USER MOD reduce.3.24.130724 H: found=0, std=0, add=515, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 516 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 Single : A 40 ASN : amide:sc= -6.46! C(o=-6.5!,f=-11!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 165:sc= -0.309 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -156:sc= -0.159 (180deg=-1.42!) USER MOD Single : A 50 THR OG1 : rot -83:sc= -1.49 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.138 USER MOD Single : A 59 SER OG : rot 74:sc= 1.11 USER MOD Single : A 63 ASN : amide:sc= -0.127 K(o=-0.13,f=-2.3!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -114:sc= -0.0901 (180deg=-0.79) USER MOD Single : A 74 ASN : amide:sc=-0.00589 K(o=-0.0059,f=-1.4!) USER MOD Single : A 75 CYS SG : rot 93:sc= -3.46 USER MOD Single : A 79 THR OG1 : rot 96:sc= 0.565 USER MOD Single : A 80 TYR OH : rot 151:sc= -5.05! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -153:sc= -0.233 (180deg=-1.89!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 94 ASN : amide:sc= -0.14 K(o=-0.14,f=-4.4!) USER MOD Single : A 96 THR OG1 : rot -99:sc= 0.146 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 100 SER OG : rot 180:sc=-0.00176 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 104 LYS NZ :NH3+ 157:sc= -0.0767 (180deg=-0.63) USER MOD Single : A 106 ASN : amide:sc= -1.81! C(o=-1.8!,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 78 N ASN A 40 -39.842 4.693 2.487 1.00 0.00 N ATOM 79 CA ASN A 40 -38.370 4.522 2.324 1.00 0.00 C ATOM 80 C ASN A 40 -38.037 4.372 0.838 1.00 0.00 C ATOM 81 O ASN A 40 -37.540 3.352 0.403 1.00 0.00 O ATOM 82 CB ASN A 40 -37.917 3.269 3.077 1.00 0.00 C ATOM 83 CG ASN A 40 -36.413 3.073 2.881 1.00 0.00 C ATOM 84 OD1 ASN A 40 -35.993 2.241 2.101 1.00 0.00 O ATOM 85 ND2 ASN A 40 -35.577 3.811 3.560 1.00 0.00 N ATOM 0 HA ASN A 40 -37.855 5.394 2.726 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -38.147 3.366 4.138 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -38.459 2.396 2.712 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -34.572 3.689 3.436 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -35.929 4.509 4.215 1.00 0.00 H new ATOM 92 N THR A 41 -38.307 5.380 0.055 1.00 0.00 N ATOM 93 CA THR A 41 -38.007 5.293 -1.402 1.00 0.00 C ATOM 94 C THR A 41 -36.586 5.799 -1.664 1.00 0.00 C ATOM 95 O THR A 41 -36.064 6.619 -0.934 1.00 0.00 O ATOM 96 CB THR A 41 -39.006 6.154 -2.178 1.00 0.00 C ATOM 97 OG1 THR A 41 -40.329 5.741 -1.864 1.00 0.00 O ATOM 98 CG2 THR A 41 -38.763 5.992 -3.680 1.00 0.00 C ATOM 0 H THR A 41 -38.722 6.260 0.361 1.00 0.00 H new ATOM 0 HA THR A 41 -38.088 4.256 -1.728 1.00 0.00 H new ATOM 0 HB THR A 41 -38.876 7.200 -1.901 1.00 0.00 H new ATOM 0 HG1 THR A 41 -40.970 6.293 -2.359 1.00 0.00 H new ATOM 0 HG21 THR A 41 -39.475 6.606 -4.232 1.00 0.00 H new ATOM 0 HG22 THR A 41 -37.748 6.309 -3.921 1.00 0.00 H new ATOM 0 HG23 THR A 41 -38.893 4.946 -3.959 1.00 0.00 H new ATOM 106 N LEU A 42 -35.958 5.316 -2.700 1.00 0.00 N ATOM 107 CA LEU A 42 -34.572 5.768 -3.012 1.00 0.00 C ATOM 108 C LEU A 42 -34.559 6.458 -4.376 1.00 0.00 C ATOM 109 O LEU A 42 -35.328 6.126 -5.256 1.00 0.00 O ATOM 110 CB LEU A 42 -33.636 4.559 -3.045 1.00 0.00 C ATOM 111 CG LEU A 42 -33.671 3.851 -1.689 1.00 0.00 C ATOM 112 CD1 LEU A 42 -34.703 2.722 -1.728 1.00 0.00 C ATOM 113 CD2 LEU A 42 -32.289 3.270 -1.383 1.00 0.00 C ATOM 0 H LEU A 42 -36.345 4.627 -3.345 1.00 0.00 H new ATOM 0 HA LEU A 42 -34.236 6.467 -2.246 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -33.940 3.872 -3.834 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -32.619 4.879 -3.275 1.00 0.00 H new ATOM 0 HG LEU A 42 -33.945 4.565 -0.913 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -34.728 2.218 -0.762 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -35.687 3.136 -1.946 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -34.430 2.006 -2.504 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -32.312 2.765 -0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -32.015 2.556 -2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -31.554 4.075 -1.354 1.00 0.00 H new ATOM 125 N TYR A 43 -33.693 7.415 -4.561 1.00 0.00 N ATOM 126 CA TYR A 43 -33.635 8.122 -5.871 1.00 0.00 C ATOM 127 C TYR A 43 -32.477 7.565 -6.701 1.00 0.00 C ATOM 128 O TYR A 43 -31.323 7.713 -6.352 1.00 0.00 O ATOM 129 CB TYR A 43 -33.422 9.618 -5.636 1.00 0.00 C ATOM 130 CG TYR A 43 -33.351 10.329 -6.966 1.00 0.00 C ATOM 131 CD1 TYR A 43 -34.526 10.774 -7.585 1.00 0.00 C ATOM 132 CD2 TYR A 43 -32.112 10.543 -7.581 1.00 0.00 C ATOM 133 CE1 TYR A 43 -34.460 11.432 -8.819 1.00 0.00 C ATOM 134 CE2 TYR A 43 -32.046 11.201 -8.814 1.00 0.00 C ATOM 135 CZ TYR A 43 -33.221 11.646 -9.434 1.00 0.00 C ATOM 136 OH TYR A 43 -33.157 12.294 -10.650 1.00 0.00 O ATOM 0 H TYR A 43 -33.023 7.738 -3.863 1.00 0.00 H new ATOM 0 HA TYR A 43 -34.572 7.969 -6.407 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -34.238 10.023 -5.038 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -32.503 9.782 -5.074 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -35.482 10.610 -7.111 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -31.206 10.200 -7.103 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -35.366 11.775 -9.297 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -31.090 11.366 -9.288 1.00 0.00 H new ATOM 0 HH TYR A 43 -32.234 12.573 -10.824 1.00 0.00 H new ATOM 146 N VAL A 44 -32.776 6.926 -7.797 1.00 0.00 N ATOM 147 CA VAL A 44 -31.694 6.360 -8.651 1.00 0.00 C ATOM 148 C VAL A 44 -31.558 7.202 -9.921 1.00 0.00 C ATOM 149 O VAL A 44 -32.536 7.589 -10.528 1.00 0.00 O ATOM 150 CB VAL A 44 -32.042 4.919 -9.028 1.00 0.00 C ATOM 151 CG1 VAL A 44 -30.863 4.286 -9.769 1.00 0.00 C ATOM 152 CG2 VAL A 44 -32.336 4.117 -7.759 1.00 0.00 C ATOM 0 H VAL A 44 -33.724 6.771 -8.139 1.00 0.00 H new ATOM 0 HA VAL A 44 -30.752 6.373 -8.103 1.00 0.00 H new ATOM 0 HB VAL A 44 -32.921 4.915 -9.673 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -31.111 3.259 -10.038 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -30.653 4.857 -10.673 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -29.984 4.290 -9.125 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -32.584 3.090 -8.027 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -31.457 4.122 -7.114 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -33.176 4.567 -7.231 1.00 0.00 H new ATOM 162 N TYR A 45 -30.351 7.491 -10.326 1.00 0.00 N ATOM 163 CA TYR A 45 -30.156 8.310 -11.554 1.00 0.00 C ATOM 164 C TYR A 45 -29.191 7.594 -12.499 1.00 0.00 C ATOM 165 O TYR A 45 -28.271 6.924 -12.073 1.00 0.00 O ATOM 166 CB TYR A 45 -29.575 9.672 -11.169 1.00 0.00 C ATOM 167 CG TYR A 45 -29.496 10.548 -12.395 1.00 0.00 C ATOM 168 CD1 TYR A 45 -30.638 11.212 -12.857 1.00 0.00 C ATOM 169 CD2 TYR A 45 -28.279 10.696 -13.072 1.00 0.00 C ATOM 170 CE1 TYR A 45 -30.565 12.024 -13.995 1.00 0.00 C ATOM 171 CE2 TYR A 45 -28.205 11.508 -14.210 1.00 0.00 C ATOM 172 CZ TYR A 45 -29.348 12.172 -14.672 1.00 0.00 C ATOM 173 OH TYR A 45 -29.276 12.971 -15.794 1.00 0.00 O ATOM 0 H TYR A 45 -29.493 7.195 -9.860 1.00 0.00 H new ATOM 0 HA TYR A 45 -31.115 8.450 -12.053 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -30.199 10.145 -10.410 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -28.584 9.547 -10.733 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -31.577 11.098 -12.335 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -27.397 10.184 -12.716 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -31.447 12.536 -14.351 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -27.266 11.622 -14.732 1.00 0.00 H new ATOM 0 HH TYR A 45 -28.360 12.965 -16.141 1.00 0.00 H new ATOM 183 N GLY A 46 -29.392 7.731 -13.782 1.00 0.00 N ATOM 184 CA GLY A 46 -28.484 7.058 -14.753 1.00 0.00 C ATOM 185 C GLY A 46 -29.062 7.180 -16.164 1.00 0.00 C ATOM 186 O GLY A 46 -30.105 7.769 -16.369 1.00 0.00 O ATOM 0 H GLY A 46 -30.145 8.279 -14.199 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -27.493 7.511 -14.714 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -28.365 6.008 -14.487 1.00 0.00 H new ATOM 190 N GLU A 