USER MOD reduce.3.24.130724 H: found=0, std=0, add=726, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 727 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 35 SER OG : rot -26:sc= 0.613 USER MOD Set 1.2: A 36 ASN : amide:sc= -2.11! C(o=-1.5!,f=-2.2!) USER MOD Single : A 43 MET CE :methyl 148:sc= -0.0706 (180deg=-0.798) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot -59:sc= 0.954 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -3.84! C(o=-3.8!,f=-10!) USER MOD Single : A 66 SER OG : rot 63:sc= 0.516 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 54:sc= 0.163! USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -8.09! C(o=-8.1!,f=-8.3!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -21:sc= -3.26! USER MOD Single : A 111 THR OG1 : rot -50:sc= 0.265 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot -68:sc= 0.181 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.033 USER MOD Single : A 126 SER OG : rot -60:sc= -5.81! USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 35 1.213 -18.976 -9.496 1.00 0.00 N ATOM 2 CA SER A 35 -0.165 -18.627 -9.044 1.00 0.00 C ATOM 3 C SER A 35 -0.119 -17.418 -8.103 1.00 0.00 C ATOM 4 O SER A 35 0.884 -17.154 -7.474 1.00 0.00 O ATOM 5 CB SER A 35 -0.670 -19.868 -8.309 1.00 0.00 C ATOM 6 OG SER A 35 0.348 -20.347 -7.439 1.00 0.00 O ATOM 0 HA SER A 35 -0.818 -18.357 -9.874 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.567 -19.627 -7.739 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.946 -20.642 -9.025 1.00 0.00 H new ATOM 0 HG SER A 35 1.226 -20.083 -7.786 1.00 0.00 H new ATOM 12 N ASN A 36 -1.202 -16.681 -8.019 1.00 0.00 N ATOM 13 CA ASN A 36 -1.252 -15.472 -7.129 1.00 0.00 C ATOM 14 C ASN A 36 -0.514 -14.288 -7.768 1.00 0.00 C ATOM 15 O ASN A 36 -0.630 -13.164 -7.320 1.00 0.00 O ATOM 16 CB ASN A 36 -0.569 -15.872 -5.819 1.00 0.00 C ATOM 17 CG ASN A 36 -0.984 -17.293 -5.431 1.00 0.00 C ATOM 18 OD1 ASN A 36 -0.153 -18.172 -5.322 1.00 0.00 O ATOM 19 ND2 ASN A 36 -2.244 -17.555 -5.214 1.00 0.00 N ATOM 0 H ASN A 36 -2.063 -16.866 -8.534 1.00 0.00 H new ATOM 0 HA ASN A 36 -2.282 -15.156 -6.965 1.00 0.00 H new ATOM 0 HB2 ASN A 36 0.514 -15.817 -5.931 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.843 -15.174 -5.028 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -2.531 -18.498 -4.953 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -2.942 -16.817 -5.306 1.00 0.00 H new ATOM 26 N ALA A 37 0.249 -14.528 -8.798 1.00 0.00 N ATOM 27 CA ALA A 37 0.997 -13.428 -9.453 1.00 0.00 C ATOM 28 C ALA A 37 0.139 -12.160 -9.546 1.00 0.00 C ATOM 29 O ALA A 37 -0.876 -12.132 -10.215 1.00 0.00 O ATOM 30 CB ALA A 37 1.326 -13.964 -10.843 1.00 0.00 C ATOM 0 H ALA A 37 0.385 -15.449 -9.215 1.00 0.00 H new ATOM 0 HA ALA A 37 1.890 -13.147 -8.895 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.882 -13.211 -11.401 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.929 -14.867 -10.751 1.00 0.00 H new ATOM 0 HB3 ALA A 37 0.402 -14.197 -11.371 1.00 0.00 H new ATOM 36 N VAL A 38 0.545 -11.112 -8.883 1.00 0.00 N ATOM 37 CA VAL A 38 -0.235 -9.840 -8.930 1.00 0.00 C ATOM 38 C VAL A 38 0.653 -8.708 -9.456 1.00 0.00 C ATOM 39 O VAL A 38 1.851 -8.703 -9.247 1.00 0.00 O ATOM 40 CB VAL A 38 -0.651 -9.580 -7.477 1.00 0.00 C ATOM 41 CG1 VAL A 38 -0.917 -8.087 -7.261 1.00 0.00 C ATOM 42 CG2 VAL A 38 -1.924 -10.372 -7.171 1.00 0.00 C ATOM 0 H VAL A 38 1.387 -11.081 -8.308 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.100 -9.899 -9.591 1.00 0.00 H new ATOM 0 HB VAL A 38 0.154 -9.895 -6.813 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -1.211 -7.916 -6.226 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -0.011 -7.521 -7.479 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.718 -7.760 -7.925 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.225 -10.192 -6.139 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -2.721 -10.053 -7.843 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.734 -11.436 -7.313 1.00 0.00 H new ATOM 52 N VAL A 39 0.084 -7.747 -10.134 1.00 0.00 N ATOM 53 CA VAL A 39 0.919 -6.631 -10.658 1.00 0.00 C ATOM 54 C VAL A 39 0.351 -5.275 -10.250 1.00 0.00 C ATOM 55 O VAL A 39 -0.839 -5.038 -10.302 1.00 0.00 O ATOM 56 CB VAL A 39 0.897 -6.763 -12.186 1.00 0.00 C ATOM 57 CG1 VAL A 39 -0.486 -6.385 -12.724 1.00 0.00 C ATOM 58 CG2 VAL A 39 1.938 -5.815 -12.795 1.00 0.00 C ATOM 0 H VAL A 39 -0.912 -7.687 -10.345 1.00 0.00 H new ATOM 0 HA VAL A 39 1.930 -6.688 -10.256 1.00 0.00 H new ATOM 0 HB VAL A 39 1.125 -7.794 -12.455 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.493 -6.481 -13.810 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.237 -7.049 -12.296 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.714 -5.355 -12.450 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.923 -5.908 -13.881 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.703 -4.788 -12.515 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.929 -6.075 -12.422 1.00 0.00 H new ATOM 68 N LEU A 40 1.209 -4.373 -9.883 1.00 0.00 N ATOM 69 CA LEU A 40 0.757 -3.009 -9.522 1.00 0.00 C ATOM 70 C LEU A 40 1.395 -2.057 -10.530 1.00 0.00 C ATOM 71 O LEU A 40 2.583 -2.116 -10.775 1.00 0.00 O ATOM 72 CB LEU A 40 1.287 -2.752 -8.111 1.00 0.00 C ATOM 73 CG LEU A 40 1.315 -1.245 -7.862 1.00 0.00 C ATOM 74 CD1 LEU A 40 -0.086 -0.672 -8.077 1.00 0.00 C ATOM 75 CD2 LEU A 40 1.767 -0.962 -6.429 1.00 0.00 C ATOM 0 H LEU A 40 2.216 -4.525 -9.817 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.325 -2.879 -9.541 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.653 -3.244 -7.374 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.287 -3.171 -8.001 1.00 0.00 H new ATOM 0 HG LEU A 40 2.014 -0.778 -8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.070 0.403 -7.900 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.406 -0.867 -9.101 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.782 -1.144 -7.384 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.785 0.115 -6.259 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.073 -1.429 -5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.766 -1.370 -6.275 1.00 0.00 H new ATOM 87 N VAL A 41 0.631 -1.213 -11.150 1.00 0.00 N ATOM 88 CA VAL A 41 1.235 -0.316 -12.171 1.00 0.00 C ATOM 89 C VAL A 41 0.843 1.138 -11.956 1.00 0.00 C ATOM 90 O VAL A 41 -0.227 1.448 -11.475 1.00 0.00 O ATOM 91 CB VAL A 41 0.664 -0.808 -13.503 1.00 0.00 C ATOM 92 CG1 VAL A 41 0.932 0.223 -14.589 1.00 0.00 C ATOM 93 CG2 VAL A 41 1.314 -2.146 -13.881 1.00 0.00 C ATOM 0 H VAL A 41 -0.372 -1.103 -11.000 1.00 0.00 H new ATOM 0 HA VAL A 41 2.324 -0.349 -12.126 1.00 0.00 H new ATOM 0 HB VAL A 41 -0.412 -0.949 -13.404 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.524 -0.131 -15.536 1.00 0.00 H new ATOM 0 HG12 VAL A 41 0.458 1.167 -14.320 1.00 0.00 H new ATOM 0 HG13 VAL A 41 2.007 0.373 -14.691 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.905 -2.494 -14.830 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.392 -2.013 -13.977 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.107 -2.883 -13.105 1.00 0.00 H new ATOM 103 N LEU A 42 1.699 2.029 -12.355 1.00 0.00 N ATOM 104 CA LEU A 42 1.388 3.461 -12.240 1.00 0.00 C ATOM 105 C LEU A 42 1.957 4.197 -13.465 1.00 0.00 C ATOM 106 O LEU A 42 2.603 3.598 -14.302 1.00 0.00 O ATOM 107 CB LEU A 42 2.054 3.935 -10.961 1.00 0.00 C ATOM 108 CG LEU A 42 1.024 4.688 -10.129 1.00 0.00 C ATOM 109 CD1 LEU A 42 0.646 3.853 -8.906 1.00 0.00 C ATOM 110 CD2 LEU A 42 1.617 6.025 -9.688 1.00 0.00 C ATOM 0 H LEU A 42 2.611 1.816 -12.760 1.00 0.00 H new ATOM 0 HA LEU A 42 0.316 3.654 -12.206 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.446 3.086 -10.401 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.900 4.582 -11.192 1.00 0.00 H new ATOM 0 HG LEU A 42 0.129 4.869 -10.724 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.091 4.392 -8.311 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.224 2.902 -9.231 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.535 3.669 -8.303 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.884 6.569 -9.092 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.511 5.847 -9.090 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.879 6.614 -10.567 1.00 0.00 H new ATOM 122 N MET A 43 1.734 5.478 -13.586 1.00 0.00 N ATOM 123 CA MET A 43 2.279 6.216 -14.770 1.00 0.00 C ATOM 124 C MET A 43 3.399 7.167 -14.332 1.00 0.00 C ATOM 125 O MET A 43 3.535 8.261 -14.842 1.00 0.00 O ATOM 126 CB MET A 43 1.090 7.001 -15.332 1.00 0.00 C ATOM 127 CG MET A 43 0.676 8.097 -14.345 1.00 0.00 C ATOM 128 SD MET A 43 -0.100 9.460 -15.249 1.00 0.00 S ATOM 129 CE MET A 43 -0.692 10.383 -13.810 1.00 0.00 C ATOM 0 H MET A 43 1.203 6.044 -12.924 1.00 0.00 H new ATOM 0 HA MET A 43 2.709 5.545 -15.514 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.357 7.445 -16.291 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.252 6.328 -15.514 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.018 7.694 -13.607 1.00 0.00 H new ATOM 0 HG3 MET A 43 1.548 8.458 -13.799 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.682 11.450 -14.033 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.709 10.071 -13.571 1.00 0.00 H new ATOM 0 HE3 MET A 43 -0.042 10.185 -12.958 1.00 0.00 H new ATOM 139 N LYS A 44 4.184 6.760 -13.376 1.00 0.00 N ATOM 140 CA LYS A 44 5.286 7.639 -12.874 1.00 0.00 C ATOM 141 C LYS A 44 6.589 7.452 -13.663 1.00 0.00 C ATOM 142 O LYS A 44 6.919 8.235 -14.528 1.00 0.00 O ATOM 143 CB LYS A 44 5.478 7.228 -11.419 1.00 0.00 C ATOM 144 CG LYS A 44 4.635 8.138 -10.528 1.00 0.00 C ATOM 145 CD LYS A 44 5.025 9.598 -10.779 1.00 0.00 C ATOM 146 CE LYS A 44 5.195 10.318 -9.439 1.00 0.00 C ATOM 147 NZ LYS A 44 5.302 11.763 -9.788 1.00 0.00 N ATOM 0 H LYS A 44 4.113 5.853 -12.916 1.00 0.00 H new ATOM 0 HA LYS A 44 5.029 8.692 -12.987 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.184 6.188 -11.280 1.00 0.00 H new ATOM 0 HB3 LYS A 44 6.530 7.301 -11.143 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.576 7.992 -10.738 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.790 7.884 -9.479 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.953 9.645 -11.350 1.00 0.00 H new ATOM 0 HD3 LYS A 44 4.259 10.093 -11.375 1.00 0.00 H new ATOM 0 HE2 LYS A 44 4.346 10.133 -8.781 1.00 0.00 H new ATOM 0 HE3 LYS A 44 6.086 9.972 -8.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.421 12.322 -8.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.123 11.910 -10.