0.021 -14.201 -5.168 1.00 0.00 H new ATOM 0 HA ILE A 58 0.195 -14.610 -2.253 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.297 -14.397 -4.000 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.053 -12.442 -2.031 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.149 -12.239 -3.769 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.510 -14.372 -1.859 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.599 -15.885 -2.080 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.978 -14.623 -0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -2.865 -10.915 -2.636 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.613 -12.179 -3.640 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.516 -12.386 -1.875 1.00 0.00 H new ATOM 656 N GLY A 59 -0.106 -17.054 -2.380 1.00 0.00 N ATOM 657 CA GLY A 59 -0.163 -18.501 -2.465 1.00 0.00 C ATOM 658 C GLY A 59 0.665 -19.170 -1.384 1.00 0.00 C ATOM 659 O GLY A 59 0.617 -18.768 -0.220 1.00 0.00 O ATOM 0 H GLY A 59 0.211 -16.693 -1.480 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.199 -18.828 -2.381 1.00 0.00 H new ATOM 0 HA3 GLY A 59 0.194 -18.820 -3.444 1.00 0.00 H new ATOM 663 N ARG A 60 1.430 -20.188 -1.772 1.00 0.00 N ATOM 664 CA ARG A 60 2.283 -20.911 -0.832 1.00 0.00 C ATOM 665 C ARG A 60 3.756 -20.728 -1.179 1.00 0.00 C ATOM 666 O ARG A 60 4.621 -20.806 -0.306 1.00 0.00 O ATOM 667 CB ARG A 60 1.943 -22.403 -0.818 1.00 0.00 C ATOM 668 CG ARG A 60 2.158 -23.052 0.540 1.00 0.00 C ATOM 669 CD ARG A 60 1.769 -24.523 0.536 1.00 0.00 C ATOM 670 NE ARG A 60 2.930 -25.396 0.377 1.00 0.00 N ATOM 671 CZ ARG A 60 3.851 -25.584 1.320 1.00 0.00 C ATOM 672 NH1 ARG A 60 3.758 -24.954 2.484 1.00 0.00 N ATOM 673 NH2 ARG A 60 4.867 -26.408 1.100 1.00 0.00 N ATOM 0 H ARG A 60 1.477 -20.531 -2.732 1.00 0.00 H new ATOM 0 HA ARG A 60 2.099 -20.497 0.159 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.903 -22.535 -1.116 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.555 -22.916 -1.560 1.00 0.00 H new ATOM 0 HG2 ARG A 60 3.205 -22.955 0.827 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.571 -22.524 1.291 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.258 -24.765 1.468 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.062 -24.709 -0.273 1.00 0.00 H new ATOM 0 HE ARG A 60 3.041 -25.890 -0.508 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.978 -24.321 2.661 1.00 0.00 H new ATOM 0 HH12 ARG A 60 4.467 -25.102 3.202 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.943 -26.898 0.208 1.00 0.00 H new ATOM 0 HH22 ARG A 60 5.573 -26.552 1.822 1.00 0.00 H new ATOM 687 N SER A 61 4.039 -20.488 -2.458 1.00 0.00 N ATOM 688 CA SER A 61 5.413 -20.298 -2.918 1.00 0.00 C ATOM 689 C SER A 61 6.168 -19.343 -1.999 1.00 0.00 C ATOM 690 O SER A 61 5.755 -18.202 -1.798 1.00 0.00 O ATOM 691 CB SER A 61 5.425 -19.768 -4.354 1.00 0.00 C ATOM 692 OG SER A 61 6.185 -20.611 -5.204 1.00 0.00 O ATOM 0 H SER A 61 3.336 -20.421 -3.194 1.00 0.00 H new ATOM 0 HA SER A 61 5.915 -21.265 -2.894 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.403 -19.697 -4.727 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.841 -18.761 -4.369 1.00 0.00 H new ATOM 0 HG SER A 61 6.175 -20.251 -6.115 1.00 0.00 H new ATOM 698 N ARG A 62 7.275 -19.821 -1.442 1.00 0.00 N ATOM 699 CA ARG A 62 8.086 -19.014 -0.540 1.00 0.00 C ATOM 700 C ARG A 62 8.496 -17.699 -1.198 1.00 0.00 C ATOM 701 O ARG A 62 8.731 -16.700 -0.518 1.00 0.00 O ATOM 702 CB ARG A 62 9.331 -19.792 -0.109 1.00 0.00 C ATOM 703 CG ARG A 62 9.940 -19.296 1.193 1.00 0.00 C ATOM 704 CD ARG A 62 11.304 -18.661 0.972 1.00 0.00 C ATOM 705 NE ARG A 62 12.265 -19.605 0.400 1.00 0.00 N ATOM 706 CZ ARG A 62 12.590 -19.652 -0.892 1.00 0.00 C ATOM 707 NH1 ARG A 62 12.029 -18.822 -1.763 1.00 0.00 N ATOM 708 NH2 ARG A 62 13.481 -20.539 -1.315 1.00 0.00 N ATOM 0 H ARG A 62 7.631 -20.764 -1.600 1.00 0.00 H new ATOM 0 HA ARG A 62 7.484 -18.784 0.339 1.00 0.00 H new ATOM 0 HB2 ARG A 62 9.071 -20.845 -0.001 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.080 -19.728 -0.898 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.271 -18.569 1.654 1.00 0.00 H new ATOM 0 HG3 ARG A 62 10.035 -20.128 1.890 1.00 0.00 H new ATOM 0 HD2 ARG A 62 11.200 -17.803 0.308 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.687 -18.285 1.921 1.00 0.00 H new ATOM 0 HE ARG A 62 12.715 -20.269 1.030 1.00 0.00 H new ATOM 0 HH11 ARG A 62 11.341 -18.139 -1.446 1.00 0.00 H new ATOM 0 HH12 ARG A 62 12.286 -18.868 -2.749 1.00 0.00 H new ATOM 0 HH21 ARG A 62 13.915 -21.182 -0.652 1.00 0.00 H new ATOM 0 HH22 ARG A 62 13.732 -20.578 -2.303 1.00 0.00 H new ATOM 722 N SER A 63 8.578 -17.706 -2.524 1.00 0.00 N ATOM 723 CA SER A 63 8.957 -16.514 -3.274 1.00 0.00 C ATOM 724 C SER A 63 7.804 -15.514 -3.335 1.00 0.00 C ATOM 725 O SER A 63 8.019 -14.319 -3.535 1.00 0.00 O ATOM 726 CB SER A 63 9.393 -16.895 -4.689 1.00 0.00 C ATOM 727 OG SER A 63 10.275 -15.924 -5.229 1.00 0.00 O ATOM 0 H SER A 63 8.387 -18.524 -3.102 1.00 0.00 H new ATOM 0 HA SER A 63 9.793 -16.042 -2.757 1.00 0.00 H new ATOM 0 HB2 SER A 63 9.884 -17.868 -4.672 1.00 0.00 H new ATOM 0 HB3 SER A 63 8.516 -16.991 -5.330 1.00 0.00 H new ATOM 0 HG SER A 63 10.541 -16.191 -6.134 1.00 0.00 H new ATOM 733 N CYS A 64 6.579 -16.009 -3.163 1.00 0.00 N ATOM 734 CA CYS A 64 5.397 -15.154 -3.202 1.00 0.00 C ATOM 735 C CYS A 64 5.522 -14.007 -2.203 1.00 0.00 C ATOM 736 O CYS A 64 6.352 -14.052 -1.294 1.00 0.00 O ATOM 737 CB CYS A 64 4.139 -15.969 -2.899 1.00 0.00 C ATOM 738 SG CYS A 64 3.683 -17.138 -4.202 1.00 0.00 S ATOM 0 H CYS A 64 6.381 -16.996 -2.996 1.00 0.00 H new ATOM 0 HA CYS A 64 5.318 -14.735 -4.205 1.00 0.00 H new ATOM 0 HB2 CYS A 64 4.290 -16.518 -1.970 1.00 0.00 H new ATOM 0 HB3 CYS A 64 3.307 -15.285 -2.733 1.00 0.00 H new ATOM 0 HG CYS A 64 2.609 -17.781 -3.852 1.00 0.00 H new ATOM 744 N ASP A 65 4.697 -12.978 -2.375 1.00 0.00 N ATOM 745 CA ASP A 65 4.728 -11.826 -1.482 1.00 0.00 C ATOM 746 C ASP A 65 3.931 -12.098 -0.210 1.00 0.00 C ATOM 747 O ASP A 65 4.415 -11.867 0.898 1.00 0.00 O ATOM 748 CB ASP A 65 4.181 -10.583 -2.180 1.00 0.00 C ATOM 749 CG ASP A 65 4.293 -9.340 -1.318 1.00 0.00 C ATOM 750 OD1 ASP A 65 3.575 -9.258 -0.299 1.00 0.00 O ATOM 751 OD2 ASP A 65 5.097 -8.449 -1.663 1.00 0.00 O ATOM 0 H ASP A 65 4.003 -12.919 -3.120 1.00 0.00 H new ATOM 0 HA ASP A 65 5.768 -11.648 -1.210 1.00 0.00 H new ATOM 0 HB2 ASP A 65 4.723 -10.425 -3.113 1.00 0.00 H new ATOM 0 HB3 ASP A 65 3.136 -10.747 -2.442 1.00 0.00 H new ATOM 756 N VAL A 66 2.704 -12.585 -0.377 1.00 0.00 N ATOM 757 CA VAL A 66 1.838 -12.881 0.758 1.00 0.00 C ATOM 758 C VAL A 66 1.348 -14.326 0.722 1.00 0.00 C ATOM 759 O VAL A 66 0.894 -14.812 -0.312 1.00 0.00 O ATOM 760 CB VAL A 66 0.620 -11.941 0.795 1.00 0.00 C ATOM 761 CG1 VAL A 66 -0.164 -12.129 2.084 1.00 0.00 C ATOM 762 CG2 VAL A 66 1.058 -10.493 0.636 1.00 0.00 C ATOM 0 H VAL A 66 2.288 -12.782 -1.287 1.00 0.00 H new ATOM 0 HA VAL A 66 2.436 -12.728 1.656 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.034 -12.193 -0.040 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.021 -11.455 2.090 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.512 -13.160 2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.478 -11.907 2.936 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.183 -9.843 0.665 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.735 -10.226 1.448 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.570 -10.370 -0.318 1.00 0.00 H new ATOM 772 N ILE A 67 1.435 -15.005 1.860 1.00 0.00 N ATOM 773 CA ILE A 67 0.991 -16.391 1.955 1.00 0.00 C ATOM 774 C ILE A 67 -0.381 -16.474 2.614 1.00 0.00 C ATOM 775 O ILE A 67 -0.567 -16.012 3.741 1.00 0.00 O ATOM 776 CB ILE A 67 1.990 -17.249 2.756 1.00 0.00 C ATOM 777 CG1 ILE A 67 2.237 -16.636 4.137 1.00 0.00 C ATOM 778 CG2 ILE A 67 3.299 -17.393 1.989 1.00 0.00 C ATOM 779 CD1 ILE A 67 1.951 -17.586 5.279 1.00 0.00 C ATOM 0 H ILE A 67 1.808 -14.620 2.728 1.00 0.00 H new ATOM 0 HA ILE A 67 0.931 -16.780 0.938 1.00 0.00 H new ATOM 0 HB ILE A 67 1.562 -18.242 2.895 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.274 -16.307 4.200 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.614 -15.749 4.248 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.994 -18.001 2.567 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.108 -17.874 1.030 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.733 -16.407 1.821 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.148 -17.085 6.227 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.907 -17.896 5.242 1.00 0.00 H new ATOM 0 HD13 ILE A 67 2.593 -18.463 5.192 1.00 0.00 H new ATOM 791 N LEU A 68 -1.343 -17.061 1.908 1.00 0.00 N ATOM 792 CA LEU A 68 -2.698 -17.193 2.434 1.00 0.00 C ATOM 793 C LEU A 68 -2.807 -18.411 3.354 1.00 0.00 C ATOM 794 O LEU A 68 -2.505 -18.322 4.543 1.00 0.00 O ATOM 795 CB LEU A 68 -3.712 -17.283 1.288 1.00 0.00 C ATOM 796 CG LEU A 68 -4.311 -15.947 0.848 1.00 0.00 C ATOM 797 CD1 LEU A 68 -4.958 -16.077 -0.522 1.00 0.00 C ATOM 798 CD2 LEU A 68 -5.323 -15.455 1.873 1.00 0.00 C ATOM 0 H LEU A 68 -1.211 -17.451 0.975 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.925 -16.305 3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.227 -17.747 0.429 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.523 -17.945 1.592 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.507 -15.215 0.779 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.379 -15.116 -0.818 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.208 -16.385 -1.251 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.751 -16.823 -0.480 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -5.740 -14.503 1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -6.124 -16.187 1.973 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.830 -15.322 2.836 1.00 0.00 H new ATOM 810 N SER A 69 -3.226 -19.549 2.803 1.00 0.00 N ATOM 811 CA SER A 69 -3.351 -20.770 3.590 1.00 0.00 C ATOM 812 C SER A 69 -2.051 -21.573 3.514 1.00 0.00 C ATOM 813 O SER A 69 -1.039 -21.163 4.083 1.00 0.00 O ATOM 814 CB SER A 69 -4.546 -21.597 