47 -28.393 6.629 -17.138 1.00 0.00 N ATOM 191 CA GLU A 47 -28.905 6.713 -18.536 1.00 0.00 C ATOM 192 C GLU A 47 -29.104 5.302 -19.093 1.00 0.00 C ATOM 193 O GLU A 47 -28.491 4.355 -18.641 1.00 0.00 O ATOM 194 CB GLU A 47 -27.893 7.465 -19.404 1.00 0.00 C ATOM 195 CG GLU A 47 -27.724 8.889 -18.871 1.00 0.00 C ATOM 196 CD GLU A 47 -26.805 9.677 -19.806 1.00 0.00 C ATOM 197 OE1 GLU A 47 -26.212 9.063 -20.678 1.00 0.00 O ATOM 198 OE2 GLU A 47 -26.710 10.881 -19.636 1.00 0.00 O ATOM 0 H GLU A 47 -27.514 6.124 -17.027 1.00 0.00 H new ATOM 0 HA GLU A 47 -29.857 7.244 -18.543 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -26.934 6.946 -19.396 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -28.233 7.491 -20.439 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -28.695 9.380 -18.799 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -27.304 8.865 -17.866 1.00 0.00 H new ATOM 205 N ASP A 48 -29.957 5.154 -20.069 1.00 0.00 N ATOM 206 CA ASP A 48 -30.195 3.802 -20.650 1.00 0.00 C ATOM 207 C ASP A 48 -30.323 2.781 -19.520 1.00 0.00 C ATOM 208 O ASP A 48 -29.569 1.832 -19.438 1.00 0.00 O ATOM 209 CB ASP A 48 -29.018 3.420 -21.552 1.00 0.00 C ATOM 210 CG ASP A 48 -28.915 4.416 -22.707 1.00 0.00 C ATOM 211 OD1 ASP A 48 -29.907 5.068 -22.993 1.00 0.00 O ATOM 212 OD2 ASP A 48 -27.847 4.511 -23.288 1.00 0.00 O ATOM 0 H ASP A 48 -30.499 5.909 -20.489 1.00 0.00 H new ATOM 0 HA ASP A 48 -31.113 3.813 -21.237 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -28.092 3.417 -20.977 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -29.156 2.411 -21.940 1.00 0.00 H new ATOM 217 N MET A 49 -31.273 2.968 -18.644 1.00 0.00 N ATOM 218 CA MET A 49 -31.443 2.009 -17.517 1.00 0.00 C ATOM 219 C MET A 49 -32.697 1.162 -17.745 1.00 0.00 C ATOM 220 O MET A 49 -33.683 1.624 -18.283 1.00 0.00 O ATOM 221 CB MET A 49 -31.584 2.784 -16.207 1.00 0.00 C ATOM 222 CG MET A 49 -30.232 3.391 -15.825 1.00 0.00 C ATOM 223 SD MET A 49 -30.318 4.039 -14.138 1.00 0.00 S ATOM 224 CE MET A 49 -31.659 5.221 -14.418 1.00 0.00 C ATOM 0 H MET A 49 -31.937 3.742 -18.661 1.00 0.00 H new ATOM 0 HA MET A 49 -30.572 1.356 -17.464 1.00 0.00 H new ATOM 0 HB2 MET A 49 -32.330 3.571 -16.316 1.00 0.00 H new ATOM 0 HB3 MET A 49 -31.934 2.121 -15.416 1.00 0.00 H new ATOM 0 HG2 MET A 49 -29.449 2.636 -15.897 1.00 0.00 H new ATOM 0 HG3 MET A 49 -29.970 4.189 -16.520 1.00 0.00 H new ATOM 0 HE1 MET A 49 -31.606 6.015 -13.673 1.00 0.00 H new ATOM 0 HE2 MET A 49 -31.562 5.652 -15.414 1.00 0.00 H new ATOM 0 HE3 MET A 49 -32.618 4.709 -14.336 1.00 0.00 H new ATOM 234 N THR A 50 -32.665 -0.076 -17.335 1.00 0.00 N ATOM 235 CA THR A 50 -33.851 -0.959 -17.520 1.00 0.00 C ATOM 236 C THR A 50 -34.398 -1.362 -16.148 1.00 0.00 C ATOM 237 O THR A 50 -33.712 -1.271 -15.150 1.00 0.00 O ATOM 238 CB THR A 50 -33.434 -2.211 -18.296 1.00 0.00 C ATOM 239 OG1 THR A 50 -32.423 -2.898 -17.572 1.00 0.00 O ATOM 240 CG2 THR A 50 -32.896 -1.807 -19.670 1.00 0.00 C ATOM 0 H THR A 50 -31.866 -0.516 -16.878 1.00 0.00 H new ATOM 0 HA THR A 50 -34.623 -0.429 -18.077 1.00 0.00 H new ATOM 0 HB THR A 50 -34.297 -2.864 -18.425 1.00 0.00 H new ATOM 0 HG1 THR A 50 -31.551 -2.493 -17.764 1.00 0.00 H new ATOM 0 HG21 THR A 50 -32.599 -2.699 -20.221 1.00 0.00 H new ATOM 0 HG22 THR A 50 -33.672 -1.279 -20.224 1.00 0.00 H new ATOM 0 HG23 THR A 50 -32.032 -1.154 -19.545 1.00 0.00 H new ATOM 248 N PRO A 51 -35.658 -1.816 -16.101 1.00 0.00 N ATOM 249 CA PRO A 51 -36.302 -2.234 -14.848 1.00 0.00 C ATOM 250 C PRO A 51 -35.676 -3.512 -14.280 1.00 0.00 C ATOM 251 O PRO A 51 -35.252 -3.551 -13.142 1.00 0.00 O ATOM 252 CB PRO A 51 -37.752 -2.495 -15.258 1.00 0.00 C ATOM 253 CG PRO A 51 -37.677 -2.802 -16.716 1.00 0.00 C ATOM 254 CD PRO A 51 -36.558 -1.961 -17.259 1.00 0.00 C ATOM 0 HA PRO A 51 -36.196 -1.483 -14.066 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -38.179 -3.327 -14.698 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -38.381 -1.626 -15.067 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -37.485 -3.862 -16.882 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -38.618 -2.567 -17.213 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -36.060 -2.446 -18.099 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -36.916 -0.995 -17.615 1.00 0.00 H new ATOM 262 N THR A 52 -35.612 -4.556 -15.060 1.00 0.00 N ATOM 263 CA THR A 52 -35.009 -5.821 -14.555 1.00 0.00 C ATOM 264 C THR A 52 -33.599 -5.537 -14.037 1.00 0.00 C ATOM 265 O THR A 52 -33.136 -6.150 -13.096 1.00 0.00 O ATOM 266 CB THR A 52 -34.941 -6.847 -15.689 1.00 0.00 C ATOM 267 OG1 THR A 52 -35.810 -6.449 -16.739 1.00 0.00 O ATOM 268 CG2 THR A 52 -35.366 -8.219 -15.163 1.00 0.00 C ATOM 0 H THR A 52 -35.950 -4.588 -16.022 1.00 0.00 H new ATOM 0 HA THR A 52 -35.622 -6.219 -13.746 1.00 0.00 H new ATOM 0 HB THR A 52 -33.920 -6.906 -16.066 1.00 0.00 H new ATOM 0 HG1 THR A 52 -35.766 -7.104 -17.466 1.00 0.00 H new ATOM 0 HG21 THR A 52 -35.317 -8.949 -15.971 1.00 0.00 H new ATOM 0 HG22 THR A 52 -34.697 -8.523 -14.358 1.00 0.00 H new ATOM 0 HG23 THR A 52 -36.387 -8.163 -14.785 1.00 0.00 H new ATOM 276 N LEU A 53 -32.915 -4.608 -14.645 1.00 0.00 N ATOM 277 CA LEU A 53 -31.535 -4.279 -14.189 1.00 0.00 C ATOM 278 C LEU A 53 -31.601 -3.620 -12.810 1.00 0.00 C ATOM 279 O LEU A 53 -30.877 -3.980 -11.904 1.00 0.00 O ATOM 280 CB LEU A 53 -30.884 -3.318 -15.185 1.00 0.00 C ATOM 281 CG LEU A 53 -29.423 -3.090 -14.794 1.00 0.00 C ATOM 282 CD1 LEU A 53 -28.612 -4.352 -15.091 1.00 0.00 C ATOM 283 CD2 LEU A 53 -28.857 -1.918 -15.600 1.00 0.00 C ATOM 0 H LEU A 53 -33.252 -4.062 -15.438 1.00 0.00 H new ATOM 0 HA LEU A 53 -30.943 -5.192 -14.128 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -30.942 -3.728 -16.193 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -31.421 -2.370 -15.195 1.00 0.00 H new ATOM 0 HG LEU A 53 -29.363 -2.862 -13.730 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -27.571 -4.189 -14.812 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -29.015 -5.187 -14.518 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -28.671 -4.581 -16.155 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -27.816 -1.755 -15.322 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -28.917 -2.146 -16.664 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -29.435 -1.018 -15.388 1.00 0.00 H new ATOM 295 N LEU A 54 -32.466 -2.656 -12.644 1.00 0.00 N ATOM 296 CA LEU A 54 -32.578 -1.977 -11.324 1.00 0.00 C ATOM 297 C LEU A 54 -33.037 -2.987 -10.271 1.00 0.00 C ATOM 298 O LEU A 54 -32.580 -2.977 -9.146 1.00 0.00 O ATOM 299 CB LEU A 54 -33.596 -0.839 -11.419 1.00 0.00 C ATOM 300 CG LEU A 54 -33.029 0.278 -12.298 1.00 0.00 C ATOM 301 CD1 LEU A 54 -34.050 0.649 -13.374 1.00 0.00 C ATOM 302 CD2 LEU A 54 -32.728 1.504 -11.435 1.00 0.00 C ATOM 0 H LEU A 54 -33.099 -2.311 -13.366 1.00 0.00 H new ATOM 0 HA LEU A 54 -31.607 -1.571 -11.040 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -34.532 -1.208 -11.839 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -33.822 -0.455 -10.424 1.00 0.00 H new ATOM 0 HG LEU A 54 -32.110 -0.065 -12.773 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -33.646 1.445 -14.000 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -34.263 -0.225 -13.990 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -34.970 0.992 -12.900 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -32.324 2.299 -12.061 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -33.646 1.848 -10.959 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -31.999 1.240 -10.669 1.00 0.00 H new ATOM 314 N ARG A 55 -33.935 -3.864 -10.630 1.00 0.00 N ATOM 315 CA ARG A 55 -34.416 -4.876 -9.649 1.00 0.00 C ATOM 316 C ARG A 55 -33.241 -5.752 -9.214 1.00 0.00 C ATOM 317 O ARG A 55 -33.153 -6.170 -8.076 1.00 0.00 O ATOM 318 CB ARG A 55 -35.492 -5.747 -10.302 1.00 0.00 C ATOM 319 CG ARG A 55 -36.730 -4.893 -10.590 1.00 0.00 C ATOM 320 CD ARG A 55 -37.792 -5.748 -11.284 1.00 0.00 C ATOM 321 NE ARG A 55 -38.364 -6.721 -10.311 1.00 0.00 N ATOM 322 CZ ARG A 55 -39.175 -7.657 -10.723 1.00 0.00 C ATOM 323 NH1 ARG A 55 -38.804 -8.469 -11.675 1.00 0.00 N ATOM 324 NH2 ARG A 55 -40.357 -7.780 -10.183 1.00 0.00 N ATOM 0 H ARG