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 4.437 12.066 -10.279 1.00 0.00 H new ATOM 161 N SER A 45 7.344 6.433 -13.341 1.00 0.00 N ATOM 162 CA SER A 45 8.642 6.193 -14.037 1.00 0.00 C ATOM 163 C SER A 45 9.644 7.294 -13.681 1.00 0.00 C ATOM 164 O SER A 45 9.692 8.334 -14.307 1.00 0.00 O ATOM 165 CB SER A 45 8.318 6.206 -15.529 1.00 0.00 C ATOM 166 OG SER A 45 9.210 7.084 -16.203 1.00 0.00 O ATOM 0 H SER A 45 7.113 5.751 -12.618 1.00 0.00 H new ATOM 0 HA SER A 45 9.097 5.248 -13.741 1.00 0.00 H new ATOM 0 HB2 SER A 45 8.403 5.200 -15.939 1.00 0.00 H new ATOM 0 HB3 SER A 45 7.288 6.527 -15.685 1.00 0.00 H new ATOM 0 HG SER A 45 9.121 7.987 -15.834 1.00 0.00 H new ATOM 172 N ASP A 46 10.445 7.068 -12.672 1.00 0.00 N ATOM 173 CA ASP A 46 11.449 8.092 -12.263 1.00 0.00 C ATOM 174 C ASP A 46 12.100 7.688 -10.935 1.00 0.00 C ATOM 175 O ASP A 46 13.197 7.164 -10.903 1.00 0.00 O ATOM 176 CB ASP A 46 10.656 9.393 -12.100 1.00 0.00 C ATOM 177 CG ASP A 46 11.464 10.388 -11.260 1.00 0.00 C ATOM 178 OD1 ASP A 46 12.348 11.020 -11.814 1.00 0.00 O ATOM 179 OD2 ASP A 46 11.182 10.500 -10.078 1.00 0.00 O ATOM 0 H ASP A 46 10.446 6.215 -12.113 1.00 0.00 H new ATOM 0 HA ASP A 46 12.251 8.198 -12.994 1.00 0.00 H new ATOM 0 HB2 ASP A 46 10.437 9.822 -13.078 1.00 0.00 H new ATOM 0 HB3 ASP A 46 9.699 9.189 -11.619 1.00 0.00 H new ATOM 184 N GLU A 47 11.436 7.938 -9.841 1.00 0.00 N ATOM 185 CA GLU A 47 12.012 7.583 -8.514 1.00 0.00 C ATOM 186 C GLU A 47 11.571 6.183 -8.085 1.00 0.00 C ATOM 187 O GLU A 47 12.067 5.639 -7.120 1.00 0.00 O ATOM 188 CB GLU A 47 11.439 8.627 -7.556 1.00 0.00 C ATOM 189 CG GLU A 47 12.419 9.781 -7.434 1.00 0.00 C ATOM 190 CD GLU A 47 11.882 10.809 -6.436 1.00 0.00 C ATOM 191 OE1 GLU A 47 11.769 10.469 -5.269 1.00 0.00 O ATOM 192 OE2 GLU A 47 11.594 11.918 -6.854 1.00 0.00 O ATOM 0 H GLU A 47 10.515 8.375 -9.809 1.00 0.00 H new ATOM 0 HA GLU A 47 13.102 7.577 -8.531 1.00 0.00 H new ATOM 0 HB2 GLU A 47 10.478 8.987 -7.923 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.259 8.181 -6.578 1.00 0.00 H new ATOM 0 HG2 GLU A 47 13.390 9.413 -7.104 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.569 10.248 -8.407 1.00 0.00 H new ATOM 199 N ILE A 48 10.637 5.604 -8.783 1.00 0.00 N ATOM 200 CA ILE A 48 10.156 4.261 -8.399 1.00 0.00 C ATOM 201 C ILE A 48 11.270 3.239 -8.443 1.00 0.00 C ATOM 202 O ILE A 48 11.651 2.700 -7.430 1.00 0.00 O ATOM 203 CB ILE A 48 9.016 3.918 -9.319 1.00 0.00 C ATOM 204 CG1 ILE A 48 9.121 4.593 -10.687 1.00 0.00 C ATOM 205 CG2 ILE A 48 7.746 4.358 -8.607 1.00 0.00 C ATOM 206 CD1 ILE A 48 8.286 5.864 -10.681 1.00 0.00 C ATOM 0 H ILE A 48 10.188 6.008 -9.605 1.00 0.00 H new ATOM 0 HA ILE A 48 9.807 4.255 -7.366 1.00 0.00 H new ATOM 0 HB ILE A 48 9.026 2.848 -9.525 1.00 0.00 H new ATOM 0 HG12 ILE A 48 10.161 4.828 -10.911 1.00 0.00 H new ATOM 0 HG13 ILE A 48 8.771 3.917 -11.467 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.882 4.132 -9.232 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.657 3.827 -7.659 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.787 5.431 -8.419 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.357 6.350 -11.654 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.245 5.615 -10.475 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.657 6.539 -9.910 1.00 0.00 H new ATOM 218 N ASP A 49 11.809 2.967 -9.581 1.00 0.00 N ATOM 219 CA ASP A 49 12.925 1.977 -9.629 1.00 0.00 C ATOM 220 C ASP A 49 13.856 2.216 -8.431 1.00 0.00 C ATOM 221 O ASP A 49 14.358 1.292 -7.818 1.00 0.00 O ATOM 222 CB ASP A 49 13.651 2.250 -10.947 1.00 0.00 C ATOM 223 CG ASP A 49 14.973 1.480 -10.973 1.00 0.00 C ATOM 224 OD1 ASP A 49 15.872 1.860 -10.240 1.00 0.00 O ATOM 225 OD2 ASP A 49 15.064 0.524 -11.724 1.00 0.00 O ATOM 0 H ASP A 49 11.539 3.375 -10.476 1.00 0.00 H new ATOM 0 HA ASP A 49 12.580 0.944 -9.578 1.00 0.00 H new ATOM 0 HB2 ASP A 49 13.026 1.948 -11.788 1.00 0.00 H new ATOM 0 HB3 ASP A 49 13.838 3.318 -11.056 1.00 0.00 H new ATOM 230 N ALA A 50 14.049 3.461 -8.073 1.00 0.00 N ATOM 231 CA ALA A 50 14.911 3.782 -6.900 1.00 0.00 C ATOM 232 C ALA A 50 14.162 3.494 -5.606 1.00 0.00 C ATOM 233 O ALA A 50 14.646 2.773 -4.756 1.00 0.00 O ATOM 234 CB ALA A 50 15.229 5.271 -7.025 1.00 0.00 C ATOM 0 H ALA A 50 13.644 4.269 -8.546 1.00 0.00 H new ATOM 0 HA ALA A 50 15.820 3.181 -6.880 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.862 5.579 -6.193 1.00 0.00 H new ATOM 0 HB2 ALA A 50 15.750 5.454 -7.965 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.302 5.844 -7.007 1.00 0.00 H new ATOM 240 N ILE A 51 12.984 4.024 -5.434 1.00 0.00 N ATOM 241 CA ILE A 51 12.260 3.730 -4.201 1.00 0.00 C ATOM 242 C ILE A 51 11.806 2.278 -4.229 1.00 0.00 C ATOM 243 O ILE A 51 12.078 1.560 -3.320 1.00 0.00 O ATOM 244 CB ILE A 51 11.097 4.693 -4.173 1.00 0.00 C ATOM 245 CG1 ILE A 51 10.292 4.592 -5.457 1.00 0.00 C ATOM 246 CG2 ILE A 51 11.611 6.119 -3.970 1.00 0.00 C ATOM 247 CD1 ILE A 51 9.797 5.978 -5.909 1.00 0.00 C ATOM 0 H ILE A 51 12.508 4.639 -6.094 1.00 0.00 H new ATOM 0 HA ILE A 51 12.868 3.852 -3.304 1.00 0.00 H new ATOM 0 HB ILE A 51 10.442 4.433 -3.341 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.905 4.148 -6.241 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.440 3.929 -5.305 1.00 0.00 H new ATOM 0 HG21 ILE A 51 10.768 6.810 -3.951 1.00 0.00 H new ATOM 0 HG22 ILE A 51 12.152 6.180 -3.026 1.00 0.00 H new ATOM 0 HG23 ILE A 51 12.279 6.385 -4.789 1.00 0.00 H new ATOM 0 HD11 ILE A 51 9.224 5.877 -6.830 1.00 0.00 H new ATOM 0 HD12 ILE A 51 9.164 6.409 -5.133 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.652 6.631 -6.084 1.00 0.00 H new ATOM 259 N ILE A 52 11.173 1.808 -5.277 1.00 0.00 N ATOM 260 CA ILE A 52 10.788 0.366 -5.299 1.00 0.00 C ATOM 261 C ILE A 52 11.963 -0.449 -4.781 1.00 0.00 C ATOM 262 O ILE A 52 11.823 -1.400 -4.046 1.00 0.00 O ATOM 263 CB ILE A 52 10.566 0.018 -6.750 1.00 0.00 C ATOM 264 CG1 ILE A 52 9.448 0.876 -7.353 1.00 0.00 C ATOM 265 CG2 ILE A 52 10.191 -1.459 -6.829 1.00 0.00 C ATOM 266 CD1 ILE A 52 8.149 0.657 -6.582 1.00 0.00 C ATOM 0 H ILE A 52 10.912 2.349 -6.101 1.00 0.00 H new ATOM 0 HA ILE A 52 9.905 0.166 -4.692 1.00 0.00 H new ATOM 0 HB ILE A 52 11.476 0.213 -7.318 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.728 1.929 -7.319 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.306 0.618 -8.402 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.025 -1.737 -7.870 1.00 0.00 H new ATOM 0 HG22 ILE A 52 11.000 -2.062 -6.417 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.280 -1.634 -6.257 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.360 1.270 -7.017 1.00 0.00 H new ATOM 0 HD12 ILE A 52 7.865 -0.394 -6.639 1.00 0.00 H new ATOM 0 HD13 ILE A 52 8.293 0.938 -5.539 1.00 0.00 H new ATOM 278 N GLU A 53 13.135 -0.064 -5.167 1.00 0.00 N ATOM 279 CA GLU A 53 14.330 -0.793 -4.704 1.00 0.00 C ATOM 280 C GLU A 53 14.503 -0.630 -3.192 1.00 0.00 C ATOM 281 O GLU A 53 14.425 -1.584 -2.443 1.00 0.00 O ATOM 282 CB GLU A 53 15.485 -0.145 -5.453 1.00 0.00 C ATOM 283 CG GLU A 53 16.811 -0.604 -4.847 1.00 0.00 C ATOM 284 CD GLU A 53 17.954 -0.264 -5.805 1.00 0.00 C ATOM 285 OE1 GLU A 53 18.303 0.901 -5.889 1.00 0.00 O ATOM 286 OE2 GLU A 53 18.459 -1.176 -6.440 1.00 0.00 O ATOM 0 H GLU A 53 13.317 0.727 -5.785 1.00 0.00 H new ATOM 0 HA GLU A 53 14.266 -1.864 -4.893 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.444 -0.414 -6.509 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.404 0.941 -5.397 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.971 -0.117 -3.885 1.00 0.00 H new ATOM 0 HG3 GLU A 53 16.786 -1.678 -4.661 1.00 0.00 H new ATOM 293 N ASP A 54 14.732 0.572 -2.735 1.00 0.00 N ATOM 294 CA ASP A 54 14.928 0.784 -1.264 1.00 0.00 C ATOM 295 C ASP A 54 13.593 0.770 -0.518 1.00 0.00 C ATOM 296 O ASP A 54 13.539 0.764 0.695 1.00 0.00 O ATOM 297 CB ASP A 54 15.579 2.154 -1.157 1.00 0.00 C ATOM 298 CG ASP A 54 16.251 2.299 0.210 1.00 0.00 C ATOM 299 OD1 ASP A 54 15.535 2.366 1.196 1.00 0.00 O ATOM 300 OD2 ASP A 54 17.469 2.339 0.247 1.00 0.00 O ATOM 0 H ASP A 54 14.792 1.413 -3.309 1.00 0.00 H new ATOM 0 HA ASP A 54 15.534 -0.005 -0.819 1.00 0.00 H new ATOM 0 HB2 ASP A 54 16.315 2.281 -1.951 1.00 0.00 H new ATOM 0 HB3 ASP A 54 14.830 2.935 -1.290 1.00 0.00 H new ATOM 305 N ILE A 55 12.524 0.782 -1.246 1.00 0.00 N ATOM 306 CA ILE A 55 11.173 0.790 -0.627 1.00 0.00 C ATOM 307 C ILE A 55 10.509 -0.575 -0.784 1.00 0.00 C ATOM 308 O ILE A 55 9.744 -1.014 0.052 1.00 0.00 O ATOM 309 CB ILE A 55 10.408 1.867 -1.412 1.00 0.00 C ATOM 310 CG1 ILE A 55 9.380 2.534 -0.523 1.00 0.00 C ATOM 311 CG2 ILE A 55 9.670 1.244 -2.579 1.00 0.00 C ATOM 312 CD1 ILE A 55 10.082 3.247 0.631 1.00 0.00 C ATOM 0 H ILE A 55 12.525 0.787 -2.266 1.00 0.00 H new ATOM 0 HA ILE A 55 11.198 0.997 0.443 1.00 0.00 H new ATOM 0 HB ILE A 55 11.135 2.597 -1.768 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.794 3.248 -1.101 1.00 0.00 H new ATOM 0 HG13 ILE A 55 8.684 1.791 -0.134 1.00 0.00 H new ATOM 0 HG21 ILE A 55 9.133 2.019 -3.125 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.385 0.760 -3.245 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.961 0.504 -2.208 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.339 3.726 1.269 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.649 2.522 1.215 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.760 4.002 0.233 1.00 0.00 H new ATOM 324 N VAL A 56 10.762 -1.221 -1.883 1.00 0.00 N ATOM 325 CA VAL A 56 10.112 -2.524 -2.140 1.00 0.00 C ATOM 326 C VAL A 56 11.132 -3.673 -2.242 1.00 0.00 C ATOM 327 O VAL A 56 10.936 -4.719 -1.655 1.00 0.00 O ATOM 328 CB VAL A 56 9.353 -2.285 -3.448 1.00 0.00 C ATOM 329 CG1 VAL A 56 9.239 -3.578 -4.244 1.00 0.00 C ATOM 330 CG2 VAL A 56 7.956 -1.767 -3.102 1.00 0.00 C ATOM 0 H VAL A 56 11.394 -0.899 -2.616 1.00 0.00 H new ATOM 0 HA VAL A 56 9.454 -2.840 -1.330 1.00 0.00 H new ATOM 0 HB VAL A 56 9.890 -1.558 -4.057 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.697 -3.388 -5.170 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.236 -3.951 -4.477 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.702 -4.322 -3.655 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.396 -1.589 -4.020 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.433 -2.507 -2.496 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.042 -0.835 -2.543 1.00 0.00 H new ATOM 340 N LEU A 57 12.211 -3.516 -2.971 1.00 0.00 N ATOM 341 CA LEU A 57 13.184 -4.649 -3.060 1.00 0.00 C ATOM 342 C LEU A 57 13.639 -5.044 -1.652 1.00 0.00 C ATOM 343 O LEU A 57 13.792 -6.208 -1.341 1.00 0.00 O ATOM 344 CB LEU A 57 14.356 -4.137 -3.907 1.00 0.00 C ATOM 345 CG LEU A 57 15.635 -4.902 -3.558 1.00 0.00 C ATOM 346 CD1 LEU A 57 16.617 -4.803 -4.725 1.00 0.00 C ATOM 347 CD2 LEU A 57 16.266 -4.290 -2.305 1.00 0.00 C ATOM 0 H LEU A 57 12.456 -2.676 -3.495 1.00 0.00 H new ATOM 0 HA LEU A 57 12.746 -5.537 -3.515 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.129 -4.258 -4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 57 14.502 -3.071 -3.732 1.00 0.00 H new ATOM 0 HG LEU A 57 15.397 -5.949 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 57 17.529 -5.347 -4.480 1.00 0.00 H new ATOM 0 HD12 LEU A 57 16.166 -5.235 -5.618 1.00 0.00 H new ATOM 0 HD13 LEU A 57 16.857 -3.756 -4.910 1.00 0.00 H new ATOM 0 HD21 LEU A 57 17.177 -4.833 -2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 57 16.507 -3.244 -2.493 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.564 -4.357 -1.474 1.00 0.00 H new ATOM 359 N LYS A 58 13.842 -4.082 -0.799 1.00 0.00 N ATOM 360 CA LYS A 58 14.275 -4.397 0.593 1.00 0.00 C ATOM 361 C LYS A 58 13.054 -4.494 1.512 1.00 0.00 C ATOM 362 O LYS A 58 12.897 -5.441 2.257 1.00 0.00 O ATOM 363 CB LYS A 58 15.161 -3.224 1.011 1.00 0.00 C ATOM 364 CG LYS A 58 16.294 -3.734 1.906 1.00 0.00 C ATOM 365 CD LYS A 58 17.361 -2.647 2.055 1.00 0.00 C ATOM 366 CE LYS A 58 18.505 -3.168 2.929 1.00 0.00 C ATOM 367 NZ LYS A 58 19.713 -3.104 2.061 1.00 0.00 N ATOM 0 H LYS A 58 13.727 -3.089 -1.004 1.00 0.00 H new ATOM 0 HA LYS A 58 14.803 -5.349 0.655 1.00 0.00 H new ATOM 0 HB2 LYS A 58 15.573 -2.733 0.129 1.00 0.00 H new ATOM 0 HB3 LYS A 58 14.570 -2.479 1.544 1.00 0.00 H new ATOM 0 HG2 LYS A 58 15.902 -4.009 2.885 1.00 0.00 H new ATOM 0 HG3 LYS A 58 16.734 -4.633 1.475 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.741 -2.359 1.075 1.00 0.00 H new ATOM 0 HD3 LYS A 58 16.925 -1.754 2.503 1.00 0.00 H new ATOM 0 HE2 LYS A 58 18.629 -2.557 3.823 1.00 0.00 H new ATOM 0 HE3 LYS A 58 18.313 -4.187 3.