3.105 1.00 0.00 C ATOM 815 OG SER A 69 -4.508 -22.911 3.638 1.00 0.00 O ATOM 0 H SER A 69 -3.483 -19.649 1.821 1.00 0.00 H new ATOM 0 HA SER A 69 -3.530 -20.508 4.633 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.474 -21.108 3.400 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.542 -21.643 2.016 1.00 0.00 H new ATOM 0 HG SER A 69 -5.282 -23.418 3.315 1.00 0.00 H new ATOM 821 N GLU A 70 -2.064 -22.702 2.800 1.00 0.00 N ATOM 822 CA GLU A 70 -0.865 -23.525 2.654 1.00 0.00 C ATOM 823 C GLU A 70 -1.191 -24.892 2.047 1.00 0.00 C ATOM 824 O GLU A 70 -0.754 -25.202 0.940 1.00 0.00 O ATOM 825 CB GLU A 70 -0.150 -23.704 4.001 1.00 0.00 C ATOM 826 CG GLU A 70 1.180 -22.973 4.090 1.00 0.00 C ATOM 827 CD GLU A 70 2.135 -23.621 5.074 1.00 0.00 C ATOM 828 OE1 GLU A 70 1.943 -24.812 5.392 1.00 0.00 O ATOM 829 OE2 GLU A 70 3.077 -22.935 5.525 1.00 0.00 O ATOM 0 H GLU A 70 -2.887 -23.064 2.318 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.197 -23.000 1.971 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -0.803 -23.350 4.799 1.00 0.00 H new ATOM 0 HB3 GLU A 70 0.018 -24.767 4.175 1.00 0.00 H new ATOM 0 HG2 GLU A 70 1.643 -22.946 3.104 1.00 0.00 H new ATOM 0 HG3 GLU A 70 1.003 -21.939 4.387 1.00 0.00 H new ATOM 836 N PRO A 71 -1.958 -25.740 2.755 1.00 0.00 N ATOM 837 CA PRO A 71 -2.303 -27.073 2.254 1.00 0.00 C ATOM 838 C PRO A 71 -3.077 -27.036 0.939 1.00 0.00 C ATOM 839 O PRO A 71 -2.847 -27.861 0.055 1.00 0.00 O ATOM 840 CB PRO A 71 -3.176 -27.673 3.363 1.00 0.00 C ATOM 841 CG PRO A 71 -2.879 -26.863 4.577 1.00 0.00 C ATOM 842 CD PRO A 71 -2.541 -25.485 4.086 1.00 0.00 C ATOM 0 HA PRO A 71 -1.406 -27.652 2.037 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -4.233 -27.620 3.104 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -2.940 -28.725 3.524 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.737 -26.838 5.248 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.048 -27.292 5.138 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -3.425 -24.850 4.024 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.834 -24.983 4.747 1.00 0.00 H new ATOM 850 N ASP A 72 -4.000 -26.089 0.816 1.00 0.00 N ATOM 851 CA ASP A 72 -4.807 -25.973 -0.395 1.00 0.00 C ATOM 852 C ASP A 72 -4.724 -24.573 -0.996 1.00 0.00 C ATOM 853 O ASP A 72 -5.663 -24.115 -1.646 1.00 0.00 O ATOM 854 CB ASP A 72 -6.265 -26.321 -0.094 1.00 0.00 C ATOM 855 CG ASP A 72 -6.404 -27.633 0.655 1.00 0.00 C ATOM 856 OD1 ASP A 72 -6.190 -28.696 0.035 1.00 0.00 O ATOM 857 OD2 ASP A 72 -6.726 -27.596 1.861 1.00 0.00 O ATOM 0 H ASP A 72 -4.208 -25.395 1.534 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.407 -26.677 -1.125 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -6.713 -25.520 0.495 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -6.822 -26.379 -1.029 1.00 0.00 H new ATOM 862 N ILE A 73 -3.600 -23.897 -0.782 1.00 0.00 N ATOM 863 CA ILE A 73 -3.416 -22.557 -1.316 1.00 0.00 C ATOM 864 C ILE A 73 -2.608 -22.587 -2.612 1.00 0.00 C ATOM 865 O ILE A 73 -1.467 -23.051 -2.638 1.00 0.00 O ATOM 866 CB ILE A 73 -2.743 -21.626 -0.281 1.00 0.00 C ATOM 867 CG1 ILE A 73 -3.118 -20.173 -0.563 1.00 0.00 C ATOM 868 CG2 ILE A 73 -1.231 -21.801 -0.272 1.00 0.00 C ATOM 869 CD1 ILE A 73 -4.587 -19.884 -0.348 1.00 0.00 C ATOM 0 H ILE A 73 -2.809 -24.254 -0.246 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.405 -22.157 -1.538 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.108 -21.900 0.709 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.528 -19.521 0.081 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.853 -19.929 -1.592 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -0.792 -21.131 0.467 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.986 -22.832 -0.018 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.832 -21.565 -1.258 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.787 -18.835 -0.565 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.182 -20.512 -1.011 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.852 -20.097 0.688 1.00 0.00 H new ATOM 881 N SER A 74 -3.217 -22.099 -3.687 1.00 0.00 N ATOM 882 CA SER A 74 -2.568 -22.075 -4.993 1.00 0.00 C ATOM 883 C SER A 74 -1.276 -21.268 -4.952 1.00 0.00 C ATOM 884 O SER A 74 -1.238 -20.162 -4.415 1.00 0.00 O ATOM 885 CB SER A 74 -3.513 -21.489 -6.043 1.00 0.00 C ATOM 886 OG SER A 74 -4.589 -22.373 -6.314 1.00 0.00 O ATOM 0 H SER A 74 -4.161 -21.714 -3.680 1.00 0.00 H new ATOM 0 HA SER A 74 -2.322 -23.102 -5.263 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.903 -20.534 -5.692 1.00 0.00 H new ATOM 0 HB3 SER A 74 -2.962 -21.290 -6.962 1.00 0.00 H new ATOM 0 HG SER A 74 -5.179 -21.974 -6.987 1.00 0.00 H new ATOM 892 N THR A 75 -0.219 -21.830 -5.528 1.00 0.00 N ATOM 893 CA THR A 75 1.079 -21.163 -5.564 1.00 0.00 C ATOM 894 C THR A 75 1.000 -19.874 -6.376 1.00 0.00 C ATOM 895 O THR A 75 1.631 -18.872 -6.036 1.00 0.00 O ATOM 896 CB THR A 75 2.137 -22.096 -6.157 1.00 0.00 C ATOM 897 OG1 THR A 75 2.256 -23.275 -5.381 1.00 0.00 O ATOM 898 CG2 THR A 75 3.512 -21.468 -6.248 1.00 0.00 C ATOM 0 H THR A 75 -0.235 -22.746 -5.977 1.00 0.00 H new ATOM 0 HA THR A 75 1.364 -20.910 -4.543 1.00 0.00 H new ATOM 0 HB THR A 75 1.790 -22.317 -7.166 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.936 -23.860 -5.777 1.00 0.00 H new ATOM 0 HG21 THR A 75 4.212 -22.185 -6.677 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.466 -20.582 -6.881 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.849 -21.184 -5.251 1.00 0.00 H new ATOM 906 N PHE A 76 0.218 -19.906 -7.449 1.00 0.00 N ATOM 907 CA PHE A 76 0.047 -18.744 -8.317 1.00 0.00 C ATOM 908 C PHE A 76 -1.316 -18.103 -8.120 1.00 0.00 C ATOM 909 O PHE A 76 -1.762 -17.290 -8.929 1.00 0.00 O ATOM 910 CB PHE A 76 0.262 -19.117 -9.784 1.00 0.00 C ATOM 911 CG PHE A 76 1.644 -19.629 -10.078 1.00 0.00 C ATOM 912 CD1 PHE A 76 2.091 -20.814 -9.517 1.00 0.00 C ATOM 913 CD2 PHE A 76 2.494 -18.923 -10.915 1.00 0.00 C ATOM 914 CE1 PHE A 76 3.362 -21.287 -9.786 1.00 0.00 C ATOM 915 CE2 PHE A 76 3.766 -19.391 -11.186 1.00 0.00 C ATOM 916 CZ PHE A 76 4.200 -20.574 -10.621 1.00 0.00 C ATOM 0 H PHE A 76 -0.311 -20.728 -7.741 1.00 0.00 H new ATOM 0 HA PHE A 76 0.805 -18.012 -8.038 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -0.466 -19.877 -10.067 1.00 0.00 H new ATOM 0 HB3 PHE A 76 0.068 -18.242 -10.405 1.00 0.00 H new ATOM 0 HD1 PHE A 76 1.440 -21.374 -8.863 1.00 0.00 H new ATOM 0 HD2 PHE A 76 2.159 -17.998 -11.360 1.00 0.00 H new ATOM 0 HE1 PHE A 76 3.699 -22.213 -9.344 1.00 0.00 H new ATOM 0 HE2 PHE A 76 4.420 -18.832 -11.839 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.194 -20.941 -10.832 1.00 0.00 H new ATOM 926 N HIS A 77 -1.962 -18.505 -7.041 1.00 0.00 N ATOM 927 CA HIS A 77 -3.300 -18.026 -6.668 1.00 0.00 C ATOM 928 C HIS A 77 -3.668 -16.703 -7.341 1.00 0.00 C ATOM 929 O HIS A 77 -4.539 -16.665 -8.210 1.00 0.00 O ATOM 930 CB HIS A 77 -3.403 -17.874 -5.149 1.00 0.00 C ATOM 931 CG HIS A 77 -4.786 -18.098 -4.624 1.00 0.00 C ATOM 932 ND1 HIS A 77 -5.051 -18.442 -3.316 1.00 0.00 N ATOM 933 CD2 HIS A 77 -5.989 -18.024 -5.243 1.00 0.00 C ATOM 934 CE1 HIS A 77 -6.355 -18.573 -3.152 1.00 0.00 C ATOM 935 NE2 HIS A 77 -6.947 -18.324 -4.306 1.00 0.00 N ATOM 0 H HIS A 77 -1.575 -19.182 -6.384 1.00 0.00 H new ATOM 0 HA HIS A 77 -4.008 -18.776 -7.019 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -2.723 -18.580 -4.673 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -3.073 -16.874 -4.868 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -4.349 -18.575 -2.588 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -6.162 -17.775 -6.280 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -6.853 -18.839 -2.231 1.00 0.00 H new ATOM 944 N ALA A 78 -3.013 -15.619 -6.933 1.00 0.00 N ATOM 945 CA ALA A 78 -3.299 -14.308 -7.506 1.00 0.00 C ATOM 946 C ALA A 78 -2.123 -13.350 -7.352 1.00 0.00 C ATOM 947 O ALA A 78 -1.211 -13.588 -6.558 1.00 0.00 O ATOM 948 CB ALA A 78 -4.544 -13.717 -6.862 1.00 0.00 C ATOM 0 H ALA A 78 -2.288 -15.622 -6.215 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.472 -14.446 -8.573 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -4.749 -12.739 -7.297 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -5.393 -14.377 -7.038 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.383 -13.611 -5.789 1.00 0.00 H new ATOM 954 N GLU A 79 -2.157 -12.262 -8.116 1.00 0.00 N ATOM 955 CA GLU A 79 -1.104 -11.254 -8.071 1.00 0.00 C ATOM 956 C GLU A 79 -1.694 -9.869 -7.822 1.00 0.00 C ATOM 957 O GLU A 79 -2.689 -9.488 -8.438 1.00 0.00 O ATOM 958 CB GLU A 79 -0.305 -11.259 -9.376 1.00 0.00 C ATOM 959 CG GLU A 79 1.011 -12.015 -9.280 1.00 0.00 C ATOM 960 CD GLU A 79 1.735 -12.093 -10.610 1.00 0.00 C ATOM 961 OE1 GLU A 79 1.489 -11.223 -11.472 1.00 0.00 O ATOM 962 OE2 GLU A 79 2.549 -13.024 -10.789 1.00 0.00 O ATOM 0 H GLU A 79 -2.906 -12.056 -8.776 1.00 0.00 H new ATOM 0 HA GLU A 79 -0.433 -11.498 -7.247 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.914 -11.704 -10.163 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.103 -10.230 -9.673 1.00 0.00 H new ATOM 0 HG2 GLU A 79 1.654 -11.526 -8.548 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.821 -13.024 -8.914 1.00 0.00 H new ATOM 969 N PHE A 80 -1.074 -9.118 -6.915 1.00 0.00 N ATOM 970 CA PHE A 80 -1.539 -7.773 -6.586 1.00 0.00 C ATOM 971 C PHE A 80 -0.458 -6.742 -6.889 1.00 0.00 C ATOM 972 O PHE A 80 0.665 -6.854 -6.405 1.00 0.00 O ATOM 973 CB PHE A 80 -1.936 -7.692 -5.111 1.00 0.00 C ATOM 974 CG PHE A 80 -3.324 -8.191 -4.831 1.00 0.00 C ATOM 975 CD1 PHE A 80 -4.413 -7.673 -5.512 1.00 0.00 C ATOM 976 CD2 PHE A 80 -3.540 -9.178 -3.882 1.00 0.00 C ATOM 977 CE1 PHE A 80 -5.691 -8.130 -5.254 1.00 0.00 C ATOM 978 CE2 PHE A 80 -4.815 -9.640 -3.619 1.00 0.00 C ATOM 979 CZ PHE A 80 -5.893 -9.114 -4.306 1.00 0.00 C ATOM 0 H PHE A 80 -0.249 -9.418 -6.395 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.413 -7.555 -7.200 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -1.226 -8.270 -4.520 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -1.858 -6.657 -4.779 