USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 756 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.101 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0.0712 USER MOD Single : A 19 GLN : amide:sc= -3.19! C(o=-3.2!,f=-3.1!) USER MOD Single : A 22 LYS NZ :NH3+ 153:sc= -0.197 (180deg=-0.391) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot -133:sc= -0.431 USER MOD Single : A 43 LYS NZ :NH3+ -136:sc= 0.801 (180deg=0.0764) USER MOD Single : A 44 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.34) USER MOD Single : A 46 GLN : amide:sc= -0.0803 K(o=-0.08,f=-1.7!) USER MOD Single : A 51 SER OG : rot 180:sc= 0.00133 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-0.55) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 CYS SG : rot 8:sc= 0.117 USER MOD Single : A 62 GLN : amide:sc= -0.3 X(o=-0.3,f=-0.014) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= -0.301 K(o=-0.3,f=-2!) USER MOD Single : A 70 CYS SG : rot 25:sc= -2.35! USER MOD Single : A 71 GLN : amide:sc= -3.87 K(o=-3.9,f=-0.71) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 170:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 92:sc= 1.05 USER MOD Single : A 81 THR OG1 : rot 180:sc=-0.00934 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot 23:sc= -0.0474 USER MOD Single : A 88 SER OG : rot 180:sc= -0.0216 USER MOD Single : A 89 THR OG1 : rot 94:sc= 0.901 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= -0.035 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.701 -11.567 -2.245 1.00 0.00 N ATOM 2 CA GLY A 1 -26.728 -10.162 -2.606 1.00 0.00 C ATOM 3 C GLY A 1 -25.851 -9.855 -3.804 1.00 0.00 C ATOM 4 O GLY A 1 -25.245 -10.755 -4.386 1.00 0.00 O ATOM 0 H1 GLY A 1 -27.659 -11.964 -2.324 1.00 0.00 H new ATOM 0 H2 GLY A 1 -26.060 -12.078 -2.885 1.00 0.00 H new ATOM 0 H3 GLY A 1 -26.365 -11.667 -1.266 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -27.754 -9.866 -2.825 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -26.398 -9.565 -1.756 1.00 0.00 H new ATOM 8 N SER A 2 -25.784 -8.580 -4.176 1.00 0.00 N ATOM 9 CA SER A 2 -24.980 -8.158 -5.316 1.00 0.00 C ATOM 10 C SER A 2 -24.846 -6.638 -5.353 1.00 0.00 C ATOM 11 O SER A 2 -25.683 -5.917 -4.811 1.00 0.00 O ATOM 12 CB SER A 2 -25.603 -8.658 -6.621 1.00 0.00 C ATOM 13 OG SER A 2 -24.716 -8.479 -7.711 1.00 0.00 O ATOM 0 H SER A 2 -26.277 -7.822 -3.704 1.00 0.00 H new ATOM 0 HA SER A 2 -23.986 -8.591 -5.208 1.00 0.00 H new ATOM 0 HB2 SER A 2 -25.858 -9.713 -6.525 1.00 0.00 H new ATOM 0 HB3 SER A 2 -26.532 -8.122 -6.813 1.00 0.00 H new ATOM 0 HG SER A 2 -25.137 -8.808 -8.533 1.00 0.00 H new ATOM 19 N SER A 3 -23.785 -6.159 -5.996 1.00 0.00 N ATOM 20 CA SER A 3 -23.538 -4.726 -6.101 1.00 0.00 C ATOM 21 C SER A 3 -23.505 -4.286 -7.562 1.00 0.00 C ATOM 22 O SER A 3 -23.488 -5.115 -8.471 1.00 0.00 O ATOM 23 CB SER A 3 -22.218 -4.363 -5.418 1.00 0.00 C ATOM 24 OG SER A 3 -22.301 -4.552 -4.016 1.00 0.00 O ATOM 0 H SER A 3 -23.083 -6.743 -6.452 1.00 0.00 H new ATOM 0 HA SER A 3 -24.354 -4.204 -5.600 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.414 -4.977 -5.824 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.967 -3.325 -5.634 1.00 0.00 H new ATOM 0 HG SER A 3 -21.445 -4.315 -3.603 1.00 0.00 H new ATOM 30 N GLY A 4 -23.497 -2.974 -7.778 1.00 0.00 N ATOM 31 CA GLY A 4 -23.467 -2.446 -9.130 1.00 0.00 C ATOM 32 C GLY A 4 -22.108 -1.887 -9.503 1.00 0.00 C ATOM 33 O GLY A 4 -21.849 -0.697 -9.329 1.00 0.00 O ATOM 0 H GLY A 4 -23.511 -2.268 -7.042 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.737 -3.236 -9.831 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -24.218 -1.662 -9.228 1.00 0.00 H new ATOM 37 N SER A 5 -21.237 -2.749 -10.018 1.00 0.00 N ATOM 38 CA SER A 5 -19.895 -2.337 -10.412 1.00 0.00 C ATOM 39 C SER A 5 -19.668 -2.577 -11.901 1.00 0.00 C ATOM 40 O SER A 5 -20.308 -3.437 -12.507 1.00 0.00 O ATOM 41 CB SER A 5 -18.845 -3.093 -9.595 1.00 0.00 C ATOM 42 OG SER A 5 -18.673 -2.507 -8.317 1.00 0.00 O ATOM 0 H SER A 5 -21.437 -3.737 -10.172 1.00 0.00 H new ATOM 0 HA SER A 5 -19.797 -1.269 -10.215 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.148 -4.134 -9.483 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.895 -3.093 -10.129 1.00 0.00 H new ATOM 0 HG SER A 5 -17.998 -3.010 -7.815 1.00 0.00 H new ATOM 48 N SER A 6 -18.752 -1.811 -12.485 1.00 0.00 N ATOM 49 CA SER A 6 -18.442 -1.937 -13.904 1.00 0.00 C ATOM 50 C SER A 6 -17.053 -2.534 -14.106 1.00 0.00 C ATOM 51 O SER A 6 -16.890 -3.537 -14.800 1.00 0.00 O ATOM 52 CB SER A 6 -18.528 -0.572 -14.590 1.00 0.00 C ATOM 53 OG SER A 6 -19.842 -0.048 -14.520 1.00 0.00 O ATOM 0 H SER A 6 -18.212 -1.097 -11.997 1.00 0.00 H new ATOM 0 HA SER A 6 -19.175 -2.608 -14.352 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.831 0.120 -14.117 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.226 -0.666 -15.633 1.00 0.00 H new ATOM 0 HG SER A 6 -19.870 0.825 -14.964 1.00 0.00 H new ATOM 59 N GLY A 7 -16.052 -1.909 -13.493 1.00 0.00 N ATOM 60 CA GLY A 7 -14.689 -2.391 -13.617 1.00 0.00 C ATOM 61 C GLY A 7 -13.670 -1.386 -13.117 1.00 0.00 C ATOM 62 O GLY A 7 -12.670 -1.123 -13.783 1.00 0.00 O ATOM 0 H GLY A 7 -16.161 -1.077 -12.913 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.583 -3.320 -13.057 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.483 -2.623 -14.662 1.00 0.00 H new ATOM 66 N ALA A 8 -13.926 -0.822 -11.941 1.00 0.00 N ATOM 67 CA ALA A 8 -13.024 0.159 -11.352 1.00 0.00 C ATOM 68 C ALA A 8 -13.189 0.218 -9.837 1.00 0.00 C ATOM 69 O ALA A 8 -14.177 0.748 -9.331 1.00 0.00 O ATOM 70 CB ALA A 8 -13.264 1.531 -11.964 1.00 0.00 C ATOM 0 H ALA A 8 -14.751 -1.028 -11.378 1.00 0.00 H new ATOM 0 HA ALA A 8 -12.001 -0.150 -11.568 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -12.583 2.254 -11.515 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -13.088 1.486 -13.039 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -14.293 1.837 -11.778 1.00 0.00 H new ATOM 76 N ALA A 9 -12.215 -0.332 -9.119 1.00 0.00 N ATOM 77 CA ALA A 9 -12.253 -0.341 -7.662 1.00 0.00 C ATOM 78 C ALA A 9 -11.226 0.625 -7.080 1.00 0.00 C ATOM 79 O ALA A 9 -11.439 1.208 -6.017 1.00 0.00 O ATOM 80 CB ALA A 9 -12.013 -1.748 -7.136 1.00 0.00 C ATOM 0 H ALA A 9 -11.391 -0.777 -9.523 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.243 -0.011 -7.347 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.044 -1.739 -6.046 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.787 -2.415 -7.516 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.036 -2.099 -7.468 1.00 0.00 H new ATOM 86 N PHE A 10 -10.110 0.789 -7.784 1.00 0.00 N ATOM 87 CA PHE A 10 -9.049 1.683 -7.336 1.00 0.00 C ATOM 88 C PHE A 10 -9.068 2.989 -8.126 1.00 0.00 C ATOM 89 O PHE A 10 -8.615 3.042 -9.268 1.00 0.00 O ATOM 90 CB PHE A 10 -7.685 1.005 -7.484 1.00 0.00 C ATOM 91 CG PHE A 10 -7.347 0.084 -6.346 1.00 0.00 C ATOM 92 CD1 PHE A 10 -6.967 0.593 -5.115 1.00 0.00 C ATOM 93 CD2 PHE A 10 -7.410 -1.291 -6.508 1.00 0.00 C ATOM 94 CE1 PHE A 10 -6.655 -0.252 -4.067 1.00 0.00 C ATOM 95 CE2 PHE A 10 -7.099 -2.141 -5.463 1.00 0.00 C ATOM 96 CZ PHE A 10 -6.722 -1.620 -4.241 1.00 0.00 C ATOM 0 H PHE A 10 -9.918 0.315 -8.666 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.221 1.912 -6.284 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -7.668 0.440 -8.416 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -6.914 1.771 -7.562 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -6.914 1.662 -4.973 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -7.705 -1.703 -7.462 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -6.359 0.157 -3.112 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -7.151 -3.211 -5.602 1.00 0.00 H new ATOM 0 HZ PHE A 10 -6.480 -2.282 -3.423 1.00 0.00 H new ATOM 106 N ALA A 11 -9.597 4.040 -7.507 1.00 0.00 N ATOM 107 CA ALA A 11 -9.674 5.345 -8.150 1.00 0.00 C ATOM 108 C ALA A 11 -8.283 5.914 -8.409 1.00 0.00 C ATOM 109 O ALA A 11 -8.086 6.706 -9.330 1.00 0.00 O ATOM 110 CB ALA A 11 -10.489 6.306 -7.297 1.00 0.00 C ATOM 0 H ALA A 11 -9.978 4.012 -6.561 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.170 5.219 -9.112 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.538 7.277 -7.789 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.497 5.913 -7.168 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.016 6.417 -6.321 1.00 0.00 H new ATOM 116 N LYS A 12 -7.320 5.505 -7.589 1.00 0.00 N ATOM 117 CA LYS A 12 -5.946 5.972 -7.728 1.00 0.00 C ATOM 118 C LYS A 12 -4.958 4.896 -7.291 1.00 0.00 C ATOM 119 O LYS A 12 -4.867 4.568 -6.107 1.00 0.00 O ATOM 120 CB LYS A 12 -5.732 7.243 -6.903 1.00 0.00 C ATOM 121 CG LYS A 12 -4.476 8.009 -7.280 1.00 0.00 C ATOM 122 CD LYS A 12 -4.574 8.584 -8.683 1.00 0.00 C ATOM 123 CE LYS A 12 -3.548 9.684 -8.908 1.00 0.00 C ATOM 124 NZ LYS A 12 -3.411 10.029 -10.350 1.00 0.00 N ATOM 0 H LYS A 12 -7.467 4.850 -6.821 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.769 6.195 -8.780 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -6.596 7.896 -7.026 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -5.682 6.977 -5.847 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.313 8.816 -6.566 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.612 7.347 -7.216 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.423 7.790 -9.414 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.576 8.981 -8.845 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -3.840 10.573 -8.348 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.582 9.365 -8.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -2.703 10.782 -10.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.108 9.188 -10.