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 20.540 -3.446 2.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 19.569 -3.701 1.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 19.875 -2.121 1.763 1.00 0.00 H new ATOM 381 N GLY A 59 12.191 -3.516 1.467 1.00 0.00 N ATOM 382 CA GLY A 59 10.982 -3.541 2.340 1.00 0.00 C ATOM 383 C GLY A 59 9.904 -4.431 1.715 1.00 0.00 C ATOM 384 O GLY A 59 9.251 -5.198 2.395 1.00 0.00 O ATOM 0 H GLY A 59 12.271 -2.699 0.862 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.245 -3.915 3.329 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.598 -2.530 2.473 1.00 0.00 H new ATOM 388 N GLY A 60 9.705 -4.335 0.428 1.00 0.00 N ATOM 389 CA GLY A 60 8.664 -5.175 -0.227 1.00 0.00 C ATOM 390 C GLY A 60 9.109 -6.638 -0.218 1.00 0.00 C ATOM 391 O GLY A 60 8.398 -7.502 0.246 1.00 0.00 O ATOM 0 H GLY A 60 10.218 -3.712 -0.196 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.714 -5.070 0.297 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.502 -4.839 -1.251 1.00 0.00 H new ATOM 395 N LYS A 61 10.283 -6.915 -0.727 1.00 0.00 N ATOM 396 CA LYS A 61 10.801 -8.317 -0.768 1.00 0.00 C ATOM 397 C LYS A 61 11.103 -8.876 0.634 1.00 0.00 C ATOM 398 O LYS A 61 11.728 -9.910 0.764 1.00 0.00 O ATOM 399 CB LYS A 61 12.090 -8.225 -1.580 1.00 0.00 C ATOM 400 CG LYS A 61 12.277 -9.514 -2.382 1.00 0.00 C ATOM 401 CD LYS A 61 13.484 -9.369 -3.310 1.00 0.00 C ATOM 402 CE LYS A 61 14.772 -9.476 -2.490 1.00 0.00 C ATOM 403 NZ LYS A 61 15.804 -9.960 -3.450 1.00 0.00 N ATOM 0 H LYS A 61 10.914 -6.218 -1.122 1.00 0.00 H new ATOM 0 HA LYS A 61 10.062 -8.992 -1.200 1.00 0.00 H new ATOM 0 HB2 LYS A 61 12.049 -7.368 -2.252 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.941 -8.070 -0.917 1.00 0.00 H new ATOM 0 HG2 LYS A 61 12.424 -10.357 -1.706 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.380 -9.725 -2.965 1.00 0.00 H new ATOM 0 HD2 LYS A 61 13.462 -10.144 -4.076 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.447 -8.409 -3.826 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.050 -8.512 -2.065 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.653 -10.169 -1.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 16.716 -10.058 -2.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 15.516 -10.883 -3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 15.901 -9.277 -4.228 1.00 0.00 H new ATOM 417 N ALA A 62 10.667 -8.228 1.680 1.00 0.00 N ATOM 418 CA ALA A 62 10.937 -8.762 3.035 1.00 0.00 C ATOM 419 C ALA A 62 10.511 -10.223 3.068 1.00 0.00 C ATOM 420 O ALA A 62 11.312 -11.128 3.200 1.00 0.00 O ATOM 421 CB ALA A 62 10.072 -7.926 3.979 1.00 0.00 C ATOM 0 H ALA A 62 10.138 -7.356 1.650 1.00 0.00 H new ATOM 0 HA ALA A 62 11.988 -8.708 3.317 1.00 0.00 H new ATOM 0 HB1 ALA A 62 10.220 -8.265 5.004 1.00 0.00 H new ATOM 0 HB2 ALA A 62 10.356 -6.877 3.899 1.00 0.00 H new ATOM 0 HB3 ALA A 62 9.023 -8.039 3.707 1.00 0.00 H new ATOM 427 N LYS A 63 9.243 -10.444 2.896 1.00 0.00 N ATOM 428 CA LYS A 63 8.704 -11.830 2.853 1.00 0.00 C ATOM 429 C LYS A 63 8.559 -12.204 1.382 1.00 0.00 C ATOM 430 O LYS A 63 8.530 -13.359 1.004 1.00 0.00 O ATOM 431 CB LYS A 63 7.325 -11.762 3.520 1.00 0.00 C ATOM 432 CG LYS A 63 7.351 -10.791 4.704 1.00 0.00 C ATOM 433 CD LYS A 63 5.927 -10.332 5.013 1.00 0.00 C ATOM 434 CE LYS A 63 5.453 -9.391 3.903 1.00 0.00 C ATOM 435 NZ LYS A 63 4.332 -8.618 4.506 1.00 0.00 N ATOM 0 H LYS A 63 8.543 -9.711 2.781 1.00 0.00 H new ATOM 0 HA LYS A 63 9.337 -12.562 3.355 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.578 -11.440 2.794 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.030 -12.754 3.862 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.786 -11.276 5.577 1.00 0.00 H new ATOM 0 HG3 LYS A 63 7.980 -9.932 4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.262 -11.193 5.086 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.897 -9.823 5.976 1.00 0.00 H new ATOM 0 HE2 LYS A 63 6.256 -8.731 3.575 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.122 -9.949 3.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 3.954 -7.950 3.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.579 -9.272 4.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 4.679 -8.092 5.333 1.00 0.00 H new ATOM 449 N ASN A 64 8.476 -11.196 0.561 1.00 0.00 N ATOM 450 CA ASN A 64 8.336 -11.395 -0.906 1.00 0.00 C ATOM 451 C ASN A 64 9.633 -11.965 -1.488 1.00 0.00 C ATOM 452 O ASN A 64 10.707 -11.449 -1.252 1.00 0.00 O ATOM 453 CB ASN A 64 8.081 -9.981 -1.431 1.00 0.00 C ATOM 454 CG ASN A 64 6.594 -9.808 -1.746 1.00 0.00 C ATOM 455 OD1 ASN A 64 6.227 -9.002 -2.578 1.00 0.00 O ATOM 456 ND2 ASN A 64 5.715 -10.530 -1.106 1.00 0.00 N ATOM 0 H ASN A 64 8.500 -10.219 0.854 1.00 0.00 H new ATOM 0 HA ASN A 64 7.545 -12.096 -1.175 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.393 -9.246 -0.690 1.00 0.00 H new ATOM 0 HB3 ASN A 64 8.676 -9.803 -2.327 1.00 0.00 H new ATOM 0 HD21 ASN A 64 4.721 -10.417 -1.304 1.00 0.00 H new ATOM 0 HD22 ASN A 64 6.022 -11.207 -0.407 1.00 0.00 H new ATOM 463 N PRO A 65 9.475 -13.025 -2.227 1.00 0.00 N ATOM 464 CA PRO A 65 10.622 -13.717 -2.867 1.00 0.00 C ATOM 465 C PRO A 65 11.323 -12.818 -3.892 1.00 0.00 C ATOM 466 O PRO A 65 12.534 -12.749 -3.940 1.00 0.00 O ATOM 467 CB PRO A 65 9.950 -14.907 -3.550 1.00 0.00 C ATOM 468 CG PRO A 65 8.549 -14.469 -3.761 1.00 0.00 C ATOM 469 CD PRO A 65 8.212 -13.692 -2.545 1.00 0.00 C ATOM 0 HA PRO A 65 11.402 -14.000 -2.160 1.00 0.00 H new ATOM 0 HB2 PRO A 65 10.437 -15.150 -4.495 1.00 0.00 H new ATOM 0 HB3 PRO A 65 9.997 -15.801 -2.928 1.00 0.00 H new ATOM 0 HG2 PRO A 65 8.456 -13.859 -4.659 1.00 0.00 H new ATOM 0 HG3 PRO A 65 7.881 -15.322 -3.884 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.412 -12.976 -2.731 1.00 0.00 H new ATOM 0 HD3 PRO A 65 7.879 -14.337 -1.732 1.00 0.00 H new ATOM 477 N SER A 66 10.577 -12.131 -4.714 1.00 0.00 N ATOM 478 CA SER A 66 11.209 -11.247 -5.727 1.00 0.00 C ATOM 479 C SER A 66 10.138 -10.581 -6.555 1.00 0.00 C ATOM 480 O SER A 66 9.387 -11.195 -7.286 1.00 0.00 O ATOM 481 CB SER A 66 12.094 -12.149 -6.576 1.00 0.00 C ATOM 482 OG SER A 66 13.458 -11.828 -6.334 1.00 0.00 O ATOM 0 H SER A 66 9.557 -12.146 -4.726 1.00 0.00 H new ATOM 0 HA SER A 66 11.800 -10.451 -5.274 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.906 -13.195 -6.334 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.859 -12.019 -7.632 1.00 0.00 H new ATOM 0 HG SER A 66 13.674 -12.006 -5.395 1.00 0.00 H new ATOM 488 N ILE A 67 10.053 -9.320 -6.368 1.00 0.00 N ATOM 489 CA ILE A 67 9.041 -8.501 -7.020 1.00 0.00 C ATOM 490 C ILE A 67 9.595 -7.809 -8.265 1.00 0.00 C ATOM 491 O ILE A 67 10.719 -7.348 -8.286 1.00 0.00 O ATOM 492 CB ILE A 67 8.729 -7.515 -5.908 1.00 0.00 C ATOM 493 CG1 ILE A 67 7.732 -8.155 -4.937 1.00 0.00 C ATOM 494 CG2 ILE A 67 8.149 -6.218 -6.478 1.00 0.00 C ATOM 495 CD1 ILE A 67 8.167 -9.596 -4.636 1.00 0.00 C ATOM 0 H ILE A 67 10.679 -8.797 -5.756 1.00 0.00 H new ATOM 0 HA ILE A 67 8.175 -9.049 -7.391 1.00 0.00 H new ATOM 0 HB ILE A 67 9.651 -7.269 -5.381 1.00 0.00 H new ATOM 0 HG12 ILE A 67 7.685 -7.577 -4.014 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.731 -8.148 -5.369 1.00 0.00 H new ATOM 0 HG21 ILE A 67 7.933 -5.527 -5.663 1.00 0.00 H new ATOM 0 HG22 ILE A 67 8.871 -5.764 -7.157 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.229 -6.438 -7.020 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.459 -10.053 -3.945 1.00 0.00 H new ATOM 0 HD12 ILE A 67 8.192 -10.170 -5.563 1.00 0.00 H new ATOM 0 HD13 ILE A 67 9.160 -9.590 -4.186 1.00 0.00 H new ATOM 507 N VAL A 68 8.808 -7.730 -9.301 1.00 0.00 N ATOM 508 CA VAL A 68 9.283 -7.061 -10.545 1.00 0.00 C ATOM 509 C VAL A 68 9.095 -5.549 -10.430 1.00 0.00 C ATOM 510 O VAL A 68 8.071 -5.070 -9.983 1.00 0.00 O ATOM 511 CB VAL A 68 8.417 -7.623 -11.678 1.00 0.00 C ATOM 512 CG1 VAL A 68 8.371 -6.633 -12.849 1.00 0.00 C ATOM 513 CG2 VAL A 68 9.009 -8.945 -12.166 1.00 0.00 C ATOM 0 H VAL A 68 7.858 -8.099 -9.341 1.00 0.00 H new ATOM 0 HA VAL A 68 10.342 -7.244 -10.725 1.00 0.00 H new ATOM 0 HB VAL A 68 7.407 -7.784 -11.302 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.753 -7.043 -13.648 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.946 -5.688 -12.510 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.381 -6.464 -13.222 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.393 -9.344 -12.972 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.022 -8.777 -12.533 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.035 -9.658 -11.342 1.00 0.00 H new ATOM 523 N VAL A 69 10.067 -4.794 -10.848 1.00 0.00 N ATOM 524 CA VAL A 69 9.936 -3.317 -10.784 1.00 0.00 C ATOM 525 C VAL A 69 10.053 -2.743 -12.193 1.00 0.00 C ATOM 526 O VAL A 69 11.102 -2.294 -12.609 1.00 0.00 O ATOM 527 CB VAL A 69 11.095 -2.846 -9.911 1.00 0.00 C ATOM 528 CG1 VAL A 69 10.959 -1.344 -9.650 1.00 0.00 C ATOM 529 CG2 VAL A 69 11.067 -3.606 -8.582 1.00 0.00 C ATOM 0 H VAL A 69 10.948 -5.137 -11.232 1.00 0.00 H new ATOM 0 HA VAL A 69 8.978 -2.996 -10.376 1.00 0.00 H new ATOM 0 HB VAL A 69 12.040 -3.038 -10.419 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.787 -1.007 -9.026 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.977 -0.807 -10.598 1.00 0.00 H new ATOM 0 HG13 VAL A 69 10.016 -1.147 -9.139 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.894 -3.273 -7.955 1.00 0.00 H new ATOM 0 HG22 VAL A 69 10.123 -3.412 -8.072 1.00 0.00 H new ATOM 0 HG23 VAL A 69 11.164 -4.675 -8.772 1.00 0.00 H new ATOM 539 N GLU A 70 8.984 -2.767 -12.936 