A 55 -34.355 -3.923 -11.558 1.00 0.00 H new ATOM 0 HA ARG A 55 -34.838 -4.373 -8.779 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -35.113 -6.181 -11.227 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -35.753 -6.576 -9.644 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -37.127 -4.485 -9.661 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -36.461 -4.046 -11.221 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -38.581 -5.112 -11.684 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -37.352 -6.279 -12.128 1.00 0.00 H new ATOM 0 HE ARG A 55 -38.122 -6.655 -9.322 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -37.880 -8.372 -12.097 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -39.438 -9.201 -11.997 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -40.647 -7.145 -9.439 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -40.991 -8.511 -10.505 1.00 0.00 H new ATOM 338 N GLY A 56 -32.334 -6.029 -10.110 1.00 0.00 N ATOM 339 CA GLY A 56 -31.161 -6.872 -9.748 1.00 0.00 C ATOM 340 C GLY A 56 -30.162 -6.030 -8.952 1.00 0.00 C ATOM 341 O GLY A 56 -29.483 -6.519 -8.071 1.00 0.00 O ATOM 0 H GLY A 56 -32.355 -5.707 -11.078 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -31.483 -7.730 -9.158 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -30.688 -7.264 -10.648 1.00 0.00 H new ATOM 345 N ALA A 57 -30.072 -4.765 -9.256 1.00 0.00 N ATOM 346 CA ALA A 57 -29.122 -3.885 -8.518 1.00 0.00 C ATOM 347 C ALA A 57 -29.710 -3.542 -7.147 1.00 0.00 C ATOM 348 O ALA A 57 -29.039 -3.004 -6.289 1.00 0.00 O ATOM 349 CB ALA A 57 -28.896 -2.598 -9.314 1.00 0.00 C ATOM 0 H ALA A 57 -30.616 -4.302 -9.984 1.00 0.00 H new ATOM 0 HA ALA A 57 -28.171 -4.402 -8.388 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -28.201 -1.954 -8.775 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -28.480 -2.843 -10.291 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -29.846 -2.079 -9.444 1.00 0.00 H new ATOM 355 N PHE A 58 -30.962 -3.848 -6.936 1.00 0.00 N ATOM 356 CA PHE A 58 -31.596 -3.544 -5.624 1.00 0.00 C ATOM 357 C PHE A 58 -32.251 -4.811 -5.067 1.00 0.00 C ATOM 358 O PHE A 58 -32.793 -4.815 -3.979 1.00 0.00 O ATOM 359 CB PHE A 58 -32.659 -2.459 -5.814 1.00 0.00 C ATOM 360 CG PHE A 58 -31.984 -1.133 -6.072 1.00 0.00 C ATOM 361 CD1 PHE A 58 -31.352 -0.897 -7.299 1.00 0.00 C ATOM 362 CD2 PHE A 58 -31.988 -0.141 -5.084 1.00 0.00 C ATOM 363 CE1 PHE A 58 -30.725 0.332 -7.539 1.00 0.00 C ATOM 364 CE2 PHE A 58 -31.360 1.087 -5.324 1.00 0.00 C ATOM 365 CZ PHE A 58 -30.729 1.324 -6.551 1.00 0.00 C ATOM 0 H PHE A 58 -31.573 -4.296 -7.618 1.00 0.00 H new ATOM 0 HA PHE A 58 -30.837 -3.192 -4.925 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -33.311 -2.716 -6.649 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -33.289 -2.392 -4.927 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -31.348 -1.663 -8.060 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -32.475 -0.323 -4.137 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -30.239 0.515 -8.486 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -31.362 1.852 -4.562 1.00 0.00 H new ATOM 0 HZ PHE A 58 -30.245 2.272 -6.735 1.00 0.00 H new ATOM 375 N SER A 59 -32.207 -5.887 -5.805 1.00 0.00 N ATOM 376 CA SER A 59 -32.826 -7.153 -5.321 1.00 0.00 C ATOM 377 C SER A 59 -32.061 -7.676 -4.100 1.00 0.00 C ATOM 378 O SER A 59 -32.635 -7.906 -3.055 1.00 0.00 O ATOM 379 CB SER A 59 -32.780 -8.200 -6.437 1.00 0.00 C ATOM 380 OG SER A 59 -34.034 -8.238 -7.102 1.00 0.00 O ATOM 0 H SER A 59 -31.768 -5.943 -6.724 1.00 0.00 H new ATOM 0 HA SER A 59 -33.861 -6.961 -5.039 1.00 0.00 H new ATOM 0 HB2 SER A 59 -31.988 -7.958 -7.145 1.00 0.00 H new ATOM 0 HB3 SER A 59 -32.547 -9.180 -6.021 1.00 0.00 H new ATOM 0 HG SER A 59 -34.128 -7.444 -7.669 1.00 0.00 H new ATOM 386 N PRO A 60 -30.739 -7.870 -4.239 1.00 0.00 N ATOM 387 CA PRO A 60 -29.897 -8.374 -3.144 1.00 0.00 C ATOM 388 C PRO A 60 -29.769 -7.356 -2.008 1.00 0.00 C ATOM 389 O PRO A 60 -29.496 -7.706 -0.877 1.00 0.00 O ATOM 390 CB PRO A 60 -28.538 -8.595 -3.811 1.00 0.00 C ATOM 391 CG PRO A 60 -28.539 -7.671 -4.979 1.00 0.00 C ATOM 392 CD PRO A 60 -29.960 -7.617 -5.465 1.00 0.00 C ATOM 0 HA PRO A 60 -30.312 -9.272 -2.688 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -27.719 -8.369 -3.128 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -28.414 -9.631 -4.125 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -28.187 -6.680 -4.692 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -27.872 -8.032 -5.762 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -30.200 -6.648 -5.903 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -30.154 -8.370 -6.229 1.00 0.00 H new ATOM 400 N PHE A 61 -29.969 -6.100 -2.297 1.00 0.00 N ATOM 401 CA PHE A 61 -29.864 -5.066 -1.230 1.00 0.00 C ATOM 402 C PHE A 61 -31.076 -5.168 -0.303 1.00 0.00 C ATOM 403 O PHE A 61 -31.101 -4.595 0.769 1.00 0.00 O ATOM 404 CB PHE A 61 -29.825 -3.676 -1.868 1.00 0.00 C ATOM 405 CG PHE A 61 -28.430 -3.388 -2.368 1.00 0.00 C ATOM 406 CD1 PHE A 61 -27.447 -2.933 -1.482 1.00 0.00 C ATOM 407 CD2 PHE A 61 -28.118 -3.576 -3.721 1.00 0.00 C ATOM 408 CE1 PHE A 61 -26.154 -2.665 -1.946 1.00 0.00 C ATOM 409 CE2 PHE A 61 -26.824 -3.309 -4.185 1.00 0.00 C ATOM 410 CZ PHE A 61 -25.843 -2.853 -3.297 1.00 0.00 C ATOM 0 H PHE A 61 -30.200 -5.745 -3.225 1.00 0.00 H new ATOM 0 HA PHE A 61 -28.952 -5.227 -0.656 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -30.536 -3.623 -2.692 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -30.124 -2.922 -1.140 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -27.686 -2.788 -0.439 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -28.876 -3.927 -4.406 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -25.397 -2.313 -1.261 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -26.583 -3.455 -5.228 1.00 0.00 H new ATOM 0 HZ PHE A 61 -24.845 -2.646 -3.655 1.00 0.00 H new ATOM 420 N GLY A 62 -32.084 -5.895 -0.706 1.00 0.00 N ATOM 421 CA GLY A 62 -33.294 -6.035 0.151 1.00 0.00 C ATOM 422 C GLY A 62 -34.523 -6.259 -0.734 1.00 0.00 C ATOM 423 O GLY A 62 -34.451 -6.175 -1.944 1.00 0.00 O ATOM 0 H GLY A 62 -32.120 -6.398 -1.593 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -33.171 -6.871 0.839 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -33.428 -5.140 0.758 1.00 0.00 H new ATOM 427 N ASN A 63 -35.651 -6.539 -0.140 1.00 0.00 N ATOM 428 CA ASN A 63 -36.883 -6.765 -0.950 1.00 0.00 C ATOM 429 C ASN A 63 -37.484 -5.416 -1.344 1.00 0.00 C ATOM 430 O ASN A 63 -37.405 -4.452 -0.608 1.00 0.00 O ATOM 431 CB ASN A 63 -37.899 -7.557 -0.125 1.00 0.00 C ATOM 432 CG ASN A 63 -38.949 -8.166 -1.056 1.00 0.00 C ATOM 433 OD1 ASN A 63 -38.710 -8.327 -2.236 1.00 0.00 O ATOM 434 ND2 ASN A 63 -40.110 -8.514 -0.572 1.00 0.00 N ATOM 0 H ASN A 63 -35.773 -6.621 0.869 1.00 0.00 H new ATOM 0 HA ASN A 63 -36.631 -7.328 -1.849 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -37.394 -8.344 0.435 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -38.379 -6.904 0.604 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -40.817 -8.921 -1.185 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -40.311 -8.379 0.419 1.00 0.00 H new ATOM 441 N ILE A 64 -38.083 -5.335 -2.499 1.00 0.00 N ATOM 442 CA ILE A 64 -38.684 -4.045 -2.936 1.00 0.00 C ATOM 443 C ILE A 64 -40.210 -4.149 -2.896 1.00 0.00 C ATOM 444 O ILE A 64 -40.803 -4.986 -3.547 1.00 0.00 O ATOM 445 CB ILE A 64 -38.229 -3.730 -4.363 1.00 0.00 C ATOM 446 CG1 ILE A 64 -36.702 -3.632 -4.399 1.00 0.00 C ATOM 447 CG2 ILE A 64 -38.838 -2.400 -4.807 1.00 0.00 C ATOM 448 CD1 ILE A 64 -36.238 -3.415 -5.841 1.00 0.00 C ATOM 0 H ILE A 64 -38.182 -6.106 -3.159 1.00 0.00 H new ATOM 0 HA ILE A 64 -38.360 -3.248 -2.266 1.00 0.00 H new ATOM 0 HB ILE A 64 -38.558 -4.522 -5.036 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -36.365 -2.808 -3.770 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -36.259 -4.543 -3.996 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -38.515 -2.173 -5.823 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -39.925 -2.470 -4.779 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -38.508 -1.607 -4.136 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -35.151 -3.345 -5.867 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -36.562 -4.253 -6.458 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -36.670 -2.492 -6.227 1.00 0.00 H new ATOM 460 N ILE A 65 -40.849 -3.306 -2.132 1.00 0.00 N ATOM 461 CA ILE A 65 -42.335 -3.355 -2.046 1.00 0.00 C ATOM 462 C ILE A 65 -42.943 -2.721 -3.298 1.00 0.00 C ATOM 463 O ILE A 65 -44.057 -3.021 -3.679 1.00 0.00 O ATOM 464 CB ILE A 65 -42.797 -2.585 -0.805 1.00 0.00 C ATOM 465 CG1 ILE A 65 -42.622 -1.083 -1.038 1.00 0.00 C ATOM 466 CG2 ILE A 65 -41.957 -3.014 0.400 1.00 0.00 C ATOM 467 CD1 ILE A 65 -43.271 -0.312 0.114 1.00 0.00 C ATOM 0 H ILE A 65 -40.405 -2.585 -1.563 1.00 0.00 H new ATOM 0 HA ILE A 65 -42.661 -4.393 -1.974 1.00 0.00 H new ATOM 0 HB ILE A 65 -43.848 -2.801 -0.614 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -41.563 -0.835 -1.105 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -43.078 -0.795 -1.985 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -42.284 -2.467 1.285 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -42.081 -4.084 0.568 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -40.906 -2.797 0.207 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -43.148 0.759 -0.050 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -44.333 -0.552 0.160 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -42.795 -0.593 1.053 1.00 0.00 H new ATOM 479 N ASP A 66 -42.223 -1.843 -3.941 1.00 0.00 N ATOM 480 CA ASP A 66 -42.764 -1.193 -5.167 1.00 0.00 C ATOM 481 C ASP A 66 -41.614 -0.620 -5.996 1.00 0.00 C ATOM 482 O ASP A 66 -40.684 -0.040 -5.470 1.00 0.00 O ATOM 483 CB ASP A 66 -43.714 -0.062 -4.766 1.00 0.00 C ATOM 484 CG ASP A 66 -44.356 0.535 -6.020 1.00 0.00 C ATOM 485 OD1 ASP A 66 -45.371 0.012 -6.449 1.00 0.00 O ATOM 486 OD2 ASP A 66 -43.820 1.505 -6.531 1.00 0.00 O ATOM 0 H ASP A 66 -41.285 -1.548 -3.670 1.00 0.00 H new ATOM 0 HA ASP A 66 -43.304 -1.932 -5.759 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -44.485 -0.441 -4.095 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -43.169 0.709 -4.221 1.00 0.00 H new ATOM 491 N LEU A 67 -41.669 -0.776 -7.291 1.00 0.00 N ATOM 492 CA LEU A 67 -40.581 -0.239 -8.156 1.00 0.00 C ATOM 493 C LEU A 67 -41.159 0.827 -9.089 1.00 0.00 C ATOM 494 O LEU A 67 -42.144 0.605 -9.766 1.00 0.00 O ATOM 495 CB LEU A 67 -39.981 -1.376 -8.987 1.00 0.00 C ATOM 496 CG LEU A 67 -38.733 -0.877 -9.723 1.00 0.00 C ATOM 497 CD1 LEU A 67 -39.152 0.027 -10.884 1.00 0.00 C ATOM 498 CD2 LEU A 67 -37.845 -0.092 -8.756 1.00 0.00 C ATOM 0 H LEU A 67 -42.422 -1.253 -7.787 1.00 0.00 H new ATOM 0 HA LEU A 67 -39.803 0.203 -7.534 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -39.722 -2.214 -8.340 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -40.716 -1.742 -9.704 1.00 0.00 H new ATOM 0 HG LEU A 67 -38.176 -1.730 -10.111 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -38.264 0.382 -11.407 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -39.780 -0.536 -11.575 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -39.711 0.880 -10.498 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -36.958 0.262 -9.282 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -38.399 0.761 -8.364 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -37.544 -0.739 -7.932 1.00 0.00 H new ATOM 510 N SER A 68 -40.558 1.986 -9.131 1.00 0.00 N ATOM 511 CA SER A 68 -41.080 3.062 -10.022 1.00 0.00 C ATOM 512 C SER A 68 -39.965 3.544 -10.952 1.00 0.00 C ATOM 513 O SER A 68 -38.796 3.460 -10.632 1.00 0.00 O ATOM 514 CB SER A 68 -41.576 4.231 -9.169 1.00 0.00 C ATOM 515 OG SER A 68 -42.321 5.127 -9.981 1.00 0.00 O ATOM 0 H SER A 68 -39.731 2.234 -8.588 1.00 0.00 H new ATOM 0 HA SER A 68 -41.904 2.671 -10.619 1.00 0.00 H new ATOM 0 HB2 SER A 68 -42.197 3.862 -8.352 1.00 0.00 H new ATOM 0 HB3 SER A 68 -40.731 4.750 -8.717 1.00 0.00 H new ATOM 0 HG SER A 68 -42.640 5.875 -9.435 1.00 0.00 H new ATOM 521 N MET A 69 -40.317 4.048 -12.104 1.00 0.00 N ATOM 522 CA MET A 69 -39.279 4.534 -13.056 1.00 0.00 C ATOM 523 C MET A 69 -39.687 5.907 -13.598 1.00 0.00 C ATOM 524 O MET A 69 -40.855 6.201 -13.754 1.00 0.00 O ATOM 525 CB MET A 69 -39.148 3.547 -14.217 1.00 0.00 C ATOM 526 CG MET A 69 -38.559 2.232 -13.704 1.00 0.00 C ATOM 527 SD MET A 69 -38.206 1.144 -15.106 1.00 0.00 S ATOM 528 CE MET A 69 -36.733 2.011 -15.701 1.00 0.00 C ATOM 0 H MET A 69 -41.280 4.144 -12.427 1.00 0.00 H new ATOM 0 HA MET A 69 -38.323 4.616 -12.539 1.00 0.00 H new ATOM 0 HB2 MET A 69 -40.124 3.369 -14.669 1.00 0.00 H new ATOM 0 HB3 MET A 69 -38.508 3.966 -14.994 1.00 0.00 H new ATOM 0 HG2 MET A 69 -37.646 2.425 -13.140 1.00 0.00 H new ATOM 0 HG3 MET A 69 -39.259 1.749 -13.022 1.00 0.00 H new ATOM 0 HE1 MET A 69 -36.936 2.443 -16.681 1.00 0.00 H new ATOM 0 HE2 MET A 69 -36.471 2.805 -15.002 1.00 0.00 H new ATOM 0 HE3 MET A 69 -35.904 1.308 -15.779 1.00 0.00 H new ATOM 538 N ASP A 70 -38.732 6.749 -13.888 1.00 0.00 N ATOM 539 CA ASP A 70 -39.066 8.100 -14.420 1.00 0.00 C ATOM 540 C ASP A 70 -38.325 8.328 -15.739 1.00 0.00 C ATOM 541 O ASP A 70 -37.171 8.708 -15.754 1.00 0.00 O ATOM 542 CB ASP A 70 -38.642 9.166 -13.407 1.00 0.00 C ATOM 543 CG ASP A 70 -39.882 9.871 -12.855 1.00 0.00 C ATOM 544 OD1 ASP A 70 -40.443 9.373 -11.892 1.00 0.00 O ATOM 545 OD2 ASP A 70 -40.249 10.896 -13.403 1.00 0.00 O ATOM 0 H ASP A 70 -37.736 6.559 -13.779 1.00 0.00 H new ATOM 0 HA ASP A 70 -40.140 8.167 -14.591 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -38.080 8.706 -12.594 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -37.980 9.891 -13.882 1.00 0.00 H new ATOM 550 N PRO A 71 -39.007 8.087 -16.870 1.00 0.00 N ATOM 551 CA PRO A 71 -38.417 8.264 -18.197 1.00 0.00 C ATOM 552 C PRO A 71 -38.267 9.741 -18.615 1.00 0.00 C ATOM 553 O PRO A 71 -37.387 10.067 -19.387 1.00 0.00 O ATOM 554 CB PRO A 71 -39.390 7.541 -19.126 1.00 0.00 C ATOM 555 CG PRO A 71 -40.701 7.546 -18.412 1.00 0.00 C ATOM 556 CD PRO A 71 -40.406 7.621 -16.935 1.00 0.00 C ATOM 0 HA PRO A 71 -37.400 7.872 -18.227 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -39.465 8.049 -20.088 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -39.057 6.523 -19.328 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -41.307 8.396 -18.727 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -41.269 6.646 -18.645 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -41.080 8.312 -16.429 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -40.525 6.650 -16.455 1.00 0.00 H new ATOM 564 N PRO A 72 -39.125 10.660 -18.116 1.00 0.00 N ATOM 565 CA PRO A 72 -39.028 12.078 -18.483 1.00 0.00 C ATOM 566 C PRO A 72 -37.862 12.772 -17.775 1.00 0.00 C ATOM 567 O PRO A 72 -37.352 13.775 -18.232 1.00 0.00 O ATOM 568 CB PRO A 72 -40.349 12.670 -18.001 1.00 0.00 C ATOM 569 CG PRO A 72 -40.791 11.778 -16.892 1.00 0.00 C ATOM 570 CD PRO A 72 -40.236 10.408 -17.176 1.00 0.00 C ATOM 0 HA PRO A 72 -38.851 12.207 -19.551 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -40.219 13.695 -17.655 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -41.086 12.696 -18.804 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -40.430 12.148 -15.933 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -41.879 11.748 -16.833 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -39.886 9.923 -16.265 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -40.990 9.755 -17.615 1.00 0.00 H new ATOM 578 N ARG A 73 -37.436 12.244 -16.658 1.00 0.00 N ATOM 579 CA ARG A 73 -36.306 12.875 -15.920 1.00 0.00 C ATOM 580 C ARG A 73 -35.085 11.951 -15.961 1.00 0.00 C ATOM 581 O ARG A 73 -34.031 12.281 -15.456 1.00 0.00 O ATOM 582 CB ARG A 73 -36.718 13.111 -14.465 1.00 0.00 C ATOM 583 CG ARG A 73 -37.878 14.107 -14.418 1.00 0.00 C ATOM 584 CD ARG A 73 -38.251 14.390 -12.961 1.00 0.00 C ATOM 585 NE ARG A 73 -37.146 15.143 -12.302 1.00 0.00 N ATOM 586 CZ ARG A 73 -37.304 15.611 -11.093 1.00 0.00 C ATOM 587 NH1 ARG A 73 -37.218 16.895 -10.874 1.00 0.00 N ATOM 588 NH2 ARG A 73 -37.549 14.795 -10.105 1.00 0.00 N ATOM 0 H ARG A 73 -37.822 11.404 -16.226 1.00 0.00 H new ATOM 0 HA ARG A 73 -36.054 13.827 -16.388 