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -4.327 10.358 -10.717 1.00 0.00 H new ATOM 138 N ILE A 13 -4.220 4.350 -8.251 1.00 0.00 N ATOM 139 CA ILE A 13 -3.237 3.313 -7.964 1.00 0.00 C ATOM 140 C ILE A 13 -1.906 3.921 -7.535 1.00 0.00 C ATOM 141 O ILE A 13 -1.714 5.136 -7.606 1.00 0.00 O ATOM 142 CB ILE A 13 -3.004 2.404 -9.185 1.00 0.00 C ATOM 143 CG1 ILE A 13 -2.331 3.190 -10.312 1.00 0.00 C ATOM 144 CG2 ILE A 13 -4.321 1.808 -9.660 1.00 0.00 C ATOM 145 CD1 ILE A 13 -1.618 2.313 -11.317 1.00 0.00 C ATOM 0 H ILE A 13 -4.284 4.609 -9.236 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.640 2.714 -7.148 1.00 0.00 H new ATOM 0 HB ILE A 13 -2.343 1.588 -8.892 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -3.084 3.784 -10.830 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.615 3.889 -9.880 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.140 1.168 -10.524 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.764 1.218 -8.857 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.004 2.610 -9.940 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.164 2.937 -12.087 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.842 1.738 -10.812 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.333 1.631 -11.777 1.00 0.00 H new ATOM 157 N LEU A 14 -0.989 3.069 -7.092 1.00 0.00 N ATOM 158 CA LEU A 14 0.327 3.521 -6.653 1.00 0.00 C ATOM 159 C LEU A 14 1.241 3.777 -7.847 1.00 0.00 C ATOM 160 O LEU A 14 0.849 3.574 -8.996 1.00 0.00 O ATOM 161 CB LEU A 14 0.961 2.484 -5.724 1.00 0.00 C ATOM 162 CG LEU A 14 0.164 2.133 -4.467 1.00 0.00 C ATOM 163 CD1 LEU A 14 -0.689 0.897 -4.703 1.00 0.00 C ATOM 164 CD2 LEU A 14 1.099 1.921 -3.285 1.00 0.00 C ATOM 0 H LEU A 14 -1.132 2.061 -7.027 1.00 0.00 H new ATOM 0 HA LEU A 14 0.199 4.457 -6.109 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.126 1.569 -6.293 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.941 2.850 -5.418 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.499 2.967 -4.236 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.249 0.663 -3.797 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.384 1.086 -5.521 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.046 0.055 -4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.515 1.672 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.787 1.105 -3.507 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.666 2.834 -3.101 1.00 0.00 H new ATOM 176 N ASP A 15 2.461 4.221 -7.567 1.00 0.00 N ATOM 177 CA ASP A 15 3.433 4.501 -8.618 1.00 0.00 C ATOM 178 C ASP A 15 4.100 3.216 -9.098 1.00 0.00 C ATOM 179 O ASP A 15 4.124 2.202 -8.401 1.00 0.00 O ATOM 180 CB ASP A 15 4.492 5.483 -8.114 1.00 0.00 C ATOM 181 CG ASP A 15 4.084 6.929 -8.315 1.00 0.00 C ATOM 182 OD1 ASP A 15 2.915 7.260 -8.029 1.00 0.00 O ATOM 183 OD2 ASP A 15 4.934 7.729 -8.760 1.00 0.00 O ATOM 0 H ASP A 15 2.801 4.395 -6.621 1.00 0.00 H new ATOM 0 HA ASP A 15 2.903 4.950 -9.459 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.674 5.304 -7.054 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.432 5.298 -8.635 1.00 0.00 H new ATOM 188 N PRO A 16 4.654 3.257 -10.319 1.00 0.00 N ATOM 189 CA PRO A 16 5.331 2.104 -10.920 1.00 0.00 C ATOM 190 C PRO A 16 6.649 1.779 -10.226 1.00 0.00 C ATOM 191 O PRO A 16 7.217 0.706 -10.425 1.00 0.00 O ATOM 192 CB PRO A 16 5.582 2.553 -12.362 1.00 0.00 C ATOM 193 CG PRO A 16 5.624 4.041 -12.294 1.00 0.00 C ATOM 194 CD PRO A 16 4.663 4.433 -11.206 1.00 0.00 C ATOM 0 HA PRO A 16 4.736 1.194 -10.839 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.518 2.148 -12.745 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.790 2.209 -13.027 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.631 4.393 -12.071 1.00 0.00 H new ATOM 0 HG3 PRO A 16 5.336 4.484 -13.247 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.994 5.329 -10.681 1.00 0.00 H new ATOM 0 HD3 PRO A 16 3.670 4.644 -11.603 1.00 0.00 H new ATOM 202 N ALA A 17 7.129 2.712 -9.411 1.00 0.00 N ATOM 203 CA ALA A 17 8.379 2.523 -8.685 1.00 0.00 C ATOM 204 C ALA A 17 8.635 3.677 -7.722 1.00 0.00 C ATOM 205 O ALA A 17 8.502 4.845 -8.089 1.00 0.00 O ATOM 206 CB ALA A 17 9.538 2.379 -9.660 1.00 0.00 C ATOM 0 H ALA A 17 6.671 3.607 -9.237 1.00 0.00 H new ATOM 0 HA ALA A 17 8.295 1.608 -8.099 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.465 2.238 -9.105 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.367 1.517 -10.304 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.614 3.279 -10.271 1.00 0.00 H new ATOM 212 N TYR A 18 9.001 3.343 -6.490 1.00 0.00 N ATOM 213 CA TYR A 18 9.273 4.352 -5.473 1.00 0.00 C ATOM 214 C TYR A 18 10.767 4.443 -5.181 1.00 0.00 C ATOM 215 O TYR A 18 11.541 3.571 -5.575 1.00 0.00 O ATOM 216 CB TYR A 18 8.509 4.029 -4.188 1.00 0.00 C ATOM 217 CG TYR A 18 7.029 4.327 -4.272 1.00 0.00 C ATOM 218 CD1 TYR A 18 6.203 3.608 -5.127 1.00 0.00 C ATOM 219 CD2 TYR A 18 6.456 5.327 -3.496 1.00 0.00 C ATOM 220 CE1 TYR A 18 4.850 3.877 -5.207 1.00 0.00 C ATOM 221 CE2 TYR A 18 5.104 5.602 -3.569 1.00 0.00 C ATOM 222 CZ TYR A 18 4.306 4.875 -4.426 1.00 0.00 C ATOM 223 OH TYR A 18 2.959 5.145 -4.502 1.00 0.00 O ATOM 0 H TYR A 18 9.116 2.381 -6.171 1.00 0.00 H new ATOM 0 HA TYR A 18 8.937 5.316 -5.855 1.00 0.00 H new ATOM 0 HB2 TYR A 18 8.646 2.974 -3.949 1.00 0.00 H new ATOM 0 HB3 TYR A 18 8.940 4.600 -3.366 1.00 0.00 H new ATOM 0 HD1 TYR A 18 6.626 2.825 -5.740 1.00 0.00 H new ATOM 0 HD2 TYR A 18 7.078 5.899 -2.824 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.222 3.309 -5.877 1.00 0.00 H new ATOM 0 HE2 TYR A 18 4.675 6.382 -2.958 1.00 0.00 H new ATOM 0 HH TYR A 18 2.736 5.875 -3.887 1.00 0.00 H new ATOM 233 N GLN A 19 11.164 5.504 -4.486 1.00 0.00 N ATOM 234 CA GLN A 19 12.566 5.709 -4.140 1.00 0.00 C ATOM 235 C GLN A 19 12.696 6.432 -2.804 1.00 0.00 C ATOM 236 O GLN A 19 12.133 7.510 -2.611 1.00 0.00 O ATOM 237 CB GLN A 19 13.272 6.508 -5.237 1.00 0.00 C ATOM 238 CG GLN A 19 13.227 5.840 -6.602 1.00 0.00 C ATOM 239 CD GLN A 19 11.930 6.107 -7.340 1.00 0.00 C ATOM 240 OE1 GLN A 19 11.428 7.232 -7.350 1.00 0.00 O ATOM 241 NE2 GLN A 19 11.379 5.072 -7.964 1.00 0.00 N ATOM 0 H GLN A 19 10.535 6.234 -4.152 1.00 0.00 H new ATOM 0 HA GLN A 19 13.039 4.731 -4.051 1.00 0.00 H new ATOM 0 HB2 GLN A 19 12.813 7.494 -5.309 1.00 0.00 H new ATOM 0 HB3 GLN A 19 14.313 6.661 -4.951 1.00 0.00 H new ATOM 0 HG2 GLN A 19 14.063 6.196 -7.204 1.00 0.00 H new ATOM 0 HG3 GLN A 19 13.357 4.765 -6.480 1.00 0.00 H new ATOM 0 HE21 GLN A 19 11.829 4.157 -7.930 1.00 0.00 H new ATOM 0 HE22 GLN A 19 10.506 5.192 -8.477 1.00 0.00 H new ATOM 250 N VAL A 20 13.443 5.832 -1.882 1.00 0.00 N ATOM 251 CA VAL A 20 13.649 6.419 -0.564 1.00 0.00 C ATOM 252 C VAL A 20 15.074 6.189 -0.076 1.00 0.00 C ATOM 253 O VAL A 20 15.800 5.355 -0.618 1.00 0.00 O ATOM 254 CB VAL A 20 12.664 5.838 0.469 1.00 0.00 C ATOM 255 CG1 VAL A 20 13.066 4.422 0.852 1.00 0.00 C ATOM 256 CG2 VAL A 20 12.593 6.732 1.698 1.00 0.00 C ATOM 0 H VAL A 20 13.915 4.939 -2.024 1.00 0.00 H new ATOM 0 HA VAL A 20 13.471 7.490 -0.663 1.00 0.00 H new ATOM 0 HB VAL A 20 11.672 5.799 0.018 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.359 4.028 1.582 1.00 0.00 H new ATOM 0 HG12 VAL A 20 13.061 3.790 -0.036 1.00 0.00 H new ATOM 0 HG13 VAL A 20 14.066 4.432 1.284 1.00 0.00 H new ATOM 0 HG21 VAL A 20 11.893 6.307 2.417 1.00 0.00 H new ATOM 0 HG22 VAL A 20 13.581 6.805 2.153 1.00 0.00 H new ATOM 0 HG23 VAL A 20 12.254 7.726 1.406 1.00 0.00 H new ATOM 266 N ASP A 21 15.470 6.933 0.951 1.00 0.00 N ATOM 267 CA ASP A 21 16.809 6.809 1.515 1.00 0.00 C ATOM 268 C ASP A 21 16.847 5.730 2.593 1.00 0.00 C ATOM 269 O ASP A 21 15.877 5.533 3.324 1.00 0.00 O ATOM 270 CB ASP A 21 17.266 8.147 2.098 1.00 0.00 C ATOM 271 CG ASP A 21 17.401 9.224 1.039 1.00 0.00 C ATOM 272 OD1 ASP A 21 18.182 9.024 0.085 1.00 0.00 O ATOM 273 OD2 ASP A 21 16.725 10.266 1.164 1.00 0.00 O ATOM 0 H ASP A 21 14.882 7.629 1.410 1.00 0.00 H new ATOM 0 HA ASP A 21 17.489 6.520 0.713 1.00 0.00 H new ATOM 0 HB2 ASP A 21 16.552 8.473 2.855 1.00 0.00 H new ATOM 0 HB3 ASP A 21 18.224 8.013 2.600 1.00 0.00 H new ATOM 278 N LYS A 22 17.975 5.033 2.686 1.00 0.00 N ATOM 279 CA LYS A 22 18.141 3.974 3.674 1.00 0.00 C ATOM 280 C LYS A 22 17.563 4.393 5.022 1.00 0.00 C ATOM 281 O LYS A 22 17.482 5.580 5.332 1.00 0.00 O ATOM 282 CB LYS A 22 19.623 3.622 3.830 1.00 0.00 C ATOM 283 CG LYS A 22 19.870 2.411 4.712 1.00 0.00 C ATOM 284 CD LYS A 22 21.278 2.417 5.285 1.00 0.00 C ATOM 285 CE LYS A 22 22.273 1.786 4.324 1.00 0.00 C ATOM 286 NZ LYS A 22 22.109 0.308 4.248 1.00 0.00 N ATOM 0 H LYS A 22 18.788 5.183 2.088 1.00 0.00 H new ATOM 0 HA LYS A 22 17.600 3.095 3.323 1.00 0.00 H new ATOM 0 HB2 LYS A 22 20.050 3.436 2.844 1.00 0.00 H new ATOM 0 HB3 LYS A 22 20.150 4.480 4.249 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.145 2.398 5.526 1.00 0.00 H new ATOM 0 HG3 LYS A 22 19.715 1.500 4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 22 21.579 3.442 5.502 1.00 0.00 H new ATOM 0 HD3 LYS A 22 21.290 1.875 6.230 1.00 0.00 H new ATOM 0 HE2 LYS A 22 22.143 2.217 3.331 1.00 0.00 H new ATOM 0 HE3 LYS A 22 23.288 2.023 4.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.435 -0.030 3.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.672 -0.143 4.