1.00 0.00 N ATOM 540 CA GLU A 70 9.030 -2.236 -14.326 1.00 0.00 C ATOM 541 C GLU A 70 8.954 -0.709 -14.313 1.00 0.00 C ATOM 542 O GLU A 70 8.221 -0.119 -13.544 1.00 0.00 O ATOM 543 CB GLU A 70 7.785 -2.805 -15.003 1.00 0.00 C ATOM 544 CG GLU A 70 7.805 -4.328 -14.993 1.00 0.00 C ATOM 545 CD GLU A 70 9.211 -4.840 -15.311 1.00 0.00 C ATOM 546 OE1 GLU A 70 10.071 -4.722 -14.452 1.00 0.00 O ATOM 547 OE2 GLU A 70 9.406 -5.342 -16.406 1.00 0.00 O ATOM 0 H GLU A 70 8.078 -3.132 -12.641 1.00 0.00 H new ATOM 0 HA GLU A 70 9.951 -2.513 -14.839 1.00 0.00 H new ATOM 0 HB2 GLU A 70 6.892 -2.446 -14.491 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.729 -2.445 -16.030 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.488 -4.697 -14.018 1.00 0.00 H new ATOM 0 HG3 GLU A 70 7.096 -4.713 -15.725 1.00 0.00 H new ATOM 554 N ASP A 71 9.694 -0.066 -15.169 1.00 0.00 N ATOM 555 CA ASP A 71 9.662 1.422 -15.219 1.00 0.00 C ATOM 556 C ASP A 71 9.847 1.891 -16.662 1.00 0.00 C ATOM 557 O ASP A 71 10.775 1.489 -17.337 1.00 0.00 O ATOM 558 CB ASP A 71 10.836 1.874 -14.351 1.00 0.00 C ATOM 559 CG ASP A 71 10.625 1.392 -12.915 1.00 0.00 C ATOM 560 OD1 ASP A 71 10.880 0.228 -12.659 1.00 0.00 O ATOM 561 OD2 ASP A 71 10.211 2.197 -12.096 1.00 0.00 O ATOM 0 H ASP A 71 10.323 -0.508 -15.840 1.00 0.00 H new ATOM 0 HA ASP A 71 8.717 1.833 -14.864 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.770 1.474 -14.747 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.921 2.961 -14.372 1.00 0.00 H new ATOM 566 N LYS A 72 8.974 2.728 -17.150 1.00 0.00 N ATOM 567 CA LYS A 72 9.124 3.197 -18.561 1.00 0.00 C ATOM 568 C LYS A 72 8.392 4.524 -18.788 1.00 0.00 C ATOM 569 O LYS A 72 7.840 5.102 -17.876 1.00 0.00 O ATOM 570 CB LYS A 72 8.503 2.086 -19.409 1.00 0.00 C ATOM 571 CG LYS A 72 9.038 2.175 -20.839 1.00 0.00 C ATOM 572 CD LYS A 72 9.017 0.788 -21.482 1.00 0.00 C ATOM 573 CE LYS A 72 7.566 0.331 -21.657 1.00 0.00 C ATOM 574 NZ LYS A 72 7.555 -1.092 -21.217 1.00 0.00 N ATOM 0 H LYS A 72 8.173 3.105 -16.643 1.00 0.00 H new ATOM 0 HA LYS A 72 10.167 3.382 -18.817 1.00 0.00 H new ATOM 0 HB2 LYS A 72 8.740 1.112 -18.981 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.417 2.178 -19.409 1.00 0.00 H new ATOM 0 HG2 LYS A 72 8.431 2.867 -21.423 1.00 0.00 H new ATOM 0 HG3 LYS A 72 10.054 2.569 -20.834 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.520 0.815 -22.448 1.00 0.00 H new ATOM 0 HD3 LYS A 72 9.561 0.078 -20.859 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.887 0.935 -21.056 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.244 0.426 -22.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 6.593 -1.476 -21.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.206 -1.644 -21.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 7.859 -1.151 -20.224 1.00 0.00 H new ATOM 588 N ALA A 73 8.401 5.003 -20.009 1.00 0.00 N ATOM 589 CA ALA A 73 7.725 6.298 -20.350 1.00 0.00 C ATOM 590 C ALA A 73 6.577 6.612 -19.386 1.00 0.00 C ATOM 591 O ALA A 73 5.460 6.168 -19.567 1.00 0.00 O ATOM 592 CB ALA A 73 7.186 6.088 -21.765 1.00 0.00 C ATOM 0 H ALA A 73 8.856 4.544 -20.798 1.00 0.00 H new ATOM 0 HA ALA A 73 8.414 7.139 -20.277 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.673 6.991 -22.097 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.013 5.871 -22.441 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.487 5.252 -21.768 1.00 0.00 H new ATOM 598 N GLY A 74 6.850 7.377 -18.362 1.00 0.00 N ATOM 599 CA GLY A 74 5.789 7.732 -17.377 1.00 0.00 C ATOM 600 C GLY A 74 4.931 6.513 -17.084 1.00 0.00 C ATOM 601 O GLY A 74 3.721 6.583 -17.032 1.00 0.00 O ATOM 0 H GLY A 74 7.769 7.773 -18.165 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.243 8.099 -16.456 1.00 0.00 H new ATOM 0 HA3 GLY A 74 5.170 8.538 -17.770 1.00 0.00 H new ATOM 605 N PHE A 75 5.565 5.405 -16.888 1.00 0.00 N ATOM 606 CA PHE A 75 4.824 4.144 -16.589 1.00 0.00 C ATOM 607 C PHE A 75 5.528 3.375 -15.469 1.00 0.00 C ATOM 608 O PHE A 75 6.401 2.564 -15.706 1.00 0.00 O ATOM 609 CB PHE A 75 4.865 3.347 -17.900 1.00 0.00 C ATOM 610 CG PHE A 75 3.469 3.141 -18.455 1.00 0.00 C ATOM 611 CD1 PHE A 75 2.448 4.066 -18.191 1.00 0.00 C ATOM 612 CD2 PHE A 75 3.200 2.016 -19.245 1.00 0.00 C ATOM 613 CE1 PHE A 75 1.165 3.865 -18.717 1.00 0.00 C ATOM 614 CE2 PHE A 75 1.917 1.815 -19.769 1.00 0.00 C ATOM 615 CZ PHE A 75 0.900 2.740 -19.505 1.00 0.00 C ATOM 0 H PHE A 75 6.580 5.308 -16.921 1.00 0.00 H new ATOM 0 HA PHE A 75 3.803 4.328 -16.254 1.00 0.00 H new ATOM 0 HB2 PHE A 75 5.477 3.875 -18.632 1.00 0.00 H new ATOM 0 HB3 PHE A 75 5.338 2.380 -17.727 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.651 4.934 -17.582 1.00 0.00 H new ATOM 0 HD2 PHE A 75 3.984 1.302 -19.450 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.380 4.579 -18.514 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.712 0.946 -20.377 1.00 0.00 H new ATOM 0 HZ PHE A 75 -0.089 2.585 -19.910 1.00 0.00 H new ATOM 625 N TRP A 76 5.148 3.627 -14.249 1.00 0.00 N ATOM 626 CA TRP A 76 5.782 2.917 -13.104 1.00 0.00 C ATOM 627 C TRP A 76 5.116 1.551 -12.916 1.00 0.00 C ATOM 628 O TRP A 76 4.233 1.390 -12.099 1.00 0.00 O ATOM 629 CB TRP A 76 5.509 3.827 -11.901 1.00 0.00 C ATOM 630 CG TRP A 76 5.759 3.104 -10.631 1.00 0.00 C ATOM 631 CD1 TRP A 76 6.698 2.160 -10.454 1.00 0.00 C ATOM 632 CD2 TRP A 76 5.107 3.285 -9.341 1.00 0.00 C ATOM 633 NE1 TRP A 76 6.641 1.718 -9.157 1.00 0.00 N ATOM 634 CE2 TRP A 76 5.673 2.378 -8.425 1.00 0.00 C ATOM 635 CE3 TRP A 76 4.084 4.130 -8.889 1.00 0.00 C ATOM 636 CZ2 TRP A 76 5.236 2.307 -7.103 1.00 0.00 C ATOM 637 CZ3 TRP A 76 3.645 4.071 -7.562 1.00 0.00 C ATOM 638 CH2 TRP A 76 4.217 3.157 -6.668 1.00 0.00 C ATOM 0 H TRP A 76 4.422 4.297 -13.994 1.00 0.00 H new ATOM 0 HA TRP A 76 6.847 2.734 -13.246 1.00 0.00 H new ATOM 0 HB2 TRP A 76 6.146 4.710 -11.954 1.00 0.00 H new ATOM 0 HB3 TRP A 76 4.477 4.176 -11.930 1.00 0.00 H new ATOM 0 HD1 TRP A 76 7.385 1.807 -11.209 1.00 0.00 H new ATOM 0 HE1 TRP A 76 7.243 0.987 -8.777 1.00 0.00 H new ATOM 0 HE3 TRP A 76 3.630 4.833 -9.572 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 5.682 1.599 -6.420 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 2.861 4.733 -7.225 1.00 0.00 H new ATOM 0 HH2 TRP A 76 3.871 3.110 -5.646 1.00 0.00 H new ATOM 649 N TRP A 77 5.521 0.568 -13.676 1.00 0.00 N ATOM 650 CA TRP A 77 4.889 -0.776 -13.542 1.00 0.00 C ATOM 651 C TRP A 77 5.623 -1.625 -12.503 1.00 0.00 C ATOM 652 O TRP A 77 6.830 -1.745 -12.521 1.00 0.00 O ATOM 653 CB TRP A 77 5.000 -1.422 -14.929 1.00 0.00 C ATOM 654 CG TRP A 77 3.895 -0.916 -15.793 1.00 0.00 C ATOM 655 CD1 TRP A 77 3.714 0.380 -16.133 1.00 0.00 C ATOM 656 CD2 TRP A 77 2.818 -1.664 -16.431 1.00 0.00 C ATOM 657 NE1 TRP A 77 2.572 0.479 -16.907 1.00 0.00 N ATOM 658 CE2 TRP A 77 1.996 -0.752 -17.133 1.00 0.00 C ATOM 659 CE3 TRP A 77 2.473 -3.027 -16.466 1.00 0.00 C ATOM 660 CZ2 TRP A 77 0.873 -1.174 -17.843 1.00 0.00 C ATOM 661 CZ3 TRP A 77 1.342 -3.456 -17.183 1.00 0.00 C ATOM 662 CH2 TRP A 77 0.543 -2.530 -17.868 1.00 0.00 C ATOM 0 H TRP A 77 6.257 0.637 -14.379 1.00 0.00 H new ATOM 0 HA TRP A 77 3.854 -0.697 -13.208 1.00 0.00 H new ATOM 0 HB2 TRP A 77 5.965 -1.187 -15.377 1.00 0.00 H new ATOM 0 HB3 TRP A 77 4.944 -2.507 -14.844 1.00 0.00 H new ATOM 0 HD1 TRP A 77 4.355 1.201 -15.848 1.00 0.00 H new ATOM 0 HE1 TRP A 77 2.201 1.358 -17.267 1.00 0.00 H new ATOM 0 HE3 TRP A 77 3.080 -3.748 -15.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 0.262 -0.456 -18.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 1.087 -4.505 -17.206 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.326 -2.865 -18.414 1.00 0.00 H new ATOM 673 N ILE A 78 4.896 -2.221 -11.602 1.00 0.00 N ATOM 674 CA ILE A 78 5.534 -3.077 -10.568 1.00 0.00 C ATOM 675 C ILE A 78 4.756 -4.381 -10.422 1.00 0.00 C ATOM 676 O ILE A 78 3.574 -4.446 -10.693 1.00 0.00 O ATOM 677 CB ILE A 78 5.468 -2.264 -9.279 1.00 0.00 C ATOM 678 CG1 ILE A 78 5.908 -0.841 -9.553 1.00 0.00 C ATOM 679 CG2 ILE A 78 6.377 -2.891 -8.227 1.00 0.00 C ATOM 680 CD1 ILE A 78 7.296 -0.866 -10.151 1.00 0.00 C ATOM 0 H ILE A 78 3.880 -2.151 -11.538 1.00 0.00 H new ATOM 0 HA ILE A 78 6.560 -3.342 -10.824 1.00 0.00 H new ATOM 0 HB ILE A 78 4.443 -2.259 -8.908 1.00 0.00 H new ATOM 0 HG12 ILE A 78 5.211 -0.356 -10.237 1.00 0.00 H new ATOM 0 HG13 ILE A 78 5.905 -0.261 -8.630 1.00 0.00 H new ATOM 0 HG21 ILE A 78 6.327 -2.307 -7.308 1.00 0.00 H new ATOM 0 HG22 ILE A 78 6.051 -3.912 -8.027 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.403 -2.903 -8.594 1.00 0.00 H new ATOM 0 HD11 ILE A 78 7.624 0.154 -10.353 1.00 0.00 H new ATOM 0 HD12 ILE A 78 7.986 -1.337 -9.450 1.00 0.00 H new ATOM 0 HD13 ILE A 78 7.281 -1.433 -11.082 1.00 0.00 H new ATOM 692 N LYS A 79 5.414 -5.425 -10.005 1.00 0.00 N ATOM 693 CA LYS A 79 4.707 -6.730 -9.857 1.00 0.00 C ATOM 694 C LYS A 79 5.230 -7.502 -8.639 1.00 0.00 C ATOM 695 O LYS A 79 6.418 -7.605 -8.415 1.00 0.00 O ATOM 696 CB LYS A 79 4.990 -7.474 -11.176 1.00 0.00 C ATOM 697 CG LYS A 79 5.294 -8.960 -10.920 1.00 0.00 C ATOM 698 CD LYS A 79 4.843 -9.790 -12.122 1.00 0.00 C ATOM 699 CE LYS A 79 5.543 -9.282 -13.384 1.00 0.00 C ATOM 700 NZ LYS A 79 4.449 -9.095 -14.378 1.00 0.00 N ATOM 0 H LYS A 79 6.404 -5.434 -9.761 1.00 0.00 H new ATOM 0 HA LYS A 79 3.637 -6.611 -9.684 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.130 -7.385 -11.839 1.00 0.00 H new ATOM 0 HB3 LYS A 79 5.834 -7.009 -11.685 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.362 -9.099 -10.749 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.781 -9.297 -10.019 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.079 -10.842 -11.960 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.762 -9.721 -12.240 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.069 -8.347 -13.195 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.283 -9.998 -13.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 4.849 -8.747 -15.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.970 -10.004 -14.