USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 719 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 75 LYS NZ :NH3+ 171:sc= 0.741 (180deg=0) USER MOD Set 1.2: A 78 ASN : amide:sc= -0.164 K(o=1.2,f=-3.2!) USER MOD Set 1.3: A 85 ASN : amide:sc= 0.667 K(o=1.2,f=-2.7) USER MOD Set 2.1: A 38 HIS : no HD1:sc= -3.97! C(o=-4!,f=-6.2!) USER MOD Set 2.2: A 89 THR OG1 : rot 180:sc=-0.00671 USER MOD Set 3.1: A 24 TYR OH : rot -105:sc= 1.26 USER MOD Set 3.2: A 28 HIS : no HE2:sc= 0.882 K(o=2.1,f=-2.9) USER MOD Set 4.1: A 23 ASN : amide:sc= 0.616 K(o=-0.16,f=-1.3) USER MOD Set 4.2: A 66 MET CE :methyl -177:sc= -0.779 (180deg=-0.759) USER MOD Single : A 9 LYS NZ :NH3+ -120:sc= 0.366 (180deg=-0.126) USER MOD Single : A 12 LYS NZ :NH3+ -166:sc=-0.00933 (180deg=-0.148) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -0.772 K(o=-0.77,f=-4.8!) USER MOD Single : A 20 ASN : amide:sc= -0.542 K(o=-0.54,f=-5.5!) USER MOD Single : A 25 LYS NZ :NH3+ 178:sc= 0.566 (180deg=0.523) USER MOD Single : A 27 LYS NZ :NH3+ -132:sc= -0.055 (180deg=-0.354) USER MOD Single : A 35 GLN : amide:sc= -0.338 K(o=-0.34,f=-2.8!) USER MOD Single : A 37 LYS NZ :NH3+ 167:sc= 1.15 (180deg=0.988) USER MOD Single : A 46 LYS NZ :NH3+ 169:sc=-0.00777 (180deg=-0.138) USER MOD Single : A 50 MET CE :methyl -154:sc= -0.236 (180deg=-0.992) USER MOD Single : A 52 THR OG1 : rot -166:sc= 0.85 USER MOD Single : A 62 LYS NZ :NH3+ 168:sc= -0.0157 (180deg=-0.184) USER MOD Single : A 65 THR OG1 : rot -83:sc= 0.452 USER MOD Single : A 69 ASN : amide:sc= -0.0903 X(o=-0.09,f=-0.14) USER MOD Single : A 72 ASN : amide:sc= -1.27 K(o=-1.3,f=-2.8!) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl -110:sc= -1.21 (180deg=-2.84!) USER MOD Single : A 91 LYS NZ :NH3+ -161:sc= 1.08 (180deg=0.885) USER MOD ----------------------------------------------------------------- ATOM 58 N ASP A 7 -11.877 -46.595 21.879 1.00 0.00 N ATOM 59 CA ASP A 7 -12.528 -45.987 23.013 1.00 0.00 C ATOM 60 C ASP A 7 -11.657 -46.081 24.246 1.00 0.00 C ATOM 61 O ASP A 7 -11.249 -47.167 24.652 1.00 0.00 O ATOM 62 CB ASP A 7 -13.886 -46.637 23.252 1.00 0.00 C ATOM 63 CG ASP A 7 -14.619 -46.043 24.427 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.886 -44.827 24.420 1.00 0.00 O ATOM 65 OD2 ASP A 7 -14.950 -46.796 25.349 1.00 0.00 O ATOM 0 HA ASP A 7 -12.686 -44.930 22.798 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.498 -46.530 22.356 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.748 -47.705 23.418 1.00 0.00 H new ATOM 70 N ILE A 8 -11.362 -44.945 24.826 1.00 0.00 N ATOM 71 CA ILE A 8 -10.504 -44.872 25.988 1.00 0.00 C ATOM 72 C ILE A 8 -11.244 -44.243 27.155 1.00 0.00 C ATOM 73 O ILE A 8 -11.970 -43.264 26.984 1.00 0.00 O ATOM 74 CB ILE A 8 -9.211 -44.094 25.672 1.00 0.00 C ATOM 75 CG1 ILE A 8 -8.436 -44.838 24.586 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.356 -43.905 26.921 1.00 0.00 C ATOM 77 CD1 ILE A 8 -7.211 -44.120 24.100 1.00 0.00 C ATOM 0 H ILE A 8 -11.710 -44.041 24.507 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.221 -45.887 26.268 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.474 -43.099 25.313 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.142 -45.815 24.970 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.099 -45.015 23.739 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.452 -43.353 26.663 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.921 -43.347 27.668 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.083 -44.879 27.326 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.721 -44.717 23.331 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.497 -43.154 23.683 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.525 -43.967 24.933 1.00 0.00 H new ATOM 89 N LYS A 9 -11.077 -44.822 28.328 1.00 0.00 N ATOM 90 CA LYS A 9 -11.790 -44.368 29.498 1.00 0.00 C ATOM 91 C LYS A 9 -10.927 -43.456 30.334 1.00 0.00 C ATOM 92 O LYS A 9 -9.743 -43.724 30.555 1.00 0.00 O ATOM 93 CB LYS A 9 -12.230 -45.570 30.328 1.00 0.00 C ATOM 94 CG LYS A 9 -13.057 -46.557 29.538 1.00 0.00 C ATOM 95 CD LYS A 9 -14.353 -45.932 29.065 1.00 0.00 C ATOM 96 CE LYS A 9 -15.124 -46.876 28.176 1.00 0.00 C ATOM 97 NZ LYS A 9 -16.404 -46.281 27.728 1.00 0.00 N ATOM 0 H LYS A 9 -10.451 -45.610 28.493 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.666 -43.807 29.174 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.348 -46.075 30.722 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.808 -45.222 31.184 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -12.485 -46.909 28.679 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -13.275 -47.429 30.155 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -14.963 -45.660 29.926 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -14.139 -45.011 28.522 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -14.519 -47.134 27.307 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -15.322 -47.803 28.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -17.195 -46.873 28.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.501 -45.325 28.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -16.416 -46.226 26.690 1.00 0.00 H new ATOM 111 N GLU A 10 -11.512 -42.382 30.794 1.00 0.00 N ATOM 112 CA GLU A 10 -10.812 -41.451 31.636 1.00 0.00 C ATOM 113 C GLU A 10 -11.441 -41.440 33.012 1.00 0.00 C ATOM 114 O GLU A 10 -12.519 -40.878 33.208 1.00 0.00 O ATOM 115 CB GLU A 10 -10.840 -40.045 31.031 1.00 0.00 C ATOM 116 CG GLU A 10 -10.122 -39.929 29.693 1.00 0.00 C ATOM 117 CD GLU A 10 -10.155 -38.526 29.136 1.00 0.00 C ATOM 118 OE1 GLU A 10 -11.124 -38.189 28.426 1.00 0.00 O ATOM 119 OE2 GLU A 10 -9.219 -37.745 29.408 1.00 0.00 O ATOM 0 H GLU A 10 -12.480 -42.130 30.597 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.771 -41.765 31.717 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.878 -39.737 30.902 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.386 -39.349 31.736 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.085 -40.244 29.813 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.582 -40.611 28.978 1.00 0.00 H new ATOM 126 N ILE A 11 -10.781 -42.070 33.957 1.00 0.00 N ATOM 127 CA ILE A 11 -11.270 -42.108 35.308 1.00 0.00 C ATOM 128 C ILE A 11 -10.716 -40.921 36.089 1.00 0.00 C ATOM 129 O ILE A 11 -9.539 -40.880 36.461 1.00 0.00 O ATOM 130 CB ILE A 11 -10.954 -43.476 36.014 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.786 -44.603 35.364 1.00 0.00 C ATOM 132 CG2 ILE A 11 -11.228 -43.402 37.517 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.513 -45.988 35.933 1.00 0.00 C ATOM 0 H ILE A 11 -9.901 -42.564 33.810 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.357 -42.029 35.282 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.894 -43.694 35.884 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.845 -44.374 35.486 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.585 -44.616 34.293 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -11.000 -44.364 37.976 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.602 -42.629 37.963 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.278 -43.160 37.684 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.138 -46.721 35.422 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.463 -46.241 35.786 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.743 -45.995 36.998 1.00 0.00 H new ATOM 145 N LYS A 12 -11.580 -39.940 36.284 1.00 0.00 N ATOM 146 CA LYS A 12 -11.237 -38.709 36.964 1.00 0.00 C ATOM 147 C LYS A 12 -11.450 -38.816 38.468 1.00 0.00 C ATOM 148 O LYS A 12 -12.527 -39.192 38.933 1.00 0.00 O ATOM 149 CB LYS A 12 -12.065 -37.562 36.383 1.00 0.00 C ATOM 150 CG LYS A 12 -11.921 -36.248 37.115 1.00 0.00 C ATOM 151 CD LYS A 12 -12.742 -35.164 36.441 1.00 0.00 C ATOM 152 CE LYS A 12 -12.799 -33.911 37.284 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.657 -34.101 38.486 1.00 0.00 N ATOM 0 H LYS A 12 -12.550 -39.979 35.970 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.177 -38.512 36.805 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -11.778 -37.416 35.342 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.116 -37.852 36.387 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -12.244 -36.365 38.149 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.872 -35.953 37.140 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -12.310 -34.930 35.468 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -13.753 -35.530 36.261 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.792 -33.634 37.595 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -13.186 -33.086 36.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.869 -33.176 38.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.545 -34.566 38.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.157 -34.694 39.179 1.00 0.00 H new ATOM 167 N LEU A 13 -10.421 -38.466 39.209 1.00 0.00 N ATOM 168 CA LEU A 13 -10.432 -38.513 40.659 1.00 0.00 C ATOM 169 C LEU A 13 -10.051 -37.147 41.221 1.00 0.00 C ATOM 170 O LEU A 13 -9.821 -36.198 40.459 1.00 0.00 O ATOM 171 CB LEU A 13 -9.455 -39.587 41.147 1.00 0.00 C ATOM 172 CG LEU A 13 -9.707 -40.992 40.585 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.693 -41.972 41.119 1.00 0.00 C ATOM 174 CD2 LEU A 13 -11.115 -41.459 40.897 1.00 0.00 C ATOM 0 H LEU A 13 -9.539 -38.136 38.817 1.00 0.00 H new ATOM 0 HA LEU A 13 -11.433 -38.766 41.008 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.442 -39.283 40.884 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.502 -39.633 42.235 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.599 -40.943 39.501 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.891 -42.961 40.707 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -7.692 -41.653 40.830 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -8.762 -42.011 42.206 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.266 -42.458 40.487 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -11.259 -41.484 41.977 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -11.834 -40.771 40.451 1.00 0.00 H new ATOM 186 N SER A 14 -9.988 -37.038 42.529 1.00 0.00 N ATOM 187 CA SER A 14 -9.630 -35.789 43.161 1.00 0.00 C ATOM 188 C SER A 14 -8.754 -36.041 44.374 1.00 0.00 C ATOM 189 O SER A 14 -8.704 -37.145 44.889 1.00 0.00 O ATOM 190 CB SER A 14 -10.885 -35.013 43.564 1.00 0.00 C ATOM 191 OG SER A 14 -11.721 -35.793 44.397 1.00 0.00 O ATOM 0 H SER A 14 -10.181 -37.802 43.177 1.00 0.00 H new ATOM 0 HA SER A 14 -9.068 -35.190 42.445 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.599 -34.099 44.084 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.434 -34.714 42.671 1.00 0.00 H new ATOM 0 HG SER A 14 -12.515 -35.274 44.642 1.00 0.00 H new ATOM 197 N VAL A 15 -8.062 -35.017 44.811 1.00 0.00 N ATOM 198 CA VAL A 15 -7.203 -35.095 45.984 1.00 0.00 C ATOM 199 C VAL A 15 -8.000 -35.370 47.276 1.00 0.00 C ATOM 200 O VAL A 15 -7.489 -35.966 48.227 1.00 0.00 O ATOM 201 CB VAL A 15 -6.360 -33.801 46.106 1.00 0.00 C ATOM 202 CG1 VAL A 15 -5.697 -33.687 47.457 1.00 0.00 C ATOM 203 CG2 VAL A 15 -5.310 -33.787 45.019 1.00 0.00 C ATOM 0 H VAL A 15 -8.074 -34.099 44.366 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.532 -35.943 45.852 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.030 -32.948 45.996 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.116 -32.766 47.501 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.459 -33.672 48.236 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.037 -34.540 47.611 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.714 -32.878 45.101 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.662 -34.657 45.128 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.796 -33.816 44.044 1.00 0.00 H new ATOM 213 N LYS A 16 -9.257 -34.982 47.277 1.00 0.00 N ATOM 214 CA LYS A 16 -10.130 -35.159 48.432 1.00 0.00 C ATOM 215 C LYS A 16 -10.863 -36.504 48.382 1.00 0.00 C ATOM 216 O LYS A 16 -11.793 -36.740 49.154 1.00 0.00 O ATOM 217 CB LYS A 16 -11.145 -34.025 48.481 1.00 0.00 C ATOM 218 CG LYS A 16 -11.764 -33.729 47.132 1.00 0.00 C ATOM 219 CD LYS A 16 -12.837 -32.677 47.219 1.00 0.00 C ATOM 220 CE LYS A 16 -13.395 -32.388 45.843 1.00 0.00 C ATOM 221 NZ LYS A 16 -14.525 -31.435 45.885 1.00 0.00 N ATOM 0 H LYS A 16 -9.709 -34.534 46.480 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.511 -35.146 49.329 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.934 -34.281 49.189 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.659 -33.125 48.857 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -10.988 -33.398 46.442 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -12.187 -34.645 46.719 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -13.635 -33.015 47.880 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -12.428 -31.765 47.653 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.605 -31.984 45.210 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -13.725 -33.320 45.