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -4.261 -6.903 -6.254 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -2.701 -9.591 -3.342 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -6.531 -7.718 -5.793 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -4.969 -10.411 -2.878 1.00 0.00 H new ATOM 0 HZ PHE A 80 -6.891 -9.472 -4.102 1.00 0.00 H new ATOM 989 N HIS A 81 -0.795 -5.738 -7.690 1.00 0.00 N ATOM 990 CA HIS A 81 0.171 -4.705 -8.040 1.00 0.00 C ATOM 991 C HIS A 81 0.051 -3.496 -7.118 1.00 0.00 C ATOM 992 O HIS A 81 -0.972 -2.812 -7.102 1.00 0.00 O ATOM 993 CB HIS A 81 -0.021 -4.271 -9.495 1.00 0.00 C ATOM 994 CG HIS A 81 0.637 -5.183 -10.484 1.00 0.00 C ATOM 995 ND1 HIS A 81 0.549 -6.524 -10.649 1.00 0.00 N flip ATOM 996 CD2 HIS A 81 1.508 -4.736 -11.455 1.00 0.00 C flip ATOM 997 CE1 HIS A 81 1.360 -6.857 -11.706 1.00 0.00 C flip ATOM 998 NE2 HIS A 81 1.926 -5.762 -12.175 1.00 0.00 N flip ATOM 0 H HIS A 81 -1.719 -5.618 -8.105 1.00 0.00 H new ATOM 0 HA HIS A 81 1.168 -5.127 -7.918 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -1.088 -4.221 -9.713 1.00 0.00 H new ATOM 0 HB3 HIS A 81 0.377 -3.264 -9.621 1.00 0.00 H new ATOM 0 HD2 HIS A 81 1.803 -3.708 -11.604 1.00 0.00 H new ATOM 0 HE1 HIS A 81 1.510 -7.855 -12.091 1.00 0.00 H new ATOM 0 HE2 HIS A 81 2.576 -5.715 -12.960 1.00 0.00 H new ATOM 1007 N LEU A 82 1.111 -3.234 -6.357 1.00 0.00 N ATOM 1008 CA LEU A 82 1.133 -2.100 -5.441 1.00 0.00 C ATOM 1009 C LEU A 82 2.035 -0.993 -5.975 1.00 0.00 C ATOM 1010 O LEU A 82 3.260 -1.136 -6.001 1.00 0.00 O ATOM 1011 CB LEU A 82 1.612 -2.542 -4.057 1.00 0.00 C ATOM 1012 CG LEU A 82 1.032 -1.745 -2.886 1.00 0.00 C ATOM 1013 CD1 LEU A 82 1.039 -2.583 -1.616 1.00 0.00 C ATOM 1014 CD2 LEU A 82 1.811 -0.455 -2.681 1.00 0.00 C ATOM 0 H LEU A 82 1.965 -3.792 -6.358 1.00 0.00 H new ATOM 0 HA LEU A 82 0.118 -1.711 -5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.360 -3.594 -3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.699 -2.468 -4.024 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.001 -1.488 -3.122 1.00 0.00 H new ATOM 0 HD11 LEU A 82 0.623 -2.001 -0.794 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.436 -3.478 -1.768 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.062 -2.871 -1.376 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.385 0.099 -1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.854 -0.690 -2.467 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.754 0.152 -3.585 1.00 0.00 H new ATOM 1026 N LEU A 83 1.424 0.108 -6.402 1.00 0.00 N ATOM 1027 CA LEU A 83 2.170 1.241 -6.940 1.00 0.00 C ATOM 1028 C LEU A 83 1.878 2.514 -6.151 1.00 0.00 C ATOM 1029 O LEU A 83 0.739 2.767 -5.761 1.00 0.00 O ATOM 1030 CB LEU A 83 1.825 1.451 -8.416 1.00 0.00 C ATOM 1031 CG LEU A 83 3.007 1.824 -9.311 1.00 0.00 C ATOM 1032 CD1 LEU A 83 2.560 1.952 -10.759 1.00 0.00 C ATOM 1033 CD2 LEU A 83 3.650 3.117 -8.833 1.00 0.00 C ATOM 0 H LEU A 83 0.413 0.240 -6.386 1.00 0.00 H new ATOM 0 HA LEU A 83 3.233 1.017 -6.850 1.00 0.00 H new ATOM 0 HB2 LEU A 83 1.372 0.537 -8.801 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.072 2.236 -8.489 1.00 0.00 H new ATOM 0 HG LEU A 83 3.750 1.028 -9.251 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.414 2.218 -11.381 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.146 1.002 -11.097 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.798 2.728 -10.837 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.490 3.367 -9.482 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.915 3.922 -8.864 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.007 2.990 -7.811 1.00 0.00 H new ATOM 1045 N GLN A 84 2.915 3.313 -5.921 1.00 0.00 N ATOM 1046 CA GLN A 84 2.770 4.562 -5.181 1.00 0.00 C ATOM 1047 C GLN A 84 2.692 5.752 -6.132 1.00 0.00 C ATOM 1048 O GLN A 84 3.575 5.951 -6.966 1.00 0.00 O ATOM 1049 CB GLN A 84 3.940 4.744 -4.212 1.00 0.00 C ATOM 1050 CG GLN A 84 4.211 3.523 -3.349 1.00 0.00 C ATOM 1051 CD GLN A 84 5.675 3.381 -2.982 1.00 0.00 C ATOM 1052 OE1 GLN A 84 6.494 2.953 -3.797 1.00 0.00 O ATOM 1053 NE2 GLN A 84 6.014 3.740 -1.749 1.00 0.00 N ATOM 0 H GLN A 84 3.865 3.118 -6.236 1.00 0.00 H new ATOM 0 HA GLN A 84 1.841 4.513 -4.613 1.00 0.00 H new ATOM 0 HB2 GLN A 84 4.838 4.983 -4.781 1.00 0.00 H new ATOM 0 HB3 GLN A 84 3.736 5.597 -3.565 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.617 3.588 -2.438 1.00 0.00 H new ATOM 0 HG3 GLN A 84 3.885 2.628 -3.879 1.00 0.00 H new ATOM 0 HE21 GLN A 84 5.303 4.089 -1.106 1.00 0.00 H new ATOM 0 HE22 GLN A 84 6.985 3.666 -1.445 1.00 0.00 H new ATOM 1062 N MET A 85 1.630 6.541 -5.999 1.00 0.00 N ATOM 1063 CA MET A 85 1.437 7.712 -6.847 1.00 0.00 C ATOM 1064 C MET A 85 0.929 8.897 -6.029 1.00 0.00 C ATOM 1065 O MET A 85 -0.132 8.824 -5.407 1.00 0.00 O ATOM 1066 CB MET A 85 0.455 7.394 -7.978 1.00 0.00 C ATOM 1067 CG MET A 85 1.079 7.472 -9.364 1.00 0.00 C ATOM 1068 SD MET A 85 0.080 8.424 -10.525 1.00 0.00 S ATOM 1069 CE MET A 85 0.291 7.463 -12.021 1.00 0.00 C ATOM 0 H MET A 85 0.891 6.391 -5.313 1.00 0.00 H new ATOM 0 HA MET A 85 2.401 7.980 -7.280 1.00 0.00 H new ATOM 0 HB2 MET A 85 0.050 6.393 -7.826 1.00 0.00 H new ATOM 0 HB3 MET A 85 -0.384 8.088 -7.926 1.00 0.00 H new ATOM 0 HG2 MET A 85 2.068 7.923 -9.288 1.00 0.00 H new ATOM 0 HG3 MET A 85 1.218 6.463 -9.753 1.00 0.00 H new ATOM 0 HE1 MET A 85 -0.269 7.926 -12.833 1.00 0.00 H new ATOM 0 HE2 MET A 85 1.348 7.426 -12.284 1.00 0.00 H new ATOM 0 HE3 MET A 85 -0.077 6.450 -11.858 1.00 0.00 H new ATOM 1079 N ASP A 86 1.691 9.985 -6.035 1.00 0.00 N ATOM 1080 CA ASP A 86 1.317 11.184 -5.293 1.00 0.00 C ATOM 1081 C ASP A 86 0.854 12.289 -6.236 1.00 0.00 C ATOM 1082 O ASP A 86 1.577 12.684 -7.151 1.00 0.00 O ATOM 1083 CB ASP A 86 2.496 11.678 -4.451 1.00 0.00 C ATOM 1084 CG ASP A 86 3.694 12.058 -5.300 1.00 0.00 C ATOM 1085 OD1 ASP A 86 4.392 11.144 -5.787 1.00 0.00 O ATOM 1086 OD2 ASP A 86 3.934 13.270 -5.478 1.00 0.00 O ATOM 0 H ASP A 86 2.571 10.062 -6.545 1.00 0.00 H new ATOM 0 HA ASP A 86 0.489 10.926 -4.632 1.00 0.00 H new ATOM 0 HB2 ASP A 86 2.183 12.541 -3.863 1.00 0.00 H new ATOM 0 HB3 ASP A 86 2.786 10.900 -3.745 1.00 0.00 H new ATOM 1091 N VAL A 87 -0.357 12.786 -6.005 1.00 0.00 N ATOM 1092 CA VAL A 87 -0.920 13.847 -6.829 1.00 0.00 C ATOM 1093 C VAL A 87 -1.327 15.044 -5.978 1.00 0.00 C ATOM 1094 O VAL A 87 -1.879 14.885 -4.889 1.00 0.00 O ATOM 1095 CB VAL A 87 -2.147 13.352 -7.617 1.00 0.00 C ATOM 1096 CG1 VAL A 87 -1.715 12.516 -8.811 1.00 0.00 C ATOM 1097 CG2 VAL A 87 -3.081 12.562 -6.712 1.00 0.00 C ATOM 0 H VAL A 87 -0.968 12.469 -5.252 1.00 0.00 H new ATOM 0 HA VAL A 87 -0.143 14.150 -7.531 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.690 14.221 -7.990 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.596 12.176 -9.355 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -1.092 13.119 -9.471 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.147 11.653 -8.464 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.942 12.221 -7.287 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.551 11.700 -6.306 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -3.420 13.198 -5.894 1.00 0.00 H new ATOM 1107 N ASP A 88 -1.053 16.245 -6.480 1.00 0.00 N ATOM 1108 CA ASP A 88 -1.389 17.477 -5.767 1.00 0.00 C ATOM 1109 C ASP A 88 -0.435 17.712 -4.598 1.00 0.00 C ATOM 1110 O ASP A 88 0.249 18.734 -4.540 1.00 0.00 O ATOM 1111 CB ASP A 88 -2.834 17.430 -5.261 1.00 0.00 C ATOM 1112 CG ASP A 88 -3.551 18.753 -5.441 1.00 0.00 C ATOM 1113 OD1 ASP A 88 -3.243 19.468 -6.419 1.00 0.00 O ATOM 1114 OD2 ASP A 88 -4.421 19.077 -4.604 1.00 0.00 O ATOM 0 H ASP A 88 -0.598 16.393 -7.381 1.00 0.00 H new ATOM 0 HA ASP A 88 -1.287 18.305 -6.468 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.378 16.650 -5.793 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.838 17.158 -4.206 1.00 0.00 H new ATOM 1119 N ASN A 89 -0.394 16.762 -3.669 1.00 0.00 N ATOM 1120 CA ASN A 89 0.474 16.864 -2.508 1.00 0.00 C ATOM 1121 C ASN A 89 0.419 15.588 -1.675 1.00 0.00 C ATOM 1122 O ASN A 89 1.448 15.079 -1.232 1.00 0.00 O ATOM 1123 CB ASN A 89 0.084 18.070 -1.653 1.00 0.00 C ATOM 1124 CG ASN A 89 1.292 18.833 -1.144 1.00 0.00 C ATOM 1125 OD1 ASN A 89 2.321 18.242 -0.818 1.00 0.00 O ATOM 1126 ND2 ASN A 89 1.171 20.153 -1.073 1.00 0.00 N ATOM 0 H ASN A 89 -0.955 15.911 -3.701 1.00 0.00 H new ATOM 0 HA ASN A 89 1.496 17.000 -2.861 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -0.545 18.740 -2.240 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -0.513 17.733 -0.806 1.00 0.00 H new ATOM 0 HD21 ASN A 89 1.950 20.719 -0.738 1.00 0.00 H new ATOM 0 HD22 ASN A 89 0.299 20.601 -1.354 1.00 0.00 H new ATOM 1133 N PHE A 90 -0.789 15.073 -1.470 1.00 0.00 N ATOM 1134 CA PHE A 90 -0.977 13.853 -0.694 1.00 0.00 C ATOM 1135 C PHE A 90 -0.665 12.624 -1.541 1.00 0.00 C ATOM 1136 O PHE A 90 -1.038 12.556 -2.713 1.00 0.00 O ATOM 1137 CB PHE A 90 -2.411 13.773 -0.166 1.00 0.00 C ATOM 1138 CG PHE A 90 -2.618 14.516 1.123 1.00 0.00 C ATOM 1139 CD1 PHE A 90 -2.031 14.070 2.296 1.00 0.00 C ATOM 1140 CD2 PHE A 90 -3.398 15.661 1.161 1.00 0.00 C ATOM 1141 CE1 PHE A 90 -2.219 14.752 3.484 1.00 0.00 C ATOM 1142 CE2 PHE A 90 -3.589 16.348 2.345 1.00 0.00 C ATOM 1143 CZ PHE A 90 -2.998 15.892 3.508 1.00 0.00 C ATOM 0 H PHE A 90 -1.652 15.481 -1.830 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.290 13.878 0.152 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.090 14.173 -0.919 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -2.678 12.726 -0.020 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.420 13.180 2.282 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.862 16.021 0.255 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.757 14.394 4.392 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.199 17.239 2.361 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.145 16.427 4.435 1.00 0.00 H new ATOM 1153 N GLN A 91 0.026 11.657 -0.946 1.00 0.00 N ATOM 1154 CA GLN A 91 0.391 10.435 -1.654 1.00 0.00 C ATOM 1155 C GLN A 91 -0.758 9.431 -1.644 1.00 0.00 C ATOM 1156 O GLN A 91 -1.301 9.103 -0.590 1.00 0.00 O ATOM 1157 CB GLN A 91 1.635 9.808 -1.022 1.00 0.00 C ATOM 1158 CG GLN A 91 2.767 10.798 -0.798 1.00 0.00 C ATOM 1159 CD GLN A 91 4.123 10.223 -1.155 1.00 0.00 C ATOM 1160 OE1 GLN A 91 4.468 10.098 -2.331 1.00 0.00 O ATOM 1161 NE2 GLN A 91 4.901 9.868 -0.140 1.00 0.00 N ATOM 0 H GLN A 91 0.344 11.695 0.022 1.00 0.00 H new ATOM 0 HA GLN A 91 0.608 10.698 -2.689 1.00 0.00 H new ATOM 0 HB2 GLN A 91 1.361 9.360 -0.067 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.990 9.001 -1.663 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.587 11.692 -1.395 1.00 0.00 H new ATOM 0 HG3 GLN A 91 2.772 11.109 0.247 1.00 0.00 H new ATOM 0 HE21 GLN A 91 4.575 9.989 0.819 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.825 9.474 -0.319 1.00 0.00 H new ATOM 1170 N ARG A 92 -1.119 8.945 -2.828 1.00 0.00 N ATOM 1171 CA ARG A 92 -2.199 7.973 -2.962 1.00 0.00 C ATOM 1172 C ARG A 92 -1.674 6.656 -3.523 1.00 0.00 C ATOM 1173 O ARG A 92 -0.846 6.645 -4.435 1.00 0.00 O ATOM 1174 CB ARG A 92 -3.303 8.526 -3.864 1.00 0.00 C ATOM 1175 CG ARG A 92 -4.453 9.162 -3.101 1.00 0.00 C ATOM 1176 CD ARG A 92 -5.165 8.148 -2.220 1.00 0.00 C ATOM 1177 NE ARG A 92 -6.404 8.682 -1.659 1.00 0.00 N ATOM 1178 CZ ARG A 92 -7.020 8.166 -0.598 1.00 0.00 C ATOM 1179 NH1 ARG A 92 -6.519 7.103 0.018 1.00 0.00 N ATOM 1180 NH2 ARG A 92 -8.142 8.715 -0.152 1.00 0.00 N ATOM 0 H ARG A 92 -0.679 9.209 -3.709 1.00 0.00 H new ATOM 0 HA ARG A 92 -2.614 7.785 -1.972 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -2.872 9.266 -4.538 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -3.692 7.718 -4.484 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -4.075 9.979 -2.486 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -5.163 9.596 -3.805 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -5.387 7.254 -2.803 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.502 7.843 -1.410 1.00 0.00 H new ATOM 0 HE ARG A 92 -6.821 9.498 -2.107 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -5.657 6.676 -0.321 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -6.996 6.713 0.831 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -8.532 9.532 -0.622 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -8.615 8.320 0.661 1.00 0.00 H new ATOM 1194 N ASN A 93 -2.156 5.547 -2.973 1.00 0.00 N ATOM 1195 CA ASN A 93 -1.729 4.225 -3.422 1.00 0.00 C ATOM 1196 C ASN A 93 -2.882 3.467 -4.073 1.00 0.00 C ATOM 1197 O ASN A 93 -3.979 3.388 -3.521 1.00 0.00 O ATOM 1198 CB ASN A 93 -1.174 3.420 -2.246 1.00 0.00 C ATOM 1199 CG ASN A 93 0.298 3.687 -2.007 1.00 0.00 C ATOM 1200 OD1 ASN A 93 1.162 3.059 -2.621 1.00 0.00 O ATOM 1201 ND2 ASN A 93 0.593 4.623 -1.113 1.00 0.00 N ATOM 0 H ASN A 93 -2.841 5.536 -2.217 1.00 0.00 H new ATOM 0 HA ASN A 93 -0.944 4.360 -4.166 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -1.736 3.664 -1.345 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -1.322 2.357 -2.435 1.00 0.00 H new ATOM 0 HD21 ASN A 93 1.568 4.847 -0.911 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -0.155 5.119 -0.628 1.00 0.00 H new ATOM 1208 N LEU A 94 -2.621 2.904 -5.250 1.00 0.00 N ATOM 1209 CA LEU A 94 -3.631 2.144 -5.978 1.00 0.00 C ATOM 1210 C LEU A 94 -3.197 0.691 -6.140 1.00 0.00 C ATOM 1211 O LEU A 94 -2.032 0.410 -6.422 1.00 0.00 O ATOM 1212 CB LEU A 94 -3.881 2.772 -7.351 1.00 0.00 C ATOM 1213 CG LEU A 94 -4.445 4.193 -7.320 1.00 0.00 C ATOM 1214 CD1 LEU A 94 -3.376 5.182 -6.882 1.00 0.00 C ATOM 1215 CD2 LEU A 94 -5.000 4.575 -8.684 1.00 0.00 C ATOM 0 H LEU A 94 -1.717 2.960 -5.720 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.557 2.168 -5.404 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.943 2.782 -7.905 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.571 2.135 -7.904 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.259 4.225 -6.596 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.796 6.188 -6.866 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.024 4.919 -5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.541 5.148 -7.582 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.397 5.589 -8.644 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.204 4.526 -9.427 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.797 3.884 -8.959 1.00 0.00 H new ATOM 1227 N ILE A 95 -4.136 -0.231 -5.952 1.00 0.00 N ATOM 1228 CA ILE A 95 -3.842 -1.654 -6.071 1.00 0.00 C ATOM 1229 C ILE A 95 -4.638 -2.292 -7.205 1.00 0.00 C ATOM 1230 O ILE A 95 -5.803 -1.963 -7.422 1.00 0.00 O ATOM 1231 CB ILE A 95 -4.144 -2.398 -4.757 1.00 0.00 C ATOM 1232 CG1 ILE A 95 -3.474 -1.689 -3.579 1.00 0.00 C ATOM 1233 CG2 ILE A 95 -3.680 -3.845 -4.846 1.00 0.00 C ATOM 1234 CD1 ILE A 95 -4.310 -0.575 -2.985 1.00 0.00 C ATOM 0 H ILE A 95 -5.105 -0.018 -5.717 1.00 0.00 H new ATOM 0 HA ILE A 95 -2.778 -1.740 -6.292 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.222 -2.394 -4.595 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.255 -2.421 -2.802 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.519 -1.279 -3.908 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.901 -4.356 -3.909 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.200 -4.344 -5.663 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.606 -3.872 -5.029 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.771 -0.119 -2.155 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.507 0.178 -3.748 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.255 -0.982 -2.624 1.00 0.00 H new ATOM 1246 N ASN A 96 -3.997 -3.207 -7.926 1.00 0.00 N ATOM 1247 CA ASN A 96 -4.643 -3.894 -9.040 1.00 0.00 C ATOM 1248 C ASN A 96 -4.815 -5.379 -8.735 1.00 0.00 C ATOM 1249 O ASN A 96 -3.882 -6.041 -8.278 1.00 0.00 O ATOM 1250 CB ASN A 96 -3.820 -3.717 -10.318 1.00 0.00 C ATOM 1251 CG ASN A 96 -4.683 -3.399 -11.523 1.00 0.00 C ATOM 1252 OD1 ASN A 96 -5.590 -4.309 -11.858 1.00 0.00 O flip ATOM 1253 ND2 ASN A 96 -4.536 -2.348 -12.147 1.00 0.00 N flip ATOM 0 H ASN A 96 -3.031 -3.490 -7.759 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.630 -3.454 -9.186 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.096 -2.916 -10.172 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.253 -4.628 -10.511 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -3.826 -1.676 -11.855 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -5.124 -2.149 -12.956 1.00 0.00 H new ATOM 1260 N VAL A 97 -6.014 -5.895 -8.986 1.00 0.00 N ATOM 1261 CA VAL A 97 -6.308 -7.303 -8.734 1.00 0.00 C ATOM 1262 C VAL A 97 -6.142 -8.137 -9.999 1.00 0.00 C ATOM 1263 O VAL A 97 -6.704 -7.813 -11.046 1.00 0.00 O ATOM 1264 CB VAL A 97 -7.738 -7.497 -8.193 1.00 0.00 C ATOM 1265 CG1 VAL A 97 -7.882 -8.866 -7.548 1.00 0.00 C ATOM 1266 CG2 VAL A 97 -8.098 -6.396 -7.206 1.00 0.00 C ATOM 0 H VAL A 97 -6.797 -5.361 -9.363 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.595 -7.639 -7.982 1.00 0.00 H new ATOM 0 HB VAL A 97 -8.431 -7.437 -9.032 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.898 -8.986 -7.172 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.675 -9.640 -8.287 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.176 -8.955 -6.722 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -9.112 -6.554 -6.838 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.401 -6.416 -6.368 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.040 -5.428 -7.704 1.00 0.00 H new ATOM 1276 N ILE A 98 -5.370 -9.213 -9.892 1.00 0.00 N ATOM 1277 CA ILE A 98 -5.129 -10.100 -11.023 1.00 0.00 C ATOM 1278 C ILE A 98 -5.374 -11.555 -10.635 1.00 0.00 C ATOM 1279 O ILE A 98 -4.737 -12.080 -9.722 1.00 0.00 O ATOM 1280 CB ILE A 98 -3.690 -9.956 -11.554 1.00 0.00 C ATOM 1281 CG1 ILE A 98 -3.349 -8.482 -11.775 1.00 0.00 C ATOM 1282 CG2 ILE A 98 -3.521 -10.744 -12.845 1.00 0.00 C ATOM 1283 CD1 ILE A 98 -1.864 -8.214 -11.878 1.00 0.00 C ATOM 0 H ILE A 98 -4.900 -9.492 -9.031 1.00 0.00 H new ATOM 0 HA ILE A 98 -5.826 -9.811 -11.809 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.002 -10.360 -10.811 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -3.836 -8.138 -12.687 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.760 -7.895 -10.953 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.499 -10.633 -13.208 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -3.727 -11.798 -12.658 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -4.216 -10.367 -13.595 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.697 -7.148 -12.034 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -1.373 -8.527 -10.957 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.451 -8.773 -12.717 1.00 0.00 H new ATOM 1295 N ASP A 99 -6.302 -12.201 -11.334 1.00 0.00 N ATOM 1296 CA ASP A 99 -6.631 -13.596 -11.059 1.00 0.00 C ATOM 1297 C ASP A 99 -6.286 -14.484 -12.250 1.00 0.00 C ATOM 1298 O ASP A 99 -6.611 -14.161 -13.393 1.00 0.00 O ATOM 1299 CB ASP A 99 -8.116 -13.735 -10.719 1.00 0.00 C ATOM 1300 CG ASP A 99 -8.469 -13.084 -9.396 1.00 0.00 C ATOM 1301 OD1 ASP A 99 -8.639 -11.847 -9.368 1.00 0.00 O ATOM 1302 OD2 ASP A 99 -8.576 -13.812 -8.386 1.00 0.00 O ATOM 0 H ASP A 99 -6.839 -11.782 -12.094 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.037 -13.920 -10.204 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -8.712 -13.284 -11.513 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -8.380 -14.792 -10.683 1.00 0.00 H new ATOM 1307 N LYS A 100 -5.625 -15.603 -11.975 1.00 0.00 N ATOM 1308 CA LYS A 100 -5.235 -16.539 -13.022 1.00 0.00 C ATOM 1309 C LYS A 100 -5.157 -17.963 -12.478 1.00 0.00 C ATOM 1310 O LYS A 100 -4.328 -18.760 -12.916 1.00 0.00 O ATOM 1311 CB LYS A 100 -3.888 -16.135 -13.621 1.00 0.00 C ATOM 1312 CG LYS A 100 -2.776 -16.017 -12.590 1.00 0.00 C ATOM 1313 CD LYS A 100 -1.627 -16.968 -12.893 1.00 0.00 C ATOM 1314 CE LYS A 100 -0.344 -16.525 -12.209 1.00 0.00 C ATOM 1315 NZ LYS A 100 0.262 -15.341 -12.877 1.00 0.00 N ATOM 0 H LYS A 100 -5.348 -15.884 -11.034 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.995 -16.509 -13.803 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.599 -16.869 -14.373 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -3.999 -15.180 -14.134 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -2.405 -14.992 -12.570 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -3.174 -16.231 -11.598 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -1.888 -17.973 -12.563 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -1.468 -17.017 -13.970 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -0.553 -16.286 -11.166 1.00 0.00 H new ATOM 0 HE3 LYS A 100 0.371 -17.348 -12.