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.763 -8.403 -14.013 1.00 0.00 H new ATOM 714 N ALA A 80 4.337 -8.058 -7.865 1.00 0.00 N ATOM 715 CA ALA A 80 4.759 -8.838 -6.667 1.00 0.00 C ATOM 716 C ALA A 80 3.945 -10.132 -6.570 1.00 0.00 C ATOM 717 O ALA A 80 2.758 -10.150 -6.826 1.00 0.00 O ATOM 718 CB ALA A 80 4.453 -7.928 -5.478 1.00 0.00 C ATOM 0 H ALA A 80 3.329 -8.005 -8.012 1.00 0.00 H new ATOM 0 HA ALA A 80 5.811 -9.122 -6.706 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.736 -8.430 -4.553 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.018 -7.001 -5.575 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.387 -7.703 -5.457 1.00 0.00 H new ATOM 724 N ASP A 81 4.571 -11.216 -6.199 1.00 0.00 N ATOM 725 CA ASP A 81 3.824 -12.503 -6.087 1.00 0.00 C ATOM 726 C ASP A 81 3.141 -12.603 -4.721 1.00 0.00 C ATOM 727 O ASP A 81 3.273 -13.584 -4.016 1.00 0.00 O ATOM 728 CB ASP A 81 4.885 -13.593 -6.241 1.00 0.00 C ATOM 729 CG ASP A 81 4.211 -14.915 -6.615 1.00 0.00 C ATOM 730 OD1 ASP A 81 3.059 -15.094 -6.255 1.00 0.00 O ATOM 731 OD2 ASP A 81 4.859 -15.726 -7.255 1.00 0.00 O ATOM 0 H ASP A 81 5.563 -11.267 -5.969 1.00 0.00 H new ATOM 0 HA ASP A 81 3.039 -12.591 -6.839 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.604 -13.309 -7.010 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.442 -13.707 -5.311 1.00 0.00 H new ATOM 736 N GLY A 82 2.409 -11.593 -4.350 1.00 0.00 N ATOM 737 CA GLY A 82 1.710 -11.609 -3.049 1.00 0.00 C ATOM 738 C GLY A 82 0.752 -10.418 -2.971 1.00 0.00 C ATOM 739 O GLY A 82 0.215 -9.976 -3.966 1.00 0.00 O ATOM 0 H GLY A 82 2.267 -10.748 -4.904 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.158 -12.542 -2.932 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.433 -11.562 -2.235 1.00 0.00 H new ATOM 743 N ALA A 83 0.539 -9.891 -1.794 1.00 0.00 N ATOM 744 CA ALA A 83 -0.379 -8.723 -1.654 1.00 0.00 C ATOM 745 C ALA A 83 0.404 -7.421 -1.851 1.00 0.00 C ATOM 746 O ALA A 83 1.553 -7.314 -1.473 1.00 0.00 O ATOM 747 CB ALA A 83 -0.924 -8.814 -0.228 1.00 0.00 C ATOM 0 H ALA A 83 0.960 -10.218 -0.925 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.180 -8.731 -2.393 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.610 -7.986 -0.047 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.453 -9.758 -0.100 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.098 -8.763 0.481 1.00 0.00 H new ATOM 753 N ILE A 84 -0.207 -6.431 -2.446 1.00 0.00 N ATOM 754 CA ILE A 84 0.508 -5.141 -2.671 1.00 0.00 C ATOM 755 C ILE A 84 -0.440 -3.958 -2.478 1.00 0.00 C ATOM 756 O ILE A 84 -1.634 -4.127 -2.310 1.00 0.00 O ATOM 757 CB ILE A 84 0.974 -5.202 -4.120 1.00 0.00 C ATOM 758 CG1 ILE A 84 1.603 -3.867 -4.499 1.00 0.00 C ATOM 759 CG2 ILE A 84 -0.224 -5.474 -5.033 1.00 0.00 C ATOM 760 CD1 ILE A 84 2.414 -4.050 -5.772 1.00 0.00 C ATOM 0 H ILE A 84 -1.168 -6.460 -2.785 1.00 0.00 H new ATOM 0 HA ILE A 84 1.332 -5.005 -1.971 1.00 0.00 H new ATOM 0 HB ILE A 84 1.706 -6.002 -4.235 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.829 -3.115 -4.650 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.243 -3.509 -3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.111 -5.517 -6.069 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -0.682 -6.425 -4.759 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.956 -4.674 -4.921 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.869 -3.100 -6.053 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.195 -4.791 -5.602 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.760 -4.390 -6.575 1.00 0.00 H new ATOM 772 N GLU A 85 0.072 -2.756 -2.501 1.00 0.00 N ATOM 773 CA GLU A 85 -0.809 -1.595 -2.317 1.00 0.00 C ATOM 774 C GLU A 85 -0.567 -0.515 -3.380 1.00 0.00 C ATOM 775 O GLU A 85 0.306 -0.623 -4.218 1.00 0.00 O ATOM 776 CB GLU A 85 -0.495 -1.071 -0.915 1.00 0.00 C ATOM 777 CG GLU A 85 -1.342 -1.829 0.110 1.00 0.00 C ATOM 778 CD GLU A 85 -0.598 -1.899 1.443 1.00 0.00 C ATOM 779 OE1 GLU A 85 0.153 -0.982 1.731 1.00 0.00 O ATOM 780 OE2 GLU A 85 -0.793 -2.870 2.157 1.00 0.00 O ATOM 0 H GLU A 85 1.059 -2.541 -2.639 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.857 -1.874 -2.425 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.565 -1.200 -0.695 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.704 -0.003 -0.858 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.301 -1.329 0.244 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -1.554 -2.835 -0.252 1.00 0.00 H new ATOM 787 N ILE A 86 -1.358 0.523 -3.336 1.00 0.00 N ATOM 788 CA ILE A 86 -1.240 1.634 -4.304 1.00 0.00 C ATOM 789 C ILE A 86 -1.939 2.867 -3.731 1.00 0.00 C ATOM 790 O ILE A 86 -2.805 2.758 -2.889 1.00 0.00 O ATOM 791 CB ILE A 86 -1.880 1.110 -5.579 1.00 0.00 C ATOM 792 CG1 ILE A 86 -1.520 2.019 -6.734 1.00 0.00 C ATOM 793 CG2 ILE A 86 -3.376 1.056 -5.408 1.00 0.00 C ATOM 794 CD1 ILE A 86 -2.299 3.298 -6.578 1.00 0.00 C ATOM 0 H ILE A 86 -2.100 0.643 -2.647 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.215 1.944 -4.508 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.511 0.106 -5.788 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.449 2.223 -6.739 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.758 1.541 -7.684 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -3.833 0.680 -6.323 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.624 0.393 -4.579 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.755 2.056 -5.198 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -2.058 3.973 -7.399 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.366 3.078 -6.591 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.037 3.770 -5.631 1.00 0.00 H new ATOM 806 N ASP A 87 -1.546 4.045 -4.138 1.00 0.00 N ATOM 807 CA ASP A 87 -2.187 5.265 -3.567 1.00 0.00 C ATOM 808 C ASP A 87 -2.486 6.303 -4.638 1.00 0.00 C ATOM 809 O ASP A 87 -2.204 6.126 -5.806 1.00 0.00 O ATOM 810 CB ASP A 87 -1.157 5.860 -2.615 1.00 0.00 C ATOM 811 CG ASP A 87 -0.484 4.753 -1.799 1.00 0.00 C ATOM 812 OD1 ASP A 87 -1.155 3.789 -1.476 1.00 0.00 O ATOM 813 OD2 ASP A 87 0.693 4.891 -1.510 1.00 0.00 O ATOM 0 H ASP A 87 -0.818 4.214 -4.832 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.130 5.001 -3.088 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.406 6.412 -3.180 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.639 6.572 -1.946 1.00 0.00 H new ATOM 818 N ALA A 88 -3.023 7.409 -4.213 1.00 0.00 N ATOM 819 CA ALA A 88 -3.319 8.516 -5.156 1.00 0.00 C ATOM 820 C ALA A 88 -3.227 9.876 -4.425 1.00 0.00 C ATOM 821 O ALA A 88 -2.889 10.892 -5.014 1.00 0.00 O ATOM 822 CB ALA A 88 -4.740 8.250 -5.686 1.00 0.00 C ATOM 0 H ALA A 88 -3.272 7.594 -3.241 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.604 8.558 -5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.019 9.035 -6.389 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.765 7.284 -6.191 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.443 8.242 -4.853 1.00 0.00 H new ATOM 828 N ALA A 89 -3.518 9.900 -3.142 1.00 0.00 N ATOM 829 CA ALA A 89 -3.448 11.175 -2.358 1.00 0.00 C ATOM 830 C ALA A 89 -2.240 12.006 -2.787 1.00 0.00 C ATOM 831 O ALA A 89 -2.340 13.196 -3.024 1.00 0.00 O ATOM 832 CB ALA A 89 -3.295 10.727 -0.906 1.00 0.00 C ATOM 0 H ALA A 89 -3.803 9.083 -2.602 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.328 11.800 -2.511 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.236 11.603 -0.259 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.155 10.122 -0.619 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.385 10.137 -0.801 1.00 0.00 H new ATOM 838 N GLU A 90 -1.104 11.388 -2.892 1.00 0.00 N ATOM 839 CA GLU A 90 0.117 12.137 -3.310 1.00 0.00 C ATOM 840 C GLU A 90 -0.181 12.922 -4.583 1.00 0.00 C ATOM 841 O GLU A 90 -0.150 14.138 -4.610 1.00 0.00 O ATOM 842 CB GLU A 90 1.169 11.063 -3.591 1.00 0.00 C ATOM 843 CG GLU A 90 1.338 10.170 -2.362 1.00 0.00 C ATOM 844 CD GLU A 90 1.479 11.042 -1.113 1.00 0.00 C ATOM 845 OE1 GLU A 90 0.484 11.617 -0.701 1.00 0.00 O ATOM 846 OE2 GLU A 90 2.577 11.121 -0.589 1.00 0.00 O ATOM 0 H GLU A 90 -0.962 10.395 -2.707 1.00 0.00 H new ATOM 0 HA GLU A 90 0.452 12.845 -2.552 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.869 10.463 -4.450 1.00 0.00 H new ATOM 0 HB3 GLU A 90 2.120 11.530 -3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 90 0.479 9.507 -2.260 1.00 0.00 H new ATOM 0 HG3 GLU A 90 2.218 9.537 -2.478 1.00 0.00 H new ATOM 853 N ALA A 91 -0.479 12.216 -5.632 1.00 0.00 N ATOM 854 CA ALA A 91 -0.801 12.875 -6.932 1.00 0.00 C ATOM 855 C ALA A 91 -1.624 14.139 -6.700 1.00 0.00 C ATOM 856 O ALA A 91 -1.443 15.135 -7.369 1.00 0.00 O ATOM 857 CB ALA A 91 -1.622 11.829 -7.694 1.00 0.00 C ATOM 0 H ALA A 91 -0.515 11.197 -5.649 1.00 0.00 H new ATOM 0 HA ALA A 91 0.091 13.182 -7.478 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -1.905 12.228 -8.668 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.025 10.927 -7.831 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -2.520 11.587 -7.126 1.00 0.00 H new ATOM 863 N GLY A 92 -2.523 14.113 -5.758 1.00 0.00 N ATOM 864 CA GLY A 92 -3.355 15.325 -5.495 1.00 0.00 C ATOM 865 C GLY A 92 -2.455 16.449 -5.016 1.00 0.00 C ATOM 866 O GLY A 92 -2.577 17.588 -5.421 1.00 0.00 O ATOM 0 H GLY A 92 -2.719 13.311 -5.160 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.881 15.624 -6.402 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.114 15.105 -4.744 1.00 0.00 H new ATOM 870 N GLU A 93 -1.542 16.122 -4.161 1.00 0.00 N ATOM 871 CA GLU A 93 -0.598 17.150 -3.642 1.00 0.00 C ATOM 872 C GLU A 93 0.181 17.738 -4.814 1.00 0.00 C ATOM 873 O GLU A 93 0.666 18.850 -4.761 1.00 0.00 O ATOM 874 CB GLU A 93 0.341 16.399 -2.693 1.00 0.00 C ATOM 875 CG GLU A 93 -0.469 15.432 -1.828 1.00 0.00 C ATOM 876 CD GLU A 93 0.318 15.093 -0.559 1.00 0.00 C ATOM 877 OE1 GLU A 93 1.506 14.844 -0.671 1.00 0.00 O ATOM 878 OE2 GLU A 93 -0.283 15.086 0.504 1.00 0.00 O ATOM 0 H GLU A 93 -1.402 15.181 -3.792 1.00 0.00 H new ATOM 0 HA GLU A 93 -1.103 17.969 -3.130 1.00 0.00 H new ATOM 0 HB2 GLU A 93 1.090 15.851 -3.265 1.00 0.00 H new ATOM 0 HB3 GLU A 93 0.877 17.107 -2.061 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.427 15.880 -1.565 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -0.685 14.522 -2.388 1.00 0.00 H new ATOM 885 N LEU A 94 0.299 16.993 -5.877 1.00 0.00 N ATOM 886 CA LEU A 94 1.038 17.499 -7.062 1.00 0.00 C ATOM 887 C LEU A 94 0.156 18.443 -7.879 1.00 0.00 C ATOM 888 O LEU A 94 0.485 19.597 -8.069 1.00 0.00 O ATOM 889 CB LEU A 94 1.383 16.259 -7.879 1.00 0.00 C ATOM 890 CG LEU A 94 2.143 16.680 -9.134 1.00 0.00 C ATOM 891 CD1 LEU A 94 3.171 15.607 -9.484 1.00 0.00 C ATOM 892 CD2 LEU A 94 1.159 16.847 -10.295 1.00 0.00 C ATOM 0 H LEU A 94 -0.086 16.054 -5.975 1.00 0.00 H new ATOM 0 HA LEU A 94 1.927 18.061 -6.776 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.989 15.575 -7.285 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.473 15.724 -8.152 1.00 0.00 H new ATOM 0 HG LEU A 94 2.652 17.627 -8.954 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.716 15.904 -10.380 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.870 15.489 -8.656 1.00 0.00 H new ATOM 0 HD13 LEU A 94 2.662 14.661 -9.666 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.701 17.148 -11.191 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.650 15.901 -10.479 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.424 17.611 -10.042 1.00 0.00 H new ATOM 904 N LEU A 95 -0.957 17.969 -8.375 1.00 0.00 N ATOM 905 CA LEU A 95 -1.828 18.877 -9.189 1.00 0.00 C ATOM 906 C LEU A 95 -3.127 19.231 -8.459 1.00 0.00 C ATOM 907 O LEU A 95 -3.759 20.220 -8.769 1.00 0.00 O ATOM 908 CB LEU A 95 -2.112 18.165 -10.514 1.00 0.00 C ATOM 909 CG