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -14.874 -31.268 44.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -15.291 -31.830 46.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -14.206 -30.536 46.298 1.00 0.00 H new ATOM 235 N ILE A 17 -10.440 -37.376 47.478 1.00 0.00 N ATOM 236 CA ILE A 17 -11.071 -38.683 47.307 1.00 0.00 C ATOM 237 C ILE A 17 -10.817 -39.586 48.526 1.00 0.00 C ATOM 238 O ILE A 17 -9.815 -39.428 49.241 1.00 0.00 O ATOM 239 CB ILE A 17 -10.554 -39.394 46.027 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.415 -40.616 45.696 1.00 0.00 C ATOM 241 CG2 ILE A 17 -9.095 -39.799 46.189 1.00 0.00 C ATOM 242 CD1 ILE A 17 -11.007 -41.311 44.419 1.00 0.00 C ATOM 0 H ILE A 17 -9.658 -37.203 46.847 1.00 0.00 H new ATOM 0 HA ILE A 17 -12.143 -38.509 47.209 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.627 -38.690 45.198 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.357 -41.326 46.521 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.457 -40.306 45.615 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.752 -40.296 45.281 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.489 -38.911 46.368 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.998 -40.481 47.034 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -11.659 -42.167 44.246 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -11.092 -40.616 43.584 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.975 -41.652 44.504 1.00 0.00 H new ATOM 254 N ALA A 18 -11.731 -40.510 48.763 1.00 0.00 N ATOM 255 CA ALA A 18 -11.605 -41.450 49.859 1.00 0.00 C ATOM 256 C ALA A 18 -10.913 -42.731 49.387 1.00 0.00 C ATOM 257 O ALA A 18 -10.971 -43.077 48.206 1.00 0.00 O ATOM 258 CB ALA A 18 -12.972 -41.758 50.438 1.00 0.00 C ATOM 0 H ALA A 18 -12.576 -40.629 48.204 1.00 0.00 H new ATOM 0 HA ALA A 18 -10.991 -41.002 50.640 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.868 -42.465 51.261 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.427 -40.838 50.805 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.605 -42.192 49.664 1.00 0.00 H new ATOM 264 N GLN A 19 -10.276 -43.432 50.314 1.00 0.00 N ATOM 265 CA GLN A 19 -9.517 -44.644 49.995 1.00 0.00 C ATOM 266 C GLN A 19 -10.423 -45.755 49.446 1.00 0.00 C ATOM 267 O GLN A 19 -10.009 -46.538 48.579 1.00 0.00 O ATOM 268 CB GLN A 19 -8.765 -45.129 51.238 1.00 0.00 C ATOM 269 CG GLN A 19 -7.840 -46.316 50.996 1.00 0.00 C ATOM 270 CD GLN A 19 -6.715 -45.992 50.031 1.00 0.00 C ATOM 271 OE1 GLN A 19 -6.266 -44.854 49.946 1.00 0.00 O ATOM 272 NE2 GLN A 19 -6.240 -46.994 49.321 1.00 0.00 N ATOM 0 H GLN A 19 -10.267 -43.183 51.303 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.799 -44.396 49.213 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.177 -44.302 51.637 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.492 -45.401 52.003 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.416 -46.641 51.946 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.421 -47.151 50.604 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.642 -47.926 49.422 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -5.470 -46.838 48.670 1.00 0.00 H new ATOM 281 N ASN A 20 -11.649 -45.819 49.943 1.00 0.00 N ATOM 282 CA ASN A 20 -12.598 -46.841 49.495 1.00 0.00 C ATOM 283 C ASN A 20 -12.937 -46.658 48.017 1.00 0.00 C ATOM 284 O ASN A 20 -13.075 -47.637 47.276 1.00 0.00 O ATOM 285 CB ASN A 20 -13.889 -46.838 50.348 1.00 0.00 C ATOM 286 CG ASN A 20 -14.732 -45.575 50.204 1.00 0.00 C ATOM 287 OD1 ASN A 20 -14.212 -44.489 49.982 1.00 0.00 O ATOM 288 ND2 ASN A 20 -16.040 -45.721 50.317 1.00 0.00 N ATOM 0 H ASN A 20 -12.013 -45.183 50.652 1.00 0.00 H new ATOM 0 HA ASN A 20 -12.115 -47.810 49.626 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.496 -47.700 50.071 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.618 -46.963 51.396 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.654 -44.912 50.219 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -16.436 -46.642 50.502 1.00 0.00 H new ATOM 295 N ASP A 21 -13.061 -45.406 47.601 1.00 0.00 N ATOM 296 CA ASP A 21 -13.386 -45.075 46.220 1.00 0.00 C ATOM 297 C ASP A 21 -12.247 -45.474 45.281 1.00 0.00 C ATOM 298 O ASP A 21 -12.487 -45.948 44.172 1.00 0.00 O ATOM 299 CB ASP A 21 -13.695 -43.580 46.094 1.00 0.00 C ATOM 300 CG ASP A 21 -14.383 -43.230 44.795 1.00 0.00 C ATOM 301 OD1 ASP A 21 -13.694 -42.995 43.788 1.00 0.00 O ATOM 302 OD2 ASP A 21 -15.632 -43.187 44.774 1.00 0.00 O ATOM 0 H ASP A 21 -12.940 -44.594 48.207 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.272 -45.639 45.929 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.326 -43.273 46.928 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.767 -43.014 46.172 1.00 0.00 H new ATOM 307 N ILE A 22 -11.005 -45.307 45.754 1.00 0.00 N ATOM 308 CA ILE A 22 -9.814 -45.654 44.965 1.00 0.00 C ATOM 309 C ILE A 22 -9.801 -47.142 44.643 1.00 0.00 C ATOM 310 O ILE A 22 -9.527 -47.545 43.509 1.00 0.00 O ATOM 311 CB ILE A 22 -8.505 -45.295 45.716 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.496 -43.815 46.116 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.289 -45.633 44.867 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.300 -43.418 46.959 1.00 0.00 C ATOM 0 H ILE A 22 -10.798 -44.933 46.680 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.862 -45.074 44.044 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.460 -45.892 46.627 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.512 -43.204 45.214 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.409 -43.592 46.668 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.381 -45.374 45.412 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.286 -46.700 44.644 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.327 -45.068 43.936 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.363 -42.358 47.203 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.293 -44.002 47.879 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.383 -43.608 46.402 1.00 0.00 H new ATOM 326 N ASN A 23 -10.121 -47.947 45.643 1.00 0.00 N ATOM 327 CA ASN A 23 -10.163 -49.400 45.492 1.00 0.00 C ATOM 328 C ASN A 23 -11.171 -49.811 44.447 1.00 0.00 C ATOM 329 O ASN A 23 -10.926 -50.700 43.636 1.00 0.00 O ATOM 330 CB ASN A 23 -10.539 -50.051 46.819 1.00 0.00 C ATOM 331 CG ASN A 23 -9.353 -50.282 47.733 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.706 -51.324 47.673 1.00 0.00 O ATOM 333 ND2 ASN A 23 -9.057 -49.318 48.581 1.00 0.00 N ATOM 0 H ASN A 23 -10.358 -47.618 46.579 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.173 -49.730 45.178 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.266 -49.421 47.331 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.028 -51.005 46.622 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.267 -49.423 49.217 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -9.618 -48.466 48.601 1.00 0.00 H new ATOM 340 N TYR A 24 -12.301 -49.170 44.481 1.00 0.00 N ATOM 341 CA TYR A 24 -13.360 -49.448 43.553 1.00 0.00 C ATOM 342 C TYR A 24 -12.994 -48.989 42.124 1.00 0.00 C ATOM 343 O TYR A 24 -13.293 -49.678 41.143 1.00 0.00 O ATOM 344 CB TYR A 24 -14.648 -48.803 44.049 1.00 0.00 C ATOM 345 CG TYR A 24 -15.826 -48.988 43.137 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.519 -50.181 43.129 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.240 -47.979 42.289 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.598 -50.377 42.298 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.323 -48.159 41.452 1.00 0.00 C ATOM 350 CZ TYR A 24 -17.999 -49.363 41.462 1.00 0.00 C ATOM 351 OH TYR A 24 -19.073 -49.554 40.622 1.00 0.00 O ATOM 0 H TYR A 24 -12.517 -48.436 45.156 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.512 -50.526 43.497 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.893 -49.216 45.027 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.475 -47.736 44.188 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.208 -50.978 43.789 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.710 -47.038 42.281 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.125 -51.320 42.303 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -17.639 -47.363 40.794 1.00 0.00 H new ATOM 0 HH TYR A 24 -18.752 -49.680 39.705 1.00 0.00 H new ATOM 361 N LYS A 25 -12.340 -47.830 42.016 1.00 0.00 N ATOM 362 CA LYS A 25 -11.951 -47.281 40.716 1.00 0.00 C ATOM 363 C LYS A 25 -10.951 -48.172 39.967 1.00 0.00 C ATOM 364 O LYS A 25 -11.089 -48.362 38.756 1.00 0.00 O ATOM 365 CB LYS A 25 -11.401 -45.859 40.849 1.00 0.00 C ATOM 366 CG LYS A 25 -12.433 -44.812 41.265 1.00 0.00 C ATOM 367 CD LYS A 25 -13.506 -44.631 40.194 1.00 0.00 C ATOM 368 CE LYS A 25 -14.448 -43.476 40.520 1.00 0.00 C ATOM 369 NZ LYS A 25 -15.220 -43.703 41.763 1.00 0.00 N ATOM 0 H LYS A 25 -12.069 -47.254 42.813 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.863 -47.249 40.120 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.593 -45.863 41.580 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.966 -45.562 39.895 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.900 -45.112 42.203 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.935 -43.860 41.447 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.030 -44.450 39.230 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.081 -45.552 40.097 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -13.870 -42.557 40.619 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.139 -43.330 39.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.819 -42.875 41.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -15.820 -44.545 41.