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 1.232 -15.204 -12.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 0.282 -15.495 -13.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -0.304 -14.495 -12.665 1.00 0.00 H new ATOM 1329 N SER A 101 -6.026 -18.274 -11.522 1.00 0.00 N ATOM 1330 CA SER A 101 -6.056 -19.600 -10.918 1.00 0.00 C ATOM 1331 C SER A 101 -7.400 -20.277 -11.162 1.00 0.00 C ATOM 1332 O SER A 101 -8.344 -19.650 -11.642 1.00 0.00 O ATOM 1333 CB SER A 101 -5.784 -19.505 -9.415 1.00 0.00 C ATOM 1334 OG SER A 101 -4.407 -19.294 -9.158 1.00 0.00 O ATOM 0 H SER A 101 -6.719 -17.625 -11.149 1.00 0.00 H new ATOM 0 HA SER A 101 -5.276 -20.203 -11.383 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.366 -18.688 -8.988 1.00 0.00 H new ATOM 0 HB3 SER A 101 -6.112 -20.421 -8.924 1.00 0.00 H new ATOM 0 HG SER A 101 -4.220 -18.332 -9.146 1.00 0.00 H new ATOM 1340 N ARG A 102 -7.480 -21.561 -10.826 1.00 0.00 N ATOM 1341 CA ARG A 102 -8.710 -22.324 -11.009 1.00 0.00 C ATOM 1342 C ARG A 102 -9.295 -22.740 -9.665 1.00 0.00 C ATOM 1343 O ARG A 102 -9.920 -23.795 -9.547 1.00 0.00 O ATOM 1344 CB ARG A 102 -8.444 -23.561 -11.868 1.00 0.00 C ATOM 1345 CG ARG A 102 -7.740 -23.252 -13.180 1.00 0.00 C ATOM 1346 CD ARG A 102 -6.262 -23.600 -13.116 1.00 0.00 C ATOM 1347 NE ARG A 102 -5.967 -24.865 -13.786 1.00 0.00 N ATOM 1348 CZ ARG A 102 -4.750 -25.231 -14.181 1.00 0.00 C ATOM 1349 NH1 ARG A 102 -3.711 -24.431 -13.976 1.00 0.00 N ATOM 1350 NH2 ARG A 102 -4.570 -26.399 -14.782 1.00 0.00 N ATOM 0 H ARG A 102 -6.708 -22.095 -10.426 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.433 -21.686 -11.518 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -7.839 -24.266 -11.298 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.392 -24.055 -12.082 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.212 -23.812 -13.988 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.856 -22.194 -13.416 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.681 -22.801 -13.578 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -5.949 -23.660 -12.074 1.00 0.00 H new ATOM 0 HE ARG A 102 -6.741 -25.506 -13.961 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -3.843 -23.531 -13.514 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -2.780 -24.716 -14.280 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -5.365 -27.018 -14.942 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -3.637 -26.679 -15.084 1.00 0.00 H new ATOM 1364 N ASN A 103 -9.090 -21.904 -8.651 1.00 0.00 N ATOM 1365 CA ASN A 103 -9.597 -22.186 -7.315 1.00 0.00 C ATOM 1366 C ASN A 103 -10.875 -21.403 -7.033 1.00 0.00 C ATOM 1367 O ASN A 103 -11.816 -21.926 -6.437 1.00 0.00 O ATOM 1368 CB ASN A 103 -8.544 -21.863 -6.273 1.00 0.00 C ATOM 1369 CG ASN A 103 -7.951 -23.107 -5.640 1.00 0.00 C ATOM 1370 OD1 ASN A 103 -7.700 -24.104 -6.318 1.00 0.00 O ATOM 1371 ND2 ASN A 103 -7.722 -23.055 -4.333 1.00 0.00 N ATOM 0 H ASN A 103 -8.576 -21.026 -8.731 1.00 0.00 H new ATOM 0 HA ASN A 103 -9.833 -23.249 -7.263 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -7.748 -21.280 -6.735 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.986 -21.240 -5.496 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -7.323 -23.862 -3.853 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.945 -22.209 -3.809 1.00 0.00 H new ATOM 1378 N GLY A 104 -10.901 -20.146 -7.466 1.00 0.00 N ATOM 1379 CA GLY A 104 -12.068 -19.311 -7.251 1.00 0.00 C ATOM 1380 C GLY A 104 -11.793 -18.166 -6.296 1.00 0.00 C ATOM 1381 O GLY A 104 -11.622 -18.376 -5.096 1.00 0.00 O ATOM 0 H GLY A 104 -10.134 -19.691 -7.962 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.405 -18.910 -8.207 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -12.880 -19.922 -6.857 1.00 0.00 H new ATOM 1385 N THR A 105 -11.752 -16.949 -6.831 1.00 0.00 N ATOM 1386 CA THR A 105 -11.496 -15.765 -6.020 1.00 0.00 C ATOM 1387 C THR A 105 -12.729 -14.868 -5.962 1.00 0.00 C ATOM 1388 O THR A 105 -13.272 -14.476 -6.996 1.00 0.00 O ATOM 1389 CB THR A 105 -10.309 -14.982 -6.583 1.00 0.00 C ATOM 1390 OG1 THR A 105 -9.163 -15.809 -6.678 1.00 0.00 O ATOM 1391 CG2 THR A 105 -9.937 -13.776 -5.750 1.00 0.00 C ATOM 0 H THR A 105 -11.893 -16.758 -7.823 1.00 0.00 H new ATOM 0 HA THR A 105 -11.259 -16.093 -5.008 1.00 0.00 H new ATOM 0 HB THR A 105 -10.631 -14.638 -7.566 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.491 -15.512 -6.030 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.088 -13.267 -6.206 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.785 -13.093 -5.699 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.669 -14.098 -4.743 1.00 0.00 H new ATOM 1399 N PHE A 106 -13.166 -14.548 -4.749 1.00 0.00 N ATOM 1400 CA PHE A 106 -14.335 -13.696 -4.557 1.00 0.00 C ATOM 1401 C PHE A 106 -13.968 -12.439 -3.776 1.00 0.00 C ATOM 1402 O PHE A 106 -13.444 -12.517 -2.664 1.00 0.00 O ATOM 1403 CB PHE A 106 -15.435 -14.464 -3.820 1.00 0.00 C ATOM 1404 CG PHE A 106 -15.919 -15.677 -4.561 1.00 0.00 C ATOM 1405 CD1 PHE A 106 -16.546 -15.552 -5.790 1.00 0.00 C ATOM 1406 CD2 PHE A 106 -15.751 -16.944 -4.024 1.00 0.00 C ATOM 1407 CE1 PHE A 106 -16.994 -16.668 -6.472 1.00 0.00 C ATOM 1408 CE2 PHE A 106 -16.196 -18.063 -4.702 1.00 0.00 C ATOM 1409 CZ PHE A 106 -16.819 -17.924 -5.927 1.00 0.00 C ATOM 0 H PHE A 106 -12.729 -14.865 -3.884 1.00 0.00 H new ATOM 0 HA PHE A 106 -14.703 -13.399 -5.539 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -15.061 -14.770 -2.843 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -16.278 -13.796 -3.644 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -16.686 -14.571 -6.220 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -15.267 -17.058 -3.065 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -17.480 -16.557 -7.430 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -16.057 -19.045 -4.275 1.00 0.00 H new ATOM 0 HZ PHE A 106 -17.169 -18.797 -6.458 1.00 0.00 H new ATOM 1419 N ILE A 107 -14.248 -11.279 -4.363 1.00 0.00 N ATOM 1420 CA ILE A 107 -13.947 -10.006 -3.720 1.00 0.00 C ATOM 1421 C ILE A 107 -15.195 -9.157 -3.565 1.00 0.00 C ATOM 1422 O ILE A 107 -16.022 -9.056 -4.471 1.00 0.00 O ATOM 1423 CB ILE A 107 -12.871 -9.210 -4.480 1.00 0.00 C ATOM 1424 CG1 ILE A 107 -12.726 -7.787 -3.926 1.00 0.00 C ATOM 1425 CG2 ILE A 107 -13.179 -9.176 -5.968 1.00 0.00 C ATOM 1426 CD1 ILE A 107 -12.076 -7.735 -2.561 1.00 0.00 C ATOM 0 H ILE A 107 -14.682 -11.195 -5.282 1.00 0.00 H new ATOM 0 HA ILE A 107 -13.556 -10.247 -2.732 1.00 0.00 H new ATOM 0 HB ILE A 107 -11.919 -9.720 -4.334 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -12.136 -7.192 -4.624 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -13.712 -7.326 -3.868 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -12.406 -8.609 -6.487 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -13.205 -10.194 -6.358 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -14.147 -8.701 -6.128 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -12.006 -6.699 -2.231 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -12.677 -8.302 -1.850 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -11.077 -8.167 -2.617 1.00 0.00 H new ATOM 1438 N ASN A 108 -15.311 -8.550 -2.399 1.00 0.00 N ATOM 1439 CA ASN A 108 -16.449 -7.694 -2.083 1.00 0.00 C ATOM 1440 C ASN A 108 -17.757 -8.476 -2.168 1.00 0.00 C ATOM 1441 O ASN A 108 -18.813 -7.908 -2.448 1.00 0.00 O ATOM 1442 CB ASN A 108 -16.496 -6.499 -3.039 1.00 0.00 C ATOM 1443 CG ASN A 108 -15.637 -5.342 -2.569 1.00 0.00 C ATOM 1444 OD1 ASN A 108 -14.445 -5.651 -2.073 1.00 0.00 O flip ATOM 1445 ND2 ASN A 108 -16.039 -4.181 -2.652 1.00 0.00 N flip ATOM 0 H ASN A 108 -14.627 -8.632 -1.647 1.00 0.00 H new ATOM 0 HA ASN A 108 -16.327 -7.331 -1.062 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -16.163 -6.816 -4.027 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -17.527 -6.162 -3.143 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -16.962 -3.988 -3.040 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -15.449 -3.413 -2.333 1.00 0.00 H new ATOM 1452 N GLY A 109 -17.680 -9.779 -1.919 1.00 0.00 N ATOM 1453 CA GLY A 109 -18.858 -10.613 -1.968 1.00 0.00 C ATOM 1454 C GLY A 109 -19.364 -10.835 -3.381 1.00 0.00 C ATOM 1455 O GLY A 109 -20.470 -11.340 -3.578 1.00 0.00 O ATOM 0 H GLY A 109 -16.818 -10.270 -1.684 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -18.634 -11.577 -1.512 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -19.647 -10.154 -1.372 1.00 0.00 H new ATOM 1459 N ASN A 110 -18.555 -10.461 -4.370 1.00 0.00 N ATOM 1460 CA ASN A 110 -18.930 -10.625 -5.768 1.00 0.00 C ATOM 1461 C ASN A 110 -17.779 -11.221 -6.573 1.00 0.00 C ATOM 1462 O ASN A 110 -16.625 -10.823 -6.410 1.00 0.00 O ATOM 1463 CB ASN A 110 -19.345 -9.280 -6.368 1.00 0.00 C ATOM 1464 CG ASN A 110 -20.719 -8.839 -5.904 1.00 0.00 C ATOM 1465 OD1 ASN A 110 -21.733 -9.429 -6.278 1.00 0.00 O ATOM 1466 ND2 ASN A 110 -20.760 -7.796 -5.084 1.00 0.00 N ATOM 0 H ASN A 110 -17.636 -10.043 -4.227 1.00 0.00 H new ATOM 0 HA ASN A 110 -19.776 -11.311 -5.814 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -18.611 -8.522 -6.094 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -19.338 -9.353 -7.456 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -21.657 -7.454 -4.738 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -19.895 -7.337 -4.799 1.00 0.00 H new ATOM 1473 N ARG A 111 -18.100 -12.175 -7.439 1.00 0.00 N ATOM 1474 CA ARG A 111 -17.090 -12.825 -8.267 1.00 0.00 C ATOM 1475 C ARG A 111 -16.499 -11.843 -9.274 1.00 0.00 C ATOM 1476 O ARG A 111 -17.207 -10.996 -9.819 