LEU A 95 -2.076 16.659 -10.332 1.00 0.00 C ATOM 910 CD1 LEU A 95 -3.220 16.248 -9.415 1.00 0.00 C ATOM 911 CD2 LEU A 95 -2.236 15.993 -11.693 1.00 0.00 C ATOM 0 H LEU A 95 -1.298 17.015 -8.258 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.318 19.824 -9.363 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.088 18.467 -10.893 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -1.374 18.464 -11.259 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.128 16.352 -9.890 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.205 15.167 -9.276 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.106 16.739 -8.449 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.169 16.543 -9.863 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.211 14.910 -11.573 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.189 16.288 -12.133 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -1.422 16.304 -12.348 1.00 0.00 H new ATOM 923 N GLY A 96 -3.535 18.460 -7.490 1.00 0.00 N ATOM 924 CA GLY A 96 -4.795 18.818 -6.766 1.00 0.00 C ATOM 925 C GLY A 96 -5.979 18.772 -7.740 1.00 0.00 C ATOM 926 O GLY A 96 -6.306 19.739 -8.399 1.00 0.00 O ATOM 0 H GLY A 96 -3.065 17.613 -7.170 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.962 18.125 -5.942 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.707 19.814 -6.332 1.00 0.00 H new ATOM 930 N LYS A 97 -6.594 17.636 -7.837 1.00 0.00 N ATOM 931 CA LYS A 97 -7.753 17.443 -8.774 1.00 0.00 C ATOM 932 C LYS A 97 -8.320 16.009 -8.571 1.00 0.00 C ATOM 933 O LYS A 97 -8.166 15.468 -7.498 1.00 0.00 O ATOM 934 CB LYS A 97 -7.087 17.633 -10.140 1.00 0.00 C ATOM 935 CG LYS A 97 -7.928 18.573 -11.010 1.00 0.00 C ATOM 936 CD LYS A 97 -7.181 18.858 -12.316 1.00 0.00 C ATOM 937 CE LYS A 97 -8.175 19.319 -13.385 1.00 0.00 C ATOM 938 NZ LYS A 97 -7.929 18.428 -14.552 1.00 0.00 N ATOM 0 H LYS A 97 -6.345 16.806 -7.299 1.00 0.00 H new ATOM 0 HA LYS A 97 -8.599 18.116 -8.635 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.085 18.043 -10.011 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.975 16.669 -10.636 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.897 18.121 -11.223 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.121 19.504 -10.478 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.424 19.625 -12.154 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.660 17.962 -12.652 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.203 19.232 -13.032 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.016 20.365 -13.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.574 18.684 -15.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -6.945 18.537 -14.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.095 17.439 -14.275 1.00 0.00 H new ATOM 952 N PRO A 98 -8.921 15.388 -9.580 1.00 0.00 N ATOM 953 CA PRO A 98 -9.397 13.984 -9.382 1.00 0.00 C ATOM 954 C PRO A 98 -8.178 13.065 -9.224 1.00 0.00 C ATOM 955 O PRO A 98 -8.309 11.878 -9.006 1.00 0.00 O ATOM 956 CB PRO A 98 -10.175 13.681 -10.656 1.00 0.00 C ATOM 957 CG PRO A 98 -9.607 14.608 -11.675 1.00 0.00 C ATOM 958 CD PRO A 98 -9.233 15.867 -10.942 1.00 0.00 C ATOM 0 HA PRO A 98 -10.014 13.840 -8.495 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -10.054 12.640 -10.956 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.243 13.851 -10.518 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -8.736 14.167 -12.159 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -10.335 14.817 -12.459 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -8.376 16.360 -11.401 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -10.051 16.588 -10.937 1.00 0.00 H new ATOM 966 N PHE A 99 -6.997 13.639 -9.328 1.00 0.00 N ATOM 967 CA PHE A 99 -5.713 12.889 -9.178 1.00 0.00 C ATOM 968 C PHE A 99 -5.888 11.583 -8.407 1.00 0.00 C ATOM 969 O PHE A 99 -5.334 10.562 -8.752 1.00 0.00 O ATOM 970 CB PHE A 99 -4.820 13.844 -8.364 1.00 0.00 C ATOM 971 CG PHE A 99 -5.141 13.717 -6.883 1.00 0.00 C ATOM 972 CD1 PHE A 99 -4.649 12.637 -6.142 1.00 0.00 C ATOM 973 CD2 PHE A 99 -5.970 14.653 -6.267 1.00 0.00 C ATOM 974 CE1 PHE A 99 -4.993 12.504 -4.795 1.00 0.00 C ATOM 975 CE2 PHE A 99 -6.306 14.524 -4.917 1.00 0.00 C ATOM 976 CZ PHE A 99 -5.819 13.447 -4.180 1.00 0.00 C ATOM 0 H PHE A 99 -6.873 14.633 -9.518 1.00 0.00 H new ATOM 0 HA PHE A 99 -5.303 12.612 -10.149 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.770 13.611 -8.539 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.977 14.871 -8.692 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.005 11.908 -6.611 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -6.356 15.485 -6.838 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.618 11.667 -4.225 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.942 15.258 -4.446 1.00 0.00 H new ATOM 0 HZ PHE A 99 -6.079 13.342 -3.137 1.00 0.00 H new ATOM 986 N SER A 100 -6.613 11.626 -7.331 1.00 0.00 N ATOM 987 CA SER A 100 -6.765 10.413 -6.511 1.00 0.00 C ATOM 988 C SER A 100 -7.269 9.288 -7.387 1.00 0.00 C ATOM 989 O SER A 100 -6.715 8.204 -7.456 1.00 0.00 O ATOM 990 CB SER A 100 -7.805 10.774 -5.450 1.00 0.00 C ATOM 991 OG SER A 100 -7.149 11.021 -4.213 1.00 0.00 O ATOM 0 H SER A 100 -7.105 12.451 -6.988 1.00 0.00 H new ATOM 0 HA SER A 100 -5.829 10.088 -6.056 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.366 11.656 -5.760 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.524 9.962 -5.338 1.00 0.00 H new ATOM 0 HG SER A 100 -6.451 11.697 -4.342 1.00 0.00 H new ATOM 997 N VAL A 101 -8.337 9.548 -8.047 1.00 0.00 N ATOM 998 CA VAL A 101 -8.938 8.522 -8.896 1.00 0.00 C ATOM 999 C VAL A 101 -8.568 8.666 -10.369 1.00 0.00 C ATOM 1000 O VAL A 101 -8.198 7.702 -11.004 1.00 0.00 O ATOM 1001 CB VAL A 101 -10.387 8.715 -8.654 1.00 0.00 C ATOM 1002 CG1 VAL A 101 -11.169 7.660 -9.426 1.00 0.00 C ATOM 1003 CG2 VAL A 101 -10.636 8.577 -7.149 1.00 0.00 C ATOM 0 H VAL A 101 -8.827 10.443 -8.034 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.587 7.518 -8.657 1.00 0.00 H new ATOM 0 HB VAL A 101 -10.713 9.699 -8.991 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -12.236 7.798 -9.251 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -10.960 7.759 -10.491 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -10.871 6.667 -9.089 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -11.697 8.715 -6.942 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.328 7.585 -6.819 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -10.061 9.333 -6.614 1.00 0.00 H new ATOM 1013 N TYR A 102 -8.647 9.833 -10.942 1.00 0.00 N ATOM 1014 CA TYR A 102 -8.266 9.921 -12.377 1.00 0.00 C ATOM 1015 C TYR A 102 -6.895 9.273 -12.537 1.00 0.00 C ATOM 1016 O TYR A 102 -6.568 8.695 -13.560 1.00 0.00 O ATOM 1017 CB TYR A 102 -8.206 11.413 -12.715 1.00 0.00 C ATOM 1018 CG TYR A 102 -8.435 11.602 -14.197 1.00 0.00 C ATOM 1019 CD1 TYR A 102 -7.401 11.352 -15.107 1.00 0.00 C ATOM 1020 CD2 TYR A 102 -9.687 12.024 -14.661 1.00 0.00 C ATOM 1021 CE1 TYR A 102 -7.618 11.525 -16.480 1.00 0.00 C ATOM 1022 CE2 TYR A 102 -9.905 12.197 -16.034 1.00 0.00 C ATOM 1023 CZ TYR A 102 -8.871 11.947 -16.943 1.00 0.00 C ATOM 1024 OH TYR A 102 -9.085 12.115 -18.298 1.00 0.00 O ATOM 0 H TYR A 102 -8.948 10.701 -10.499 1.00 0.00 H new ATOM 0 HA TYR A 102 -8.970 9.415 -13.037 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -8.961 11.956 -12.147 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -7.237 11.823 -12.430 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -6.435 11.026 -14.750 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -10.485 12.216 -13.960 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -6.820 11.333 -17.181 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -10.871 12.523 -16.391 1.00 0.00 H new ATOM 0 HH TYR A 102 -10.007 12.410 -18.449 1.00 0.00 H new ATOM 1034 N ASP A 103 -6.102 9.327 -11.501 1.00 0.00 N ATOM 1035 CA ASP A 103 -4.766 8.692 -11.567 1.00 0.00 C ATOM 1036 C ASP A 103 -4.929 7.204 -11.315 1.00 0.00 C ATOM 1037 O ASP A 103 -4.368 6.386 -12.016 1.00 0.00 O ATOM 1038 CB ASP A 103 -3.936 9.346 -10.464 1.00 0.00 C ATOM 1039 CG ASP A 103 -2.453 9.063 -10.706 1.00 0.00 C ATOM 1040 OD1 ASP A 103 -2.065 7.912 -10.593 1.00 0.00 O ATOM 1041 OD2 ASP A 103 -1.730 10.002 -10.998 1.00 0.00 O ATOM 0 H ASP A 103 -6.326 9.783 -10.617 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.282 8.820 -12.535 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.114 10.421 -10.449 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -4.237 8.960 -9.490 1.00 0.00 H new ATOM 1046 N LEU A 104 -5.710 6.826 -10.336 1.00 0.00 N ATOM 1047 CA LEU A 104 -5.884 5.376 -10.113 1.00 0.00 C ATOM 1048 C LEU A 104 -6.469 4.740 -11.380 1.00 0.00 C ATOM 1049 O LEU A 104 -6.010 3.726 -11.831 1.00 0.00 O ATOM 1050 CB LEU A 104 -6.813 5.239 -8.890 1.00 0.00 C ATOM 1051 CG LEU A 104 -8.289 5.170 -9.300 1.00 0.00 C ATOM 1052 CD1 LEU A 104 -8.603 3.804 -9.910 1.00 0.00 C ATOM 1053 CD2 LEU A 104 -9.156 5.371 -8.060 1.00 0.00 C ATOM 0 H LEU A 104 -6.218 7.444 -9.703 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.946 4.858 -9.914 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.549 4.341 -8.332 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.661 6.086 -8.221 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.494 5.946 -10.037 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.654 3.767 -10.197 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.980 3.647 -10.791 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.399 3.023 -9.178 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -10.208 5.324 -8.340 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.939 4.588 -7.333 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.941 6.345 -7.620 1.00 0.00 H new ATOM 1065 N LEU A 105 -7.464 5.327 -11.983 1.00 0.00 N ATOM 1066 CA LEU A 105 -8.030 4.704 -13.216 1.00 0.00 C ATOM 1067 C LEU A 105 -6.993 4.680 -14.348 1.00 0.00 C ATOM 1068 O LEU A 105 -7.039 3.839 -15.224 1.00 0.00 O ATOM 1069 CB LEU A 105 -9.212 5.587 -13.619 1.00 0.00 C ATOM 1070 CG LEU A 105 -10.198 5.716 -12.460 1.00 0.00 C ATOM 1071 CD1 LEU A 105 -10.721 7.153 -12.400 1.00 0.00 C ATOM 1072 CD2 LEU A 105 -11.372 4.763 -12.687 1.00 0.00 C ATOM 0 H LEU A 105 -7.905 6.197 -11.684 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.327 3.672 -13.032 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -8.854 6.574 -13.912 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -9.714 5.160 -14.487 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.698 5.467 -11.524 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -11.425 7.250 -11.574 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -9.887 7.838 -12.248 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -11.224 7.397 -13.336 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.078 4.852 -11.861 