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -14.564 -43.849 42.557 1.00 0.00 H new ATOM 383 N VAL A 26 -9.949 -48.723 40.670 1.00 0.00 N ATOM 384 CA VAL A 26 -8.979 -49.594 40.008 1.00 0.00 C ATOM 385 C VAL A 26 -9.648 -50.850 39.465 1.00 0.00 C ATOM 386 O VAL A 26 -9.264 -51.354 38.414 1.00 0.00 O ATOM 387 CB VAL A 26 -7.763 -49.981 40.900 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.783 -48.826 41.025 1.00 0.00 C ATOM 389 CG2 VAL A 26 -8.202 -50.451 42.272 1.00 0.00 C ATOM 0 H VAL A 26 -9.795 -48.584 41.669 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.582 -49.004 39.182 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.257 -50.811 40.407 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.945 -49.126 41.654 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.415 -48.552 40.036 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.285 -47.970 41.475 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.325 -50.712 42.865 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.753 -49.654 42.771 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.844 -51.326 42.169 1.00 0.00 H new ATOM 399 N LYS A 27 -10.659 -51.336 40.172 1.00 0.00 N ATOM 400 CA LYS A 27 -11.411 -52.497 39.718 1.00 0.00 C ATOM 401 C LYS A 27 -12.126 -52.196 38.408 1.00 0.00 C ATOM 402 O LYS A 27 -12.175 -53.035 37.513 1.00 0.00 O ATOM 403 CB LYS A 27 -12.387 -52.974 40.789 1.00 0.00 C ATOM 404 CG LYS A 27 -11.690 -53.594 41.988 1.00 0.00 C ATOM 405 CD LYS A 27 -12.675 -54.060 43.043 1.00 0.00 C ATOM 406 CE LYS A 27 -11.951 -54.714 44.210 1.00 0.00 C ATOM 407 NZ LYS A 27 -11.192 -55.921 43.783 1.00 0.00 N ATOM 0 H LYS A 27 -10.976 -50.946 41.059 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.706 -53.308 39.536 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -12.993 -52.132 41.123 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -13.069 -53.704 40.353 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -11.086 -54.439 41.658 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -11.007 -52.866 42.426 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.259 -53.212 43.401 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.378 -54.768 42.603 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.267 -53.996 44.662 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.674 -54.992 44.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.397 -56.708 44.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.475 -56.185 42.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.173 -55.715 43.801 1.00 0.00 H new ATOM 421 N HIS A 28 -12.668 -50.989 38.294 1.00 0.00 N ATOM 422 CA HIS A 28 -13.313 -50.556 37.056 1.00 0.00 C ATOM 423 C HIS A 28 -12.300 -50.474 35.939 1.00 0.00 C ATOM 424 O HIS A 28 -12.566 -50.871 34.813 1.00 0.00 O ATOM 425 CB HIS A 28 -13.995 -49.200 37.225 1.00 0.00 C ATOM 426 CG HIS A 28 -15.432 -49.287 37.602 1.00 0.00 C ATOM 427 ND1 HIS A 28 -16.362 -48.335 37.246 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.106 -50.219 38.300 1.00 0.00 C ATOM 429 CE1 HIS A 28 -17.547 -48.682 37.715 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.418 -49.819 38.357 1.00 0.00 N ATOM 0 H HIS A 28 -12.675 -50.293 39.040 1.00 0.00 H new ATOM 0 HA HIS A 28 -14.074 -51.295 36.807 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.464 -48.630 37.988 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.908 -48.642 36.292 1.00 0.00 H new ATOM 0 HD1 HIS A 28 -16.166 -47.493 36.704 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -15.691 -51.116 38.735 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -18.464 -48.126 37.591 1.00 0.00 H new ATOM 438 N ALA A 29 -11.119 -49.967 36.274 1.00 0.00 N ATOM 439 CA ALA A 29 -10.048 -49.819 35.310 1.00 0.00 C ATOM 440 C ALA A 29 -9.633 -51.172 34.753 1.00 0.00 C ATOM 441 O ALA A 29 -9.391 -51.310 33.557 1.00 0.00 O ATOM 442 CB ALA A 29 -8.858 -49.119 35.947 1.00 0.00 C ATOM 0 H ALA A 29 -10.883 -49.651 37.215 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.412 -49.208 34.484 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.061 -49.015 35.211 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.161 -48.132 36.297 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.498 -49.708 36.791 1.00 0.00 H new ATOM 448 N LEU A 30 -9.604 -52.175 35.625 1.00 0.00 N ATOM 449 CA LEU A 30 -9.205 -53.523 35.245 1.00 0.00 C ATOM 450 C LEU A 30 -10.146 -54.085 34.189 1.00 0.00 C ATOM 451 O LEU A 30 -9.711 -54.727 33.232 1.00 0.00 O ATOM 452 CB LEU A 30 -9.198 -54.437 36.471 1.00 0.00 C ATOM 453 CG LEU A 30 -8.195 -54.078 37.569 1.00 0.00 C ATOM 454 CD1 LEU A 30 -8.316 -55.045 38.736 1.00 0.00 C ATOM 455 CD2 LEU A 30 -6.772 -54.063 37.030 1.00 0.00 C ATOM 0 H LEU A 30 -9.855 -52.076 36.609 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.199 -53.476 34.827 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.198 -54.437 36.905 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.995 -55.455 36.139 1.00 0.00 H new ATOM 0 HG LEU A 30 -8.428 -53.074 37.924 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -7.595 -54.775 39.508 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.324 -54.995 39.147 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.115 -56.059 38.391 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.082 -53.805 37.833 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -6.521 -55.049 36.638 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -6.693 -53.325 36.232 1.00 0.00 H new ATOM 467 N GLU A 31 -11.435 -53.817 34.357 1.00 0.00 N ATOM 468 CA GLU A 31 -12.447 -54.294 33.433 1.00 0.00 C ATOM 469 C GLU A 31 -12.170 -53.789 32.016 1.00 0.00 C ATOM 470 O GLU A 31 -12.206 -54.555 31.052 1.00 0.00 O ATOM 471 CB GLU A 31 -13.826 -53.817 33.883 1.00 0.00 C ATOM 472 CG GLU A 31 -14.240 -54.308 35.259 1.00 0.00 C ATOM 473 CD GLU A 31 -15.613 -53.819 35.653 1.00 0.00 C ATOM 474 OE1 GLU A 31 -16.607 -54.300 35.071 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.713 -52.951 36.547 1.00 0.00 O ATOM 0 H GLU A 31 -11.803 -53.267 35.133 1.00 0.00 H new ATOM 0 HA GLU A 31 -12.419 -55.384 33.427 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.839 -52.727 33.880 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.567 -54.147 33.155 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -14.227 -55.398 35.272 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -13.511 -53.972 35.997 1.00 0.00 H new ATOM 482 N PHE A 32 -11.883 -52.497 31.903 1.00 0.00 N ATOM 483 CA PHE A 32 -11.607 -51.883 30.611 1.00 0.00 C ATOM 484 C PHE A 32 -10.257 -52.319 30.049 1.00 0.00 C ATOM 485 O PHE A 32 -10.085 -52.423 28.833 1.00 0.00 O ATOM 486 CB PHE A 32 -11.711 -50.360 30.683 1.00 0.00 C ATOM 487 CG PHE A 32 -13.088 -49.881 31.039 1.00 0.00 C ATOM 488 CD1 PHE A 32 -14.101 -49.879 30.096 1.00 0.00 C ATOM 489 CD2 PHE A 32 -13.375 -49.453 32.319 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.370 -49.451 30.425 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.644 -49.027 32.656 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.643 -49.027 31.707 1.00 0.00 C ATOM 0 H PHE A 32 -11.836 -51.854 32.693 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.373 -52.236 29.920 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.001 -49.988 31.421 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.422 -49.936 29.721 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.895 -50.217 29.091 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.596 -49.451 33.067 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -16.150 -49.448 29.678 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.854 -48.694 33.662 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.637 -48.696 31.967 1.00 0.00 H new ATOM 502 N LEU A 33 -9.301 -52.569 30.941 1.00 0.00 N ATOM 503 CA LEU A 33 -7.965 -53.010 30.536 1.00 0.00 C ATOM 504 C LEU A 33 -8.059 -54.352 29.819 1.00 0.00 C ATOM 505 O LEU A 33 -7.439 -54.569 28.784 1.00 0.00 O ATOM 506 CB LEU A 33 -7.058 -53.133 31.769 1.00 0.00 C ATOM 507 CG LEU A 33 -6.709 -51.825 32.485 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.858 -52.098 33.710 1.00 0.00 C ATOM 509 CD2 LEU A 33 -6.002 -50.861 31.548 1.00 0.00 C ATOM 0 H LEU A 33 -9.425 -52.474 31.949 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.537 -52.274 29.856 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.542 -53.797 32.485 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.129 -53.615 31.464 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.640 -51.359 32.807 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.620 -51.156 34.205 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.406 -52.741 34.398 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.935 -52.593 33.409 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.766 -49.941 32.083 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.081 -51.316 31.185 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.651 -50.633 30.703 1.00 0.00 H new ATOM 521 N GLU A 34 -8.863 -55.227 30.375 1.00 0.00 N ATOM 522 CA GLU A 34 -9.135 -56.536 29.797 1.00 0.00 C ATOM 523 C GLU A 34 -9.813 -56.402 28.433 1.00 0.00 C ATOM 524 O GLU A 34 -9.634 -57.244 27.552 1.00 0.00 O ATOM 525 CB GLU A 34 -10.016 -57.337 30.749 1.00 0.00 C ATOM 526 CG GLU A 34 -9.332 -57.680 32.054 1.00 0.00 C ATOM 527 CD GLU A 34 -8.136 -58.580 31.859 1.00 0.00 C ATOM 528 OE1 GLU A 34 -8.304 -59.689 31.298 1.00 0.00 O ATOM 529 OE2 GLU A 34 -7.019 -58.183 32.261 1.00 0.00 O ATOM 0 H GLU A 34 -9.356 -55.055 31.251 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.189 -57.058 29.651 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.921 -56.768 30.960 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.326 -58.259 30.257 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -9.015 -56.761 32.547 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -10.046 -58.168 32.718 1.00 0.00 H new ATOM 536 N GLN A 35 -10.587 -55.335 28.269 1.00 0.00 N ATOM 537 CA GLN A 35 -11.267 -55.061 27.012 1.00 0.00 C ATOM 538 C GLN A 35 -10.276 -54.575 25.956 1.00 0.00 C ATOM 539 O GLN A 35 -10.614 -54.460 24.779 1.00 0.00 O ATOM 540 CB GLN A 35 -12.347 -54.003 27.219 1.00 0.00 C ATOM 541 CG GLN A 35 -13.474 -54.440 28.133 1.00 0.00 C ATOM 542 CD GLN A 35 -14.510 -53.351 28.341 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.688 -52.469 27.496 1.00 0.00 O ATOM 544 NE2 GLN A 35 -15.199 -53.403 29.462 1.00 0.00 N ATOM 0 H GLN A 35 -10.759 -54.642 28.998 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.726 -55.987 26.665 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.887 -53.105 27.631 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.764 -53.731 26.250 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.958 -55.321 27.712 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -13.061 -54.733 29.098 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -15.022 -54.148 30.135 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.910 -52.698 29.657 1.00 0.00 H new ATOM 553 N GLY A 36 -9.057 -54.286 26.385 1.00 0.00 N ATOM 554 CA GLY A 36 -8.045 -53.804 25.479 1.00 0.00 C ATOM 555 C GLY A 36 -8.024 -52.298 25.399 1.00 0.00 C ATOM 556 O GLY A 36 -7.310 -51.723 24.578 1.00 0.00 O ATOM 0 H GLY A 36 -8.752 -54.379 27.354 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.068 -54.163 25.804 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.222 -54.217 24.486 1.00 0.00 H new ATOM 560 N LYS A 37 -8.797 -51.649 26.253 1.00 0.00 N ATOM 561 CA LYS A 37 -8.847 -50.204 26.254 1.00 0.00 C ATOM 562 C LYS A 37 -7.818 -49.642 27.216 1.00 0.00 C ATOM 563 O LYS A 37 -7.099 -50.387 27.890 1.00 0.00 O ATOM 564 CB LYS A 37 -10.237 -49.681 26.630 1.00 0.00 C ATOM 565 CG LYS A 37 -11.373 -50.218 25.777 1.00 0.00 C ATOM 566 CD LYS A 37 -12.669 -49.481 26.080 1.00 0.00 C ATOM 567 CE LYS A 37 -13.853 -50.105 25.350 1.00 0.00 C ATOM 568 NZ LYS A 37 -15.125 -49.381 25.600 1.00 0.00 N ATOM 0 H LYS A 37 -9.393 -52.099 26.948 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.623 -49.872 25.240 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.434 -49.932 27.672 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.232 -48.593 26.560 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.125 -50.108 24.721 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.503 -51.284 25.965 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.854 -49.496 27.154 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.571 -48.435 25.788 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.650 -50.116 24.279 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.962 -51.143 25.