1.00 0.00 O ATOM 1477 CB ARG A 111 -17.696 -14.024 -9.001 1.00 0.00 C ATOM 1478 CG ARG A 111 -19.020 -13.715 -9.682 1.00 0.00 C ATOM 1479 CD ARG A 111 -20.140 -14.610 -9.172 1.00 0.00 C ATOM 1480 NE ARG A 111 -21.099 -13.874 -8.352 1.00 0.00 N ATOM 1481 CZ ARG A 111 -22.204 -14.413 -7.840 1.00 0.00 C ATOM 1482 NH1 ARG A 111 -22.491 -15.690 -8.060 1.00 0.00 N ATOM 1483 NH2 ARG A 111 -23.023 -13.673 -7.106 1.00 0.00 N ATOM 0 H ARG A 111 -19.050 -12.516 -7.586 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.290 -13.174 -7.614 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -16.986 -14.378 -9.749 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -17.843 -14.838 -8.291 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -19.282 -12.671 -9.510 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -18.914 -13.844 -10.759 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -20.658 -15.061 -10.019 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -19.714 -15.426 -8.588 1.00 0.00 H new ATOM 0 HE ARG A 111 -20.911 -12.890 -8.160 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -21.864 -16.264 -8.624 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -23.339 -16.098 -7.665 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -22.807 -12.691 -6.934 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -23.869 -14.085 -6.714 1.00 0.00 H new ATOM 1497 N LEU A 112 -15.198 -11.963 -9.516 1.00 0.00 N ATOM 1498 CA LEU A 112 -14.512 -11.086 -10.456 1.00 0.00 C ATOM 1499 C LEU A 112 -14.807 -11.496 -11.896 1.00 0.00 C ATOM 1500 O LEU A 112 -14.896 -12.683 -12.209 1.00 0.00 O ATOM 1501 CB LEU A 112 -13.003 -11.114 -10.205 1.00 0.00 C ATOM 1502 CG LEU A 112 -12.577 -10.740 -8.784 1.00 0.00 C ATOM 1503 CD1 LEU A 112 -12.522 -11.976 -7.901 1.00 0.00 C ATOM 1504 CD2 LEU A 112 -11.229 -10.035 -8.802 1.00 0.00 C ATOM 0 H LEU A 112 -14.598 -12.659 -9.074 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.880 -10.071 -10.302 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -12.631 -12.114 -10.428 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -12.521 -10.431 -10.904 1.00 0.00 H new ATOM 0 HG LEU A 112 -13.318 -10.056 -8.370 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -12.217 -11.691 -6.894 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -13.507 -12.441 -7.864 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.802 -12.684 -8.311 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.940 -9.776 -7.783 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.478 -10.696 -9.235 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -11.301 -9.127 -9.401 1.00 0.00 H new ATOM 1516 N VAL A 113 -14.955 -10.504 -12.769 1.00 0.00 N ATOM 1517 CA VAL A 113 -15.239 -10.761 -14.176 1.00 0.00 C ATOM 1518 C VAL A 113 -14.396 -9.864 -15.077 1.00 0.00 C ATOM 1519 O VAL A 113 -14.827 -9.481 -16.165 1.00 0.00 O ATOM 1520 CB VAL A 113 -16.729 -10.537 -14.498 1.00 0.00 C ATOM 1521 CG1 VAL A 113 -17.577 -11.650 -13.903 1.00 0.00 C ATOM 1522 CG2 VAL A 113 -17.188 -9.179 -13.991 1.00 0.00 C ATOM 0 H VAL A 113 -14.883 -9.516 -12.527 1.00 0.00 H new ATOM 0 HA VAL A 113 -14.987 -11.804 -14.366 1.00 0.00 H new ATOM 0 HB VAL A 113 -16.854 -10.555 -15.581 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -18.626 -11.475 -14.141 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -17.265 -12.608 -14.320 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -17.448 -11.667 -12.821 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -18.243 -9.040 -14.228 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -17.049 -9.128 -12.911 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -16.602 -8.395 -14.470 1.00 0.00 H new ATOM 1532 N LYS A 114 -13.195 -9.533 -14.617 1.00 0.00 N ATOM 1533 CA LYS A 114 -12.292 -8.681 -15.383 1.00 0.00 C ATOM 1534 C LYS A 114 -10.840 -9.101 -15.176 1.00 0.00 C ATOM 1535 O LYS A 114 -10.554 -10.034 -14.425 1.00 0.00 O ATOM 1536 CB LYS A 114 -12.477 -7.216 -14.979 1.00 0.00 C ATOM 1537 CG LYS A 114 -12.680 -6.280 -16.159 1.00 0.00 C ATOM 1538 CD LYS A 114 -13.399 -5.006 -15.744 1.00 0.00 C ATOM 1539 CE LYS A 114 -12.724 -3.771 -16.320 1.00 0.00 C ATOM 1540 NZ LYS A 114 -11.623 -3.282 -15.445 1.00 0.00 N ATOM 0 H LYS A 114 -12.824 -9.841 -13.718 1.00 0.00 H new ATOM 0 HA LYS A 114 -12.534 -8.793 -16.440 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -13.335 -7.137 -14.312 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.603 -6.891 -14.414 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -11.713 -6.028 -16.595 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -13.256 -6.788 -16.933 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -14.435 -5.046 -16.081 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.420 -4.937 -14.656 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -12.327 -4.002 -17.309 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -13.463 -2.980 -16.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -11.188 -2.439 -15.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -12.006 -3.038 -14.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -10.905 -4.027 -15.341 1.00 0.00 H new ATOM 1554 N LYS A 115 -9.927 -8.406 -15.848 1.00 0.00 N ATOM 1555 CA LYS A 115 -8.504 -8.706 -15.738 1.00 0.00 C ATOM 1556 C LYS A 115 -7.778 -7.620 -14.950 1.00 0.00 C ATOM 1557 O LYS A 115 -6.956 -7.914 -14.081 1.00 0.00 O ATOM 1558 CB LYS A 115 -7.882 -8.845 -17.129 1.00 0.00 C ATOM 1559 CG LYS A 115 -6.770 -9.879 -17.199 1.00 0.00 C ATOM 1560 CD LYS A 115 -7.295 -11.284 -16.944 1.00 0.00 C ATOM 1561 CE LYS A 115 -6.861 -12.250 -18.034 1.00 0.00 C ATOM 1562 NZ LYS A 115 -5.378 -12.350 -18.129 1.00 0.00 N ATOM 0 H LYS A 115 -10.148 -7.632 -16.474 1.00 0.00 H new ATOM 0 HA LYS A 115 -8.397 -9.650 -15.204 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -8.662 -9.114 -17.841 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.487 -7.878 -17.439 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.297 -9.839 -18.180 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.002 -9.638 -16.464 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.934 -11.638 -15.978 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -8.383 -11.262 -16.889 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.279 -13.236 -17.833 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.265 -11.922 -18.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -5.121 -13.196 -18.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.003 -11.504 -18.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -4.973 -12.420 -17.174 1.00 0.00 H new ATOM 1576 N ASP A 116 -8.089 -6.365 -15.257 1.00 0.00 N ATOM 1577 CA ASP A 116 -7.466 -5.236 -14.577 1.00 0.00 C ATOM 1578 C ASP A 116 -8.420 -4.628 -13.552 1.00 0.00 C ATOM 1579 O ASP A 116 -8.981 -3.554 -13.769 1.00 0.00 O ATOM 1580 CB ASP A 116 -7.042 -4.173 -15.593 1.00 0.00 C ATOM 1581 CG ASP A 116 -5.556 -4.224 -15.896 1.00 0.00 C ATOM 1582 OD1 ASP A 116 -4.759 -4.330 -14.941 1.00 0.00 O ATOM 1583 OD2 ASP A 116 -5.191 -4.159 -17.089 1.00 0.00 O ATOM 0 H ASP A 116 -8.768 -6.105 -15.972 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.582 -5.599 -14.053 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.604 -4.312 -16.517 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -7.298 -3.185 -15.210 1.00 0.00 H new ATOM 1588 N TYR A 117 -8.599 -5.324 -12.433 1.00 0.00 N ATOM 1589 CA TYR A 117 -9.485 -4.854 -11.373 1.00 0.00 C ATOM 1590 C TYR A 117 -8.763 -3.872 -10.455 1.00 0.00 C ATOM 1591 O TYR A 117 -7.597 -4.069 -10.112 1.00 0.00 O ATOM 1592 CB TYR A 117 -10.017 -6.037 -10.560 1.00 0.00 C ATOM 1593 CG TYR A 117 -11.526 -6.077 -10.464 1.00 0.00 C ATOM 1594 CD1 TYR A 117 -12.224 -5.086 -9.787 1.00 0.00 C ATOM 1595 CD2 TYR A 117 -12.251 -7.106 -11.052 1.00 0.00 C ATOM 1596 CE1 TYR A 117 -13.603 -5.120 -9.696 1.00 0.00 C ATOM 1597 CE2 TYR A 117 -13.630 -7.147 -10.967 1.00 0.00 C ATOM 1598 CZ TYR A 117 -14.301 -6.152 -10.289 1.00 0.00 C ATOM 1599 OH TYR A 117 -15.673 -6.187 -10.201 1.00 0.00 O ATOM 0 H TYR A 117 -8.143 -6.215 -12.237 1.00 0.00 H new ATOM 0 HA TYR A 117 -10.324 -4.337 -11.838 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -9.665 -6.965 -11.012 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -9.598 -5.993 -9.554 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -11.681 -4.275 -9.324 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -11.728 -7.887 -11.584 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -14.131 -4.343 -9.164 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -14.179 -7.954 -11.429 1.00 0.00 H new ATOM 0 HH TYR A 117 -16.011 -6.977 -10.672 1.00 0.00 H new ATOM 1609 N ILE A 118 -9.464 -2.814 -10.059 1.00 0.00 N ATOM 1610 CA ILE A 118 -8.894 -1.804 -9.184 1.00 0.00 C ATOM 1611 C ILE A 118 -9.316 -2.040 -7.735 1.00 0.00 C ATOM 1612 O ILE A 118 -10.504 -2.033 -7.413 1.00 0.00 O ATOM 1613 CB ILE A 118 -9.317 -0.385 -9.628 1.00 0.00 C ATOM 1614 CG1 ILE A 118 -8.422 0.661 -8.969 1.00 0.00 C ATOM 1615 CG2 ILE A 118 -10.782 -0.122 -9.304 1.00 0.00 C ATOM 1616 CD1 ILE A 118 -6.951 0.425 -9.219 1.00 0.00 C ATOM 0 H ILE A 118 -10.430 -2.637 -10.333 1.00 0.00 H new ATOM 0 HA ILE A 118 -7.809 -1.883 -9.252 1.00 0.00 H new ATOM 0 HB ILE A 118 -9.199 -0.315 -10.709 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -8.694 1.649 -9.341 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -8.606 0.663 -7.895 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -11.051 0.883 -9.627 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -11.406 -0.850 -9.823 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -10.939 -0.211 -8.229 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.369 1.202 -8.724 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -6.666 -0.550 -8.822 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.755 0.452 -10.291 1.00 0.00 H new ATOM 1628 N LEU A 119 -8.334 -2.264 -6.868 1.00 0.00 N ATOM 1629 CA LEU A 119 -8.605 -2.517 -5.458 1.00 0.00 C ATOM 1630 C LEU A 119 -8.313 -1.290 -4.600 1.00 0.00 C ATOM 1631 O LEU A 119 -7.283 -0.632 -4.758 1.00 0.00 