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 21.106 0.063 4.373 1.00 0.00 H new ATOM 300 N GLY A 23 17.163 3.408 5.821 1.00 0.00 N ATOM 301 CA GLY A 23 16.598 3.694 7.126 1.00 0.00 C ATOM 302 C GLY A 23 15.726 4.934 7.122 1.00 0.00 C ATOM 303 O GLY A 23 15.708 5.692 8.090 1.00 0.00 O ATOM 0 H GLY A 23 17.220 2.417 5.587 1.00 0.00 H new ATOM 0 HA2 GLY A 23 16.008 2.840 7.458 1.00 0.00 H new ATOM 0 HA3 GLY A 23 17.405 3.824 7.847 1.00 0.00 H new ATOM 307 N GLY A 24 15.001 5.142 6.026 1.00 0.00 N ATOM 308 CA GLY A 24 14.134 6.301 5.919 1.00 0.00 C ATOM 309 C GLY A 24 12.670 5.946 6.083 1.00 0.00 C ATOM 310 O GLY A 24 12.320 5.075 6.879 1.00 0.00 O ATOM 0 H GLY A 24 14.999 4.529 5.211 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.415 7.032 6.677 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.283 6.775 4.949 1.00 0.00 H new ATOM 314 N ARG A 25 11.811 6.624 5.329 1.00 0.00 N ATOM 315 CA ARG A 25 10.375 6.378 5.396 1.00 0.00 C ATOM 316 C ARG A 25 9.730 6.545 4.023 1.00 0.00 C ATOM 317 O ARG A 25 9.836 7.602 3.400 1.00 0.00 O ATOM 318 CB ARG A 25 9.720 7.329 6.399 1.00 0.00 C ATOM 319 CG ARG A 25 8.345 6.874 6.861 1.00 0.00 C ATOM 320 CD ARG A 25 7.567 8.013 7.501 1.00 0.00 C ATOM 321 NE ARG A 25 7.173 9.023 6.523 1.00 0.00 N ATOM 322 CZ ARG A 25 6.680 10.212 6.852 1.00 0.00 C ATOM 323 NH1 ARG A 25 6.523 10.538 8.128 1.00 0.00 N ATOM 324 NH2 ARG A 25 6.344 11.078 5.905 1.00 0.00 N ATOM 0 H ARG A 25 12.084 7.348 4.665 1.00 0.00 H new ATOM 0 HA ARG A 25 10.222 5.351 5.727 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.370 7.432 7.268 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.634 8.317 5.947 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.786 6.482 6.011 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.452 6.058 7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.678 7.615 7.990 1.00 0.00 H new ATOM 0 HD3 ARG A 25 8.176 8.477 8.277 1.00 0.00 H new ATOM 0 HE ARG A 25 7.282 8.804 5.533 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.781 9.875 8.859 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.144 11.451 8.378 1.00 0.00 H new ATOM 0 HH21 ARG A 25 6.464 10.831 4.923 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.966 11.990 6.159 1.00 0.00 H new ATOM 338 N VAL A 26 9.062 5.495 3.557 1.00 0.00 N ATOM 339 CA VAL A 26 8.399 5.526 2.259 1.00 0.00 C ATOM 340 C VAL A 26 6.930 5.911 2.401 1.00 0.00 C ATOM 341 O VAL A 26 6.367 5.859 3.494 1.00 0.00 O ATOM 342 CB VAL A 26 8.494 4.163 1.548 1.00 0.00 C ATOM 343 CG1 VAL A 26 9.937 3.854 1.177 1.00 0.00 C ATOM 344 CG2 VAL A 26 7.913 3.063 2.424 1.00 0.00 C ATOM 0 H VAL A 26 8.966 4.612 4.059 1.00 0.00 H new ATOM 0 HA VAL A 26 8.912 6.277 1.659 1.00 0.00 H new ATOM 0 HB VAL A 26 7.910 4.211 0.629 1.00 0.00 H new ATOM 0 HG11 VAL A 26 9.985 2.887 0.676 1.00 0.00 H new ATOM 0 HG12 VAL A 26 10.315 4.628 0.509 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.547 3.825 2.080 1.00 0.00 H new ATOM 0 HG21 VAL A 26 7.989 2.107 1.906 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.468 3.013 3.361 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.866 3.280 2.634 1.00 0.00 H new ATOM 354 N ARG A 27 6.315 6.296 1.287 1.00 0.00 N ATOM 355 CA ARG A 27 4.912 6.691 1.287 1.00 0.00 C ATOM 356 C ARG A 27 4.106 5.835 0.314 1.00 0.00 C ATOM 357 O ARG A 27 4.442 5.735 -0.866 1.00 0.00 O ATOM 358 CB ARG A 27 4.776 8.169 0.916 1.00 0.00 C ATOM 359 CG ARG A 27 3.345 8.679 0.961 1.00 0.00 C ATOM 360 CD ARG A 27 3.244 10.102 0.435 1.00 0.00 C ATOM 361 NE ARG A 27 3.397 10.162 -1.016 1.00 0.00 N ATOM 362 CZ ARG A 27 3.762 11.259 -1.671 1.00 0.00 C ATOM 363 NH1 ARG A 27 4.010 12.380 -1.008 1.00 0.00 N ATOM 364 NH2 ARG A 27 3.880 11.234 -2.993 1.00 0.00 N ATOM 0 H ARG A 27 6.766 6.343 0.374 1.00 0.00 H new ATOM 0 HA ARG A 27 4.518 6.538 2.292 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.386 8.763 1.596 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.176 8.322 -0.087 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.706 8.025 0.368 1.00 0.00 H new ATOM 0 HG3 ARG A 27 2.976 8.642 1.986 1.00 0.00 H new ATOM 0 HD2 ARG A 27 2.279 10.524 0.715 1.00 0.00 H new ATOM 0 HD3 ARG A 27 4.010 10.718 0.906 1.00 0.00 H new ATOM 0 HE ARG A 27 3.214 9.316 -1.556 1.00 0.00 H new ATOM 0 HH11 ARG A 27 3.921 12.402 0.008 1.00 0.00 H new ATOM 0 HH12 ARG A 27 4.290 13.220 -1.514 1.00 0.00 H new ATOM 0 HH21 ARG A 27 3.690 10.373 -3.506 1.00 0.00 H new ATOM 0 HH22 ARG A 27 4.160 12.076 -3.496 1.00 0.00 H new ATOM 378 N PHE A 28 3.043 5.218 0.818 1.00 0.00 N ATOM 379 CA PHE A 28 2.190 4.368 -0.005 1.00 0.00 C ATOM 380 C PHE A 28 0.716 4.653 0.265 1.00 0.00 C ATOM 381 O PHE A 28 0.184 4.289 1.315 1.00 0.00 O ATOM 382 CB PHE A 28 2.494 2.893 0.261 1.00 0.00 C ATOM 383 CG PHE A 28 3.834 2.454 -0.256 1.00 0.00 C ATOM 384 CD1 PHE A 28 4.248 2.803 -1.532 1.00 0.00 C ATOM 385 CD2 PHE A 28 4.681 1.692 0.534 1.00 0.00 C ATOM 386 CE1 PHE A 28 5.480 2.401 -2.010 1.00 0.00 C ATOM 387 CE2 PHE A 28 5.915 1.288 0.060 1.00 0.00 C ATOM 388 CZ PHE A 28 6.314 1.642 -1.213 1.00 0.00 C ATOM 0 H PHE A 28 2.751 5.290 1.793 1.00 0.00 H new ATOM 0 HA PHE A 28 2.399 4.591 -1.051 1.00 0.00 H new ATOM 0 HB2 PHE A 28 2.450 2.709 1.334 1.00 0.00 H new ATOM 0 HB3 PHE A 28 1.718 2.282 -0.199 1.00 0.00 H new ATOM 0 HD1 PHE A 28 3.600 3.396 -2.160 1.00 0.00 H new ATOM 0 HD2 PHE A 28 4.373 1.411 1.530 1.00 0.00 H new ATOM 0 HE1 PHE A 28 5.791 2.680 -3.006 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.567 0.696 0.685 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.277 1.326 -1.585 1.00 0.00 H new ATOM 398 N VAL A 29 0.060 5.305 -0.689 1.00 0.00 N ATOM 399 CA VAL A 29 -1.353 5.639 -0.555 1.00 0.00 C ATOM 400 C VAL A 29 -2.148 5.156 -1.763 1.00 0.00 C ATOM 401 O VAL A 29 -1.614 5.040 -2.866 1.00 0.00 O ATOM 402 CB VAL A 29 -1.559 7.156 -0.392 1.00 0.00 C ATOM 403 CG1 VAL A 29 -0.753 7.920 -1.432 1.00 0.00 C ATOM 404 CG2 VAL A 29 -3.036 7.507 -0.487 1.00 0.00 C ATOM 0 H VAL A 29 0.485 5.613 -1.564 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.714 5.133 0.341 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.203 7.449 0.596 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -0.912 8.990 -1.301 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.306 7.692 -1.311 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.075 7.625 -2.431 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.163 8.583 -0.370 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.421 7.200 -1.460 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.584 6.989 0.300 1.00 0.00 H new ATOM 414 N VAL A 30 -3.430 4.877 -1.548 1.00 0.00 N ATOM 415 CA VAL A 30 -4.301 4.409 -2.619 1.00 0.00 C ATOM 416 C VAL A 30 -5.704 4.988 -2.480 1.00 0.00 C ATOM 417 O VAL A 30 -6.062 5.529 -1.434 1.00 0.00 O ATOM 418 CB VAL A 30 -4.392 2.871 -2.637 1.00 0.00 C ATOM 419 CG1 VAL A 30 -3.068 2.263 -3.076 1.00 0.00 C ATOM 420 CG2 VAL A 30 -4.802 2.346 -1.270 1.00 0.00 C ATOM 0 H VAL A 30 -3.888 4.967 -0.641 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.861 4.751 -3.556 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.156 2.578 -3.357 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.151 1.176 -3.083 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.821 2.614 -4.078 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.282 2.562 -2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.861 1.258 -1.301 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.063 2.648 -0.528 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.776 2.755 -1.000 1.00 0.00 H new ATOM 430 N GLU A 31 -6.496 4.870 -3.542 1.00 0.00 N ATOM 431 CA GLU A 31 -7.861 5.383 -3.537 1.00 0.00 C ATOM 432 C GLU A 31 -8.855 4.287 -3.910 1.00 0.00 C ATOM 433 O GLU A 31 -8.512 3.333 -4.610 1.00 0.00 O ATOM 434 CB GLU A 31 -7.991 6.557 -4.510 1.00 0.00 C ATOM 435 CG GLU A 31 -9.170 7.468 -4.209 1.00 0.00 C ATOM 436 CD GLU A 31 -9.126 8.759 -5.003 1.00 0.00 C ATOM 437 OE1 GLU A 31 -8.019 9.307 -5.183 1.00 0.00 O ATOM 438 OE2 GLU A 31 -10.199 9.221 -5.444 1.00 0.00 O ATOM 0 H GLU A 31 -6.216 4.424 -4.416 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.089 5.729 -2.529 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -7.073 7.144 -4.483 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.092 6.169 -5.524 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.098 6.941 -4.431 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -9.182 7.701 -3.144 1.00 0.00 H new ATOM 445 N LEU A 32 -10.088 4.429 -3.436 1.00 0.00 N ATOM 446 CA LEU A 32 -11.133 3.452 -3.718 1.00 0.00 C ATOM 447 C LEU A 32 -12.408 4.140 -4.196 1.00 0.00 C ATOM 448 O LEU A 32 -12.901 5.068 -3.557 1.00 0.00 O ATOM 449 CB LEU A 32 -11.428 2.617 -2.470 1.00 0.00 C ATOM 450 CG LEU A 32 -10.209 2.100 -1.705 1.00 0.00 C ATOM 451 CD1 LEU A 32 -10.532 1.950 -0.226 1.00 0.00 C ATOM 452 CD2 LEU A 32 -9.736 0.777 -2.287 1.00 0.00 C ATOM 0 H LEU A 32 -10.388 5.211 -2.855 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.777 2.795 -4.512 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.031 3.218 -1.789 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.036 1.762 -2.765 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.404 2.827 -1.808 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.653 1.581 0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.822 2.918 0.183 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.353 1.243 -0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.868 0.424 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.537 0.041 -2.215 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.464 0.916 -3.333 1.00 0.00 H new ATOM 464 N ALA A 33 -12.937 3.676 -5.324 1.00 0.00 N ATOM 465 CA ALA A 33 -14.156 4.244 -5.885 1.00 0.00 C ATOM 466 C ALA A 33 -15.279 4.261 -4.854 1.00 0.00 C ATOM 467 O ALA A 33 -16.199 5.075 -4.937 1.00 0.00 O ATOM 468 CB ALA A 33 -14.582 3.463 -7.120 1.00 0.00 C ATOM 0 H ALA A 33 -12.540 2.909 -5.866 1.00 0.00 H new ATOM 0 HA ALA A 33 -13.948 5.274 -6.174 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.494 3.898 -7.529 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -13.791 3.507 -7.869 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -14.766 2.424 -6.848 1.00 0.00 H new ATOM 474 N ASP A 34 -15.199 3.358 -3.883 1.00 0.00 N ATOM 475 CA ASP A 34 -16.208 3.270 -2.835 1.00 0.00 C ATOM 476 C ASP A 34 -15.626 2.645 -1.571 1.00 0.00 C ATOM 477 O ASP A 34 -14.813 1.723 -1.623 1.00 0.00 O ATOM 478 CB ASP A 34 -17.406 2.450 -3.319 1.00 0.00 C ATOM 479 CG ASP A 34 -18.258 3.206 -4.320 1.00 0.00 C ATOM 480 OD1 ASP A 34 -17.893 3.225 -5.514 1.00 0.00 O ATOM 481 OD2 ASP A 34 -19.289 3.779 -3.909 1.00 0.00 O ATOM 0 H ASP A 34 -14.445 2.676 -3.800 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.540 4.281 -2.599 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.050 1.526 -3.774 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -18.020 2.168 -2.463 1.00 0.00 H new ATOM 486 N PRO A 35 -16.051 3.160 -0.407 1.00 0.00 N ATOM 487 CA PRO A 35 -15.584 2.668 0.893 1.00 0.00 C ATOM 488 C PRO A 35 -16.109 1.271 1.206 1.00 0.00 C ATOM 489 O PRO A 35 -15.597 0.589 2.095 1.00 0.00 O ATOM 490 CB PRO A 35 -16.153 3.687 1.883 1.00 0.00 C ATOM 491 CG PRO A 35 -17.347 4.255 1.197 1.00 0.00 C ATOM 492 CD PRO A 35 -17.019 4.260 -0.270 1.00 0.00 C ATOM 0 HA PRO A 35 -14.498 2.579 0.929 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -16.426 3.213 2.826 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -15.424 4.463 2.116 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -18.234 3.654 1.396 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -17.559 5.263 1.553 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -17.906 4.093 -0.881 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.592 5.213 -0.583 1.00 0.00 H new ATOM 500 N LYS A 36 -17.132 0.849 0.471 1.00 0.00 N ATOM 501 CA LYS A 36 -17.726 -0.468 0.669 1.00 0.00 C ATOM 502 C LYS A 36 -16.670 -1.563 0.555 1.00 0.00 C ATOM 503 O LYS A 36 -16.672 -2.524 1.325 1.00 0.00 O ATOM 504 CB LYS A 36 -18.838 -0.707 -0.354 1.00 0.00 C ATOM 505 CG LYS A 36 -20.012 0.245 -0.211 1.00 0.00 C ATOM 506 CD LYS A 36 -21.218 -0.233 -1.003 1.00 0.00 C ATOM 507 CE LYS A 36 -21.086 0.109 -2.479 1.00 0.00 C ATOM 508 NZ LYS A 36 -22.243 -0.395 -3.270 1.00 0.00 N ATOM 0 H LYS A 36 -17.568 1.401 -0.268 1.00 0.00 H new ATOM 0 HA LYS A 36 -18.151 -0.501 1.672 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.423 -0.611 -1.358 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -19.198 -1.731 -0.254 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -20.280 0.338 0.841 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -19.720 1.238 -0.554 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -21.327 -1.311 -0.887 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -22.123 0.224 -0.602 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -21.009 1.190 -2.596 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -20.164 -0.320 -2.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -22.116 -0.142 -4.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -22.302 -1.429 -3.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -23.121 0.034 -2.913 1.00 0.00 H new ATOM 522 N LEU A 37 -15.770 -1.411 -0.409 1.00 0.00 N ATOM 523 CA LEU A 37 -14.707 -2.387 -0.623 1.00 0.00 C ATOM 524 C LEU A 37 -13.672 -2.321 0.496 1.00 0.00 C ATOM 525 O LEU A 37 -13.547 -1.304 1.178 1.00 0.00 O ATOM 526 CB LEU A 37 -14.030 -2.146 -1.974 1.00 0.00 C ATOM 527 CG LEU A 37 -14.960 -2.053 -3.184 1.00 0.00 C ATOM 528 CD1 LEU A 37 -14.182 -1.646 -4.425 1.00 0.00 C ATOM 529 CD2 LEU A 37 -15.673 -3.378 -3.410 1.00 0.00 C ATOM 0 H LEU A 37 -15.754 -0.622 -1.055 1.00 0.00 H new ATOM 0 HA LEU A 37 -15.155 -3.381 -0.620 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -13.456 -1.222 -1.910 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -13.318 -2.952 -2.150 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.710 -1.288 -2.984 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -14.860 -1.585 -5.276 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -13.718 -0.674 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -13.409 -2.387 -4.629 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.331 -3.294 -4.275 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -14.937 -4.162 -3.589 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -16.263 -3.629 -2.528 1.00 0.00 H new ATOM 541 N GLU A 38 -12.933 -3.410 0.677 1.00 0.00 N ATOM 542 CA GLU A 38 -11.908 -3.473 1.713 1.00 0.00 C ATOM 543 C GLU A 38 -10.513 -3.365 1.106 1.00 0.00 C ATOM 544 O GLU A 38 -10.343 -3.461 -0.110 1.00 0.00 O ATOM 545 CB GLU A 38 -12.032 -4.777 2.505 1.00 0.00 C ATOM 546 CG GLU A 38 -11.540 -4.668 3.938 1.00 0.00 C ATOM 547 CD GLU A 38 -12.118 -5.743 4.837 1.00 0.00 C ATOM 548 OE1 GLU A 38 -13.359 -5.841 4.925 1.00 0.00 O ATOM 549 OE2 GLU A 38 -11.327 -6.489 5.453 1.00 0.00 O ATOM 0 H GLU A 38 -13.024 -4.260 0.121 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.058 -2.630 2.388 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -13.076 -5.091 2.511 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.468 -5.557 1.994 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.452 -4.735 3.951 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.803 -3.688 4.335 1.00 0.00 H new ATOM 556 N VAL A 39 -9.515 -3.165 1.961 1.00 0.00 N ATOM 557 CA VAL A 39 -8.134 -3.044 1.510 1.00 0.00 C ATOM 558 C VAL A 39 -7.220 -3.993 2.277 1.00 0.00 C ATOM 559 O VAL A 39 -7.462 -4.296 3.446 1.00 0.00 O ATOM 560 CB VAL A 39 -7.614 -1.603 1.675 1.00 0.00 C ATOM 561 CG1 VAL A 39 -8.447 -0.637 0.847 1.00 0.00 C ATOM 562 CG2 VAL A 39 -7.617 -1.201 3.142 1.00 0.00 C ATOM 0 H VAL A 39 -9.637 -3.083 2.970 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.122 -3.308 0.453 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.587 -1.562 1.313 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.065 0.376 0.976 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.388 -0.916 -0.205 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.485 -0.678 1.176 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.247 -0.181 3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.633 -1.258 3.533 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.973 -1.876 3.706 1.00 0.00 H new ATOM 572 N LYS A 40 -6.169 -4.460 1.612 1.00 0.00 N ATOM 573 CA LYS A 40 -5.216 -5.374 2.230 1.00 0.00 C ATOM 574 C LYS A 40 -3.824 -5.194 1.634 1.00 0.00 C ATOM 575 O LYS A 40 -3.638 -5.310 0.423 1.00 0.00 O ATOM 576 CB LYS A 40 -5.677 -6.822 2.049 1.00 0.00 C ATOM 577 CG LYS A 40 -6.984 -7.138 2.754 1.00 0.00 C ATOM 578 CD LYS A 40 -7.461 -8.546 2.441 1.00 0.00 C ATOM 579 CE LYS A 40 -8.259 -9.134 3.595 1.00 0.00 C ATOM 580 NZ LYS A 40 -9.664 -8.640 3.607 1.00 0.00 N ATOM 0 H LYS A 40 -5.955 -4.220 0.644 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.168 -5.144 3.294 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.789 -7.028 0.985 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.902 -7.491 2.423 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -6.853 -7.028 3.831 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.745 -6.419 2.450 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.077 -8.531 1.542 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -6.603 -9.183 2.229 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -8.257 -10.221 3.521 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.776 -8.878 4.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -10.174 -9.064 4.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -9.667 -7.604 3.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.133 -8.906 2.718 1.00 0.00 H new ATOM 594 N TRP A 41 -2.851 -4.911 2.492 1.00 0.00 N ATOM 595 CA TRP A 41 -1.474 -4.717 2.049 1.00 0.00 C ATOM 596 C TRP A 41 -0.671 -6.005 2.186 1.00 0.00 C ATOM 597 O TRP A 41 -0.714 -6.667 3.224 1.00 0.00 O ATOM 598 CB TRP A 41 -0.811 -3.599 2.855 1.00 0.00 C ATOM 599 CG TRP A 41 -1.447 -2.258 2.648 1.00 0.00 C ATOM 600 CD1 TRP A 41 -2.627 -1.820 3.178 1.00 0.00 C ATOM 601 CD2 TRP A 41 -0.939 -1.183 1.850 1.00 0.00 C ATOM 602 NE1 TRP A 41 -2.883 -0.537 2.759 1.00 0.00 N ATOM 603 CE2 TRP A 41 -1.862 -0.123 1.944 1.00 0.00 C ATOM 604 CE3 TRP A 41 0.206 -1.011 1.068 1.00 0.00 C ATOM 605 CZ2 TRP A 41 -1.674 1.089 1.284 1.00 0.00 C ATOM 606 CZ3 TRP A 41 0.391 0.191 0.414 1.00 0.00 C ATOM 607 CH2 TRP A 41 -0.544 1.229 0.525 1.00 0.00 C ATOM 0 H TRP A 41 -2.989 -4.811 3.498 1.00 0.00 H new ATOM 0 HA TRP A 41 -1.493 -4.434 0.996 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -0.851 -3.852 3.914 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.242 -3.539 2.581 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.265 -2.397 3.831 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -3.700 0.018 3.013 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.933 -1.804 0.977 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.394 1.889 1.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.272 0.334 -0.194 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -0.369 2.157 0.001 1.00 0.00 H new ATOM 618 N TYR A 42 0.061 -6.356 1.135 1.00 0.00 N ATOM 619 CA TYR A 42 0.872 -7.567 1.138 1.00 0.00 C ATOM 620 C TYR A 42 2.307 -7.262 0.719 1.00 0.00 C ATOM 621 O TYR A 42 2.548 -6.443 -0.167 1.00 0.00 O ATOM 622 CB TYR A 42 0.267 -8.614 0.201 1.00 0.00 C ATOM 623 CG TYR A 42 -1.073 -9.139 0.664 1.00 0.00 C ATOM 624 CD1 TYR A 42 -2.255 -8.522 0.274 1.00 0.00 C ATOM 625 CD2 TYR A 42 -1.156 -10.253 1.490 1.00 0.00 C ATOM 626 CE1 TYR A 42 -3.481 -8.999 0.696 1.00 0.00 C ATOM 627 CE2 TYR A 42 -2.378 -10.737 1.915 1.00 0.00 C ATOM 628 CZ TYR A 42 -3.538 -10.106 1.516 1.00 0.00 C ATOM 629 OH TYR A 42 -4.758 -10.584 1.937 1.00 0.00 O ATOM 0 H TYR A 42 0.109 -5.819 0.269 1.00 0.00 H new ATOM 0 HA TYR A 42 0.885 -7.963 2.154 1.00 0.00 H new ATOM 0 HB2 TYR A 42 0.154 -8.179 -0.792 1.00 0.00 H new ATOM 0 HB3 TYR A 42 0.962 -9.449 0.106 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -2.215 -7.656 -0.369 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.250 -10.749 1.805 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -4.391 -8.507 0.385 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -2.425 -11.605 2.556 1.00 0.00 H new ATOM 0 HH TYR A 42 -4.729 -10.749 2.903 1.00 0.00 H new ATOM 639 N LYS A 43 3.259 -7.929 1.364 1.00 0.00 N ATOM 640 CA LYS A 43 4.671 -7.734 1.060 1.00 0.00 C ATOM 641 C LYS A 43 5.342 -9.059 0.714 1.00 0.00 C ATOM 642 O LYS A 43 5.663 -9.852 1.598 1.00 0.00 O ATOM 643 CB LYS A 43 5.384 -7.084 2.248 1.00 0.00 C ATOM 644 CG LYS A 43 6.879 -6.909 2.039 1.00 0.00 C ATOM 645 CD LYS A 43 7.623 -6.844 3.362 1.00 0.00 C ATOM 646 CE LYS A 43 9.031 -6.298 3.183 1.00 0.00 C ATOM 647 NZ LYS A 43 9.669 -5.971 4.488 1.00 0.00 N ATOM 0 H LYS A 43 3.077 -8.610 2.101 1.00 0.00 H new ATOM 0 HA LYS A 43 4.743 -7.075 0.195 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.936 -6.109 2.441 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.219 -7.692 3.137 1.00 0.00 H new ATOM 0 HG2 LYS A 43 7.264 -7.738 1.445 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.064 -5.997 1.471 1.00 0.00 H new ATOM 0 HD2 LYS A 43 7.073 -6.213 4.060 1.00 0.00 H new ATOM 0 HD3 LYS A 43 7.671 -7.840 3.803 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.640 -7.031 2.654 1.00 0.00 H new ATOM 0 HE3 LYS A 43 8.997 -5.404 2.