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -15.845 -49.700 24.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.451 -49.576 26.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.971 -48.359 25.486 1.00 0.00 H new ATOM 582 N HIS A 38 -7.744 -48.336 27.277 1.00 0.00 N ATOM 583 CA HIS A 38 -6.807 -47.665 28.156 1.00 0.00 C ATOM 584 C HIS A 38 -7.559 -46.843 29.180 1.00 0.00 C ATOM 585 O HIS A 38 -8.672 -46.384 28.917 1.00 0.00 O ATOM 586 CB HIS A 38 -5.857 -46.750 27.358 1.00 0.00 C ATOM 587 CG HIS A 38 -4.882 -47.467 26.466 1.00 0.00 C ATOM 588 ND1 HIS A 38 -3.750 -46.865 25.954 1.00 0.00 N ATOM 589 CD2 HIS A 38 -4.874 -48.733 25.981 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.094 -47.727 25.199 1.00 0.00 C ATOM 591 NE2 HIS A 38 -3.757 -48.864 25.199 1.00 0.00 N ATOM 0 H HIS A 38 -8.326 -47.707 26.724 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.212 -48.426 28.661 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.456 -46.075 26.747 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.297 -46.133 28.060 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -5.612 -49.497 26.175 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.172 -47.532 24.672 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -3.483 -49.708 24.697 1.00 0.00 H new ATOM 599 N VAL A 39 -6.966 -46.674 30.344 1.00 0.00 N ATOM 600 CA VAL A 39 -7.550 -45.852 31.381 1.00 0.00 C ATOM 601 C VAL A 39 -6.641 -44.682 31.689 1.00 0.00 C ATOM 602 O VAL A 39 -5.441 -44.851 31.917 1.00 0.00 O ATOM 603 CB VAL A 39 -7.846 -46.655 32.682 1.00 0.00 C ATOM 604 CG1 VAL A 39 -8.103 -45.715 33.857 1.00 0.00 C ATOM 605 CG2 VAL A 39 -9.060 -47.538 32.482 1.00 0.00 C ATOM 0 H VAL A 39 -6.073 -47.099 30.596 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.505 -45.487 31.003 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.973 -47.269 32.903 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.307 -46.301 34.753 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.224 -45.092 34.023 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.961 -45.081 33.635 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -9.259 -48.096 33.397 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.924 -46.919 32.239 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.872 -48.236 31.666 1.00 0.00 H new ATOM 615 N ARG A 40 -7.208 -43.500 31.670 1.00 0.00 N ATOM 616 CA ARG A 40 -6.466 -42.308 31.964 1.00 0.00 C ATOM 617 C ARG A 40 -6.912 -41.770 33.304 1.00 0.00 C ATOM 618 O ARG A 40 -8.062 -41.382 33.469 1.00 0.00 O ATOM 619 CB ARG A 40 -6.717 -41.260 30.876 1.00 0.00 C ATOM 620 CG ARG A 40 -5.871 -40.008 31.000 1.00 0.00 C ATOM 621 CD ARG A 40 -6.239 -38.992 29.932 1.00 0.00 C ATOM 622 NE ARG A 40 -5.301 -37.869 29.901 1.00 0.00 N ATOM 623 CZ ARG A 40 -5.630 -36.614 29.576 1.00 0.00 C ATOM 624 NH1 ARG A 40 -6.894 -36.302 29.256 1.00 0.00 N ATOM 625 NH2 ARG A 40 -4.692 -35.671 29.571 1.00 0.00 N ATOM 0 H ARG A 40 -8.192 -43.342 31.451 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.401 -42.537 31.995 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.531 -41.714 29.903 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.769 -40.976 30.899 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.009 -39.568 31.988 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -4.816 -40.268 30.911 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.254 -39.479 28.957 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -7.246 -38.619 30.118 1.00 0.00 H new ATOM 0 HE ARG A 40 -4.328 -38.057 30.144 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -7.614 -37.024 29.259 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.136 -35.342 29.009 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -3.730 -35.907 29.814 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -4.935 -34.712 29.324 1.00 0.00 H new ATOM 639 N PHE A 41 -6.014 -41.753 34.256 1.00 0.00 N ATOM 640 CA PHE A 41 -6.331 -41.244 35.564 1.00 0.00 C ATOM 641 C PHE A 41 -6.031 -39.768 35.614 1.00 0.00 C ATOM 642 O PHE A 41 -4.881 -39.357 35.492 1.00 0.00 O ATOM 643 CB PHE A 41 -5.538 -41.978 36.649 1.00 0.00 C ATOM 644 CG PHE A 41 -5.993 -43.389 36.896 1.00 0.00 C ATOM 645 CD1 PHE A 41 -7.092 -43.643 37.707 1.00 0.00 C ATOM 646 CD2 PHE A 41 -5.327 -44.460 36.326 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.512 -44.936 37.942 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.743 -45.757 36.558 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.837 -45.995 37.366 1.00 0.00 C ATOM 0 H PHE A 41 -5.056 -42.087 34.149 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.392 -41.410 35.753 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.485 -41.992 36.367 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.612 -41.416 37.580 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.624 -42.819 38.159 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.471 -44.280 35.692 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -8.367 -45.120 38.575 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -5.213 -46.583 36.108 1.00 0.00 H new ATOM 0 HZ PHE A 41 -7.165 -47.008 37.548 1.00 0.00 H new ATOM 659 N ARG A 42 -7.067 -38.982 35.761 1.00 0.00 N ATOM 660 CA ARG A 42 -6.940 -37.540 35.821 1.00 0.00 C ATOM 661 C ARG A 42 -7.409 -37.063 37.169 1.00 0.00 C ATOM 662 O ARG A 42 -8.448 -37.492 37.642 1.00 0.00 O ATOM 663 CB ARG A 42 -7.790 -36.898 34.724 1.00 0.00 C ATOM 664 CG ARG A 42 -7.329 -37.220 33.309 1.00 0.00 C ATOM 665 CD ARG A 42 -8.309 -36.690 32.274 1.00 0.00 C ATOM 666 NE ARG A 42 -8.458 -35.234 32.339 1.00 0.00 N ATOM 667 CZ ARG A 42 -9.622 -34.591 32.202 1.00 0.00 C ATOM 668 NH1 ARG A 42 -10.748 -35.273 32.035 1.00 0.00 N ATOM 669 NH2 ARG A 42 -9.658 -33.270 32.236 1.00 0.00 N ATOM 0 H ARG A 42 -8.026 -39.320 35.843 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.898 -37.258 35.672 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.823 -37.226 34.841 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.782 -35.816 34.860 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.345 -36.785 33.137 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.225 -38.299 33.195 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.970 -36.973 31.278 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.281 -37.159 32.425 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.620 -34.675 32.499 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -10.728 -36.293 32.011 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.634 -34.778 31.931 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -8.797 -32.740 32.367 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -10.547 -32.781 32.131 1.00 0.00 H new ATOM 683 N VAL A 43 -6.667 -36.184 37.787 1.00 0.00 N ATOM 684 CA VAL A 43 -7.054 -35.684 39.088 1.00 0.00 C ATOM 685 C VAL A 43 -7.282 -34.185 39.061 1.00 0.00 C ATOM 686 O VAL A 43 -6.462 -33.423 38.543 1.00 0.00 O ATOM 687 CB VAL A 43 -6.016 -36.043 40.189 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.618 -35.618 39.795 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.403 -35.415 41.521 1.00 0.00 C ATOM 0 H VAL A 43 -5.797 -35.799 37.419 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.993 -36.177 39.338 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.019 -37.127 40.299 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.919 -35.885 40.588 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.330 -36.123 38.873 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.596 -34.539 39.640 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.663 -35.679 42.276 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.442 -34.331 41.415 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.382 -35.785 41.827 1.00 0.00 H new ATOM 699 N PHE A 44 -8.414 -33.777 39.599 1.00 0.00 N ATOM 700 CA PHE A 44 -8.749 -32.379 39.706 1.00 0.00 C ATOM 701 C PHE A 44 -8.340 -31.867 41.071 1.00 0.00 C ATOM 702 O PHE A 44 -8.729 -32.434 42.102 1.00 0.00 O ATOM 703 CB PHE A 44 -10.251 -32.165 39.486 1.00 0.00 C ATOM 704 CG PHE A 44 -10.693 -30.729 39.619 1.00 0.00 C ATOM 705 CD1 PHE A 44 -10.512 -29.835 38.578 1.00 0.00 C ATOM 706 CD2 PHE A 44 -11.292 -30.279 40.788 1.00 0.00 C ATOM 707 CE1 PHE A 44 -10.917 -28.521 38.697 1.00 0.00 C ATOM 708 CE2 PHE A 44 -11.699 -28.965 40.912 1.00 0.00 C ATOM 709 CZ PHE A 44 -11.510 -28.085 39.866 1.00 0.00 C ATOM 0 H PHE A 44 -9.124 -34.407 39.972 1.00 0.00 H new ATOM 0 HA PHE A 44 -8.212 -31.825 38.936 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.517 -32.526 38.492 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.803 -32.772 40.204 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -10.048 -30.170 37.662 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.441 -30.964 41.609 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -10.770 -27.834 37.877 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -12.164 -28.627 41.826 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.825 -27.056 39.961 1.00 0.00 H new ATOM 719 N LEU A 45 -7.552 -30.823 41.083 1.00 0.00 N ATOM 720 CA LEU A 45 -7.094 -30.249 42.320 1.00 0.00 C ATOM 721 C LEU A 45 -8.063 -29.158 42.749 1.00 0.00 C ATOM 722 O LEU A 45 -8.398 -28.282 41.960 1.00 0.00 O ATOM 723 CB LEU A 45 -5.684 -29.677 42.138 1.00 0.00 C ATOM 724 CG LEU A 45 -4.646 -30.634 41.532 1.00 0.00 C ATOM 725 CD1 LEU A 45 -3.300 -29.955 41.420 1.00 0.00 C ATOM 726 CD2 LEU A 45 -4.528 -31.900 42.351 1.00 0.00 C ATOM 0 H LEU A 45 -7.213 -30.351 40.245 1.00 0.00 H new ATOM 0 HA LEU A 45 -7.055 -31.016 43.093 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.750 -28.794 41.503 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -5.319 -29.344 43.110 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.985 -30.906 40.533 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.578 -30.648 40.989 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.387 -29.077 40.780 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.963 -29.650 42.411 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.786 -32.558 41.898 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -4.220 -31.649 43.366 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.493 -32.406 42.380 1.00 0.00 H new ATOM 738 N LYS A 46 -8.515 -29.225 43.992 1.00 0.00 N ATOM 739 CA LYS A 46 -9.494 -28.270 44.509 1.00 0.00 C ATOM 740 C LYS A 46 -8.949 -26.831 44.509 1.00 0.00 C ATOM 741 O LYS A 46 -9.622 -25.910 44.040 1.00 0.00 O ATOM 742 CB LYS A 46 -9.952 -28.686 45.913 1.00 0.00 C ATOM 743 CG LYS A 46 -10.983 -27.755 46.539 1.00 0.00 C ATOM 744 CD LYS A 46 -11.394 -28.229 47.922 1.00 0.00 C ATOM 745 CE LYS A 46 -12.402 -27.285 48.559 1.00 0.00 C ATOM 746 NZ LYS A 46 -13.671 -27.213 47.789 1.00 0.00 N ATOM 0 H LYS A 46 -8.221 -29.932 44.666 1.00 0.00 H new ATOM 0 HA LYS A 46 -10.356 -28.283 43.842 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.371 -29.691 45.863 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.081 -28.736 46.566 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -10.572 -26.748 46.606 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.862 -27.699 45.896 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -11.824 -29.228 47.852 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.512 -28.305 48.559 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -12.615 -27.616 49.576 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -11.967 -26.288 48.