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -37.014 12.169 -14.003 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -35.872 13.494 -13.894 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -37.596 15.033 -14.919 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -38.738 13.705 -14.953 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -39.175 14.966 -12.916 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -38.433 13.454 -12.433 1.00 0.00 H new ATOM 0 HE ARG A 73 -36.266 15.293 -12.796 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -37.027 17.533 -11.647 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -37.341 17.261 -9.930 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -37.617 13.792 -10.277 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -37.672 15.160 -9.161 1.00 0.00 H new ATOM 602 N ASN A 74 -35.219 10.797 -16.555 1.00 0.00 N ATOM 603 CA ASN A 74 -34.065 9.856 -16.624 1.00 0.00 C ATOM 604 C ASN A 74 -33.666 9.435 -15.209 1.00 0.00 C ATOM 605 O ASN A 74 -32.500 9.385 -14.871 1.00 0.00 O ATOM 606 CB ASN A 74 -32.881 10.550 -17.303 1.00 0.00 C ATOM 607 CG ASN A 74 -33.282 10.976 -18.716 1.00 0.00 C ATOM 608 OD1 ASN A 74 -34.254 10.489 -19.258 1.00 0.00 O ATOM 609 ND2 ASN A 74 -32.569 11.873 -19.340 1.00 0.00 N ATOM 0 H ASN A 74 -36.077 10.465 -16.995 1.00 0.00 H new ATOM 0 HA ASN A 74 -34.348 8.975 -17.199 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -32.574 11.420 -16.723 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -32.025 9.876 -17.344 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -32.828 12.165 -20.282 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -31.753 12.282 -18.885 1.00 0.00 H new ATOM 616 N CYS A 75 -34.626 9.134 -14.377 1.00 0.00 N ATOM 617 CA CYS A 75 -34.300 8.718 -12.984 1.00 0.00 C ATOM 618 C CYS A 75 -35.261 7.613 -12.540 1.00 0.00 C ATOM 619 O CYS A 75 -36.351 7.479 -13.062 1.00 0.00 O ATOM 620 CB CYS A 75 -34.438 9.920 -12.049 1.00 0.00 C ATOM 621 SG CYS A 75 -36.137 10.543 -12.112 1.00 0.00 S ATOM 0 H CYS A 75 -35.621 9.158 -14.602 1.00 0.00 H new ATOM 0 HA CYS A 75 -33.277 8.343 -12.948 1.00 0.00 H new ATOM 0 HB2 CYS A 75 -34.183 9.632 -11.029 1.00 0.00 H new ATOM 0 HB3 CYS A 75 -33.741 10.705 -12.343 1.00 0.00 H new ATOM 0 HG CYS A 75 -36.841 9.980 -11.175 1.00 0.00 H new ATOM 627 N ALA A 76 -34.868 6.820 -11.581 1.00 0.00 N ATOM 628 CA ALA A 76 -35.760 5.726 -11.105 1.00 0.00 C ATOM 629 C ALA A 76 -35.900 5.804 -9.584 1.00 0.00 C ATOM 630 O ALA A 76 -35.129 6.462 -8.913 1.00 0.00 O ATOM 631 CB ALA A 76 -35.159 4.372 -11.491 1.00 0.00 C ATOM 0 H ALA A 76 -33.967 6.883 -11.107 1.00 0.00 H new ATOM 0 HA ALA A 76 -36.742 5.834 -11.566 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -35.812 3.572 -11.143 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -35.060 4.314 -12.575 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -34.177 4.265 -11.031 1.00 0.00 H new ATOM 637 N PHE A 77 -36.878 5.137 -9.034 1.00 0.00 N ATOM 638 CA PHE A 77 -37.066 5.173 -7.556 1.00 0.00 C ATOM 639 C PHE A 77 -37.155 3.743 -7.020 1.00 0.00 C ATOM 640 O PHE A 77 -37.818 2.898 -7.589 1.00 0.00 O ATOM 641 CB PHE A 77 -38.357 5.924 -7.223 1.00 0.00 C ATOM 642 CG PHE A 77 -38.234 7.358 -7.678 1.00 0.00 C ATOM 643 CD1 PHE A 77 -38.547 7.701 -8.999 1.00 0.00 C ATOM 644 CD2 PHE A 77 -37.808 8.344 -6.781 1.00 0.00 C ATOM 645 CE1 PHE A 77 -38.434 9.029 -9.423 1.00 0.00 C ATOM 646 CE2 PHE A 77 -37.694 9.674 -7.205 1.00 0.00 C ATOM 647 CZ PHE A 77 -38.007 10.017 -8.525 1.00 0.00 C ATOM 0 H PHE A 77 -37.554 4.569 -9.544 1.00 0.00 H new ATOM 0 HA PHE A 77 -36.221 5.683 -7.094 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -39.205 5.447 -7.714 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -38.546 5.886 -6.150 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -38.876 6.940 -9.691 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -37.567 8.079 -5.762 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -38.676 9.293 -10.442 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -37.364 10.435 -6.513 1.00 0.00 H new ATOM 0 HZ PHE A 77 -37.920 11.043 -8.852 1.00 0.00 H new ATOM 657 N VAL A 78 -36.495 3.465 -5.930 1.00 0.00 N ATOM 658 CA VAL A 78 -36.543 2.089 -5.362 1.00 0.00 C ATOM 659 C VAL A 78 -37.163 2.137 -3.964 1.00 0.00 C ATOM 660 O VAL A 78 -36.829 2.979 -3.155 1.00 0.00 O ATOM 661 CB VAL A 78 -35.125 1.523 -5.273 1.00 0.00 C ATOM 662 CG1 VAL A 78 -35.182 0.091 -4.739 1.00 0.00 C ATOM 663 CG2 VAL A 78 -34.487 1.525 -6.664 1.00 0.00 C ATOM 0 H VAL A 78 -35.925 4.131 -5.408 1.00 0.00 H new ATOM 0 HA VAL A 78 -37.148 1.451 -6.006 1.00 0.00 H new ATOM 0 HB VAL A 78 -34.528 2.139 -4.600 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -34.172 -0.314 -4.675 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -35.637 0.090 -3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -35.778 -0.525 -5.413 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -33.476 1.122 -6.601 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -35.082 0.909 -7.338 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -34.447 2.546 -7.045 1.00 0.00 H new ATOM 673 N THR A 79 -38.065 1.240 -3.674 1.00 0.00 N ATOM 674 CA THR A 79 -38.706 1.234 -2.330 1.00 0.00 C ATOM 675 C THR A 79 -38.223 0.017 -1.539 1.00 0.00 C ATOM 676 O THR A 79 -38.298 -1.105 -2.001 1.00 0.00 O ATOM 677 CB THR A 79 -40.226 1.164 -2.493 1.00 0.00 C ATOM 678 OG1 THR A 79 -40.634 2.078 -3.501 1.00 0.00 O ATOM 679 CG2 THR A 79 -40.903 1.523 -1.170 1.00 0.00 C ATOM 0 H THR A 79 -38.386 0.511 -4.311 1.00 0.00 H new ATOM 0 HA THR A 79 -38.437 2.145 -1.795 1.00 0.00 H new ATOM 0 HB THR A 79 -40.514 0.153 -2.780 1.00 0.00 H new ATOM 0 HG1 THR A 79 -40.722 1.605 -4.355 1.00 0.00 H new ATOM 0 HG21 THR A 79 -41.985 1.472 -1.290 1.00 0.00 H new ATOM 0 HG22 THR A 79 -40.590 0.820 -0.398 1.00 0.00 H new ATOM 0 HG23 THR A 79 -40.617 2.533 -0.878 1.00 0.00 H new ATOM 687 N TYR A 80 -37.728 0.225 -0.349 1.00 0.00 N ATOM 688 CA TYR A 80 -37.244 -0.925 0.467 1.00 0.00 C ATOM 689 C TYR A 80 -38.135 -1.087 1.698 1.00 0.00 C ATOM 690 O TYR A 80 -38.537 -0.124 2.318 1.00 0.00 O ATOM 691 CB TYR A 80 -35.803 -0.670 0.914 1.00 0.00 C ATOM 692 CG TYR A 80 -34.846 -1.143 -0.155 1.00 0.00 C ATOM 693 CD1 TYR A 80 -35.054 -2.374 -0.790 1.00 0.00 C ATOM 694 CD2 TYR A 80 -33.749 -0.350 -0.510 1.00 0.00 C ATOM 695 CE1 TYR A 80 -34.166 -2.811 -1.780 1.00 0.00 C ATOM 696 CE2 TYR A 80 -32.861 -0.787 -1.500 1.00 0.00 C ATOM 697 CZ TYR A 80 -33.070 -2.017 -2.135 1.00 0.00 C ATOM 698 OH TYR A 80 -32.196 -2.447 -3.111 1.00 0.00 O ATOM 0 H TYR A 80 -37.638 1.140 0.093 1.00 0.00 H new ATOM 0 HA TYR A 80 -37.281 -1.834 -0.134 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -35.654 0.393 1.104 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -35.605 -1.192 1.850 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -35.900 -2.987 -0.516 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -33.588 0.599 -0.020 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -34.327 -3.760 -2.269 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -32.014 -0.175 -1.774 1.00 0.00 H new ATOM 0 HH TYR A 80 -31.803 -1.671 -3.563 1.00 0.00 H new ATOM 708 N GLU A 81 -38.445 -2.303 2.059 1.00 0.00 N ATOM 709 CA GLU A 81 -39.307 -2.529 3.253 1.00 0.00 C ATOM 710 C GLU A 81 -38.553 -2.097 4.513 1.00 0.00 C ATOM 711 O GLU A 81 -39.144 -1.817 5.536 1.00 0.00 O ATOM 712 CB GLU A 81 -39.659 -4.015 3.352 1.00 0.00 C ATOM 713 CG GLU A 81 -40.691 -4.222 4.463 1.00 0.00 C ATOM 714 CD GLU A 81 -40.958 -5.719 4.636 1.00 0.00 C ATOM 715 OE1 GLU A 81 -40.359 -6.496 3.911 1.00 0.00 O ATOM 716 OE2 GLU A 81 -41.756 -6.063 5.493 1.00 0.00 O ATOM 0 H GLU A 81 -38.138 -3.149 1.578 1.00 0.00 H new ATOM 0 HA GLU A 81 -40.222 -1.945 3.159 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -40.057 -4.370 2.401 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -38.763 -4.599 3.560 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -40.326 -3.796 5.398 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -41.617 -3.702 4.216 1.00 0.00 H new ATOM 723 N LYS A 82 -37.251 -2.042 4.446 1.00 0.00 N ATOM 724 CA LYS A 82 -36.459 -1.629 5.637 1.00 0.00 C ATOM 725 C LYS A 82 -35.577 -0.432 5.275 1.00 0.00 C ATOM 726 O LYS A 82 -35.012 -0.368 4.201 1.00 0.00 O ATOM 727 CB LYS A 82 -35.575 -2.791 6.090 1.00 0.00 C ATOM 728 CG LYS A 82 -36.457 -3.957 6.543 1.00 0.00 C ATOM 729 CD LYS A 82 -35.574 -5.085 7.081 1.00 0.00 C ATOM 730 CE LYS A 82 -36.436 -6.318 7.357 1.00 0.00 C ATOM 731 NZ LYS A 82 -36.957 -6.257 8.751 1.00 0.00 N ATOM 0 H LYS A 82 -36.702 -2.266 3.616 1.00 0.00 H new ATOM 0 HA LYS A 82 -37.137 -1.351 6.444 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -34.926 -3.108 5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -34.927 -2.472 6.907 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -37.151 -3.624 7.315 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -37.058 -4.318 5.709 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -34.794 -5.327 6.359 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -35.074 -4.765 7.995 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -37.264 -6.362 6.649 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -35.848 -7.225 7.