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 10.150 -5.052 4.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 8.941 -5.925 5.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 10.363 -6.707 4.729 1.00 0.00 H new ATOM 661 N ASN A 44 5.552 -9.291 -0.578 1.00 0.00 N ATOM 662 CA ASN A 44 6.186 -10.521 -1.040 1.00 0.00 C ATOM 663 C ASN A 44 5.261 -11.718 -0.842 1.00 0.00 C ATOM 664 O ASN A 44 5.707 -12.809 -0.491 1.00 0.00 O ATOM 665 CB ASN A 44 7.503 -10.751 -0.296 1.00 0.00 C ATOM 666 CG ASN A 44 8.419 -11.714 -1.026 1.00 0.00 C ATOM 667 OD1 ASN A 44 8.479 -12.900 -0.698 1.00 0.00 O ATOM 668 ND2 ASN A 44 9.138 -11.208 -2.021 1.00 0.00 N ATOM 0 H ASN A 44 5.293 -8.644 -1.323 1.00 0.00 H new ATOM 0 HA ASN A 44 6.392 -10.416 -2.105 1.00 0.00 H new ATOM 0 HB2 ASN A 44 8.014 -9.797 -0.164 1.00 0.00 H new ATOM 0 HB3 ASN A 44 7.291 -11.140 0.700 1.00 0.00 H new ATOM 0 HD21 ASN A 44 9.772 -11.808 -2.548 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.056 -10.219 -2.258 1.00 0.00 H new ATOM 675 N GLY A 45 3.968 -11.504 -1.069 1.00 0.00 N ATOM 676 CA GLY A 45 3.001 -12.574 -0.912 1.00 0.00 C ATOM 677 C GLY A 45 2.733 -12.904 0.544 1.00 0.00 C ATOM 678 O GLY A 45 2.516 -14.064 0.893 1.00 0.00 O ATOM 0 H GLY A 45 3.574 -10.609 -1.359 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.066 -12.289 -1.395 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.364 -13.466 -1.423 1.00 0.00 H new ATOM 682 N GLN A 46 2.751 -11.882 1.393 1.00 0.00 N ATOM 683 CA GLN A 46 2.511 -12.070 2.819 1.00 0.00 C ATOM 684 C GLN A 46 1.751 -10.885 3.405 1.00 0.00 C ATOM 685 O GLN A 46 2.103 -9.730 3.164 1.00 0.00 O ATOM 686 CB GLN A 46 3.836 -12.259 3.560 1.00 0.00 C ATOM 687 CG GLN A 46 4.604 -13.498 3.127 1.00 0.00 C ATOM 688 CD GLN A 46 4.219 -14.730 3.922 1.00 0.00 C ATOM 689 OE1 GLN A 46 3.345 -14.677 4.787 1.00 0.00 O ATOM 690 NE2 GLN A 46 4.872 -15.849 3.632 1.00 0.00 N ATOM 0 H GLN A 46 2.929 -10.916 1.119 1.00 0.00 H new ATOM 0 HA GLN A 46 1.902 -12.965 2.944 1.00 0.00 H new ATOM 0 HB2 GLN A 46 4.461 -11.380 3.400 1.00 0.00 H new ATOM 0 HB3 GLN A 46 3.639 -12.320 4.630 1.00 0.00 H new ATOM 0 HG2 GLN A 46 4.422 -13.682 2.068 1.00 0.00 H new ATOM 0 HG3 GLN A 46 5.673 -13.316 3.240 1.00 0.00 H new ATOM 0 HE21 GLN A 46 5.589 -15.848 2.907 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.656 -16.710 4.134 1.00 0.00 H new ATOM 699 N GLU A 47 0.708 -11.178 4.175 1.00 0.00 N ATOM 700 CA GLU A 47 -0.101 -10.135 4.793 1.00 0.00 C ATOM 701 C GLU A 47 0.735 -9.295 5.754 1.00 0.00 C ATOM 702 O GLU A 47 1.506 -9.830 6.552 1.00 0.00 O ATOM 703 CB GLU A 47 -1.287 -10.753 5.538 1.00 0.00 C ATOM 704 CG GLU A 47 -2.438 -9.785 5.759 1.00 0.00 C ATOM 705 CD GLU A 47 -3.746 -10.493 6.051 1.00 0.00 C ATOM 706 OE1 GLU A 47 -4.330 -11.073 5.112 1.00 0.00 O ATOM 707 OE2 GLU A 47 -4.187 -10.466 7.220 1.00 0.00 O ATOM 0 H GLU A 47 0.404 -12.129 4.385 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.476 -9.485 4.002 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.650 -11.614 4.976 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -0.945 -11.124 6.504 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.195 -9.121 6.589 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.557 -9.160 4.874 1.00 0.00 H new ATOM 714 N ILE A 48 0.578 -7.978 5.671 1.00 0.00 N ATOM 715 CA ILE A 48 1.318 -7.065 6.532 1.00 0.00 C ATOM 716 C ILE A 48 0.537 -6.755 7.805 1.00 0.00 C ATOM 717 O ILE A 48 -0.675 -6.539 7.764 1.00 0.00 O ATOM 718 CB ILE A 48 1.642 -5.745 5.808 1.00 0.00 C ATOM 719 CG1 ILE A 48 2.444 -6.021 4.535 1.00 0.00 C ATOM 720 CG2 ILE A 48 2.407 -4.808 6.730 1.00 0.00 C ATOM 721 CD1 ILE A 48 2.628 -4.800 3.660 1.00 0.00 C ATOM 0 H ILE A 48 -0.055 -7.520 5.016 1.00 0.00 H new ATOM 0 HA ILE A 48 2.251 -7.565 6.793 1.00 0.00 H new ATOM 0 HB ILE A 48 0.706 -5.262 5.528 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.424 -6.412 4.810 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.941 -6.798 3.959 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.628 -3.880 6.203 1.00 0.00 H new ATOM 0 HG22 ILE A 48 1.803 -4.590 7.611 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.339 -5.282 7.038 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.205 -5.070 2.776 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.653 -4.421 3.355 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.159 -4.029 4.218 1.00 0.00 H new ATOM 733 N ARG A 49 1.238 -6.733 8.933 1.00 0.00 N ATOM 734 CA ARG A 49 0.610 -6.449 10.218 1.00 0.00 C ATOM 735 C ARG A 49 0.846 -4.998 10.629 1.00 0.00 C ATOM 736 O ARG A 49 1.946 -4.461 10.496 1.00 0.00 O ATOM 737 CB ARG A 49 1.153 -7.390 11.295 1.00 0.00 C ATOM 738 CG ARG A 49 2.641 -7.221 11.557 1.00 0.00 C ATOM 739 CD ARG A 49 3.249 -8.483 12.148 1.00 0.00 C ATOM 740 NE ARG A 49 3.181 -8.493 13.606 1.00 0.00 N ATOM 741 CZ ARG A 49 3.316 -9.591 14.341 1.00 0.00 C ATOM 742 NH1 ARG A 49 3.525 -10.763 13.756 1.00 0.00 N ATOM 743 NH2 ARG A 49 3.242 -9.520 15.664 1.00 0.00 N ATOM 0 H ARG A 49 2.242 -6.908 8.984 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.463 -6.610 10.113 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.608 -7.220 12.223 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.960 -8.420 10.996 1.00 0.00 H new ATOM 0 HG2 ARG A 49 3.150 -6.972 10.626 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.799 -6.386 12.239 1.00 0.00 H new ATOM 0 HD2 ARG A 49 2.727 -9.355 11.755 1.00 0.00 H new ATOM 0 HD3 ARG A 49 4.289 -8.566 11.833 1.00 0.00 H new ATOM 0 HE ARG A 49 3.021 -7.608 14.087 1.00 0.00 H new ATOM 0 HH11 ARG A 49 3.582 -10.823 12.739 1.00 0.00 H new ATOM 0 HH12 ARG A 49 3.628 -11.605 14.323 1.00 0.00 H new ATOM 0 HH21 ARG A 49 3.081 -8.621 16.118 1.00 0.00 H new ATOM 0 HH22 ARG A 49 3.346 -10.364 16.227 1.00 0.00 H new ATOM 757 N PRO A 50 -0.210 -4.348 11.139 1.00 0.00 N ATOM 758 CA PRO A 50 -0.144 -2.952 11.580 1.00 0.00 C ATOM 759 C PRO A 50 0.695 -2.782 12.842 1.00 0.00 C ATOM 760 O PRO A 50 0.414 -3.394 13.873 1.00 0.00 O ATOM 761 CB PRO A 50 -1.606 -2.597 11.858 1.00 0.00 C ATOM 762 CG PRO A 50 -2.260 -3.900 12.165 1.00 0.00 C ATOM 763 CD PRO A 50 -1.552 -4.927 11.326 1.00 0.00 C ATOM 0 HA PRO A 50 0.329 -2.312 10.836 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.693 -1.904 12.694 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.067 -2.116 10.996 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -2.177 -4.138 13.225 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.323 -3.868 11.928 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.506 -5.894 11.828 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -2.058 -5.086 10.373 1.00 0.00 H new ATOM 771 N SER A 51 1.725 -1.946 12.755 1.00 0.00 N ATOM 772 CA SER A 51 2.607 -1.698 13.890 1.00 0.00 C ATOM 773 C SER A 51 3.368 -0.388 13.710 1.00 0.00 C ATOM 774 O SER A 51 3.272 0.262 12.669 1.00 0.00 O ATOM 775 CB SER A 51 3.593 -2.855 14.059 1.00 0.00 C ATOM 776 OG SER A 51 4.102 -2.903 15.380 1.00 0.00 O ATOM 0 H SER A 51 1.969 -1.429 11.910 1.00 0.00 H new ATOM 0 HA SER A 51 1.992 -1.621 14.787 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.097 -3.797 13.823 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.416 -2.742 13.353 1.00 0.00 H new ATOM 0 HG SER A 51 4.728 -3.652 15.462 1.00 0.00 H new ATOM 782 N THR A 52 4.124 -0.006 14.734 1.00 0.00 N ATOM 783 CA THR A 52 4.901 1.226 14.692 1.00 0.00 C ATOM 784 C THR A 52 5.589 1.397 13.342 1.00 0.00 C ATOM 785 O THR A 52 5.726 2.513 12.840 1.00 0.00 O ATOM 786 CB THR A 52 5.966 1.258 15.805 1.00 0.00 C ATOM 787 OG1 THR A 52 5.338 1.145 17.087 1.00 0.00 O ATOM 788 CG2 THR A 52 6.776 2.544 15.743 1.00 0.00 C ATOM 0 H THR A 52 4.215 -0.532 15.603 1.00 0.00 H new ATOM 0 HA THR A 52 4.200 2.046 14.846 1.00 0.00 H new ATOM 0 HB THR A 52 6.641 0.415 15.656 1.00 0.00 H new ATOM 0 HG1 THR A 52 6.022 1.164 17.789 1.00 0.00 H new ATOM 0 HG21 THR A 52 7.521 2.543 16.538 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.276 2.613 14.777 1.00 0.00 H new ATOM 0 HG23 THR A 52 6.112 3.399 15.869 1.00 0.00 H new ATOM 796 N LYS A 53 6.019 0.284 12.757 1.00 0.00 N ATOM 797 CA LYS A 53 6.690 0.309 11.464 1.00 0.00 C ATOM 798 C LYS A 53 5.710 0.658 10.348 1.00 0.00 C ATOM 799 O LYS A 53 5.999 1.497 9.495 1.00 0.00 O ATOM 800 CB LYS A 53 7.343 -1.045 11.178 1.00 0.00 C ATOM 801 CG LYS A 53 8.055 -1.107 9.838 1.00 0.00 C ATOM 802 CD LYS A 53 9.095 -2.215 9.810 1.00 0.00 C ATOM 803 CE LYS A 53 9.625 -2.445 8.403 1.00 0.00 C ATOM 804 NZ LYS A 53 10.825 -3.328 8.400 1.00 0.00 N ATOM 0 H LYS A 53 5.914 -0.648 13.159 1.00 0.00 H new ATOM 0 HA LYS A 53 7.462 1.078 11.499 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.058 -1.269 11.970 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.579 -1.821 11.210 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.326 -1.271 9.045 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.536 -0.150 9.636 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.921 -1.958 10.474 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.656 -3.137 10.190 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.843 -2.892 7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.878 -1.487 7.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.156 -3.461 7.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.580 -2.890 8.