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -11.872 5.018 -13.621 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -11.004 3.738 -12.740 1.00 0.00 H new ATOM 1084 N ILE A 106 -6.065 5.597 -14.345 1.00 0.00 N ATOM 1085 CA ILE A 106 -5.042 5.626 -15.427 1.00 0.00 C ATOM 1086 C ILE A 106 -3.783 4.882 -14.975 1.00 0.00 C ATOM 1087 O ILE A 106 -2.904 4.591 -15.763 1.00 0.00 O ATOM 1088 CB ILE A 106 -4.773 7.116 -15.655 1.00 0.00 C ATOM 1089 CG1 ILE A 106 -5.528 7.582 -16.901 1.00 0.00 C ATOM 1090 CG2 ILE A 106 -3.278 7.376 -15.851 1.00 0.00 C ATOM 1091 CD1 ILE A 106 -5.334 9.090 -17.079 1.00 0.00 C ATOM 0 H ILE A 106 -5.971 6.328 -13.639 1.00 0.00 H new ATOM 0 HA ILE A 106 -5.369 5.135 -16.344 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.113 7.667 -14.778 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.163 7.051 -17.780 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.589 7.349 -16.805 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.112 8.441 -16.011 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.733 7.053 -14.964 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -2.922 6.819 -16.718 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.871 9.424 -17.967 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.720 9.612 -16.203 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.272 9.309 -17.194 1.00 0.00 H new ATOM 1103 N ASN A 107 -3.688 4.588 -13.712 1.00 0.00 N ATOM 1104 CA ASN A 107 -2.483 3.882 -13.204 1.00 0.00 C ATOM 1105 C ASN A 107 -2.876 2.528 -12.596 1.00 0.00 C ATOM 1106 O ASN A 107 -2.157 1.557 -12.704 1.00 0.00 O ATOM 1107 CB ASN A 107 -1.898 4.849 -12.154 1.00 0.00 C ATOM 1108 CG ASN A 107 -2.143 4.341 -10.728 1.00 0.00 C ATOM 1109 OD1 ASN A 107 -1.782 3.230 -10.392 1.00 0.00 O ATOM 1110 ND2 ASN A 107 -2.741 5.119 -9.873 1.00 0.00 N ATOM 0 H ASN A 107 -4.393 4.806 -13.008 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.755 3.649 -13.982 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -0.827 4.966 -12.321 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.349 5.834 -12.273 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.907 4.797 -8.920 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.043 6.051 -10.156 1.00 0.00 H new ATOM 1117 N VAL A 108 -4.007 2.462 -11.954 1.00 0.00 N ATOM 1118 CA VAL A 108 -4.442 1.181 -11.321 1.00 0.00 C ATOM 1119 C VAL A 108 -4.649 0.076 -12.366 1.00 0.00 C ATOM 1120 O VAL A 108 -4.943 -1.051 -12.020 1.00 0.00 O ATOM 1121 CB VAL A 108 -5.773 1.505 -10.618 1.00 0.00 C ATOM 1122 CG1 VAL A 108 -6.938 1.422 -11.618 1.00 0.00 C ATOM 1123 CG2 VAL A 108 -6.017 0.504 -9.493 1.00 0.00 C ATOM 0 H VAL A 108 -4.654 3.242 -11.838 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.686 0.809 -10.629 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.715 2.515 -10.213 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.873 1.653 -11.108 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.778 2.138 -12.424 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.991 0.415 -12.033 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -6.960 0.736 -8.998 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.063 -0.504 -9.906 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.203 0.563 -8.770 1.00 0.00 H new ATOM 1133 N SER A 109 -4.527 0.391 -13.630 1.00 0.00 N ATOM 1134 CA SER A 109 -4.737 -0.647 -14.692 1.00 0.00 C ATOM 1135 C SER A 109 -4.227 -2.018 -14.254 1.00 0.00 C ATOM 1136 O SER A 109 -4.730 -3.036 -14.685 1.00 0.00 O ATOM 1137 CB SER A 109 -3.949 -0.139 -15.898 1.00 0.00 C ATOM 1138 OG SER A 109 -4.621 -0.514 -17.092 1.00 0.00 O ATOM 0 H SER A 109 -4.291 1.321 -13.976 1.00 0.00 H new ATOM 0 HA SER A 109 -5.796 -0.783 -14.912 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.848 0.945 -15.850 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.941 -0.554 -15.889 1.00 0.00 H new ATOM 0 HG SER A 109 -4.118 -0.187 -17.867 1.00 0.00 H new ATOM 1144 N SER A 110 -3.263 -2.067 -13.387 1.00 0.00 N ATOM 1145 CA SER A 110 -2.772 -3.392 -12.920 1.00 0.00 C ATOM 1146 C SER A 110 -3.684 -3.921 -11.811 1.00 0.00 C ATOM 1147 O SER A 110 -3.255 -4.661 -10.948 1.00 0.00 O ATOM 1148 CB SER A 110 -1.381 -3.126 -12.365 1.00 0.00 C ATOM 1149 OG SER A 110 -1.494 -2.327 -11.196 1.00 0.00 O ATOM 0 H SER A 110 -2.795 -1.256 -12.982 1.00 0.00 H new ATOM 0 HA SER A 110 -2.760 -4.133 -13.719 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.883 -4.067 -12.131 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.769 -2.618 -13.110 1.00 0.00 H new ATOM 0 HG SER A 110 -2.356 -1.860 -11.201 1.00 0.00 H new ATOM 1155 N THR A 111 -4.940 -3.555 -11.820 1.00 0.00 N ATOM 1156 CA THR A 111 -5.853 -4.053 -10.753 1.00 0.00 C ATOM 1157 C THR A 111 -6.482 -5.374 -11.199 1.00 0.00 C ATOM 1158 O THR A 111 -7.663 -5.605 -11.041 1.00 0.00 O ATOM 1159 CB THR A 111 -6.914 -2.974 -10.594 1.00 0.00 C ATOM 1160 OG1 THR A 111 -7.883 -3.396 -9.643 1.00 0.00 O ATOM 1161 CG2 THR A 111 -7.583 -2.742 -11.938 1.00 0.00 C ATOM 0 H THR A 111 -5.367 -2.940 -12.512 1.00 0.00 H new ATOM 0 HA THR A 111 -5.336 -4.240 -9.812 1.00 0.00 H new ATOM 0 HB THR A 111 -6.454 -2.049 -10.247 1.00 0.00 H new ATOM 0 HG1 THR A 111 -8.192 -4.298 -9.869 1.00 0.00 H new ATOM 0 HG21 THR A 111 -8.346 -1.970 -11.836 1.00 0.00 H new ATOM 0 HG22 THR A 111 -6.837 -2.421 -12.665 1.00 0.00 H new ATOM 0 HG23 THR A 111 -8.047 -3.668 -12.278 1.00 0.00 H new ATOM 1169 N VAL A 112 -5.688 -6.229 -11.774 1.00 0.00 N ATOM 1170 CA VAL A 112 -6.204 -7.541 -12.266 1.00 0.00 C ATOM 1171 C VAL A 112 -6.849 -8.347 -11.134 1.00 0.00 C ATOM 1172 O VAL A 112 -7.929 -8.883 -11.285 1.00 0.00 O ATOM 1173 CB VAL A 112 -4.970 -8.270 -12.802 1.00 0.00 C ATOM 1174 CG1 VAL A 112 -5.371 -9.660 -13.301 1.00 0.00 C ATOM 1175 CG2 VAL A 112 -4.371 -7.470 -13.959 1.00 0.00 C ATOM 0 H VAL A 112 -4.691 -6.076 -11.928 1.00 0.00 H new ATOM 0 HA VAL A 112 -6.976 -7.410 -13.024 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.233 -8.369 -12.005 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.491 -10.178 -13.682 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.800 -10.232 -12.478 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -6.108 -9.562 -14.098 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.492 -7.988 -14.342 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -5.110 -7.372 -14.754 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.084 -6.479 -13.606 1.00 0.00 H new ATOM 1185 N GLY A 113 -6.198 -8.451 -10.008 1.00 0.00 N ATOM 1186 CA GLY A 113 -6.783 -9.238 -8.888 1.00 0.00 C ATOM 1187 C GLY A 113 -7.867 -8.419 -8.188 1.00 0.00 C ATOM 1188 O GLY A 113 -9.047 -8.669 -8.341 1.00 0.00 O ATOM 0 H GLY A 113 -5.290 -8.027 -9.816 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -7.206 -10.168 -9.268 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -6.003 -9.509 -8.176 1.00 0.00 H new ATOM 1192 N ARG A 114 -7.477 -7.454 -7.405 1.00 0.00 N ATOM 1193 CA ARG A 114 -8.459 -6.635 -6.683 1.00 0.00 C ATOM 1194 C ARG A 114 -7.892 -5.242 -6.400 1.00 0.00 C ATOM 1195 O ARG A 114 -6.796 -4.920 -6.805 1.00 0.00 O ATOM 1196 CB ARG A 114 -8.678 -7.401 -5.397 1.00 0.00 C ATOM 1197 CG ARG A 114 -9.932 -6.889 -4.686 1.00 0.00 C ATOM 1198 CD ARG A 114 -10.731 -8.074 -4.139 1.00 0.00 C ATOM 1199 NE ARG A 114 -12.153 -7.759 -4.452 1.00 0.00 N ATOM 1200 CZ ARG A 114 -12.991 -7.503 -3.485 1.00 0.00 C ATOM 1201 NH1 ARG A 114 -12.581 -6.876 -2.417 1.00 0.00 N ATOM 1202 NH2 ARG A 114 -14.238 -7.873 -3.586 1.00 0.00 N ATOM 0 H ARG A 114 -6.503 -7.203 -7.239 1.00 0.00 H new ATOM 0 HA ARG A 114 -9.381 -6.476 -7.243 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -8.781 -8.465 -5.611 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -7.811 -7.290 -4.746 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -9.653 -6.219 -3.873 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -10.545 -6.312 -5.378 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -10.422 -9.008 -4.607 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -10.580 -8.190 -3.066 1.00 0.00 H new ATOM 0 HE ARG A 114 -12.471 -7.743 -5.421 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -11.606 -6.586 -2.338 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -13.235 -6.675 -1.661 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -14.559 -8.363 -4.421 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -14.892 -7.673 -2.830 1.00 0.00 H new ATOM 1216 N ALA A 115 -8.632 -4.415 -5.707 1.00 0.00 N ATOM 1217 CA ALA A 115 -8.134 -3.043 -5.397 1.00 0.00 C ATOM 1218 C ALA A 115 -9.059 -2.357 -4.386 1.00 0.00 C ATOM 1219 O ALA A 115 -9.814 -1.468 -4.728 1.00 0.00 O ATOM 1220 CB ALA A 115 -8.159 -2.305 -6.736 1.00 0.00 C ATOM 0 H ALA A 115 -9.560 -4.631 -5.343 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.138 -3.054 -4.954 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.806 -1.284 -6.595 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -7.511 -2.818 -7.447 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -9.178 -2.286 -7.122 1.00 0.00 H new ATOM 1226 N TYR A 116 -9.004 -2.758 -3.145 1.00 0.00 N ATOM 1227 CA TYR A 116 -9.879 -2.120 -2.119 1.00 0.00 C ATOM 1228 C TYR A 116 -9.369 -0.712 -1.806 1.00 0.00 C ATOM 1229 O TYR A 116 -8.179 -0.475 -1.735 1.00 0.00 O ATOM 1230 CB TYR A 116 -9.775 -3.018 -0.885 1.00 0.00 C ATOM 1231 CG TYR A 116 -10.858 -2.645 0.099 1.00 0.00 C ATOM 1232 CD1 TYR A 116 -10.739 -1.476 0.860 1.00 0.00 C ATOM 1233 CD2 TYR A 116 -11.979 -3.467 0.250 1.00 0.00 C ATOM 1234 CE1 TYR A 116 -11.743 -1.130 1.772 1.00 0.00 C ATOM 1235 CE2 TYR A 116 -12.983 -3.122 1.162 1.00 0.00 C ATOM 1236 CZ TYR A 116 -12.865 -1.953 1.924 1.00 0.00 C ATOM 1237 OH TYR A 116 -13.853 -1.611 2.823 1.00 0.00 O ATOM 0 H TYR A 116 -8.393 -3.497 -2.797 1.00 0.00 H new ATOM 0 HA TYR A 116 -10.911 -2.021 -2.457 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -9.875 -4.064 -1.174 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -8.794 -2.907 -0.423 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -9.873 -0.841 0.743 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -12.070 -4.369 -0.337 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -11.652 -0.228 2.359 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -13.849 -3.757 1.278 1.00 0.00 H new ATOM 0 HH TYR A 116 -14.561 -2.288 2.804 1.00 0.00 H new ATOM 1247 N THR A 117 -10.256 0.226 -1.626 1.00 0.00 N ATOM 1248 CA THR A 117 -9.815 1.618 -1.328 1.00 0.00 C ATOM 1249 C THR A 117 -9.664 1.822 0.183 1.00 0.00 C ATOM 1250 O THR A 117 -10.614 1.723 0.933 1.00 0.00 O ATOM 1251 CB THR A 117 -10.925 2.509 -1.883 1.00 0.00 C ATOM 1252 OG1 THR A 117 -10.894 2.472 -3.304 1.00 0.00 O ATOM 1253 CG2 THR A 117 -10.718 3.946 -1.402 1.00 0.00 C ATOM 0 H THR A 117 -11.266 0.090 -1.672 1.00 0.00 H new ATOM 0 HA THR A 117 -8.846 1.846 -1.772 1.00 0.00 H new ATOM 0 HB THR A 117 -11.891 2.148 -1.531 