O ATOM 1632 CB LEU A 119 -7.775 -3.705 -4.963 1.00 0.00 C ATOM 1633 CG LEU A 119 -7.932 -4.034 -3.476 1.00 0.00 C ATOM 1634 CD1 LEU A 119 -7.721 -5.521 -3.234 1.00 0.00 C ATOM 1635 CD2 LEU A 119 -6.960 -3.214 -2.639 1.00 0.00 C ATOM 0 H LEU A 119 -7.345 -2.275 -7.117 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.666 -2.750 -5.364 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.047 -4.586 -5.545 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.723 -3.502 -5.165 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.947 -3.776 -3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.836 -5.737 -2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -8.457 -6.090 -3.802 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -6.718 -5.803 -3.555 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -7.088 -3.463 -1.585 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.938 -3.439 -2.944 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.158 -2.152 -2.788 1.00 0.00 H new ATOM 1647 N LYS A 120 -9.225 -1.009 -3.675 1.00 0.00 N ATOM 1648 CA LYS A 120 -9.082 0.117 -2.759 1.00 0.00 C ATOM 1649 C LYS A 120 -9.046 -0.393 -1.325 1.00 0.00 C ATOM 1650 O LYS A 120 -9.929 -1.138 -0.899 1.00 0.00 O ATOM 1651 CB LYS A 120 -10.237 1.104 -2.939 1.00 0.00 C ATOM 1652 CG LYS A 120 -10.306 1.715 -4.328 1.00 0.00 C ATOM 1653 CD LYS A 120 -9.172 2.700 -4.561 1.00 0.00 C ATOM 1654 CE LYS A 120 -8.970 2.978 -6.042 1.00 0.00 C ATOM 1655 NZ LYS A 120 -7.528 3.112 -6.389 1.00 0.00 N ATOM 0 H LYS A 120 -10.078 -1.551 -3.540 1.00 0.00 H new ATOM 0 HA LYS A 120 -8.149 0.636 -2.980 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -11.176 0.593 -2.729 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -10.138 1.903 -2.204 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -10.262 0.924 -5.077 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -11.262 2.223 -4.456 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -9.387 3.633 -4.041 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -8.251 2.303 -4.135 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -9.411 2.171 -6.627 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -9.496 3.893 -6.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -7.429 3.708 -7.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -7.019 3.551 -5.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -7.128 2.171 -6.579 1.00 0.00 H new ATOM 1669 N ASN A 121 -8.014 -0.004 -0.590 1.00 0.00 N ATOM 1670 CA ASN A 121 -7.851 -0.439 0.792 1.00 0.00 C ATOM 1671 C ASN A 121 -9.120 -0.206 1.609 1.00 0.00 C ATOM 1672 O ASN A 121 -9.875 0.733 1.361 1.00 0.00 O ATOM 1673 CB ASN A 121 -6.671 0.282 1.436 1.00 0.00 C ATOM 1674 CG ASN A 121 -5.422 0.214 0.582 1.00 0.00 C ATOM 1675 OD1 ASN A 121 -5.478 0.366 -0.638 1.00 0.00 O ATOM 1676 ND2 ASN A 121 -4.282 -0.020 1.221 1.00 0.00 N ATOM 0 H ASN A 121 -7.275 0.613 -0.927 1.00 0.00 H new ATOM 0 HA ASN A 121 -7.655 -1.511 0.781 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -6.935 1.326 1.608 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -6.466 -0.160 2.411 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -3.408 -0.080 0.699 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -4.280 -0.140 2.234 1.00 0.00 H new ATOM 1683 N GLY A 122 -9.341 -1.087 2.577 1.00 0.00 N ATOM 1684 CA GLY A 122 -10.511 -1.000 3.428 1.00 0.00 C ATOM 1685 C GLY A 122 -11.653 -1.838 2.898 1.00 0.00 C ATOM 1686 O GLY A 122 -12.810 -1.417 2.923 1.00 0.00 O ATOM 0 H GLY A 122 -8.722 -1.869 2.789 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -10.254 -1.330 4.434 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -10.828 0.040 3.505 1.00 0.00 H new ATOM 1690 N ASP A 123 -11.322 -3.029 2.413 1.00 0.00 N ATOM 1691 CA ASP A 123 -12.325 -3.937 1.866 1.00 0.00 C ATOM 1692 C ASP A 123 -12.003 -5.383 2.223 1.00 0.00 C ATOM 1693 O ASP A 123 -10.878 -5.704 2.602 1.00 0.00 O ATOM 1694 CB ASP A 123 -12.409 -3.781 0.347 1.00 0.00 C ATOM 1695 CG ASP A 123 -13.387 -2.699 -0.070 1.00 0.00 C ATOM 1696 OD1 ASP A 123 -14.302 -2.390 0.722 1.00 0.00 O ATOM 1697 OD2 ASP A 123 -13.236 -2.161 -1.187 1.00 0.00 O ATOM 0 H ASP A 123 -10.368 -3.389 2.387 1.00 0.00 H new ATOM 0 HA ASP A 123 -13.289 -3.680 2.305 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.420 -3.545 -0.046 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -12.710 -4.730 -0.097 1.00 0.00 H new ATOM 1702 N ARG A 124 -13.002 -6.251 2.103 1.00 0.00 N ATOM 1703 CA ARG A 124 -12.828 -7.664 2.416 1.00 0.00 C ATOM 1704 C ARG A 124 -12.504 -8.464 1.158 1.00 0.00 C ATOM 1705 O ARG A 124 -13.262 -8.450 0.188 1.00 0.00 O ATOM 1706 CB ARG A 124 -14.089 -8.219 3.081 1.00 0.00 C ATOM 1707 CG ARG A 124 -13.906 -8.541 4.556 1.00 0.00 C ATOM 1708 CD ARG A 124 -13.623 -10.020 4.774 1.00 0.00 C ATOM 1709 NE ARG A 124 -14.417 -10.572 5.868 1.00 0.00 N ATOM 1710 CZ ARG A 124 -15.731 -10.773 5.804 1.00 0.00 C ATOM 1711 NH1 ARG A 124 -16.402 -10.465 4.701 1.00 0.00 N ATOM 1712 NH2 ARG A 124 -16.377 -11.281 6.844 1.00 0.00 N ATOM 0 H ARG A 124 -13.940 -6.000 1.791 1.00 0.00 H new ATOM 0 HA ARG A 124 -11.991 -7.758 3.108 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -14.896 -7.494 2.973 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -14.399 -9.122 2.556 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -13.084 -7.949 4.959 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -14.803 -8.257 5.105 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -13.837 -10.569 3.857 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -12.563 -10.159 4.989 1.00 0.00 H new ATOM 0 HE ARG A 124 -13.936 -10.818 6.733 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -15.911 -10.073 3.898 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -17.409 -10.621 4.656 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -15.867 -11.518 7.695 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -17.384 -11.434 6.793 1.00 0.00 H new ATOM 1726 N ILE A 125 -11.374 -9.161 1.184 1.00 0.00 N ATOM 1727 CA ILE A 125 -10.948 -9.971 0.049 1.00 0.00 C ATOM 1728 C ILE A 125 -10.935 -11.451 0.410 1.00 0.00 C ATOM 1729 O ILE A 125 -10.249 -11.866 1.344 1.00 0.00 O ATOM 1730 CB ILE A 125 -9.544 -9.562 -0.438 1.00 0.00 C ATOM 1731 CG1 ILE A 125 -9.451 -8.041 -0.594 1.00 0.00 C ATOM 1732 CG2 ILE A 125 -9.217 -10.257 -1.752 1.00 0.00 C ATOM 1733 CD1 ILE A 125 -8.296 -7.427 0.166 1.00 0.00 C ATOM 0 H ILE A 125 -10.736 -9.181 1.979 1.00 0.00 H new ATOM 0 HA ILE A 125 -11.667 -9.799 -0.752 1.00 0.00 H new ATOM 0 HB ILE A 125 -8.813 -9.874 0.309 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -9.350 -7.797 -1.652 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -10.382 -7.591 -0.250 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.223 -9.959 -2.084 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -9.243 -11.337 -1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -9.951 -9.974 -2.506 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -8.291 -6.348 0.011 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -8.406 -7.640 1.229 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -7.358 -7.850 -0.194 1.00 0.00 H new ATOM 1745 N VAL A 126 -11.697 -12.244 -0.336 1.00 0.00 N ATOM 1746 CA VAL A 126 -11.772 -13.678 -0.090 1.00 0.00 C ATOM 1747 C VAL A 126 -11.076 -14.461 -1.199 1.00 0.00 C ATOM 1748 O VAL A 126 -11.405 -14.316 -2.377 1.00 0.00 O ATOM 1749 CB VAL A 126 -13.233 -14.154 0.024 1.00 0.00 C ATOM 1750 CG1 VAL A 126 -13.291 -15.624 0.411 1.00 0.00 C ATOM 1751 CG2 VAL A 126 -13.993 -13.303 1.030 1.00 0.00 C ATOM 0 H VAL A 126 -12.270 -11.918 -1.114 1.00 0.00 H new ATOM 0 HA VAL A 126 -11.265 -13.865 0.856 1.00 0.00 H new ATOM 0 HB VAL A 126 -13.708 -14.041 -0.950 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -14.332 -15.940 0.486 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -12.785 -16.220 -0.348 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -12.798 -15.767 1.373 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -15.023 -13.653 1.098 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -13.517 -13.383 2.007 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -13.984 -12.262 0.706 1.00 0.00 H new ATOM 1761 N PHE A 127 -10.113 -15.291 -0.812 1.00 0.00 N ATOM 1762 CA PHE A 127 -9.368 -16.098 -1.771 1.00 0.00 C ATOM 1763 C PHE A 127 -9.495 -17.581 -1.443 1.00 0.00 C ATOM 1764 O PHE A 127 -9.583 -17.965 -0.277 1.00 0.00 O ATOM 1765 CB PHE A 127 -7.893 -15.690 -1.777 1.00 0.00 C ATOM 1766 CG PHE A 127 -7.577 -14.604 -2.766 1.00 0.00 C ATOM 1767 CD1 PHE A 127 -7.333 -14.909 -4.095 1.00 0.00 C ATOM 1768 CD2 PHE A 127 -7.521 -13.279 -2.365 1.00 0.00 C ATOM 1769 CE1 PHE A 127 -7.041 -13.913 -5.007 1.00 0.00 C ATOM 1770 CE2 PHE A 127 -7.230 -12.278 -3.272 1.00 0.00 C ATOM 1771 CZ PHE A 127 -6.989 -12.595 -4.595 1.00 0.00 C ATOM 0 H PHE A 127 -9.830 -15.422 0.159 1.00 0.00 H new ATOM 0 HA PHE A 127 -9.789 -15.924 -2.761 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -7.613 -15.354 -0.779 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -7.283 -16.565 -2.002 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -7.371 -15.938 -4.422 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -7.707 -13.026 -1.332 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -6.854 -14.164 -6.041 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -7.191 -11.249 -2.947 1.00 0.00 H new ATOM 0 HZ PHE A 127 -6.760 -11.814 -5.306 1.00 0.00 H new ATOM 1781 N GLY A 128 -9.506 -18.412 -2.479 1.00 0.00 N ATOM 1782 CA GLY A 128 -9.625 -19.842 -2.281 1.00 0.00 C ATOM 1783 C GLY A 128 -11.058 -20.273 -2.045 1.00 0.00 C ATOM 1784 O GLY A 128 -11.644 -20.981 -2.863 1.00 0.00 O ATOM 0 H GLY A 128 -9.434 -18.119 -3.453 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -9.231 -20.361 -3.155 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -9.013 -20.141 -1.430 1.00 0.00 H new ATOM 1788 N LYS A 129 -11.626 -19.841 -0.921 1.00 0.00 N ATOM 1789 CA LYS A 129 -13.004 -20.181 -0.576 1.00 0.00 C ATOM 1790 C LYS A 129 -13.329 -19.765 0.856 1.00 0.00 C ATOM 1791 O LYS A 129 -14.459 -19.382 1.160 1.00 0.00 O ATOM 1792 CB LYS A 129 -13.245 -21.686 -0.747 1.00 0.00 C ATOM 1793 CG LYS A 129 -14.102 -22.030 -1.955 1.00 0.00 C ATOM 1794 CD LYS A 129 -13.564 -23.244 -2.698 1.00 0.00 C ATOM 1795 CE LYS A 129 -14.606 -24.348 -2.798 1.00 0.00 C ATOM 1796 NZ LYS A 129 -14.020 -25.621 -3.299 1.00 0.00 N ATOM 0 H LYS A 129 -11.153 -19.255 -0.234 1.00 0.00 H new ATOM 0 HA LYS A 129 -13.661 -19.635 -1.253 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -12.284 -22.192 -0.838 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.725 -22.073 0.151 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -15.125 -22.224 -1.632 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -14.138 -21.176 -2.631 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -13.249 -22.948 -3.699 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -12.680 -23.623 -2.185 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -15.053 -24.515 -1.818 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -15.408 -24.031 -3.