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -37.543 -7.095 8.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -36.160 -6.235 9.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -37.532 -5.399 8.869 1.00 0.00 H new ATOM 745 N MET A 83 -35.451 0.516 6.163 1.00 0.00 N ATOM 746 CA MET A 83 -34.603 1.704 5.868 1.00 0.00 C ATOM 747 C MET A 83 -33.137 1.275 5.789 1.00 0.00 C ATOM 748 O MET A 83 -32.316 1.940 5.189 1.00 0.00 O ATOM 749 CB MET A 83 -34.772 2.741 6.980 1.00 0.00 C ATOM 750 CG MET A 83 -34.082 4.044 6.571 1.00 0.00 C ATOM 751 SD MET A 83 -34.190 5.235 7.930 1.00 0.00 S ATOM 752 CE MET A 83 -35.996 5.290 8.039 1.00 0.00 C ATOM 0 H MET A 83 -35.899 0.519 7.079 1.00 0.00 H new ATOM 0 HA MET A 83 -34.907 2.140 4.916 1.00 0.00 H new ATOM 0 HB2 MET A 83 -35.831 2.921 7.167 1.00 0.00 H new ATOM 0 HB3 MET A 83 -34.344 2.366 7.910 1.00 0.00 H new ATOM 0 HG2 MET A 83 -33.038 3.853 6.323 1.00 0.00 H new ATOM 0 HG3 MET A 83 -34.553 4.452 5.677 1.00 0.00 H new ATOM 0 HE1 MET A 83 -36.307 6.255 8.439 1.00 0.00 H new ATOM 0 HE2 MET A 83 -36.425 5.153 7.046 1.00 0.00 H new ATOM 0 HE3 MET A 83 -36.345 4.495 8.698 1.00 0.00 H new ATOM 762 N GLU A 84 -32.801 0.168 6.394 1.00 0.00 N ATOM 763 CA GLU A 84 -31.388 -0.303 6.355 1.00 0.00 C ATOM 764 C GLU A 84 -31.059 -0.816 4.951 1.00 0.00 C ATOM 765 O GLU A 84 -29.918 -0.823 4.535 1.00 0.00 O ATOM 766 CB GLU A 84 -31.200 -1.433 7.369 1.00 0.00 C ATOM 767 CG GLU A 84 -31.378 -0.884 8.786 1.00 0.00 C ATOM 768 CD GLU A 84 -31.011 -1.966 9.803 1.00 0.00 C ATOM 769 OE1 GLU A 84 -30.793 -3.092 9.388 1.00 0.00 O ATOM 770 OE2 GLU A 84 -30.957 -1.650 10.981 1.00 0.00 O ATOM 0 H GLU A 84 -33.444 -0.430 6.913 1.00 0.00 H new ATOM 0 HA GLU A 84 -30.722 0.523 6.604 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -31.923 -2.227 7.182 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -30.208 -1.872 7.260 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -30.747 -0.007 8.929 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -32.409 -0.564 8.936 1.00 0.00 H new ATOM 777 N SER A 85 -32.050 -1.246 4.219 1.00 0.00 N ATOM 778 CA SER A 85 -31.792 -1.758 2.843 1.00 0.00 C ATOM 779 C SER A 85 -31.503 -0.584 1.909 1.00 0.00 C ATOM 780 O SER A 85 -30.757 -0.703 0.958 1.00 0.00 O ATOM 781 CB SER A 85 -33.022 -2.518 2.341 1.00 0.00 C ATOM 782 OG SER A 85 -33.345 -3.554 3.256 1.00 0.00 O ATOM 0 H SER A 85 -33.026 -1.265 4.514 1.00 0.00 H new ATOM 0 HA SER A 85 -30.933 -2.429 2.861 1.00 0.00 H new ATOM 0 HB2 SER A 85 -33.866 -1.836 2.235 1.00 0.00 H new ATOM 0 HB3 SER A 85 -32.826 -2.938 1.354 1.00 0.00 H new ATOM 0 HG SER A 85 -34.134 -4.039 2.935 1.00 0.00 H new ATOM 788 N ALA A 86 -32.089 0.552 2.172 1.00 0.00 N ATOM 789 CA ALA A 86 -31.848 1.734 1.298 1.00 0.00 C ATOM 790 C ALA A 86 -30.459 2.307 1.588 1.00 0.00 C ATOM 791 O ALA A 86 -29.715 2.643 0.689 1.00 0.00 O ATOM 792 CB ALA A 86 -32.908 2.800 1.577 1.00 0.00 C ATOM 0 H ALA A 86 -32.724 0.712 2.954 1.00 0.00 H new ATOM 0 HA ALA A 86 -31.905 1.431 0.253 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -32.731 3.665 0.937 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -33.897 2.392 1.371 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -32.852 3.104 2.622 1.00 0.00 H new ATOM 798 N ASP A 87 -30.103 2.420 2.838 1.00 0.00 N ATOM 799 CA ASP A 87 -28.763 2.971 3.184 1.00 0.00 C ATOM 800 C ASP A 87 -27.675 2.050 2.632 1.00 0.00 C ATOM 801 O ASP A 87 -26.638 2.497 2.184 1.00 0.00 O ATOM 802 CB ASP A 87 -28.627 3.068 4.704 1.00 0.00 C ATOM 803 CG ASP A 87 -29.656 4.064 5.245 1.00 0.00 C ATOM 804 OD1 ASP A 87 -30.237 4.779 4.445 1.00 0.00 O ATOM 805 OD2 ASP A 87 -29.845 4.096 6.450 1.00 0.00 O ATOM 0 H ASP A 87 -30.682 2.155 3.635 1.00 0.00 H new ATOM 0 HA ASP A 87 -28.655 3.964 2.747 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -28.780 2.088 5.157 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -27.620 3.388 4.970 1.00 0.00 H new ATOM 810 N GLN A 88 -27.903 0.767 2.662 1.00 0.00 N ATOM 811 CA GLN A 88 -26.881 -0.184 2.140 1.00 0.00 C ATOM 812 C GLN A 88 -26.758 -0.019 0.625 1.00 0.00 C ATOM 813 O GLN A 88 -25.672 0.030 0.081 1.00 0.00 O ATOM 814 CB GLN A 88 -27.302 -1.618 2.465 1.00 0.00 C ATOM 815 CG GLN A 88 -26.180 -2.581 2.068 1.00 0.00 C ATOM 816 CD GLN A 88 -26.598 -4.015 2.396 1.00 0.00 C ATOM 817 OE1 GLN A 88 -27.628 -4.236 3.000 1.00 0.00 O ATOM 818 NE2 GLN A 88 -25.836 -5.006 2.021 1.00 0.00 N ATOM 0 H GLN A 88 -28.753 0.335 3.025 1.00 0.00 H new ATOM 0 HA GLN A 88 -25.919 0.025 2.608 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -27.518 -1.713 3.529 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -28.218 -1.870 1.930 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -25.966 -2.488 1.003 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -25.263 -2.327 2.600 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -24.971 -4.820 1.514 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -26.106 -5.966 2.235 1.00 0.00 H new ATOM 827 N ALA A 89 -27.863 0.072 -0.058 1.00 0.00 N ATOM 828 CA ALA A 89 -27.814 0.237 -1.538 1.00 0.00 C ATOM 829 C ALA A 89 -27.101 1.547 -1.875 1.00 0.00 C ATOM 830 O ALA A 89 -26.284 1.609 -2.772 1.00 0.00 O ATOM 831 CB ALA A 89 -29.239 0.273 -2.095 1.00 0.00 C ATOM 0 H ALA A 89 -28.800 0.039 0.344 1.00 0.00 H new ATOM 0 HA ALA A 89 -27.273 -0.599 -1.982 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -29.204 0.394 -3.178 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -29.749 -0.659 -1.850 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -29.781 1.110 -1.654 1.00 0.00 H new ATOM 837 N VAL A 90 -27.401 2.595 -1.159 1.00 0.00 N ATOM 838 CA VAL A 90 -26.739 3.901 -1.433 1.00 0.00 C ATOM 839 C VAL A 90 -25.261 3.809 -1.049 1.00 0.00 C ATOM 840 O VAL A 90 -24.427 4.519 -1.573 1.00 0.00 O ATOM 841 CB VAL A 90 -27.416 4.998 -0.610 1.00 0.00 C ATOM 842 CG1 VAL A 90 -26.656 6.314 -0.786 1.00 0.00 C ATOM 843 CG2 VAL A 90 -28.859 5.173 -1.087 1.00 0.00 C ATOM 0 H VAL A 90 -28.077 2.603 -0.395 1.00 0.00 H new ATOM 0 HA VAL A 90 -26.825 4.140 -2.493 1.00 0.00 H new ATOM 0 HB VAL A 90 -27.412 4.717 0.443 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -27.140 7.095 -0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -25.628 6.189 -0.446 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -26.658 6.597 -1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -29.343 5.955 -0.502 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -28.863 5.454 -2.140 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -29.401 4.236 -0.959 1.00 0.00 H new ATOM 853 N ALA A 91 -24.932 2.938 -0.134 1.00 0.00 N ATOM 854 CA ALA A 91 -23.509 2.800 0.284 1.00 0.00 C ATOM 855 C ALA A 91 -22.756 1.940 -0.736 1.00 0.00 C ATOM 856 O ALA A 91 -21.544 1.974 -0.815 1.00 0.00 O ATOM 857 CB ALA A 91 -23.445 2.132 1.659 1.00 0.00 C ATOM 0 H ALA A 91 -25.587 2.317 0.341 1.00 0.00 H new ATOM 0 HA ALA A 91 -23.049 3.787 0.336 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -22.404 2.030 1.966 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -23.980 2.743 2.386 