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 10.578 -4.251 8.810 1.00 0.00 H new ATOM 818 N TYR A 54 4.551 0.010 10.362 1.00 0.00 N ATOM 819 CA TYR A 54 3.528 0.251 9.351 1.00 0.00 C ATOM 820 C TYR A 54 2.430 1.161 9.893 1.00 0.00 C ATOM 821 O TYR A 54 1.690 0.784 10.802 1.00 0.00 O ATOM 822 CB TYR A 54 2.924 -1.073 8.881 1.00 0.00 C ATOM 823 CG TYR A 54 3.944 -2.042 8.329 1.00 0.00 C ATOM 824 CD1 TYR A 54 4.504 -1.851 7.072 1.00 0.00 C ATOM 825 CD2 TYR A 54 4.348 -3.150 9.064 1.00 0.00 C ATOM 826 CE1 TYR A 54 5.437 -2.735 6.563 1.00 0.00 C ATOM 827 CE2 TYR A 54 5.281 -4.038 8.564 1.00 0.00 C ATOM 828 CZ TYR A 54 5.822 -3.826 7.313 1.00 0.00 C ATOM 829 OH TYR A 54 6.750 -4.709 6.811 1.00 0.00 O ATOM 0 H TYR A 54 4.296 -0.686 11.062 1.00 0.00 H new ATOM 0 HA TYR A 54 4.000 0.748 8.504 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.404 -1.542 9.716 1.00 0.00 H new ATOM 0 HB3 TYR A 54 2.176 -0.870 8.114 1.00 0.00 H new ATOM 0 HD1 TYR A 54 4.205 -0.997 6.482 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.925 -3.320 10.043 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.862 -2.572 5.584 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.585 -4.893 9.149 1.00 0.00 H new ATOM 0 HH TYR A 54 6.911 -5.421 7.465 1.00 0.00 H new ATOM 839 N ILE A 55 2.330 2.359 9.328 1.00 0.00 N ATOM 840 CA ILE A 55 1.322 3.322 9.752 1.00 0.00 C ATOM 841 C ILE A 55 0.110 3.293 8.827 1.00 0.00 C ATOM 842 O ILE A 55 0.170 3.766 7.692 1.00 0.00 O ATOM 843 CB ILE A 55 1.890 4.753 9.790 1.00 0.00 C ATOM 844 CG1 ILE A 55 3.324 4.741 10.325 1.00 0.00 C ATOM 845 CG2 ILE A 55 1.007 5.651 10.644 1.00 0.00 C ATOM 846 CD1 ILE A 55 3.406 4.590 11.828 1.00 0.00 C ATOM 0 H ILE A 55 2.935 2.686 8.575 1.00 0.00 H new ATOM 0 HA ILE A 55 1.016 3.035 10.758 1.00 0.00 H new ATOM 0 HB ILE A 55 1.904 5.150 8.775 1.00 0.00 H new ATOM 0 HG12 ILE A 55 3.872 3.924 9.855 1.00 0.00 H new ATOM 0 HG13 ILE A 55 3.820 5.667 10.033 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.422 6.659 10.661 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.002 5.679 10.223 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.964 5.259 11.660 1.00 0.00 H new ATOM 0 HD11 ILE A 55 4.451 4.589 12.137 1.00 0.00 H new ATOM 0 HD12 ILE A 55 2.887 5.421 12.306 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.939 3.651 12.125 1.00 0.00 H new ATOM 858 N PHE A 56 -0.991 2.735 9.321 1.00 0.00 N ATOM 859 CA PHE A 56 -2.219 2.645 8.539 1.00 0.00 C ATOM 860 C PHE A 56 -3.165 3.793 8.878 1.00 0.00 C ATOM 861 O PHE A 56 -3.599 3.936 10.020 1.00 0.00 O ATOM 862 CB PHE A 56 -2.913 1.305 8.793 1.00 0.00 C ATOM 863 CG PHE A 56 -2.186 0.132 8.200 1.00 0.00 C ATOM 864 CD1 PHE A 56 -1.071 -0.398 8.829 1.00 0.00 C ATOM 865 CD2 PHE A 56 -2.618 -0.441 7.015 1.00 0.00 C ATOM 866 CE1 PHE A 56 -0.400 -1.478 8.286 1.00 0.00 C ATOM 867 CE2 PHE A 56 -1.952 -1.521 6.468 1.00 0.00 C ATOM 868 CZ PHE A 56 -0.841 -2.040 7.104 1.00 0.00 C ATOM 0 H PHE A 56 -1.058 2.339 10.258 1.00 0.00 H new ATOM 0 HA PHE A 56 -1.955 2.715 7.484 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.013 1.155 9.868 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -3.921 1.343 8.381 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.722 0.037 9.754 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -3.485 -0.039 6.513 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.468 -1.882 8.786 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -2.300 -1.959 5.544 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.318 -2.884 6.678 1.00 0.00 H new ATOM 878 N GLU A 57 -3.479 4.608 7.876 1.00 0.00 N ATOM 879 CA GLU A 57 -4.373 5.745 8.068 1.00 0.00 C ATOM 880 C GLU A 57 -5.422 5.805 6.962 1.00 0.00 C ATOM 881 O GLU A 57 -5.095 5.747 5.776 1.00 0.00 O ATOM 882 CB GLU A 57 -3.575 7.050 8.100 1.00 0.00 C ATOM 883 CG GLU A 57 -2.479 7.067 9.152 1.00 0.00 C ATOM 884 CD GLU A 57 -3.027 7.089 10.565 1.00 0.00 C ATOM 885 OE1 GLU A 57 -4.004 7.828 10.811 1.00 0.00 O ATOM 886 OE2 GLU A 57 -2.481 6.367 11.426 1.00 0.00 O ATOM 0 H GLU A 57 -3.128 4.503 6.924 1.00 0.00 H new ATOM 0 HA GLU A 57 -4.883 5.616 9.023 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -3.129 7.217 7.120 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -4.258 7.879 8.285 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.846 6.189 9.026 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.846 7.941 8.998 1.00 0.00 H new ATOM 893 N HIS A 58 -6.686 5.920 7.359 1.00 0.00 N ATOM 894 CA HIS A 58 -7.785 5.988 6.402 1.00 0.00 C ATOM 895 C HIS A 58 -8.423 7.374 6.405 1.00 0.00 C ATOM 896 O HIS A 58 -8.804 7.891 7.455 1.00 0.00 O ATOM 897 CB HIS A 58 -8.838 4.928 6.726 1.00 0.00 C ATOM 898 CG HIS A 58 -9.772 5.328 7.826 1.00 0.00 C ATOM 899 ND1 HIS A 58 -9.605 4.932 9.137 1.00 0.00 N ATOM 900 CD2 HIS A 58 -10.886 6.096 7.806 1.00 0.00 C ATOM 901 CE1 HIS A 58 -10.578 5.438 9.874 1.00 0.00 C ATOM 902 NE2 HIS A 58 -11.369 6.148 9.090 1.00 0.00 N ATOM 0 H HIS A 58 -6.974 5.968 8.336 1.00 0.00 H new ATOM 0 HA HIS A 58 -7.381 5.796 5.408 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -9.418 4.717 5.827 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -8.335 4.002 7.006 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -11.315 6.579 6.940 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -10.705 5.295 10.937 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -12.203 6.653 9.390 1.00 0.00 H new ATOM 911 N LYS A 59 -8.536 7.970 5.223 1.00 0.00 N ATOM 912 CA LYS A 59 -9.128 9.296 5.088 1.00 0.00 C ATOM 913 C LYS A 59 -9.855 9.433 3.754 1.00 0.00 C ATOM 914 O LYS A 59 -9.229 9.473 2.696 1.00 0.00 O ATOM 915 CB LYS A 59 -8.049 10.374 5.206 1.00 0.00 C ATOM 916 CG LYS A 59 -8.601 11.789 5.224 1.00 0.00 C ATOM 917 CD LYS A 59 -7.509 12.817 4.981 1.00 0.00 C ATOM 918 CE LYS A 59 -6.676 13.052 6.231 1.00 0.00 C ATOM 919 NZ LYS A 59 -5.451 13.848 5.940 1.00 0.00 N ATOM 0 H LYS A 59 -8.225 7.556 4.344 1.00 0.00 H new ATOM 0 HA LYS A 59 -9.852 9.427 5.892 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -7.477 10.205 6.118 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.355 10.274 4.371 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -9.373 11.889 4.461 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -9.077 11.983 6.185 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -6.863 12.479 4.171 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -7.958 13.757 4.660 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -7.278 13.572 6.976 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.392 12.093 6.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.910 13.986 6.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.864 13.341 5.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -5.723 14.773 5.551 1.00 0.00 H new ATOM 933 N GLY A 60 -11.182 9.508 3.813 1.00 0.00 N ATOM 934 CA GLY A 60 -11.971 9.642 2.603 1.00 0.00 C ATOM 935 C GLY A 60 -11.502 8.716 1.498 1.00 0.00 C ATOM 936 O GLY A 60 -10.660 9.090 0.681 1.00 0.00 O ATOM 0 H GLY A 60 -11.724 9.478 4.677 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -13.016 9.432 2.830 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -11.922 10.673 2.254 1.00 0.00 H new ATOM 940 N CYS A 61 -12.046 7.504 1.474 1.00 0.00 N ATOM 941 CA CYS A 61 -11.676 6.521 0.462 1.00 0.00 C ATOM 942 C CYS A 61 -10.204 6.656 0.086 1.00 0.00 C ATOM 943 O CYS A 61 -9.853 6.655 -1.094 1.00 0.00 O ATOM 944 CB CYS A 61 -12.550 6.684 -0.782 1.00 0.00 C ATOM 945 SG CYS A 61 -12.493 8.336 -1.513 1.00 0.00 S ATOM 0 H CYS A 61 -12.744 7.179 2.143 1.00 0.00 H new ATOM 0 HA CYS A 61 -11.836 5.527 0.881 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -12.237 5.956 -1.531 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -13.582 6.449 -0.521 1.00 0.00 H new ATOM 0 HG CYS A 61 -11.578 9.042 -0.919 1.00 0.00 H new ATOM 951 N GLN A 62 -9.348 6.773 1.096 1.00 0.00 N ATOM 952 CA GLN A 62 -7.914 6.911 0.870 1.00 0.00 C ATOM 953 C GLN A 62 -7.120 6.273 2.005 1.00 0.00 C ATOM 954 O GLN A 62 -7.133 6.762 3.135 1.00 0.00 O ATOM 955 CB GLN A 62 -7.538 8.388 0.736 1.00 0.00 C ATOM 956 CG GLN A 62 -6.313 8.627 -0.133 1.00 0.00 C ATOM 957 CD GLN A 62 -5.799 10.050 -0.037 1.00 0.00 C ATOM 958 OE1 GLN A 62 -5.605 10.722 -1.050 1.00 0.00 O ATOM 959 NE2 GLN A 62 -5.574 10.517 1.186 1.00 0.00 N ATOM 0 H GLN A 62 -9.622 6.775 2.078 1.00 0.00 H new ATOM 0 HA GLN A 62 -7.666 6.394 -0.057 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -8.383 8.933 0.316 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -7.355 8.799 1.729 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -5.522 7.938 0.163 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -6.559 8.403 -1.171 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.749 9.925 1.998 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.227 11.468 1.313 1.00 0.00 H new ATOM 968 N ARG A 63 -6.431 5.180 1.696 1.00 0.00 N ATOM 969 CA ARG A 63 -5.632 4.474 2.691 1.00 0.00 C ATOM 970 C ARG A 63 -4.147 4.767 2.503 1.00 0.00 C ATOM 971 O ARG A 63 -3.597 4.569 1.419 1.00 0.00 O ATOM 972 CB ARG A 63 -5.881 2.967 2.601 1.00 0.00 C ATOM 973 CG ARG A 63 -7.310 2.565 2.927 1.00 0.00 C ATOM 974 CD ARG A 63 -7.534 2.472 4.428 1.00 0.00 C ATOM 975 NE ARG A 63 -6.906 1.285 5.002 1.00 0.00 N ATOM 976 CZ ARG A 63 -7.274 0.745 6.159 1.00 0.00 C ATOM 977 NH1 ARG A 63 -8.262 1.283 6.860 1.00 0.00 N ATOM 978 NH2 ARG A 63 -6.654 -0.336 6.615 1.00 0.00 N ATOM 0 H ARG A 63 -6.410 4.764 0.765 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.932 4.826 3.678 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.637 2.627 1.595 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.204 2.454 3.284 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.000 3.292 2.499 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.533 1.604 2.464 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.133 3.363 4.910 