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -14.762 -26.347 -3.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -13.616 -25.468 -4.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -13.272 -25.938 -2.650 1.00 0.00 H new ATOM 1810 N SER A 130 -12.335 -19.847 1.735 1.00 0.00 N ATOM 1811 CA SER A 130 -12.524 -19.484 3.135 1.00 0.00 C ATOM 1812 C SER A 130 -11.600 -18.339 3.546 1.00 0.00 C ATOM 1813 O SER A 130 -11.972 -17.495 4.361 1.00 0.00 O ATOM 1814 CB SER A 130 -12.275 -20.697 4.034 1.00 0.00 C ATOM 1815 OG SER A 130 -10.933 -21.142 3.933 1.00 0.00 O ATOM 0 H SER A 130 -11.393 -20.161 1.503 1.00 0.00 H new ATOM 0 HA SER A 130 -13.554 -19.149 3.254 1.00 0.00 H new ATOM 0 HB2 SER A 130 -12.498 -20.438 5.069 1.00 0.00 H new ATOM 0 HB3 SER A 130 -12.951 -21.505 3.755 1.00 0.00 H new ATOM 0 HG SER A 130 -10.800 -21.917 4.518 1.00 0.00 H new ATOM 1821 N CYS A 131 -10.394 -18.316 2.985 1.00 0.00 N ATOM 1822 CA CYS A 131 -9.423 -17.274 3.306 1.00 0.00 C ATOM 1823 C CYS A 131 -10.010 -15.883 3.088 1.00 0.00 C ATOM 1824 O CYS A 131 -10.150 -15.425 1.955 1.00 0.00 O ATOM 1825 CB CYS A 131 -8.161 -17.436 2.463 1.00 0.00 C ATOM 1826 SG CYS A 131 -7.463 -19.105 2.488 1.00 0.00 S ATOM 0 H CYS A 131 -10.066 -19.005 2.308 1.00 0.00 H new ATOM 0 HA CYS A 131 -9.166 -17.380 4.360 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -8.389 -17.165 1.432 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -7.407 -16.733 2.818 1.00 0.00 H new ATOM 0 HG CYS A 131 -6.863 -19.341 1.359 1.00 0.00 H new ATOM 1832 N SER A 132 -10.345 -15.216 4.187 1.00 0.00 N ATOM 1833 CA SER A 132 -10.913 -13.873 4.129 1.00 0.00 C ATOM 1834 C SER A 132 -10.089 -12.898 4.964 1.00 0.00 C ATOM 1835 O SER A 132 -9.826 -13.144 6.142 1.00 0.00 O ATOM 1836 CB SER A 132 -12.362 -13.886 4.622 1.00 0.00 C ATOM 1837 OG SER A 132 -13.180 -14.684 3.784 1.00 0.00 O ATOM 0 H SER A 132 -10.233 -15.584 5.132 1.00 0.00 H new ATOM 0 HA SER A 132 -10.893 -13.542 3.091 1.00 0.00 H new ATOM 0 HB2 SER A 132 -12.399 -14.269 5.642 1.00 0.00 H new ATOM 0 HB3 SER A 132 -12.749 -12.867 4.650 1.00 0.00 H new ATOM 0 HG SER A 132 -12.909 -15.623 3.860 1.00 0.00 H new ATOM 1843 N PHE A 133 -9.683 -11.791 4.350 1.00 0.00 N ATOM 1844 CA PHE A 133 -8.887 -10.783 5.044 1.00 0.00 C ATOM 1845 C PHE A 133 -9.289 -9.374 4.619 1.00 0.00 C ATOM 1846 O PHE A 133 -9.812 -9.170 3.524 1.00 0.00 O ATOM 1847 CB PHE A 133 -7.398 -11.001 4.767 1.00 0.00 C ATOM 1848 CG PHE A 133 -7.090 -11.262 3.321 1.00 0.00 C ATOM 1849 CD1 PHE A 133 -7.348 -12.501 2.756 1.00 0.00 C ATOM 1850 CD2 PHE A 133 -6.542 -10.269 2.525 1.00 0.00 C ATOM 1851 CE1 PHE A 133 -7.067 -12.744 1.426 1.00 0.00 C ATOM 1852 CE2 PHE A 133 -6.257 -10.506 1.194 1.00 0.00 C ATOM 1853 CZ PHE A 133 -6.521 -11.745 0.642 1.00 0.00 C ATOM 0 H PHE A 133 -9.891 -11.569 3.376 1.00 0.00 H new ATOM 0 HA PHE A 133 -9.075 -10.887 6.113 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.843 -10.122 5.096 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -7.045 -11.842 5.363 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -7.774 -13.286 3.363 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -6.335 -9.298 2.950 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -7.274 -13.714 0.999 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.828 -9.724 0.585 1.00 0.00 H new ATOM 0 HZ PHE A 133 -6.301 -11.932 -0.399 1.00 0.00 H new ATOM 1863 N LEU A 134 -9.030 -8.403 5.492 1.00 0.00 N ATOM 1864 CA LEU A 134 -9.352 -7.010 5.206 1.00 0.00 C ATOM 1865 C LEU A 134 -8.081 -6.206 4.969 1.00 0.00 C ATOM 1866 O LEU A 134 -7.227 -6.100 5.849 1.00 0.00 O ATOM 1867 CB LEU A 134 -10.147 -6.390 6.362 1.00 0.00 C ATOM 1868 CG LEU A 134 -10.992 -5.163 6.002 1.00 0.00 C ATOM 1869 CD1 LEU A 134 -10.162 -4.135 5.248 1.00 0.00 C ATOM 1870 CD2 LEU A 134 -12.205 -5.575 5.183 1.00 0.00 C ATOM 0 H LEU A 134 -8.598 -8.557 6.403 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.963 -6.984 4.304 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -10.805 -7.153 6.777 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -9.448 -6.109 7.150 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.339 -4.704 6.928 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -10.784 -3.274 5.004 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -9.327 -3.815 5.870 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.780 -4.579 4.329 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.794 -4.692 4.936 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -11.876 -6.060 4.264 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -12.816 -6.269 5.761 1.00 0.00 H new ATOM 1882 N PHE A 135 -7.967 -5.634 3.778 1.00 0.00 N ATOM 1883 CA PHE A 135 -6.807 -4.829 3.428 1.00 0.00 C ATOM 1884 C PHE A 135 -7.056 -3.378 3.757 1.00 0.00 C ATOM 1885 O PHE A 135 -8.158 -2.864 3.594 1.00 0.00 O ATOM 1886 CB PHE A 135 -6.450 -4.965 1.961 1.00 0.00 C ATOM 1887 CG PHE A 135 -5.297 -4.109 1.519 1.00 0.00 C ATOM 1888 CD1 PHE A 135 -4.114 -4.086 2.238 1.00 0.00 C ATOM 1889 CD2 PHE A 135 -5.399 -3.331 0.378 1.00 0.00 C ATOM 1890 CE1 PHE A 135 -3.054 -3.301 1.827 1.00 0.00 C ATOM 1891 CE2 PHE A 135 -4.343 -2.546 -0.038 1.00 0.00 C ATOM 1892 CZ PHE A 135 -3.169 -2.530 0.686 1.00 0.00 C ATOM 0 H PHE A 135 -8.665 -5.713 3.038 1.00 0.00 H new ATOM 0 HA PHE A 135 -5.967 -5.197 4.016 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -6.212 -6.008 1.753 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -7.325 -4.712 1.362 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -4.019 -4.688 3.130 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -6.316 -3.339 -0.193 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -2.137 -3.290 2.397 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -4.436 -1.944 -0.930 1.00 0.00 H new ATOM 0 HZ PHE A 135 -2.342 -1.916 0.362 1.00 0.00 H new ATOM 1902 N LYS A 136 -6.014 -2.748 4.241 1.00 0.00 N ATOM 1903 CA LYS A 136 -6.064 -1.340 4.633 1.00 0.00 C ATOM 1904 C LYS A 136 -4.680 -0.691 4.574 1.00 0.00 C ATOM 1905 O LYS A 136 -3.665 -1.365 4.740 1.00 0.00 O ATOM 1906 CB LYS A 136 -6.639 -1.208 6.045 1.00 0.00 C ATOM 1907 CG LYS A 136 -7.542 0.003 6.223 1.00 0.00 C ATOM 1908 CD LYS A 136 -8.775 -0.333 7.049 1.00 0.00 C ATOM 1909 CE LYS A 136 -8.686 0.254 8.449 1.00 0.00 C ATOM 1910 NZ LYS A 136 -10.025 0.362 9.091 1.00 0.00 N ATOM 0 H LYS A 136 -5.103 -3.186 4.379 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.711 -0.821 3.926 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -7.203 -2.110 6.285 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -5.817 -1.146 6.759 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -6.985 0.804 6.709 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -7.849 0.375 5.246 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -9.665 0.050 6.549 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -8.887 -1.415 7.114 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -8.038 -0.370 9.064 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -8.226 1.241 8.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -9.922 0.766 10.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -10.636 0.978 8.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -10.454 -0.583 9.161 1.00 0.00 H new ATOM 1924 N TYR A 137 -4.646 0.626 4.362 1.00 0.00 N ATOM 1925 CA TYR A 137 -3.379 1.356 4.316 1.00 0.00 C ATOM 1926 C TYR A 137 -2.771 1.437 5.706 1.00 0.00 C ATOM 1927 O TYR A 137 -3.475 1.619 6.699 1.00 0.00 O ATOM 1928 CB TYR A 137 -3.536 2.773 3.769 1.00 0.00 C ATOM 1929 CG TYR A 137 -4.110 2.860 2.371 1.00 0.00 C ATOM 1930 CD1 TYR A 137 -3.325 2.574 1.260 1.00 0.00 C ATOM 1931 CD2 TYR A 137 -5.429 3.244 2.157 1.00 0.00 C ATOM 1932 CE1 TYR A 137 -3.836 2.662 -0.022 1.00 0.00 C ATOM 1933 CE2 TYR A 137 -5.949 3.335 0.877 1.00 0.00 C ATOM 1934 CZ TYR A 137 -5.148 3.043 -0.208 1.00 0.00 C ATOM 1935 OH TYR A 137 -5.661 3.133 -1.481 1.00 0.00 O ATOM 0 H TYR A 137 -5.474 1.204 4.221 1.00 0.00 H new ATOM 0 HA TYR A 137 -2.726 0.802 3.641 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -4.178 3.338 4.445 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -2.560 3.259 3.776 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -2.296 2.277 1.401 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -6.059 3.475 3.003 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -3.211 2.434 -0.873 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -6.976 3.633 0.729 1.00 0.00 H new ATOM 0 HH TYR A 137 -4.938 3.335 -2.111 1.00 0.00 H new ATOM 1945 N ALA A 138 -1.462 1.299 5.764 1.00 0.00 N ATOM 1946 CA ALA A 138 -0.737 1.354 7.029 1.00 0.00 C ATOM 1947 C ALA A 138 -0.512 2.794 7.474 1.00 0.00 C ATOM 1948 O ALA A 138 -0.344 3.691 6.647 1.00 0.00 O ATOM 1949 CB ALA A 138 0.592 0.622 6.913 1.00 0.00 C ATOM 0 H ALA A 138 -0.870 1.147 4.947 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.346 0.859 7.785 1.00 0.00 H new ATOM 0 HB1 ALA A 138 1.120 0.673 7.865 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.411 -0.421 6.653 1.00 0.00 H new ATOM 0 HB3 ALA A 138 1.198 1.089 6.137 1.00 0.00 H new