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -23.906 1.146 1.606 1.00 0.00 H new ATOM 863 N GLU A 92 -23.463 1.168 -1.516 1.00 0.00 N ATOM 864 CA GLU A 92 -22.783 0.307 -2.525 1.00 0.00 C ATOM 865 C GLU A 92 -23.242 0.699 -3.932 1.00 0.00 C ATOM 866 O GLU A 92 -22.442 1.029 -4.785 1.00 0.00 O ATOM 867 CB GLU A 92 -23.135 -1.159 -2.265 1.00 0.00 C ATOM 868 CG GLU A 92 -22.616 -1.570 -0.885 1.00 0.00 C ATOM 869 CD GLU A 92 -22.891 -3.057 -0.659 1.00 0.00 C ATOM 870 OE1 GLU A 92 -23.612 -3.634 -1.457 1.00 0.00 O ATOM 871 OE2 GLU A 92 -22.377 -3.596 0.307 1.00 0.00 O ATOM 0 H GLU A 92 -24.480 1.096 -1.498 1.00 0.00 H new ATOM 0 HA GLU A 92 -21.704 0.443 -2.446 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -24.215 -1.300 -2.316 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -22.694 -1.792 -3.035 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -21.547 -1.372 -0.813 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -23.103 -0.977 -0.110 1.00 0.00 H new ATOM 878 N LEU A 93 -24.523 0.666 -4.186 1.00 0.00 N ATOM 879 CA LEU A 93 -25.021 1.036 -5.540 1.00 0.00 C ATOM 880 C LEU A 93 -24.544 2.446 -5.888 1.00 0.00 C ATOM 881 O LEU A 93 -24.284 2.759 -7.032 1.00 0.00 O ATOM 882 CB LEU A 93 -26.552 0.996 -5.554 1.00 0.00 C ATOM 883 CG LEU A 93 -27.028 -0.441 -5.328 1.00 0.00 C ATOM 884 CD1 LEU A 93 -28.554 -0.494 -5.428 1.00 0.00 C ATOM 885 CD2 LEU A 93 -26.415 -1.355 -6.390 1.00 0.00 C ATOM 0 H LEU A 93 -25.244 0.399 -3.515 1.00 0.00 H new ATOM 0 HA LEU A 93 -24.635 0.329 -6.274 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -26.950 1.649 -4.777 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -26.927 1.369 -6.507 1.00 0.00 H new ATOM 0 HG LEU A 93 -26.717 -0.775 -4.338 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -28.894 -1.517 -5.267 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -28.991 0.157 -4.671 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -28.866 -0.160 -6.417 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -26.754 -2.378 -6.229 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -26.725 -1.021 -7.380 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -25.328 -1.317 -6.319 1.00 0.00 H new ATOM 897 N ASN A 94 -24.427 3.300 -4.908 1.00 0.00 N ATOM 898 CA ASN A 94 -23.966 4.689 -5.184 1.00 0.00 C ATOM 899 C ASN A 94 -22.501 4.661 -5.623 1.00 0.00 C ATOM 900 O ASN A 94 -21.649 4.125 -4.943 1.00 0.00 O ATOM 901 CB ASN A 94 -24.101 5.534 -3.915 1.00 0.00 C ATOM 902 CG ASN A 94 -23.952 7.016 -4.267 1.00 0.00 C ATOM 903 OD1 ASN A 94 -23.649 7.357 -5.394 1.00 0.00 O ATOM 904 ND2 ASN A 94 -24.153 7.917 -3.345 1.00 0.00 N ATOM 0 H ASN A 94 -24.631 3.096 -3.930 1.00 0.00 H new ATOM 0 HA ASN A 94 -24.576 5.123 -5.976 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -25.070 5.356 -3.449 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -23.341 5.244 -3.190 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -24.056 8.907 -3.570 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -24.407 7.631 -2.399 1.00 0.00 H new ATOM 911 N GLY A 95 -22.201 5.233 -6.757 1.00 0.00 N ATOM 912 CA GLY A 95 -20.791 5.237 -7.239 1.00 0.00 C ATOM 913 C GLY A 95 -20.464 3.883 -7.873 1.00 0.00 C ATOM 914 O GLY A 95 -19.501 3.235 -7.514 1.00 0.00 O ATOM 0 H GLY A 95 -22.871 5.697 -7.370 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -20.647 6.036 -7.967 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -20.112 5.435 -6.409 1.00 0.00 H new ATOM 918 N THR A 96 -21.259 3.451 -8.813 1.00 0.00 N ATOM 919 CA THR A 96 -20.993 2.140 -9.469 1.00 0.00 C ATOM 920 C THR A 96 -21.119 2.294 -10.986 1.00 0.00 C ATOM 921 O THR A 96 -21.657 3.265 -11.479 1.00 0.00 O ATOM 922 CB THR A 96 -22.008 1.106 -8.977 1.00 0.00 C ATOM 923 OG1 THR A 96 -23.293 1.422 -9.495 1.00 0.00 O ATOM 924 CG2 THR A 96 -22.055 1.119 -7.448 1.00 0.00 C ATOM 0 H THR A 96 -22.081 3.949 -9.155 1.00 0.00 H new ATOM 0 HA THR A 96 -19.986 1.808 -9.219 1.00 0.00 H new ATOM 0 HB THR A 96 -21.711 0.115 -9.320 1.00 0.00 H new ATOM 0 HG1 THR A 96 -23.815 1.890 -8.811 1.00 0.00 H new ATOM 0 HG21 THR A 96 -22.779 0.382 -7.100 1.00 0.00 H new ATOM 0 HG22 THR A 96 -21.069 0.875 -7.052 1.00 0.00 H new ATOM 0 HG23 THR A 96 -22.351 2.109 -7.101 1.00 0.00 H new ATOM 932 N GLN A 97 -20.626 1.342 -11.730 1.00 0.00 N ATOM 933 CA GLN A 97 -20.718 1.433 -13.215 1.00 0.00 C ATOM 934 C GLN A 97 -21.252 0.113 -13.773 1.00 0.00 C ATOM 935 O GLN A 97 -21.288 -0.892 -13.091 1.00 0.00 O ATOM 936 CB GLN A 97 -19.329 1.709 -13.796 1.00 0.00 C ATOM 937 CG GLN A 97 -19.442 1.930 -15.305 1.00 0.00 C ATOM 938 CD GLN A 97 -18.100 2.422 -15.851 1.00 0.00 C ATOM 939 OE1 GLN A 97 -17.194 2.716 -15.096 1.00 0.00 O ATOM 940 NE2 GLN A 97 -17.931 2.524 -17.142 1.00 0.00 N ATOM 0 H GLN A 97 -20.164 0.505 -11.374 1.00 0.00 H new ATOM 0 HA GLN A 97 -21.393 2.243 -13.489 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -18.892 2.587 -13.321 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -18.664 0.871 -13.589 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -19.729 1.002 -15.799 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -20.223 2.660 -15.519 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -18.690 2.278 -17.777 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -17.040 2.850 -17.515 1.00 0.00 H new ATOM 949 N VAL A 98 -21.664 0.107 -15.010 1.00 0.00 N ATOM 950 CA VAL A 98 -22.195 -1.149 -15.615 1.00 0.00 C ATOM 951 C VAL A 98 -21.457 -1.417 -16.926 1.00 0.00 C ATOM 952 O VAL A 98 -20.401 -0.871 -17.176 1.00 0.00 O ATOM 953 CB VAL A 98 -23.698 -1.010 -15.901 1.00 0.00 C ATOM 954 CG1 VAL A 98 -24.426 -2.262 -15.406 1.00 0.00 C ATOM 955 CG2 VAL A 98 -24.265 0.220 -15.186 1.00 0.00 C ATOM 0 H VAL A 98 -21.656 0.917 -15.629 1.00 0.00 H new ATOM 0 HA VAL A 98 -22.043 -1.974 -14.919 1.00 0.00 H new ATOM 0 HB VAL A 98 -23.844 -0.894 -16.975 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -25.493 -2.166 -15.608 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -24.036 -3.138 -15.924 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -24.268 -2.374 -14.333 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -25.331 0.305 -15.398 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -24.116 0.117 -14.111 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -23.752 1.115 -15.539 1.00 0.00 H new ATOM 965 N GLU A 99 -22.005 -2.244 -17.772 1.00 0.00 N ATOM 966 CA GLU A 99 -21.329 -2.530 -19.067 1.00 0.00 C ATOM 967 C GLU A 99 -21.075 -1.209 -19.794 1.00 0.00 C ATOM 968 O GLU A 99 -20.244 -1.122 -20.677 1.00 0.00 O ATOM 969 CB GLU A 99 -22.225 -3.423 -19.927 1.00 0.00 C ATOM 970 CG GLU A 99 -22.394 -4.783 -19.244 1.00 0.00 C ATOM 971 CD GLU A 99 -23.212 -5.707 -20.147 1.00 0.00 C ATOM 972 OE1 GLU A 99 -23.734 -5.224 -21.139 1.00 0.00 O ATOM 973 OE2 GLU A 99 -23.303 -6.882 -19.833 1.00 0.00 O ATOM 0 H GLU A 99 -22.888 -2.732 -17.623 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.383 -3.041 -18.886 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -23.198 -2.952 -20.069 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.786 -3.553 -20.916 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -21.418 -5.225 -19.042 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -22.893 -4.660 -18.283 1.00 0.00 H new ATOM 980 N SER A 100 -21.786 -0.179 -19.425 1.00 0.00 N ATOM 981 CA SER A 100 -21.592 1.142 -20.085 1.00 0.00 C ATOM 982 C SER A 100 -22.606 2.143 -19.527 1.00 0.00 C ATOM 983 O SER A 100 -23.131 2.973 -20.242 1.00 0.00 O ATOM 984 CB SER A 100 -21.794 0.993 -21.595 1.00 0.00 C ATOM 985 OG SER A 100 -22.914 0.156 -21.843 1.00 0.00 O ATOM 0 H SER A 100 -22.495 -0.196 -18.692 1.00 0.00 H new ATOM 0 HA SER A 100 -20.582 1.503 -19.890 1.00 0.00 H new ATOM 0 HB2 SER A 100 -21.950 1.971 -22.050 1.00 0.00 H new ATOM 0 HB3 SER A 100 -20.900 0.568 -22.052 1.00 0.00 H new ATOM 0 HG SER A 100 -23.044 0.062 -22.810 1.00 0.00 H new ATOM 991 N VAL A 101 -22.883 2.071 -18.253 1.00 0.00 N ATOM 992 CA VAL A 101 -23.862 3.018 -17.647 1.00 0.00 C ATOM 993 C VAL A 101 -23.391 3.414 -16.246 1.00 0.00 C ATOM 994 O VAL A 101 -22.541 2.774 -15.660 1.00 0.00 O ATOM 995 CB VAL A 101 -25.229 2.339 -17.548 1.00 0.00 C ATOM 996 CG1 VAL A 101 -26.155 