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.604 2.452 4.634 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.143 0.846 4.486 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.741 2.113 6.512 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.543 0.867 7.748 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.894 -0.753 6.077 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.937 -0.750 7.503 1.00 0.00 H new ATOM 992 N ILE A 64 -3.503 5.240 3.565 1.00 0.00 N ATOM 993 CA ILE A 64 -2.082 5.560 3.517 1.00 0.00 C ATOM 994 C ILE A 64 -1.265 4.555 4.322 1.00 0.00 C ATOM 995 O ILE A 64 -1.728 4.032 5.337 1.00 0.00 O ATOM 996 CB ILE A 64 -1.805 6.977 4.053 1.00 0.00 C ATOM 997 CG1 ILE A 64 -2.803 7.974 3.460 1.00 0.00 C ATOM 998 CG2 ILE A 64 -0.377 7.394 3.734 1.00 0.00 C ATOM 999 CD1 ILE A 64 -4.059 8.135 4.287 1.00 0.00 C ATOM 0 H ILE A 64 -3.943 5.410 4.469 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.783 5.512 2.470 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.927 6.971 5.136 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.318 8.945 3.358 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.077 7.648 2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.196 8.398 4.119 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.319 6.696 4.200 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.229 7.388 2.654 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.721 8.856 3.807 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.567 7.174 4.368 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.796 8.491 5.283 1.00 0.00 H new ATOM 1011 N LEU A 65 -0.046 4.290 3.865 1.00 0.00 N ATOM 1012 CA LEU A 65 0.838 3.349 4.544 1.00 0.00 C ATOM 1013 C LEU A 65 2.262 3.893 4.613 1.00 0.00 C ATOM 1014 O LEU A 65 2.843 4.272 3.596 1.00 0.00 O ATOM 1015 CB LEU A 65 0.830 2.000 3.823 1.00 0.00 C ATOM 1016 CG LEU A 65 1.417 0.821 4.598 1.00 0.00 C ATOM 1017 CD1 LEU A 65 2.936 0.894 4.611 1.00 0.00 C ATOM 1018 CD2 LEU A 65 0.871 0.791 6.018 1.00 0.00 C ATOM 0 H LEU A 65 0.353 4.713 3.027 1.00 0.00 H new ATOM 0 HA LEU A 65 0.471 3.213 5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.199 1.758 3.558 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.383 2.106 2.890 1.00 0.00 H new ATOM 0 HG LEU A 65 1.122 -0.101 4.097 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.336 0.046 5.167 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.310 0.866 3.588 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.252 1.822 5.087 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.300 -0.055 6.555 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.135 1.717 6.529 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.214 0.690 5.989 1.00 0.00 H new ATOM 1030 N PHE A 66 2.819 3.925 5.819 1.00 0.00 N ATOM 1031 CA PHE A 66 4.175 4.421 6.022 1.00 0.00 C ATOM 1032 C PHE A 66 5.064 3.340 6.631 1.00 0.00 C ATOM 1033 O PHE A 66 4.721 2.742 7.651 1.00 0.00 O ATOM 1034 CB PHE A 66 4.161 5.655 6.926 1.00 0.00 C ATOM 1035 CG PHE A 66 3.476 6.841 6.310 1.00 0.00 C ATOM 1036 CD1 PHE A 66 4.050 7.510 5.241 1.00 0.00 C ATOM 1037 CD2 PHE A 66 2.260 7.287 6.800 1.00 0.00 C ATOM 1038 CE1 PHE A 66 3.423 8.603 4.673 1.00 0.00 C ATOM 1039 CE2 PHE A 66 1.627 8.379 6.235 1.00 0.00 C ATOM 1040 CZ PHE A 66 2.209 9.037 5.170 1.00 0.00 C ATOM 0 H PHE A 66 2.352 3.613 6.671 1.00 0.00 H new ATOM 0 HA PHE A 66 4.583 4.697 5.050 1.00 0.00 H new ATOM 0 HB2 PHE A 66 3.663 5.404 7.863 1.00 0.00 H new ATOM 0 HB3 PHE A 66 5.187 5.926 7.173 1.00 0.00 H new ATOM 0 HD1 PHE A 66 4.998 7.174 4.847 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.801 6.776 7.633 1.00 0.00 H new ATOM 0 HE1 PHE A 66 3.882 9.117 3.841 1.00 0.00 H new ATOM 0 HE2 PHE A 66 0.679 8.717 6.626 1.00 0.00 H new ATOM 0 HZ PHE A 66 1.716 9.889 4.726 1.00 0.00 H new ATOM 1050 N ILE A 67 6.206 3.095 5.997 1.00 0.00 N ATOM 1051 CA ILE A 67 7.144 2.088 6.477 1.00 0.00 C ATOM 1052 C ILE A 67 8.449 2.727 6.940 1.00 0.00 C ATOM 1053 O ILE A 67 9.198 3.283 6.138 1.00 0.00 O ATOM 1054 CB ILE A 67 7.455 1.044 5.387 1.00 0.00 C ATOM 1055 CG1 ILE A 67 6.157 0.507 4.780 1.00 0.00 C ATOM 1056 CG2 ILE A 67 8.286 -0.092 5.964 1.00 0.00 C ATOM 1057 CD1 ILE A 67 6.351 -0.166 3.439 1.00 0.00 C ATOM 0 H ILE A 67 6.504 3.580 5.150 1.00 0.00 H new ATOM 0 HA ILE A 67 6.667 1.590 7.321 1.00 0.00 H new ATOM 0 HB ILE A 67 8.032 1.525 4.597 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.708 -0.205 5.473 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.451 1.330 4.666 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.498 -0.821 5.182 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.224 0.305 6.354 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.733 -0.574 6.770 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.390 -0.522 3.068 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.771 0.548 2.731 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.032 -1.010 3.550 1.00 0.00 H new ATOM 1069 N ASN A 68 8.714 2.642 8.239 1.00 0.00 N ATOM 1070 CA ASN A 68 9.930 3.212 8.809 1.00 0.00 C ATOM 1071 C ASN A 68 11.073 2.202 8.771 1.00 0.00 C ATOM 1072 O ASN A 68 10.847 0.996 8.696 1.00 0.00 O ATOM 1073 CB ASN A 68 9.680 3.662 10.250 1.00 0.00 C ATOM 1074 CG ASN A 68 8.766 4.870 10.328 1.00 0.00 C ATOM 1075 OD1 ASN A 68 9.219 6.011 10.242 1.00 0.00 O ATOM 1076 ND2 ASN A 68 7.472 4.622 10.493 1.00 0.00 N ATOM 0 H ASN A 68 8.104 2.185 8.917 1.00 0.00 H new ATOM 0 HA ASN A 68 10.213 4.077 8.209 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.239 2.839 10.813 1.00 0.00 H new ATOM 0 HB3 ASN A 68 10.632 3.899 10.724 1.00 0.00 H new ATOM 0 HD21 ASN A 68 6.808 5.394 10.554 1.00 0.00 H new ATOM 0 HD22 ASN A 68 7.142 3.659 10.559 1.00 0.00 H new ATOM 1083 N ASN A 69 12.302 2.706 8.824 1.00 0.00 N ATOM 1084 CA ASN A 69 13.482 1.849 8.796 1.00 0.00 C ATOM 1085 C ASN A 69 13.626 1.168 7.438 1.00 0.00 C ATOM 1086 O ASN A 69 13.828 -0.045 7.359 1.00 0.00 O ATOM 1087 CB ASN A 69 13.398 0.795 9.902 1.00 0.00 C ATOM 1088 CG ASN A 69 13.112 1.404 11.261 1.00 0.00 C ATOM 1089 OD1 ASN A 69 13.099 2.625 11.416 1.00 0.00 O ATOM 1090 ND2 ASN A 69 12.881 0.552 12.253 1.00 0.00 N ATOM 0 H ASN A 69 12.507 3.703 8.887 1.00 0.00 H new ATOM 0 HA ASN A 69 14.359 2.473 8.965 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.616 0.077 9.657 1.00 0.00 H new ATOM 0 HB3 ASN A 69 14.336 0.242 9.945 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.682 0.902 13.190 1.00 0.00 H new ATOM 0 HD22 ASN A 69 12.902 -0.453 12.078 1.00 0.00 H new ATOM 1097 N CYS A 70 13.523 1.955 6.374 1.00 0.00 N ATOM 1098 CA CYS A 70 13.643 1.429 5.019 1.00 0.00 C ATOM 1099 C CYS A 70 15.078 1.006 4.724 1.00 0.00 C ATOM 1100 O CYS A 70 15.920 1.835 4.378 1.00 0.00 O ATOM 1101 CB CYS A 70 13.187 2.475 4.001 1.00 0.00 C ATOM 1102 SG CYS A 70 11.467 2.997 4.198 1.00 0.00 S ATOM 0 H CYS A 70 13.357 2.960 6.423 1.00 0.00 H new ATOM 0 HA CYS A 70 13.002 0.551 4.939 1.00 0.00 H new ATOM 0 HB2 CYS A 70 13.832 3.350 4.081 1.00 0.00 H new ATOM 0 HB3 CYS A 70 13.320 2.072 2.997 1.00 0.00 H new ATOM 0 HG CYS A 70 11.092 2.801 5.427 1.00 0.00 H new ATOM 1108 N GLN A 71 15.350 -0.287 4.865 1.00 0.00 N ATOM 1109 CA GLN A 71 16.684 -0.819 4.617 1.00 0.00 C ATOM 1110 C GLN A 71 16.759 -1.484 3.247 1.00 0.00 C ATOM 1111 O GLN A 71 15.747 -1.933 2.708 1.00 0.00 O ATOM 1112 CB GLN A 71 17.068 -1.822 5.706 1.00 0.00 C ATOM 1113 CG GLN A 71 18.569 -1.992 5.875 1.00 0.00 C ATOM 1114 CD GLN A 71 19.154 -1.031 6.892 1.00 0.00 C ATOM 1115 OE1 GLN A 71 19.522 -1.428 7.998 1.00 0.00 O ATOM 1116 NE2 GLN A 71 19.244 0.241 6.522 1.00 0.00 N ATOM 0 H GLN A 71 14.664 -0.986 5.150 1.00 0.00 H new ATOM 0 HA GLN A 71 17.388 0.013 4.636 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.638 -1.498 6.654 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.626 -2.790 5.469 1.00 0.00 H new ATOM 0 HG2 GLN A 71 18.783 -3.016 6.183 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.059 -1.840 4.913 1.00 0.00 H new ATOM 0 HE21 GLN A 71 18.927 0.526 5.595 1.00 0.00 H new ATOM 0 HE22 GLN A 71 19.630 0.933 7.164 1.00 0.00 H new ATOM 1125 N MET A 72 17.963 -1.544 2.687 1.00 0.00 N ATOM 1126 CA MET A 72 18.168 -2.156 1.380 1.00 0.00 C ATOM 1127 C MET A 72 17.373 -3.452 1.255 1.00 0.00 C ATOM 1128 O MET A 72 16.784 -3.733 0.211 1.00 0.00 O ATOM 1129 CB MET A 72 19.656 -2.432 1.150 1.00 0.00 C ATOM 1130 CG MET A 72 20.532 -1.198 1.293 1.00 0.00 C ATOM 1131 SD MET A 72 22.008 -1.272 0.261 1.00 0.00 S ATOM 1132 CE MET A 72 21.431 -0.438 -1.216 1.00 0.00 C ATOM 0 H MET A 72 18.811 -1.176 3.118 1.00 0.00 H new ATOM 0 HA MET A 72 17.813 -1.459 0.621 1.00 0.00 H new ATOM 0 HB2 MET A 72 19.991 -3.189 1.859 1.00 0.00 H new ATOM 0 HB3 MET A 72 19.790 -2.849 0.152 1.00 0.00 H new ATOM 0 HG2 MET A 72 19.953 -0.313 1.029 1.00 0.00 H new ATOM 0 HG3 MET A 72 20.828 -1.086 2.336 1.00 0.00 H new ATOM 0 HE1 MET A 72 22.234 -0.404 -1.952 1.00 0.00 H new ATOM 0 HE2 MET A 72 20.581 -0.980 -1.631 1.00 0.00 H new ATOM 0 HE3 MET A 72 21.126 0.578 -0.965 1.00 0.00 H new ATOM 1142 N THR A 73 17.361 -4.239 2.326 1.00 0.00 N ATOM 1143 CA THR A 73 16.640 -5.506 2.336 1.00 0.00 C ATOM 1144 C THR A 73 15.137 -5.283 2.217 1.00 0.00 C ATOM 1145 O THR A 73 14.434 -6.060 1.571 1.00 0.00 O ATOM 1146 CB THR A 73 16.929 -6.307 3.619 1.00 0.00 C ATOM 1147 OG1 THR A 73 16.690 -5.490 4.771 1.00 0.00 O ATOM 1148 CG2 THR A 73 18.366 -6.806 3.633 1.00 0.00 C ATOM 0 H THR A 73 17.843 -4.021 3.198 1.00 0.00 H new ATOM 0 HA THR A 73 16.990 -6.076 1.475 1.00 0.00 H new ATOM 0 HB THR A 73 16.262 -7.169 3.641 1.00 0.00 H new ATOM 0 HG1 THR A 73 16.874 -6.007 5.583 1.00 0.00 H new ATOM 0 HG21 THR A 73 18.547 -7.369 4.549 1.00 0.00 H new ATOM 0 HG22 THR A 73 18.536 -7.451 2.771 1.00 0.00 H new ATOM 0 HG23 THR A 73 19.047 -5.956 3.589 1.00 0.00 H new ATOM 1156 N ASP A 74 14.650 -4.218 2.843 1.00 0.00 N ATOM 1157 CA ASP A 74 13.229 -3.892 2.806 1.00 0.00 C ATOM 1158 C ASP A 74 12.708 -3.897 1.372 