1.00 0.00 H new ATOM 0 HG1 THR A 117 -10.077 2.908 -3.625 1.00 0.00 H new ATOM 0 HG21 THR A 117 -11.511 4.580 -1.799 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.743 3.972 -0.313 1.00 0.00 H new ATOM 0 HG23 THR A 117 -9.752 4.311 -1.751 1.00 0.00 H new ATOM 1261 N LEU A 118 -8.472 2.111 0.629 1.00 0.00 N ATOM 1262 CA LEU A 118 -8.245 2.330 2.087 1.00 0.00 C ATOM 1263 C LEU A 118 -8.517 3.776 2.462 1.00 0.00 C ATOM 1264 O LEU A 118 -7.814 4.342 3.270 1.00 0.00 O ATOM 1265 CB LEU A 118 -6.775 1.989 2.322 1.00 0.00 C ATOM 1266 CG LEU A 118 -6.615 1.326 3.690 1.00 0.00 C ATOM 1267 CD1 LEU A 118 -5.933 -0.034 3.529 1.00 0.00 C ATOM 1268 CD2 LEU A 118 -5.758 2.219 4.589 1.00 0.00 C ATOM 0 H LEU A 118 -7.642 2.205 0.044 1.00 0.00 H new ATOM 0 HA LEU A 118 -8.910 1.716 2.695 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -6.416 1.321 1.539 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.169 2.894 2.272 1.00 0.00 H new ATOM 0 HG LEU A 118 -7.598 1.186 4.140 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -5.821 -0.503 4.507 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -6.541 -0.672 2.888 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.950 0.103 3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -5.642 1.748 5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.777 2.358 4.135 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -6.243 3.188 4.708 1.00 0.00 H new ATOM 1280 N GLY A 119 -9.540 4.370 1.897 1.00 0.00 N ATOM 1281 CA GLY A 119 -9.874 5.786 2.235 1.00 0.00 C ATOM 1282 C GLY A 119 -8.704 6.699 1.900 1.00 0.00 C ATOM 1283 O GLY A 119 -8.798 7.590 1.078 1.00 0.00 O ATOM 0 H GLY A 119 -10.159 3.932 1.214 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -10.759 6.100 1.682 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.115 5.867 3.295 1.00 0.00 H new ATOM 1287 N THR A 120 -7.607 6.475 2.541 1.00 0.00 N ATOM 1288 CA THR A 120 -6.400 7.310 2.294 1.00 0.00 C ATOM 1289 C THR A 120 -5.578 6.715 1.148 1.00 0.00 C ATOM 1290 O THR A 120 -4.891 7.420 0.435 1.00 0.00 O ATOM 1291 CB THR A 120 -5.614 7.269 3.607 1.00 0.00 C ATOM 1292 OG1 THR A 120 -5.108 5.958 3.816 1.00 0.00 O ATOM 1293 CG2 THR A 120 -6.531 7.655 4.770 1.00 0.00 C ATOM 0 H THR A 120 -7.485 5.740 3.238 1.00 0.00 H new ATOM 0 HA THR A 120 -6.650 8.331 2.006 1.00 0.00 H new ATOM 0 HB THR A 120 -4.785 7.975 3.553 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.604 5.932 4.656 1.00 0.00 H new ATOM 0 HG21 THR A 120 -5.968 7.625 5.703 1.00 0.00 H new ATOM 0 HG22 THR A 120 -6.916 8.662 4.611 1.00 0.00 H new ATOM 0 HG23 THR A 120 -7.363 6.953 4.826 1.00 0.00 H new ATOM 1301 N LYS A 121 -5.644 5.422 0.959 1.00 0.00 N ATOM 1302 CA LYS A 121 -4.862 4.798 -0.154 1.00 0.00 C ATOM 1303 C LYS A 121 -5.621 3.606 -0.746 1.00 0.00 C ATOM 1304 O LYS A 121 -6.788 3.410 -0.484 1.00 0.00 O ATOM 1305 CB LYS A 121 -3.532 4.365 0.480 1.00 0.00 C ATOM 1306 CG LYS A 121 -3.658 2.969 1.099 1.00 0.00 C ATOM 1307 CD LYS A 121 -2.915 2.938 2.436 1.00 0.00 C ATOM 1308 CE LYS A 121 -1.448 2.572 2.194 1.00 0.00 C ATOM 1309 NZ LYS A 121 -0.860 2.415 3.554 1.00 0.00 N ATOM 0 H LYS A 121 -6.199 4.776 1.520 1.00 0.00 H new ATOM 0 HA LYS A 121 -4.699 5.489 -0.981 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -2.746 4.364 -0.275 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.237 5.083 1.246 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -4.708 2.718 1.248 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -3.245 2.221 0.423 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -2.983 3.910 2.925 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.377 2.212 3.105 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -1.361 1.651 1.618 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -0.935 3.351 1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 0.146 2.164 3.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -0.951 3.309 4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.364 1.662 4.065 1.00 0.00 H new ATOM 1323 N PHE A 122 -4.965 2.817 -1.552 1.00 0.00 N ATOM 1324 CA PHE A 122 -5.648 1.640 -2.172 1.00 0.00 C ATOM 1325 C PHE A 122 -5.004 0.332 -1.711 1.00 0.00 C ATOM 1326 O PHE A 122 -3.899 0.316 -1.198 1.00 0.00 O ATOM 1327 CB PHE A 122 -5.426 1.795 -3.671 1.00 0.00 C ATOM 1328 CG PHE A 122 -6.576 2.513 -4.311 1.00 0.00 C ATOM 1329 CD1 PHE A 122 -6.748 3.881 -4.102 1.00 0.00 C ATOM 1330 CD2 PHE A 122 -7.458 1.809 -5.134 1.00 0.00 C ATOM 1331 CE1 PHE A 122 -7.808 4.551 -4.715 1.00 0.00 C ATOM 1332 CE2 PHE A 122 -8.518 2.474 -5.748 1.00 0.00 C ATOM 1333 CZ PHE A 122 -8.696 3.847 -5.539 1.00 0.00 C ATOM 0 H PHE A 122 -3.985 2.934 -1.810 1.00 0.00 H new ATOM 0 HA PHE A 122 -6.702 1.606 -1.896 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.503 2.346 -3.851 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -5.305 0.813 -4.128 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -6.062 4.421 -3.467 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -7.319 0.750 -5.295 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -7.943 5.610 -4.554 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -9.201 1.931 -6.384 1.00 0.00 H new ATOM 0 HZ PHE A 122 -9.518 4.363 -6.013 1.00 0.00 H new ATOM 1343 N THR A 123 -5.673 -0.768 -1.928 1.00 0.00 N ATOM 1344 CA THR A 123 -5.116 -2.073 -1.544 1.00 0.00 C ATOM 1345 C THR A 123 -5.380 -3.080 -2.673 1.00 0.00 C ATOM 1346 O THR A 123 -6.487 -3.544 -2.857 1.00 0.00 O ATOM 1347 CB THR A 123 -5.842 -2.447 -0.237 1.00 0.00 C ATOM 1348 OG1 THR A 123 -4.938 -2.319 0.852 1.00 0.00 O ATOM 1349 CG2 THR A 123 -6.361 -3.888 -0.291 1.00 0.00 C ATOM 0 H THR A 123 -6.595 -0.806 -2.362 1.00 0.00 H new ATOM 0 HA THR A 123 -4.037 -2.062 -1.387 1.00 0.00 H new ATOM 0 HB THR A 123 -6.691 -1.776 -0.108 1.00 0.00 H new ATOM 0 HG1 THR A 123 -5.395 -2.554 1.686 1.00 0.00 H new ATOM 0 HG21 THR A 123 -6.869 -4.127 0.643 1.00 0.00 H new ATOM 0 HG22 THR A 123 -7.060 -3.992 -1.121 1.00 0.00 H new ATOM 0 HG23 THR A 123 -5.524 -4.571 -0.434 1.00 0.00 H new ATOM 1357 N ILE A 124 -4.373 -3.415 -3.431 1.00 0.00 N ATOM 1358 CA ILE A 124 -4.574 -4.384 -4.545 1.00 0.00 C ATOM 1359 C ILE A 124 -3.913 -5.721 -4.190 1.00 0.00 C ATOM 1360 O ILE A 124 -2.855 -5.758 -3.592 1.00 0.00 O ATOM 1361 CB ILE A 124 -3.903 -3.729 -5.757 1.00 0.00 C ATOM 1362 CG1 ILE A 124 -4.860 -2.702 -6.382 1.00 0.00 C ATOM 1363 CG2 ILE A 124 -3.564 -4.799 -6.798 1.00 0.00 C ATOM 1364 CD1 ILE A 124 -4.932 -1.443 -5.510 1.00 0.00 C ATOM 0 H ILE A 124 -3.422 -3.061 -3.328 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.624 -4.599 -4.742 1.00 0.00 H new ATOM 0 HB ILE A 124 -2.989 -3.230 -5.435 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.519 -2.440 -7.384 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.854 -3.137 -6.487 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.087 -4.331 -7.659 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -2.885 -5.530 -6.360 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -4.479 -5.299 -7.117 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -5.613 -0.724 -5.965 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -5.294 -1.709 -4.517 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.939 -1.000 -5.428 1.00 0.00 H new ATOM 1376 N THR A 125 -4.530 -6.820 -4.538 1.00 0.00 N ATOM 1377 CA THR A 125 -3.929 -8.144 -4.195 1.00 0.00 C ATOM 1378 C THR A 125 -4.308 -9.207 -5.231 1.00 0.00 C ATOM 1379 O THR A 125 -4.869 -8.911 -6.268 1.00 0.00 O ATOM 1380 CB THR A 125 -4.527 -8.495 -2.832 1.00 0.00 C ATOM 1381 OG1 THR A 125 -3.910 -9.675 -2.336 1.00 0.00 O ATOM 1382 CG2 THR A 125 -6.031 -8.727 -2.980 1.00 0.00 C ATOM 0 H THR A 125 -5.417 -6.859 -5.041 1.00 0.00 H new ATOM 0 HA THR A 125 -2.840 -8.105 -4.180 1.00 0.00 H new ATOM 0 HB THR A 125 -4.354 -7.675 -2.135 1.00 0.00 H new ATOM 0 HG1 THR A 125 -4.291 -9.901 -1.462 1.00 0.00 H new ATOM 0 HG21 THR A 125 -6.458 -8.977 -2.009 1.00 0.00 H new ATOM 0 HG22 THR A 125 -6.503 -7.822 -3.361 1.00 0.00 H new ATOM 0 HG23 THR A 125 -6.206 -9.548 -3.676 1.00 0.00 H new ATOM 1390 N SER A 126 -4.002 -10.447 -4.951 1.00 0.00 N ATOM 1391 CA SER A 126 -4.337 -11.540 -5.911 1.00 0.00 C ATOM 1392 C SER A 126 -5.653 -12.210 -5.522 1.00 0.00 C ATOM 1393 O SER A 126 -6.402 -12.660 -6.367 1.00 0.00 O ATOM 1394 CB SER A 126 -3.190 -12.540 -5.790 1.00 0.00 C ATOM 1395 OG SER A 126 -2.939 -13.122 -7.062 1.00 0.00 O ATOM 0 H SER A 126 -3.534 -10.750 -4.097 1.00 0.00 H new ATOM 0 HA SER A 126 -4.456 -11.164 -6.927 1.00 0.00 H new ATOM 0 HB2 SER A 126 -2.294 -12.040 -5.423 1.00 0.00 H new ATOM 0 HB3 SER A 126 -3.442 -13.315 -5.066 1.00 0.00 H new ATOM 0 HG SER A 126 -3.744 -13.585 -7.375 1.00 0.00 H new ATOM 1401 N GLU A 127 -5.928 -12.293 -4.249 1.00 0.00 N ATOM 1402 CA GLU A 127 -7.190 -12.946 -3.790 1.00 0.00 C ATOM 1403 C GLU A 127 -8.345 -12.619 -4.741 1.00 0.00 C ATOM 1404 O GLU A 127 -8.862 -11.520 -4.751 1.00 0.00 O ATOM 1405 CB GLU A 127 -7.457 -12.365 -2.401 1.00 0.00 C ATOM 1406 CG GLU A 127 -6.304 -12.736 -1.465 1.00 0.00 C ATOM 1407 CD GLU A 127 -6.787 -13.768 -0.445 1.00 0.00 C ATOM 1408 OE1 GLU A 127 -6.749 -14.947 -0.760 1.00 0.00 O ATOM 1409 OE2 GLU A 127 -7.185 -13.364 0.634 1.00 0.00 O ATOM 0 H GLU A 127 -5.331 -11.936 -3.503 1.00 0.00 H new ATOM 0 HA GLU A 127 -7.102 -14.032 -3.769 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -7.557 -11.281 -2.461 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -8.398 -12.751 -2.008 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -5.470 -13.140 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -5.937 -11.847 -0.953 1.00 0.00 H new ATOM 1416 N LEU A 128 -8.739 -13.569 -5.547 1.00 0.00 N ATOM 1417 CA LEU A 128 -9.846 -13.337 -6.505 1.00 0.00 C ATOM 1418 C LEU A 128 -10.995 -12.583 -5.828 1.00 0.00 C ATOM 1419 O LEU A 128 -10.997 -12.376 -4.631 1.00 0.00 O ATOM 1420 CB LEU A 128 -10.301 -14.734 -6.930 1.00 0.00 C ATOM 1421 CG LEU A 128 -9.232 -15.377 -7.814 1.00 0.00 C ATOM 1422 CD1 LEU A 128 -8.829 -16.731 -7.227 1.00 0.00 C ATOM 1423 CD2 LEU A 128 -9.792 -15.583 -9.224 1.00 0.00 C ATOM 0 H LEU A 128 -8.333 -14.504 -5.579 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.531 -12.731 -7.355 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -10.479 -15.352 -6.050 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -11.245 -14.671 -7.472 1.00 0.00 H new ATOM 0 HG LEU A 128 -8.360 -14.725 -7.859 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.067 -17.189 -7.858 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -8.431 -16.588 -6.222 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -9.702 -17.382 -7.182 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -9.030 -16.041 -9.855 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -10.665 -16.234 -9.177 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -10.080 -14.620 -9.645 1.00 0.00 H new TER 1435 LEU A 128