3.175 -16.660 1.00 0.00 C ATOM 997 CG2 VAL A 101 -25.841 2.214 -18.945 1.00 0.00 C ATOM 0 H VAL A 101 -22.474 1.397 -17.606 1.00 0.00 H new ATOM 0 HA VAL A 101 -23.939 3.909 -18.270 1.00 0.00 H new ATOM 0 HB VAL A 101 -25.108 1.347 -17.113 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -27.128 2.690 -16.591 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -25.722 3.263 -15.664 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -26.275 4.168 -17.093 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -26.815 1.730 -18.874 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -25.960 3.206 -19.380 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -25.185 1.617 -19.578 1.00 0.00 H new ATOM 1007 N GLN A 102 -23.943 4.465 -15.704 1.00 0.00 N ATOM 1008 CA GLN A 102 -23.537 4.905 -14.340 1.00 0.00 C ATOM 1009 C GLN A 102 -24.769 4.933 -13.434 1.00 0.00 C ATOM 1010 O GLN A 102 -25.730 5.628 -13.698 1.00 0.00 O ATOM 1011 CB GLN A 102 -22.927 6.306 -14.415 1.00 0.00 C ATOM 1012 CG GLN A 102 -21.630 6.256 -15.225 1.00 0.00 C ATOM 1013 CD GLN A 102 -20.970 7.636 -15.215 1.00 0.00 C ATOM 1014 OE1 GLN A 102 -21.571 8.607 -14.799 1.00 0.00 O ATOM 1015 NE2 GLN A 102 -19.749 7.765 -15.658 1.00 0.00 N ATOM 0 H GLN A 102 -24.659 5.039 -16.149 1.00 0.00 H new ATOM 0 HA GLN A 102 -22.800 4.212 -13.936 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -23.631 6.996 -14.879 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -22.727 6.681 -13.411 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -20.953 5.514 -14.802 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -21.840 5.949 -16.250 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -19.244 6.950 -16.007 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -19.299 8.681 -15.655 1.00 0.00 H new ATOM 1024 N LEU A 103 -24.752 4.181 -12.367 1.00 0.00 N ATOM 1025 CA LEU A 103 -25.922 4.163 -11.448 1.00 0.00 C ATOM 1026 C LEU A 103 -25.670 5.117 -10.277 1.00 0.00 C ATOM 1027 O LEU A 103 -24.702 4.985 -9.554 1.00 0.00 O ATOM 1028 CB LEU A 103 -26.119 2.745 -10.916 1.00 0.00 C ATOM 1029 CG LEU A 103 -26.906 1.919 -11.937 1.00 0.00 C ATOM 1030 CD1 LEU A 103 -26.908 0.449 -11.512 1.00 0.00 C ATOM 1031 CD2 LEU A 103 -28.346 2.432 -12.006 1.00 0.00 C ATOM 0 H LEU A 103 -23.976 3.578 -12.093 1.00 0.00 H new ATOM 0 HA LEU A 103 -26.815 4.482 -11.986 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -25.152 2.280 -10.724 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -26.653 2.773 -9.966 1.00 0.00 H new ATOM 0 HG LEU A 103 -26.439 2.013 -12.917 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -27.468 -0.139 -12.239 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -25.882 0.083 -11.462 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -27.375 0.354 -10.532 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -28.907 1.845 -12.733 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -28.813 2.338 -11.026 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -28.345 3.479 -12.309 1.00 0.00 H new ATOM 1043 N LYS A 104 -26.533 6.076 -10.083 1.00 0.00 N ATOM 1044 CA LYS A 104 -26.341 7.034 -8.958 1.00 0.00 C ATOM 1045 C LYS A 104 -27.573 7.006 -8.048 1.00 0.00 C ATOM 1046 O LYS A 104 -28.678 7.274 -8.476 1.00 0.00 O ATOM 1047 CB LYS A 104 -26.152 8.444 -9.519 1.00 0.00 C ATOM 1048 CG LYS A 104 -25.747 9.394 -8.390 1.00 0.00 C ATOM 1049 CD LYS A 104 -25.657 10.822 -8.934 1.00 0.00 C ATOM 1050 CE LYS A 104 -25.167 11.760 -7.829 1.00 0.00 C ATOM 1051 NZ LYS A 104 -23.780 11.382 -7.434 1.00 0.00 N ATOM 0 H LYS A 104 -27.362 6.238 -10.654 1.00 0.00 H new ATOM 0 HA LYS A 104 -25.459 6.750 -8.383 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -25.387 8.438 -10.295 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -27.076 8.788 -9.984 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -26.476 9.347 -7.581 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -24.787 9.091 -7.972 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -24.975 10.856 -9.784 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -26.633 11.147 -9.295 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -25.188 12.792 -8.178 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -25.831 11.701 -6.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -23.307 12.200 -7.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -23.815 10.600 -6.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -23.249 11.082 -8.276 1.00 0.00 H new ATOM 1065 N VAL A 105 -27.390 6.681 -6.797 1.00 0.00 N ATOM 1066 CA VAL A 105 -28.549 6.633 -5.863 1.00 0.00 C ATOM 1067 C VAL A 105 -28.547 7.879 -4.975 1.00 0.00 C ATOM 1068 O VAL A 105 -27.508 8.410 -4.636 1.00 0.00 O ATOM 1069 CB VAL A 105 -28.446 5.386 -4.984 1.00 0.00 C ATOM 1070 CG1 VAL A 105 -29.687 5.283 -4.095 1.00 0.00 C ATOM 1071 CG2 VAL A 105 -28.349 4.142 -5.870 1.00 0.00 C ATOM 0 H VAL A 105 -26.488 6.447 -6.382 1.00 0.00 H new ATOM 0 HA VAL A 105 -29.473 6.599 -6.439 1.00 0.00 H new ATOM 0 HB VAL A 105 -27.556 5.457 -4.359 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -29.613 4.394 -3.469 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -29.756 6.168 -3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -30.577 5.214 -4.720 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -28.276 3.253 -5.243 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -29.238 4.071 -6.497 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -27.464 4.214 -6.502 1.00 0.00 H new ATOM 1081 N ASN A 106 -29.703 8.346 -4.592 1.00 0.00 N ATOM 1082 CA ASN A 106 -29.771 9.554 -3.723 1.00 0.00 C ATOM 1083 C ASN A 106 -30.901 9.384 -2.705 1.00 0.00 C ATOM 1084 O ASN A 106 -31.564 8.366 -2.663 1.00 0.00 O ATOM 1085 CB ASN A 106 -30.042 10.789 -4.584 1.00 0.00 C ATOM 1086 CG ASN A 106 -28.758 11.193 -5.311 1.00 0.00 C ATOM 1087 OD1 ASN A 106 -27.680 10.765 -4.949 1.00 0.00 O ATOM 1088 ND2 ASN A 106 -28.829 12.004 -6.331 1.00 0.00 N ATOM 0 H ASN A 106 -30.605 7.942 -4.844 1.00 0.00 H new ATOM 0 HA ASN A 106 -28.823 9.679 -3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -30.830 10.577 -5.306 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -30.394 11.611 -3.960 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -27.980 12.279 -6.824 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -29.734 12.363 -6.635 1.00 0.00 H new ATOM 1095 N ILE A 107 -31.126 10.371 -1.882 1.00 0.00 N ATOM 1096 CA ILE A 107 -32.212 10.263 -0.869 1.00 0.00 C ATOM 1097 C ILE A 107 -33.337 11.240 -1.220 1.00 0.00 C ATOM 1098 O ILE A 107 -33.122 12.429 -1.350 1.00 0.00 O ATOM 1099 CB ILE A 107 -31.653 10.605 0.514 1.00 0.00 C ATOM 1100 CG1 ILE A 107 -30.437 9.724 0.805 1.00 0.00 C ATOM 1101 CG2 ILE A 107 -32.728 10.360 1.575 1.00 0.00 C ATOM 1102 CD1 ILE A 107 -30.785 8.262 0.515 1.00 0.00 C ATOM 0 H ILE A 107 -30.604 11.247 -1.868 1.00 0.00 H new ATOM 0 HA ILE A 107 -32.604 9.246 -0.863 1.00 0.00 H new ATOM 0 HB ILE A 107 -31.355 11.653 0.536 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -29.593 10.037 0.191 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -30.133 9.837 1.846 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -32.329 10.604 2.560 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -33.594 10.989 1.368 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -33.028 9.312 1.554 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -29.919 7.634 0.722 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -31.617 7.953 1.148 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -31.068 8.156 -0.532 1.00 0.00 H new ATOM 1114 N ALA A 108 -34.536 10.748 -1.375 1.00 0.00 N ATOM 1115 CA ALA A 108 -35.672 11.650 -1.718 1.00 0.00 C ATOM 1116 C ALA A 108 -36.000 12.539 -0.517 1.00 0.00 C ATOM 1117 O ALA A 108 -35.854 12.139 0.622 1.00 0.00 O ATOM 1118 CB ALA A 108 -36.898 10.808 -2.079 1.00 0.00 C ATOM 0 H ALA A 108 -34.778 9.762 -1.279 1.00 0.00 H new ATOM 0 HA ALA A 108 -35.396 12.275 -2.567 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -37.730 11.466 -2.330 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -36.665 10.174 -2.935 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -37.173 10.183 -1.229 1.00 0.00 H new