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -14.389 -26.712 48.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -13.508 -26.702 46.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -14.005 -28.175 47.580 1.00 0.00 H new ATOM 760 N GLY A 47 -7.741 -26.640 45.023 1.00 0.00 N ATOM 761 CA GLY A 47 -7.156 -25.317 45.020 1.00 0.00 C ATOM 762 C GLY A 47 -5.859 -25.231 45.806 1.00 0.00 C ATOM 763 O GLY A 47 -4.888 -24.646 45.338 1.00 0.00 O ATOM 0 H GLY A 47 -7.162 -27.370 45.438 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.969 -25.012 43.990 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.873 -24.610 45.437 1.00 0.00 H new ATOM 767 N ARG A 48 -5.832 -25.816 46.995 1.00 0.00 N ATOM 768 CA ARG A 48 -4.640 -25.745 47.846 1.00 0.00 C ATOM 769 C ARG A 48 -3.710 -26.908 47.593 1.00 0.00 C ATOM 770 O ARG A 48 -2.528 -26.857 47.932 1.00 0.00 O ATOM 771 CB ARG A 48 -5.021 -25.678 49.317 1.00 0.00 C ATOM 772 CG ARG A 48 -5.734 -24.399 49.711 1.00 0.00 C ATOM 773 CD ARG A 48 -6.090 -24.401 51.183 1.00 0.00 C ATOM 774 NE ARG A 48 -6.770 -23.173 51.585 1.00 0.00 N ATOM 775 CZ ARG A 48 -6.927 -22.788 52.851 1.00 0.00 C ATOM 776 NH1 ARG A 48 -6.433 -23.529 53.835 1.00 0.00 N ATOM 777 NH2 ARG A 48 -7.566 -21.658 53.131 1.00 0.00 N ATOM 0 H ARG A 48 -6.610 -26.341 47.394 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.110 -24.829 47.586 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.662 -26.527 49.555 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.119 -25.780 49.921 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.098 -23.542 49.489 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.640 -24.286 49.115 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -6.730 -25.257 51.400 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.183 -24.523 51.775 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.148 -22.573 50.852 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.934 -24.392 53.622 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.553 -23.235 54.804 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.938 -21.082 52.376 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -7.685 -21.366 54.101 1.00 0.00 H new ATOM 791 N GLU A 49 -4.242 -27.958 47.001 1.00 0.00 N ATOM 792 CA GLU A 49 -3.441 -29.094 46.610 1.00 0.00 C ATOM 793 C GLU A 49 -2.720 -28.785 45.312 1.00 0.00 C ATOM 794 O GLU A 49 -2.029 -29.626 44.744 1.00 0.00 O ATOM 795 CB GLU A 49 -4.282 -30.362 46.488 1.00 0.00 C ATOM 796 CG GLU A 49 -5.606 -30.174 45.787 1.00 0.00 C ATOM 797 CD GLU A 49 -6.680 -29.644 46.699 1.00 0.00 C ATOM 798 OE1 GLU A 49 -7.355 -30.444 47.357 1.00 0.00 O ATOM 799 OE2 GLU A 49 -6.849 -28.416 46.761 1.00 0.00 O ATOM 0 H GLU A 49 -5.234 -28.046 46.780 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.702 -29.281 47.389 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.705 -31.114 45.950 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.468 -30.756 47.487 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.475 -29.487 44.951 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.929 -31.127 45.369 1.00 0.00 H new ATOM 806 N MET A 50 -2.914 -27.557 44.838 1.00 0.00 N ATOM 807 CA MET A 50 -2.234 -27.066 43.677 1.00 0.00 C ATOM 808 C MET A 50 -0.843 -26.572 44.076 1.00 0.00 C ATOM 809 O MET A 50 -0.163 -27.229 44.864 1.00 0.00 O ATOM 810 CB MET A 50 -3.040 -25.944 43.006 1.00 0.00 C ATOM 811 CG MET A 50 -4.339 -26.404 42.372 1.00 0.00 C ATOM 812 SD MET A 50 -5.235 -25.050 41.587 1.00 0.00 S ATOM 813 CE MET A 50 -6.534 -25.950 40.738 1.00 0.00 C ATOM 0 H MET A 50 -3.553 -26.884 45.261 1.00 0.00 H new ATOM 0 HA MET A 50 -2.132 -27.875 42.954 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.263 -25.178 43.749 1.00 0.00 H new ATOM 0 HB3 MET A 50 -2.421 -25.475 42.241 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.126 -27.174 41.630 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.971 -26.861 43.134 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.873 -25.374 39.877 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.150 -26.913 40.402 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.370 -26.111 41.419 1.00 0.00 H new ATOM 823 N ALA A 51 -0.461 -25.380 43.588 1.00 0.00 N ATOM 824 CA ALA A 51 0.902 -24.828 43.764 1.00 0.00 C ATOM 825 C ALA A 51 1.962 -25.741 43.118 1.00 0.00 C ATOM 826 O ALA A 51 2.672 -25.337 42.191 1.00 0.00 O ATOM 827 CB ALA A 51 1.217 -24.585 45.242 1.00 0.00 C ATOM 0 H ALA A 51 -1.084 -24.769 43.060 1.00 0.00 H new ATOM 0 HA ALA A 51 0.934 -23.865 43.254 1.00 0.00 H new ATOM 0 HB1 ALA A 51 2.224 -24.180 45.337 1.00 0.00 H new ATOM 0 HB2 ALA A 51 0.500 -23.876 45.655 1.00 0.00 H new ATOM 0 HB3 ALA A 51 1.151 -25.526 45.788 1.00 0.00 H new ATOM 833 N THR A 52 2.037 -26.960 43.604 1.00 0.00 N ATOM 834 CA THR A 52 2.938 -27.961 43.103 1.00 0.00 C ATOM 835 C THR A 52 2.135 -29.186 42.641 1.00 0.00 C ATOM 836 O THR A 52 1.231 -29.656 43.334 1.00 0.00 O ATOM 837 CB THR A 52 3.989 -28.355 44.183 1.00 0.00 C ATOM 838 OG1 THR A 52 4.829 -29.418 43.705 1.00 0.00 O ATOM 839 CG2 THR A 52 3.314 -28.767 45.489 1.00 0.00 C ATOM 0 H THR A 52 1.457 -27.286 44.377 1.00 0.00 H new ATOM 0 HA THR A 52 3.484 -27.554 42.252 1.00 0.00 H new ATOM 0 HB THR A 52 4.606 -27.478 44.381 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.329 -29.803 44.455 1.00 0.00 H new ATOM 0 HG21 THR A 52 4.074 -29.036 46.222 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.721 -27.936 45.870 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.665 -29.624 45.308 1.00 0.00 H new ATOM 847 N PRO A 53 2.459 -29.702 41.458 1.00 0.00 N ATOM 848 CA PRO A 53 1.745 -30.830 40.844 1.00 0.00 C ATOM 849 C PRO A 53 2.013 -32.170 41.534 1.00 0.00 C ATOM 850 O PRO A 53 1.349 -33.169 41.239 1.00 0.00 O ATOM 851 CB PRO A 53 2.279 -30.846 39.412 1.00 0.00 C ATOM 852 CG PRO A 53 3.625 -30.212 39.498 1.00 0.00 C ATOM 853 CD PRO A 53 3.560 -29.219 40.614 1.00 0.00 C ATOM 0 HA PRO A 53 0.665 -30.704 40.917 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.345 -31.863 39.026 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.624 -30.292 38.740 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.394 -30.960 39.690 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.883 -29.723 38.559 1.00 0.00 H new ATOM 0 HD2 PRO A 53 4.498 -29.179 41.167 1.00 0.00 H new ATOM 0 HD3 PRO A 53 3.366 -28.213 40.242 1.00 0.00 H new ATOM 861 N GLU A 54 2.969 -32.184 42.453 1.00 0.00 N ATOM 862 CA GLU A 54 3.348 -33.408 43.159 1.00 0.00 C ATOM 863 C GLU A 54 2.175 -34.004 43.935 1.00 0.00 C ATOM 864 O GLU A 54 2.098 -35.215 44.107 1.00 0.00 O ATOM 865 CB GLU A 54 4.533 -33.150 44.088 1.00 0.00 C ATOM 866 CG GLU A 54 4.236 -32.176 45.204 1.00 0.00 C ATOM 867 CD GLU A 54 5.458 -31.823 45.999 1.00 0.00 C ATOM 868 OE1 GLU A 54 6.176 -30.883 45.596 1.00 0.00 O ATOM 869 OE2 GLU A 54 5.708 -32.466 47.034 1.00 0.00 O ATOM 0 H GLU A 54 3.501 -31.359 42.730 1.00 0.00 H new ATOM 0 HA GLU A 54 3.646 -34.138 42.407 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.855 -34.097 44.522 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.367 -32.769 43.499 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.805 -31.267 44.784 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.487 -32.607 45.868 1.00 0.00 H new ATOM 876 N ALA A 55 1.258 -33.150 44.396 1.00 0.00 N ATOM 877 CA ALA A 55 0.085 -33.622 45.124 1.00 0.00 C ATOM 878 C ALA A 55 -0.773 -34.515 44.232 1.00 0.00 C ATOM 879 O ALA A 55 -1.290 -35.543 44.676 1.00 0.00 O ATOM 880 CB ALA A 55 -0.728 -32.444 45.640 1.00 0.00 C ATOM 0 H ALA A 55 1.307 -32.138 44.278 1.00 0.00 H new ATOM 0 HA ALA A 55 0.421 -34.210 45.978 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -1.600 -32.813 46.181 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.113 -31.843 46.310 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.055 -31.831 44.800 1.00 0.00 H new ATOM 886 N GLY A 56 -0.904 -34.120 42.972 1.00 0.00 N ATOM 887 CA GLY A 56 -1.646 -34.912 42.015 1.00 0.00 C ATOM 888 C GLY A 56 -0.938 -36.205 41.706 1.00 0.00 C ATOM 889 O GLY A 56 -1.562 -37.258 41.587 1.00 0.00 O ATOM 0 H GLY A 56 -0.506 -33.259 42.596 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.640 -35.125 42.409 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.783 -34.342 41.096 1.00 0.00 H new ATOM 893 N VAL A 57 0.375 -36.122 41.593 1.00 0.00 N ATOM 894 CA VAL A 57 1.203 -37.278 41.295 1.00 0.00 C ATOM 895 C VAL A 57 1.141 -38.289 42.441 1.00 0.00 C ATOM 896 O VAL A 57 1.020 -39.491 42.213 1.00 0.00 O ATOM 897 CB VAL A 57 2.676 -36.869 41.035 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.523 -38.086 40.704 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.755 -35.846 39.910 1.00 0.00 C ATOM 0 H VAL A 57 0.898 -35.253 41.705 1.00 0.00 H new ATOM 0 HA VAL A 57 0.811 -37.738 40.387 1.00 0.00 H new ATOM 0 HB VAL A 57 3.069 -36.416 41.945 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.552 -37.775 40.525 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.495 -38.787 41.539 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.130 -38.571 39.810 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.796 -35.570 39.741 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.341 -36.276 38.998 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.185 -34.959 40.184 1.00 0.00 H new ATOM 909 N ALA A 58 1.198 -37.783 43.674 1.00 0.00 N ATOM 910 CA ALA A 58 1.154 -38.623 44.872 1.00 0.00 C ATOM 911 C ALA A 58 -0.106 -39.489 44.897 1.00 0.00 C ATOM 912 O ALA A 58 -0.055 -40.671 45.272 1.00 0.00 O ATOM 913 CB ALA A 58 1.224 -37.759 46.124 1.00 0.00 C ATOM 0 H ALA A 58 1.276 -36.785 43.870 1.00 0.00 H new ATOM 0 HA ALA A 58 2.018 -39.287 44.849 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.190 -38.396 47.008 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.154 -37.190 46.122 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.378 -37.072 46.140 1.00 0.00 H new ATOM 919 N LEU A 59 -1.233 -38.902 44.502 1.00 0.00 N ATOM 920 CA LEU A 59 -2.493 -39.638 44.420 1.00 0.00 C ATOM 921 C LEU A 59 -2.375 -40.760 43.397 1.00 0.00 C ATOM 922 O LEU A 59 -2.750 -41.903 43.657 1.00 0.00 O ATOM 923 CB LEU A 59 -3.630 -38.689 44.006 1.00 0.00 C ATOM 924 CG LEU A 59 -5.007 -39.335 43.759 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.642 -39.817 45.048 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.929 -38.374 43.048 1.00 0.00 C ATOM 0 H LEU A 59 -1.300 -37.920 44.234 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.715 -40.063 45.399 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.742 -37.932 44.782 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.328 -38.171 43.096 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.847 -40.205 43.122 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.611 -40.266 44.831 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.996 -40.559 45.517 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.777 -38.973 45.725 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.895 -38.851 42.884 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.064 -37.481 43.658 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.494 -38.095 42.088 1.00 0.00 H new ATOM 938 N LEU A 60 -1.815 -40.424 42.247 1.00 0.00 N ATOM 939 CA LEU A 60 -1.667 -41.361 41.155 1.00 0.00 C ATOM 940 C LEU A 60 -0.729 -42.507 41.513 1.00 0.00 C ATOM 941 O LEU A 60 -1.003 -43.648 41.185 1.00 0.00 O ATOM 942 CB LEU A 60 -1.190 -40.643 39.901 1.00 0.00 C ATOM 943 CG LEU A 60 -2.166 -39.616 39.319 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.577 -38.954 38.095 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.500 -40.263 38.985 1.00 0.00 C ATOM 0 H LEU A 60 -1.451 -39.492 42.048 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.647 -41.796 40.959 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.251 -40.138 40.127 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.975 -41.389 39.136 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.340 -38.850 40.075 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.286 -38.228 37.697 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.651 -38.446 38.366 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.368 -39.710 37.338 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.175 -39.513 38.573 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.347 -41.055 38.252 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.936 -40.686 39.890 1.00 0.00 H new ATOM 957 N GLU A 61 0.366 -42.195 42.194 1.00 0.00 N ATOM 958 CA GLU A 61 1.341 -43.208 42.614 1.00 0.00 C ATOM 959 C GLU A 61 0.696 -44.239 43.531 1.00 0.00 C ATOM 960 O GLU A 61 0.972 -45.441 43.441 1.00 0.00 O ATOM 961 CB GLU A 61 2.506 -42.537 43.328 1.00 0.00 C ATOM 962 CG GLU A 61 3.330 -41.653 42.422 1.00 0.00 C ATOM 963 CD GLU A 61 4.052 -42.441 41.363 1.00 0.00 C ATOM 964 OE1 GLU A 61 5.009 -43.174 41.710 1.00 0.00 O ATOM 965 OE2 GLU A 61 3.672 -42.342 40.188 1.00 0.00 O ATOM 0 H GLU A 61 0.607 -41.244 42.471 1.00 0.00 H new ATOM 0 HA GLU A 61 1.706 -43.722 41.725 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.122 -41.940 44.155 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.149 -43.304 43.760 1.00 0.00 H new ATOM 0 HG2 GLU A 61 2.681 -40.918 41.946 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.055 -41.100 43.019 1.00 0.00 H new ATOM 972 N LYS A 62 -0.169 -43.764 44.405 1.00 0.00 N ATOM 973 CA LYS A 62 -0.872 -44.620 45.338 1.00 0.00 C ATOM 974 C LYS A 62 -1.782 -45.593 44.578 1.00 0.00 C ATOM 975 O LYS A 62 -1.889 -46.771 44.926 1.00 0.00 O ATOM 976 CB LYS A 62 -1.683 -43.754 46.301 1.00 0.00 C ATOM 977 CG LYS A 62 -2.144 -44.465 47.553 1.00 0.00 C ATOM 978 CD LYS A 62 -2.832 -43.502 48.507 1.00 0.00 C ATOM 979 CE LYS A 62 -3.297 -44.202 49.771 1.00 0.00 C ATOM 980 NZ LYS A 62 -2.170 -44.782 50.539 1.00 0.00 N ATOM 0 H LYS A 62 -0.404 -42.775 44.488 1.00 0.00 H new ATOM 0 HA LYS A 62 -0.155 -45.208 45.910 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.080 -42.893 46.589 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.557 -43.370 45.775 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.829 -45.270 47.287 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.290 -44.925 48.049 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.146 -42.696 48.768 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.687 -43.044 48.009 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.835 -43.493 50.400 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.000 -44.993 49.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -2.503 -45.068 51.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -1.799 -45.613 50.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -1.416 -44.073 50.638 1.00 0.00 H new ATOM 994 N ILE A 63 -2.438 -45.076 43.552 1.00 0.00 N ATOM 995 CA ILE A 63 -3.311 -45.868 42.688 1.00 0.00 C ATOM 996 C ILE A 63 -2.497 -46.838 41.822 1.00 0.00 C ATOM 997 O ILE A 63 -2.817 -48.023 41.713 1.00 0.00 O ATOM 998 CB ILE A 63 -4.110 -44.936 41.753 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.887 -43.915 42.570 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -5.047 -45.739 40.859 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.515 -42.823 41.739 1.00 0.00 C ATOM 0 H ILE A 63 -2.383 -44.092 43.290 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.986 -46.436 43.329 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.408 -44.405 41.110 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.669 -44.429 43.129 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.217 -43.463 43.302 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.600 -45.061 40.209 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -4.465 -46.431 40.251 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.748 -46.300 41.477 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.052 -42.133 42.390 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.737 -42.282 41.201 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.211 -43.264 41.025 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.436 -46.307 41.234 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.581 -47.040 40.310 1.00 0.00 C ATOM 1015 C TRP A 64 0.007 -48.289 40.937 1.00 0.00 C ATOM 1016 O TRP A 64 0.036 -49.339 40.314 1.00 0.00 O ATOM 1017 CB TRP A 64 0.542 -46.129 39.781 1.00 0.00 C ATOM 1018 CG TRP A 64 1.544 -46.842 38.928 1.00 0.00 C ATOM 1019 CD1 TRP A 64 2.893 -46.889 39.110 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.269 -47.634 37.767 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.470 -47.650 38.127 1.00 0.00 N ATOM 1022 CE2 TRP A 64 2.497 -48.122 37.299 1.00 0.00 C ATOM 1023 CE3 TRP A 64 0.101 -47.977 37.078 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 2.595 -48.931 36.180 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 0.203 -48.783 35.968 1.00 0.00 C ATOM 1026 CH2 TRP A 64 1.441 -49.251 35.531 1.00 0.00 C ATOM 0 H TRP A 64 -1.140 -45.343 41.386 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.208 -47.360 39.478 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.098 -45.318 39.204 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.057 -45.673 40.627 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.428 -46.399 39.910 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.469 -47.834 38.031 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -0.861 -47.616 37.411 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 3.551 -49.295 35.834 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.690 -49.058 35.427 1.00 0.00 H new ATOM 0 HH2 TRP A 64 1.486 -49.883 34.656 1.00 0.00 H new ATOM 1037 N THR A 65 0.431 -48.190 42.173 1.00 0.00 N ATOM 1038 CA THR A 65 1.043 -49.323 42.847 1.00 0.00 C ATOM 1039 C THR A 65 0.066 -50.500 42.999 1.00 0.00 C ATOM 1040 O THR A 65 0.480 -51.652 43.107 1.00 0.00 O ATOM 1041 CB THR A 65 1.615 -48.907 44.216 1.00 0.00 C ATOM 1042 OG1 THR A 65 0.701 -48.022 44.873 1.00 0.00 O ATOM 1043 CG2 THR A 65 2.964 -48.220 44.051 1.00 0.00 C ATOM 0 H THR A 65 0.367 -47.342 42.736 1.00 0.00 H new ATOM 0 HA THR A 65 1.866 -49.664 42.218 1.00 0.00 H new ATOM 0 HB THR A 65 1.754 -49.804 44.820 1.00 0.00 H new ATOM 0 HG1 THR A 65 0.840 -47.108 44.548 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.349 -47.935 45.030 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.664 -48.904 43.571 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.846 -47.329 43.434 1.00 0.00 H new ATOM 1051 N MET A 66 -1.228 -50.203 42.999 1.00 0.00 N ATOM 1052 CA MET A 66 -2.245 -51.233 43.112 1.00 0.00 C ATOM 1053 C MET A 66 -2.429 -52.012 41.797 1.00 0.00 C ATOM 1054 O MET A 66 -2.708 -53.206 41.814 1.00 0.00 O ATOM 1055 CB MET A 66 -3.577 -50.627 43.545 1.00 0.00 C ATOM 1056 CG MET A 66 -3.565 -50.057 44.949 1.00 0.00 C ATOM 1057 SD MET A 66 -5.156 -49.354 45.430 1.00 0.00 S ATOM 1058 CE MET A 66 -6.160 -50.836 45.536 1.00 0.00 C ATOM 0 H MET A 66 -1.595 -49.254 42.922 1.00 0.00 H new ATOM 0 HA MET A 66 -1.903 -51.936 43.871 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.850 -49.837 42.845 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.351 -51.392 43.481 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.292 -50.843 45.653 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.797 -49.287 45.017 1.00 0.00 H new ATOM 0 HE1 MET A 66 -7.188 -50.563 45.772 1.00 0.00 H new ATOM 0 HE2 MET A 66 -6.135 -51.362 44.582 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.768 -51.486 46.319 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.276 -51.329 40.666 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.543 -51.947 39.356 1.00 0.00 C ATOM 1070 C ILE A 67 -1.280 -52.241 38.542 1.00 0.00 C ATOM 1071 O ILE A 67 -1.355 -52.893 37.500 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.493 -51.073 38.509 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.933 -49.646 38.365 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -4.888 -51.063 39.109 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.756 -48.755 37.456 1.00 0.00 C ATOM 0 H ILE A 67 -1.972 -50.356 40.622 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.014 -52.903 39.586 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.564 -51.504 37.511 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.874 -49.187 39.352 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.915 -49.702 37.979 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.543 -50.442 38.498 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.278 -52.080 39.140 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.846 -50.660 40.121 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.299 -47.767 37.404 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.794 -49.190 36.457 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.768 -48.667 37.852 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.134 -51.791 39.026 1.00 0.00 N ATOM 1088 CA GLU A 68 1.146 -51.959 38.306 1.00 0.00 C ATOM 1089 C GLU A 68 1.456 -53.431 37.984 1.00 0.00 C ATOM 1090 O GLU A 68 2.213 -53.729 37.058 1.00 0.00 O ATOM 1091 CB GLU A 68 2.299 -51.363 39.116 1.00 0.00 C ATOM 1092 CG GLU A 68 2.520 -52.058 40.445 1.00 0.00 C ATOM 1093 CD GLU A 68 3.723 -51.541 41.199 1.00 0.00 C ATOM 1094 OE1 GLU A 68 4.802 -51.389 40.585 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.610 -51.316 42.425 1.00 0.00 O ATOM 0 H GLU A 68 -0.050 -51.303 39.918 1.00 0.00 H new ATOM 0 HA GLU A 68 1.041 -51.427 37.360 1.00 0.00 H new ATOM 0 HB2 GLU A 68 3.215 -51.420 38.527 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.100 -50.306 39.295 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.631 -51.934 41.064 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.641 -53.127 40.272 1.00 0.00 H new ATOM 1102 N ASN A 69 0.870 -54.343 38.742 1.00 0.00 N ATOM 1103 CA ASN A 69 1.112 -55.766 38.542 1.00 0.00 C ATOM 1104 C ASN A 69 0.601 -56.244 37.170 1.00 0.00 C ATOM 1105 O ASN A 69 1.260 -57.041 36.500 1.00 0.00 O ATOM 1106 CB ASN A 69 0.494 -56.605 39.682 1.00 0.00 C ATOM 1107 CG ASN A 69 -1.027 -56.579 39.693 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -1.674 -57.401 39.051 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -1.604 -55.650 40.429 1.00 0.00 N ATOM 0 H ASN A 69 0.224 -54.126 39.501 1.00 0.00 H new ATOM 0 HA ASN A 69 2.192 -55.914 38.561 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.832 -57.637 39.588 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.864 -56.234 40.638 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -2.621 -55.597 40.478 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -1.033 -54.984 40.949 1.00 0.00 H new ATOM 1116 N GLU A 70 -0.551 -55.738 36.741 1.00 0.00 N ATOM 1117 CA GLU A 70 -1.141 -56.178 35.482 1.00 0.00 C ATOM 1118 C GLU A 70 -1.337 -55.020 34.493 1.00 0.00 C ATOM 1119 O GLU A 70 -1.911 -55.196 33.419 1.00 0.00 O ATOM 1120 CB GLU A 70 -2.455 -56.916 35.746 1.00 0.00 C ATOM 1121 CG GLU A 70 -3.501 -56.100 36.494 1.00 0.00 C ATOM 1122 CD GLU A 70 -4.704 -56.931 36.875 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -5.348 -57.500 35.973 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -5.000 -57.046 38.085 1.00 0.00 O ATOM 0 H GLU A 70 -1.090 -55.030 37.241 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.441 -56.868 35.011 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -2.876 -57.235 34.792 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.241 -57.819 36.317 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.054 -55.676 37.393 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -3.821 -55.264 35.872 1.00 0.00 H new ATOM 1131 N ALA A 71 -0.837 -53.854 34.852 1.00 0.00 N ATOM 1132 CA ALA A 71 -0.921 -52.689 33.991 1.00 0.00 C ATOM 1133 C ALA A 71 0.455 -52.082 33.807 1.00 0.00 C ATOM 1134 O ALA A 71 1.288 -52.147 34.707 1.00 0.00 O ATOM 1135 CB ALA A 71 -1.886 -51.660 34.576 1.00 0.00 C ATOM 0 H ALA A 71 -0.365 -53.687 35.741 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.301 -52.998 33.017 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.937 -50.793 33.917 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.878 -52.103 34.670 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.534 -51.349 35.559 1.00 0.00 H new ATOM 1141 N ASN A 72 0.706 -51.531 32.638 1.00 0.00 N ATOM 1142 CA ASN A 72 1.978 -50.877 32.360 1.00 0.00 C ATOM 1143 C ASN A 72 1.753 -49.392 32.146 1.00 0.00 C ATOM 1144 O ASN A 72 0.693 -48.981 31.658 1.00 0.00 O ATOM 1145 CB ASN A 72 2.694 -51.505 31.144 1.00 0.00 C ATOM 1146 CG ASN A 72 1.908 -51.406 29.848 1.00 0.00 C ATOM 1147 OD1 ASN A 72 1.986 -50.406 29.135 1.00 0.00 O ATOM 1148 ND2 ASN A 72 1.166 -52.449 29.530 1.00 0.00 N ATOM 0 H ASN A 72 0.047 -51.520 31.860 1.00 0.00 H new ATOM 0 HA ASN A 72 2.630 -51.021 33.222 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.659 -51.016 31.010 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.896 -52.555 31.356 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.628 -52.447 28.663 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.130 -53.258 30.151 1.00 0.00 H new ATOM 1155 N ARG A 73 2.728 -48.582 32.528 1.00 0.00 N ATOM 1156 CA ARG A 73 2.596 -47.151 32.403 1.00 0.00 C ATOM 1157 C ARG A 73 2.910 -46.724 30.964 1.00 0.00 C ATOM 1158 O ARG A 73 3.929 -47.124 30.395 1.00 0.00 O ATOM 1159 CB ARG A 73 3.516 -46.425 33.423 1.00 0.00 C ATOM 1160 CG ARG A 73 4.791 -45.826 32.837 1.00 0.00 C ATOM 1161 CD ARG A 73 5.707 -45.262 33.919 1.00 0.00 C ATOM 1162 NE ARG A 73 6.904 -44.625 33.349 1.00 0.00 N ATOM 1163 CZ ARG A 73 8.163 -45.079 33.480 1.00 0.00 C ATOM 1164 NH1 ARG A 73 8.427 -46.164 34.202 1.00 0.00 N ATOM 1165 NH2 ARG A 73 9.158 -44.421 32.896 1.00 0.00 N ATOM 0 H ARG A 73 3.614 -48.896 32.925 1.00 0.00 H new ATOM 0 HA ARG A 73 1.568 -46.866 32.629 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.945 -45.628 33.900 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.792 -47.131 34.206 1.00 0.00 H new ATOM 0 HG2 ARG A 73 5.325 -46.591 32.273 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.530 -45.035 32.134 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.158 -44.534 34.516 1.00 0.00 H new ATOM 0 HD3 ARG A 73 6.009 -46.064 34.593 1.00 0.00 H new ATOM 0 HE ARG A 73 6.768 -43.769 32.811 1.00 0.00 H new ATOM 0 HH11 ARG A 73 7.669 -46.665 34.666 1.00 0.00 H new ATOM 0 HH12 ARG A 73 9.387 -46.496 34.292 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.964 -43.579 32.354 1.00 0.00 H new ATOM 0 HH22 ARG A 73 10.116 -44.758 32.990 1.00 0.00 H new ATOM 1179 N ASP A 74 2.004 -45.975 30.364 1.00 0.00 N ATOM 1180 CA ASP A 74 2.231 -45.437 29.024 1.00 0.00 C ATOM 1181 C ASP A 74 3.227 -44.297 29.091 1.00 0.00 C ATOM 1182 O ASP A 74 4.053 -44.116 28.200 1.00 0.00 O ATOM 1183 CB ASP A 74 0.919 -44.972 28.388 1.00 0.00 C ATOM 1184 CG ASP A 74 1.125 -44.257 27.063 1.00 0.00 C ATOM 1185 OD1 ASP A 74 1.453 -44.930 26.064 1.00 0.00 O ATOM 1186 OD2 ASP A 74 0.952 -43.015 27.014 1.00 0.00 O ATOM 0 H ASP A 74 1.106 -45.723 30.776 1.00 0.00 H new ATOM 0 HA ASP A 74 2.640 -46.229 28.396 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.271 -45.834 28.233 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.403 -44.305 29.079 1.00 0.00 H new ATOM 1191 N LYS A 75 3.141 -43.547 30.169 1.00 0.00 N ATOM 1192 CA LYS A 75 4.017 -42.425 30.411 1.00 0.00 C ATOM 1193 C LYS A 75 3.976 -42.074 31.884 1.00 0.00 C ATOM 1194 O LYS A 75 3.163 -42.627 32.633 1.00 0.00 O ATOM 1195 CB LYS A 75 3.615 -41.186 29.582 1.00 0.00 C ATOM 1196 CG LYS A 75 2.383 -40.441 30.097 1.00 0.00 C ATOM 1197 CD LYS A 75 2.199 -39.117 29.367 1.00 0.00 C ATOM 1198 CE LYS A 75 1.092 -38.263 29.988 1.00 0.00 C ATOM 1199 NZ LYS A 75 -0.261 -38.831 29.781 1.00 0.00 N ATOM 0 H LYS A 75 2.454 -43.702 30.907 1.00 0.00 H new ATOM 0 HA LYS A 75 5.024 -42.714 30.109 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.457 -40.494 29.558 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.430 -41.499 28.554 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.496 -41.061 29.962 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.485 -40.259 31.167 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.137 -38.561 29.384 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.962 -39.311 28.321 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.277 -38.159 31.057 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.129 -37.262 29.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.952 -38.298 30.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.515 -38.765 28.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.267 -39.828 30.075 1.00 0.00 H new ATOM 1213 N GLU A 76 4.840 -41.175 32.290 1.00 0.00 N ATOM 1214 CA GLU A 76 4.879 -40.708 33.662 1.00 0.00 C ATOM 1215 C GLU A 76 3.738 -39.714 33.884 1.00 0.00 C ATOM 1216 O GLU A 76 3.286 -39.076 32.931 1.00 0.00 O ATOM 1217 CB GLU A 76 6.232 -40.020 33.960 1.00 0.00 C ATOM 1218 CG GLU A 76 7.471 -40.892 33.733 1.00 0.00 C ATOM 1219 CD GLU A 76 7.708 -41.221 32.271 1.00 0.00 C ATOM 1220 OE1 GLU A 76 8.072 -40.314 31.507 1.00 0.00 O ATOM 1221 OE2 GLU A 76 7.521 -42.393 31.882 1.00 0.00 O ATOM 0 H GLU A 76 5.537 -40.745 31.682 1.00 0.00 H new ATOM 0 HA GLU A 76 4.767 -41.560 34.333 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.314 -39.130 33.336 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.230 -39.683 34.997 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.347 -40.379 34.130 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.363 -41.820 34.295 1.00 0.00 H new ATOM 1228 N PRO A 77 3.233 -39.584 35.123 1.00 0.00 N ATOM 1229 CA PRO A 77 2.188 -38.614 35.426 1.00 0.00 C ATOM 1230 C PRO A 77 2.675 -37.206 35.157 1.00 0.00 C ATOM 1231 O PRO A 77 3.828 -36.869 35.451 1.00 0.00 O ATOM 1232 CB PRO A 77 1.921 -38.798 36.921 1.00 0.00 C ATOM 1233 CG PRO A 77 2.508 -40.127 37.265 1.00 0.00 C ATOM 1234 CD PRO A 77 3.636 -40.356 36.302 1.00 0.00 C ATOM 0 HA PRO A 77 1.297 -38.763 34.816 1.00 0.00 H new ATOM 0 HB2 PRO A 77 2.383 -38.001 37.504 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.853 -38.772 37.136 1.00 0.00 H new ATOM 0 HG2 PRO A 77 2.868 -40.138 38.294 1.00 0.00 H new ATOM 0 HG3 PRO A 77 1.760 -40.915 37.181 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.587 -40.008 36.706 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.757 -41.414 36.068 1.00 0.00 H new ATOM 1242 N ASN A 78 1.814 -36.389 34.618 1.00 0.00 N ATOM 1243 CA ASN A 78 2.179 -35.031 34.274 1.00 0.00 C ATOM 1244 C ASN A 78 1.047 -34.084 34.588 1.00 0.00 C ATOM 1245 O ASN A 78 -0.088 -34.510 34.820 1.00 0.00 O ATOM 1246 CB ASN A 78 2.553 -34.916 32.780 1.00 0.00 C ATOM 1247 CG ASN A 78 1.387 -35.221 31.836 1.00 0.00 C ATOM 1248 OD1 ASN A 78 0.520 -36.035 32.136 1.00 0.00 O ATOM 1249 ND2 ASN A 78 1.361 -34.562 30.695 1.00 0.00 N ATOM 0 H ASN A 78 0.848 -36.636 34.404 1.00 0.00 H new ATOM 0 HA ASN A 78 3.050 -34.761 34.871 1.00 0.00 H new ATOM 0 HB2 ASN A 78 2.918 -33.908 32.581 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.374 -35.600 32.565 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.604 -34.722 30.031 1.00 0.00 H new ATOM 0 HD22 ASN A 78 2.098 -33.892 30.476 1.00 0.00 H new ATOM 1256 N PHE A 79 1.355 -32.809 34.598 1.00 0.00 N ATOM 1257 CA PHE A 79 0.379 -31.794 34.887 1.00 0.00 C ATOM 1258 C PHE A 79 -0.081 -31.130 33.594 1.00 0.00 C ATOM 1259 O PHE A 79 0.691 -30.456 32.913 1.00 0.00 O ATOM 1260 CB PHE A 79 0.986 -30.777 35.856 1.00 0.00 C ATOM 1261 CG PHE A 79 0.059 -29.688 36.307 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -0.884 -29.932 37.288 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.154 -28.417 35.774 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.719 -28.928 37.730 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.679 -27.408 36.207 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.618 -27.664 37.187 1.00 0.00 C ATOM 0 H PHE A 79 2.290 -32.449 34.406 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.497 -32.240 35.358 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.349 -31.310 36.735 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.853 -30.319 35.380 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.968 -30.921 37.713 1.00 0.00 H new ATOM 0 HD2 PHE A 79 0.889 -28.212 35.010 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.450 -29.130 38.499 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.598 -26.419 35.781 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.272 -26.875 37.528 1.00 0.00 H new ATOM 1276 N GLU A 80 -1.334 -31.337 33.265 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.925 -30.796 32.059 1.00 0.00 C ATOM 1278 C GLU A 80 -2.996 -29.786 32.427 1.00 0.00 C ATOM 1279 O GLU A 80 -4.033 -30.150 32.994 1.00 0.00 O ATOM 1280 CB GLU A 80 -2.537 -31.931 31.226 1.00 0.00 C ATOM 1281 CG GLU A 80 -3.170 -31.481 29.918 1.00 0.00 C ATOM 1282 CD GLU A 80 -3.796 -32.629 29.158 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -4.929 -33.026 29.499 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -3.157 -33.146 28.216 1.00 0.00 O ATOM 0 H GLU A 80 -1.979 -31.890 33.830 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.154 -30.301 31.469 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.760 -32.663 31.006 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.293 -32.438 31.826 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.930 -30.728 30.125 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.412 -31.006 29.295 1.00 0.00 H new ATOM 1291 N GLY A 81 -2.749 -28.527 32.110 1.00 0.00 N ATOM 1292 CA GLY A 81 -3.691 -27.478 32.452 1.00 0.00 C ATOM 1293 C GLY A 81 -3.810 -27.306 33.954 1.00 0.00 C ATOM 1294 O GLY A 81 -3.048 -26.556 34.564 1.00 0.00 O ATOM 0 H GLY A 81 -1.912 -28.209 31.621 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -3.371 -26.539 32.001 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.669 -27.715 32.033 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.779 -27.991 34.543 1.00 0.00 N ATOM 1299 CA ARG A 82 -4.983 -27.983 35.990 1.00 0.00 C ATOM 1300 C ARG A 82 -5.201 -29.398 36.505 1.00 0.00 C ATOM 1301 O ARG A 82 -5.585 -29.604 37.654 1.00 0.00 O ATOM 1302 CB ARG A 82 -6.160 -27.082 36.377 1.00 0.00 C ATOM 1303 CG ARG A 82 -5.850 -25.598 36.264 1.00 0.00 C ATOM 1304 CD ARG A 82 -7.050 -24.748 36.620 1.00 0.00 C ATOM 1305 NE ARG A 82 -6.730 -23.322 36.601 1.00 0.00 N ATOM 1306 CZ ARG A 82 -7.521 -22.368 37.095 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -8.711 -22.684 37.600 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -7.120 -21.095 37.087 1.00 0.00 N ATOM 0 H ARG A 82 -5.448 -28.569 34.034 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.084 -27.578 36.455 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.012 -27.317 35.739 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.457 -27.306 37.401 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.019 -25.348 36.923 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.530 -25.369 35.247 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -7.859 -24.948 35.917 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.412 -25.026 37.610 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.844 -23.038 36.183 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.019 -23.656 37.610 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.315 -21.954 37.977 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.207 -20.850 36.703 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -7.726 -20.367 37.465 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.941 -30.368 35.647 1.00 0.00 N ATOM 1323 CA TYR A 83 -5.131 -31.766 35.982 1.00 0.00 C ATOM 1324 C TYR A 83 -3.820 -32.519 35.916 1.00 0.00 C ATOM 1325 O TYR A 83 -3.012 -32.289 35.031 1.00 0.00 O ATOM 1326 CB TYR A 83 -6.104 -32.424 35.000 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.525 -31.911 35.048 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.894 -30.743 34.390 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.504 -32.610 35.737 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.199 -30.291 34.421 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.808 -32.165 35.775 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.151 -31.003 35.115 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.453 -30.558 35.143 1.00 0.00 O ATOM 0 H TYR A 83 -4.593 -30.209 34.701 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.531 -31.807 36.995 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.721 -32.286 33.989 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.117 -33.497 35.193 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.149 -30.181 33.846 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.240 -33.521 36.254 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.471 -29.383 33.903 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.557 -32.723 36.318 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.998 -31.175 35.675 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.621 -33.412 36.840 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.482 -34.300 36.790 1.00 0.00 C ATOM 1345 C VAL A 84 -2.994 -35.627 36.260 1.00 0.00 C ATOM 1346 O VAL A 84 -3.984 -36.153 36.771 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.833 -34.492 38.192 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.810 -35.609 38.182 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.172 -33.214 38.647 1.00 0.00 C ATOM 0 H VAL A 84 -4.233 -33.550 37.644 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.707 -33.881 36.149 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.631 -34.759 38.885 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.377 -35.715 39.177 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.294 -36.543 37.895 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.022 -35.374 37.467 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.723 -33.366 39.629 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.398 -32.931 37.934 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -1.917 -32.421 38.707 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.371 -36.155 35.226 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.898 -37.361 34.619 1.00 0.00 C ATOM 1361 C ASN A 85 -1.835 -38.397 34.341 1.00 0.00 C ATOM 1362 O ASN A 85 -0.659 -38.082 34.168 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.676 -37.032 33.331 1.00 0.00 C ATOM 1364 CG ASN A 85 -2.780 -36.684 32.153 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -2.416 -37.557 31.350 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -2.432 -35.421 32.032 1.00 0.00 N ATOM 0 H ASN A 85 -1.524 -35.782 34.798 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.580 -37.797 35.349 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.298 -37.886 33.064 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.348 -36.196 33.525 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.840 -35.127 31.255 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.754 -34.736 32.715 1.00 0.00 H new ATOM 1373 N MET A 86 -2.276 -39.636 34.315 1.00 0.00 N ATOM 1374 CA MET A 86 -1.440 -40.779 34.024 1.00 0.00 C ATOM 1375 C MET A 86 -2.223 -41.751 33.159 1.00 0.00 C ATOM 1376 O MET A 86 -3.404 -41.978 33.400 1.00 0.00 O ATOM 1377 CB MET A 86 -1.019 -41.461 35.326 1.00 0.00 C ATOM 1378 CG MET A 86 -0.113 -42.668 35.141 1.00 0.00 C ATOM 1379 SD MET A 86 0.314 -43.452 36.707 1.00 0.00 S ATOM 1380 CE MET A 86 -1.319 -43.871 37.324 1.00 0.00 C ATOM 0 H MET A 86 -3.249 -39.882 34.500 1.00 0.00 H new ATOM 0 HA MET A 86 -0.544 -40.455 33.495 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.508 -40.732 35.955 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.914 -41.773 35.864 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.608 -43.395 34.497 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.800 -42.359 34.631 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.558 -43.240 38.180 1.00 0.00 H new ATOM 0 HE2 MET A 86 -2.057 -43.711 36.538 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.335 -44.917 37.629 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.583 -42.315 32.161 1.00 0.00 N ATOM 1391 CA LEU A 87 -2.253 -43.248 31.271 1.00 0.00 C ATOM 1392 C LEU A 87 -1.717 -44.650 31.515 1.00 0.00 C ATOM 1393 O LEU A 87 -0.501 -44.879 31.487 1.00 0.00 O ATOM 1394 CB LEU A 87 -2.047 -42.817 29.800 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.934 -43.493 28.714 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -2.547 -44.940 28.479 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -4.405 -43.388 29.073 1.00 0.00 C ATOM 0 H LEU A 87 -0.601 -42.148 31.941 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.324 -43.247 31.473 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.208 -41.741 29.741 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.004 -42.998 29.541 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.762 -42.954 27.782 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.193 -45.370 27.713 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.510 -44.990 28.148 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.660 -45.502 29.406 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.004 -43.868 28.299 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.583 -43.883 30.028 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.686 -42.338 29.151 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.618 -45.578 31.759 1.00 0.00 N ATOM 1410 CA VAL A 88 -2.243 -46.954 32.011 1.00 0.00 C ATOM 1411 C VAL A 88 -2.716 -47.860 30.885 1.00 0.00 C ATOM 1412 O VAL A 88 -3.849 -47.750 30.403 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.772 -47.477 33.372 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -2.145 -46.700 34.516 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -4.290 -47.404 33.446 1.00 0.00 C ATOM 0 H VAL A 88 -3.622 -45.403 31.788 1.00 0.00 H new ATOM 0 HA VAL A 88 -1.154 -46.974 32.055 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.487 -48.525 33.460 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.526 -47.078 35.465 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -1.062 -46.819 34.486 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.396 -45.644 34.419 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.626 -47.778 34.413 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.611 -46.369 33.326 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.723 -48.012 32.652 1.00 0.00 H new ATOM 1425 N THR A 89 -1.832 -48.718 30.447 1.00 0.00 N ATOM 1426 CA THR A 89 -2.117 -49.636 29.380 1.00 0.00 C ATOM 1427 C THR A 89 -2.111 -51.061 29.928 1.00 0.00 C ATOM 1428 O THR A 89 -1.286 -51.397 30.775 1.00 0.00 O ATOM 1429 CB THR A 89 -1.043 -49.495 28.283 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.853 -48.106 27.980 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.425 -50.238 27.015 1.00 0.00 C ATOM 0 H THR A 89 -0.888 -48.798 30.825 1.00 0.00 H new ATOM 0 HA THR A 89 -3.096 -49.415 28.955 1.00 0.00 H new ATOM 0 HB THR A 89 -0.120 -49.934 28.662 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.169 -48.014 27.284 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.640 -50.112 26.269 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.547 -51.298 27.237 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.362 -49.838 26.627 1.00 0.00 H new ATOM 1439 N PRO A 90 -3.048 -51.900 29.490 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.118 -53.297 29.930 1.00 0.00 C ATOM 1441 C PRO A 90 -1.906 -54.083 29.419 1.00 0.00 C ATOM 1442 O PRO A 90 -1.430 -53.845 28.304 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.424 -53.785 29.277 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.550 -52.934 28.066 1.00 0.00 C ATOM 1445 CD PRO A 90 -4.103 -51.580 28.510 1.00 0.00 C ATOM 0 HA PRO A 90 -3.108 -53.423 31.013 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.372 -54.843 29.020 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.277 -53.661 29.945 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -3.930 -53.309 27.252 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.577 -52.913 27.701 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.720 -50.986 27.680 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.916 -51.011 28.960 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.391 -54.993 30.234 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.233 -55.773 29.839 1.00 0.00 C ATOM 1455 C LYS A 91 -0.618 -56.889 28.889 1.00 0.00 C ATOM 1456 O LYS A 91 -1.629 -57.566 29.088 1.00 0.00 O ATOM 1457 CB LYS A 91 0.488 -56.351 31.056 1.00 0.00 C ATOM 1458 CG LYS A 91 1.189 -55.318 31.920 1.00 0.00 C ATOM 1459 CD LYS A 91 1.906 -55.977 33.089 1.00 0.00 C ATOM 1460 CE LYS A 91 2.625 -54.957 33.951 1.00 0.00 C ATOM 1461 NZ LYS A 91 3.318 -55.592 35.103 1.00 0.00 N ATOM 0 H LYS A 91 -1.754 -55.206 31.163 1.00 0.00 H new ATOM 0 HA LYS A 91 0.447 -55.097 29.321 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -0.235 -56.889 31.669 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.223 -57.080 30.715 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.906 -54.761 31.317 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.461 -54.598 32.295 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.185 -56.524 33.697 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.624 -56.706 32.712 1.00 0.00 H new ATOM 0 HE2 LYS A 91 3.351 -54.417 33.344 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.908 -54.223 34.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.516 -54.873 35.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.711 -56.333 35.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.212 -56.014 34.780 1.00 0.00 H new