1.00 0.00 C ATOM 1159 O ASP A 74 11.650 -4.458 1.088 1.00 0.00 O ATOM 1160 CB ASP A 74 12.980 -2.526 3.448 1.00 0.00 C ATOM 1161 CG ASP A 74 11.611 -2.430 4.093 1.00 0.00 C ATOM 1162 OD1 ASP A 74 11.149 -3.444 4.659 1.00 0.00 O ATOM 1163 OD2 ASP A 74 11.003 -1.342 4.033 1.00 0.00 O ATOM 0 H ASP A 74 15.218 -3.565 3.383 1.00 0.00 H new ATOM 0 HA ASP A 74 12.692 -4.653 3.372 1.00 0.00 H new ATOM 0 HB2 ASP A 74 13.746 -2.336 4.199 1.00 0.00 H new ATOM 0 HB3 ASP A 74 13.077 -1.749 2.690 1.00 0.00 H new ATOM 1168 N ASP A 75 13.457 -3.267 0.474 1.00 0.00 N ATOM 1169 CA ASP A 75 13.070 -3.198 -0.931 1.00 0.00 C ATOM 1170 C ASP A 75 12.367 -4.480 -1.364 1.00 0.00 C ATOM 1171 O ASP A 75 13.012 -5.451 -1.761 1.00 0.00 O ATOM 1172 CB ASP A 75 14.299 -2.954 -1.808 1.00 0.00 C ATOM 1173 CG ASP A 75 14.158 -3.570 -3.186 1.00 0.00 C ATOM 1174 OD1 ASP A 75 13.022 -3.613 -3.703 1.00 0.00 O ATOM 1175 OD2 ASP A 75 15.183 -4.010 -3.747 1.00 0.00 O ATOM 0 H ASP A 75 14.335 -2.797 0.693 1.00 0.00 H new ATOM 0 HA ASP A 75 12.376 -2.366 -1.052 1.00 0.00 H new ATOM 0 HB2 ASP A 75 14.463 -1.881 -1.908 1.00 0.00 H new ATOM 0 HB3 ASP A 75 15.180 -3.367 -1.317 1.00 0.00 H new ATOM 1180 N SER A 76 11.040 -4.478 -1.284 1.00 0.00 N ATOM 1181 CA SER A 76 10.249 -5.642 -1.663 1.00 0.00 C ATOM 1182 C SER A 76 9.057 -5.233 -2.522 1.00 0.00 C ATOM 1183 O SER A 76 8.740 -4.049 -2.639 1.00 0.00 O ATOM 1184 CB SER A 76 9.763 -6.383 -0.416 1.00 0.00 C ATOM 1185 OG SER A 76 9.620 -7.770 -0.670 1.00 0.00 O ATOM 0 H SER A 76 10.490 -3.682 -0.960 1.00 0.00 H new ATOM 0 HA SER A 76 10.885 -6.307 -2.248 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.470 -6.231 0.400 1.00 0.00 H new ATOM 0 HB3 SER A 76 8.808 -5.969 -0.092 1.00 0.00 H new ATOM 0 HG SER A 76 9.466 -8.243 0.174 1.00 0.00 H new ATOM 1191 N GLU A 77 8.400 -6.221 -3.122 1.00 0.00 N ATOM 1192 CA GLU A 77 7.243 -5.963 -3.971 1.00 0.00 C ATOM 1193 C GLU A 77 5.969 -5.856 -3.138 1.00 0.00 C ATOM 1194 O GLU A 77 5.644 -6.755 -2.363 1.00 0.00 O ATOM 1195 CB GLU A 77 7.091 -7.073 -5.014 1.00 0.00 C ATOM 1196 CG GLU A 77 5.793 -6.996 -5.800 1.00 0.00 C ATOM 1197 CD GLU A 77 4.658 -7.743 -5.126 1.00 0.00 C ATOM 1198 OE1 GLU A 77 4.926 -8.793 -4.505 1.00 0.00 O ATOM 1199 OE2 GLU A 77 3.503 -7.278 -5.219 1.00 0.00 O ATOM 0 H GLU A 77 8.649 -7.206 -3.036 1.00 0.00 H new ATOM 0 HA GLU A 77 7.404 -5.013 -4.481 1.00 0.00 H new ATOM 0 HB2 GLU A 77 7.930 -7.025 -5.708 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.146 -8.040 -4.514 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.511 -5.951 -5.927 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.952 -7.406 -6.797 1.00 0.00 H new ATOM 1206 N TYR A 78 5.254 -4.749 -3.303 1.00 0.00 N ATOM 1207 CA TYR A 78 4.017 -4.521 -2.565 1.00 0.00 C ATOM 1208 C TYR A 78 2.814 -4.520 -3.503 1.00 0.00 C ATOM 1209 O TYR A 78 2.897 -4.047 -4.637 1.00 0.00 O ATOM 1210 CB TYR A 78 4.088 -3.194 -1.807 1.00 0.00 C ATOM 1211 CG TYR A 78 5.276 -3.091 -0.877 1.00 0.00 C ATOM 1212 CD1 TYR A 78 6.492 -2.589 -1.324 1.00 0.00 C ATOM 1213 CD2 TYR A 78 5.182 -3.496 0.449 1.00 0.00 C ATOM 1214 CE1 TYR A 78 7.579 -2.493 -0.477 1.00 0.00 C ATOM 1215 CE2 TYR A 78 6.264 -3.402 1.303 1.00 0.00 C ATOM 1216 CZ TYR A 78 7.460 -2.901 0.835 1.00 0.00 C ATOM 1217 OH TYR A 78 8.541 -2.807 1.682 1.00 0.00 O ATOM 0 H TYR A 78 5.509 -3.995 -3.941 1.00 0.00 H new ATOM 0 HA TYR A 78 3.896 -5.335 -1.850 1.00 0.00 H new ATOM 0 HB2 TYR A 78 4.128 -2.376 -2.526 1.00 0.00 H new ATOM 0 HB3 TYR A 78 3.173 -3.066 -1.229 1.00 0.00 H new ATOM 0 HD1 TYR A 78 6.589 -2.269 -2.351 1.00 0.00 H new ATOM 0 HD2 TYR A 78 4.247 -3.891 0.818 1.00 0.00 H new ATOM 0 HE1 TYR A 78 8.517 -2.100 -0.840 1.00 0.00 H new ATOM 0 HE2 TYR A 78 6.173 -3.719 2.331 1.00 0.00 H new ATOM 0 HH TYR A 78 8.290 -3.135 2.571 1.00 0.00 H new ATOM 1227 N TYR A 79 1.697 -5.053 -3.021 1.00 0.00 N ATOM 1228 CA TYR A 79 0.476 -5.116 -3.816 1.00 0.00 C ATOM 1229 C TYR A 79 -0.759 -5.082 -2.922 1.00 0.00 C ATOM 1230 O TYR A 79 -0.885 -5.873 -1.987 1.00 0.00 O ATOM 1231 CB TYR A 79 0.465 -6.383 -4.672 1.00 0.00 C ATOM 1232 CG TYR A 79 0.179 -7.643 -3.886 1.00 0.00 C ATOM 1233 CD1 TYR A 79 1.205 -8.347 -3.267 1.00 0.00 C ATOM 1234 CD2 TYR A 79 -1.117 -8.128 -3.760 1.00 0.00 C ATOM 1235 CE1 TYR A 79 0.948 -9.498 -2.548 1.00 0.00 C ATOM 1236 CE2 TYR A 79 -1.383 -9.277 -3.042 1.00 0.00 C ATOM 1237 CZ TYR A 79 -0.347 -9.959 -2.439 1.00 0.00 C ATOM 1238 OH TYR A 79 -0.607 -11.105 -1.722 1.00 0.00 O ATOM 0 H TYR A 79 1.612 -5.448 -2.084 1.00 0.00 H new ATOM 0 HA TYR A 79 0.453 -4.244 -4.469 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.285 -6.275 -5.455 1.00 0.00 H new ATOM 0 HB3 TYR A 79 1.431 -6.485 -5.167 1.00 0.00 H new ATOM 0 HD1 TYR A 79 2.220 -7.988 -3.350 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.930 -7.597 -4.232 1.00 0.00 H new ATOM 0 HE1 TYR A 79 1.757 -10.034 -2.074 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.396 -9.640 -2.953 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.808 -10.870 -0.792 1.00 0.00 H new ATOM 1248 N VAL A 80 -1.670 -4.159 -3.215 1.00 0.00 N ATOM 1249 CA VAL A 80 -2.897 -4.021 -2.440 1.00 0.00 C ATOM 1250 C VAL A 80 -4.099 -4.550 -3.215 1.00 0.00 C ATOM 1251 O VAL A 80 -4.181 -4.398 -4.434 1.00 0.00 O ATOM 1252 CB VAL A 80 -3.154 -2.553 -2.053 1.00 0.00 C ATOM 1253 CG1 VAL A 80 -3.325 -1.695 -3.297 1.00 0.00 C ATOM 1254 CG2 VAL A 80 -4.374 -2.447 -1.150 1.00 0.00 C ATOM 0 H VAL A 80 -1.581 -3.495 -3.984 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.766 -4.610 -1.532 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.289 -2.183 -1.502 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.506 -0.661 -3.004 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.420 -1.748 -3.902 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.172 -2.061 -3.878 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.542 -1.403 -0.886 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.249 -2.834 -1.673 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -4.207 -3.028 -0.243 1.00 0.00 H new ATOM 1264 N THR A 81 -5.031 -5.171 -2.499 1.00 0.00 N ATOM 1265 CA THR A 81 -6.229 -5.723 -3.119 1.00 0.00 C ATOM 1266 C THR A 81 -7.484 -5.023 -2.609 1.00 0.00 C ATOM 1267 O THR A 81 -7.630 -4.786 -1.410 1.00 0.00 O ATOM 1268 CB THR A 81 -6.354 -7.235 -2.852 1.00 0.00 C ATOM 1269 OG1 THR A 81 -6.385 -7.483 -1.442 1.00 0.00 O ATOM 1270 CG2 THR A 81 -5.193 -7.993 -3.480 1.00 0.00 C ATOM 0 H THR A 81 -4.979 -5.304 -1.489 1.00 0.00 H new ATOM 0 HA THR A 81 -6.134 -5.558 -4.192 1.00 0.00 H new ATOM 0 HB THR A 81 -7.283 -7.586 -3.302 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.466 -8.446 -1.281 1.00 0.00 H new ATOM 0 HG21 THR A 81 -5.303 -9.059 -3.278 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.190 -7.826 -4.557 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.254 -7.638 -3.055 1.00 0.00 H new ATOM 1278 N ALA A 82 -8.387 -4.695 -3.527 1.00 0.00 N ATOM 1279 CA ALA A 82 -9.631 -4.025 -3.169 1.00 0.00 C ATOM 1280 C ALA A 82 -10.779 -4.487 -4.060 1.00 0.00 C ATOM 1281 O ALA A 82 -10.853 -4.122 -5.233 1.00 0.00 O ATOM 1282 CB ALA A 82 -9.463 -2.516 -3.262 1.00 0.00 C ATOM 0 H ALA A 82 -8.280 -4.882 -4.524 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.875 -4.290 -2.140 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.400 -2.028 -2.992 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.677 -2.195 -2.579 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.192 -2.242 -4.282 1.00 0.00 H new ATOM 1288 N GLY A 83 -11.673 -5.293 -3.495 1.00 0.00 N ATOM 1289 CA GLY A 83 -12.806 -5.792 -4.254 1.00 0.00 C ATOM 1290 C GLY A 83 -12.408 -6.856 -5.257 1.00 0.00 C ATOM 1291 O GLY A 83 -11.994 -7.952 -4.878 1.00 0.00 O ATOM 0 H GLY A 83 -11.633 -5.609 -2.526 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -13.547 -6.203 -3.568 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -13.282 -4.963 -4.778 1.00 0.00 H new ATOM 1295 N ASP A 84 -12.534 -6.535 -6.540 1.00 0.00 N ATOM 1296 CA ASP A 84 -12.184 -7.472 -7.601 1.00 0.00 C ATOM 1297 C ASP A 84 -11.006 -6.953 -8.418 1.00 0.00 C ATOM 1298 O ASP A 84 -10.770 -7.402 -9.539 1.00 0.00 O ATOM 1299 CB ASP A 84 -13.387 -7.713 -8.514 1.00 0.00 C ATOM 1300 CG ASP A 84 -14.306 -6.509 -8.591 1.00 0.00 C ATOM 1301 OD1 ASP A 84 -15.085 -6.296 -7.639 1.00 0.00 O ATOM 1302 OD2 ASP A 84 -14.246 -5.780 -9.603 1.00 0.00 O ATOM 0 H ASP A 84 -12.876 -5.633 -6.870 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.894 -8.415 -7.138 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -13.035 -7.963 -9.515 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -13.949 -8.573 -8.150 1.00 0.00 H new ATOM 1307 N GLU A 85 -10.269 -6.004 -7.849 1.00 0.00 N ATOM 1308 CA GLU A 85 -9.116 -5.423 -8.526 1.00 0.00 C ATOM 1309 C GLU A 85 -7.948 -5.250 -7.560 1.00 0.00 C ATOM 1310 O GLU A 85 -8.136 -5.179 -6.345 1.00 0.00 O ATOM 1311 CB GLU A 85 -9.486 -4.073 -9.143 1.00 0.00 C ATOM 1312 CG GLU A 85 -10.495 -4.177 -10.275 1.00 0.00 C ATOM 1313 CD GLU A 85 -10.424 -3.001 -11.230 1.00 0.00 C ATOM 1314 OE1 GLU A 85 -10.920 -1.913 -10.868 1.00 0.00 O ATOM 1315 OE2 GLU A 85 -9.874 -3.168 -12.338 1.00 0.00 O ATOM 0 H GLU A 85 -10.450 -5.621 -6.921 1.00 0.00 H new ATOM 0 HA GLU A 85 -8.811 -6.105 -9.319 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.891 -3.426 -8.365 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -8.581 -3.594 -9.517 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -10.321 -5.100 -10.828 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.500 -4.240 -9.857 1.00 0.00 H new ATOM 1322 N LYS A 86 -6.739 -5.182 -8.109 1.00 0.00 N ATOM 1323 CA LYS A 86 -5.539 -5.017 -7.298 1.00 0.00 C ATOM 1324 C LYS A 86 -4.360 -4.567 -8.156 1.00 0.00 C ATOM 1325 O LYS A 86 -4.347 -4.779 -9.369 1.00 0.00 O ATOM 1326 CB LYS A 86 -5.194 -6.327 -6.586 1.00 0.00 C ATOM 1327 CG LYS A 86 -4.532 -7.354 -7.489 1.00 0.00 C ATOM 1328 CD LYS A 86 -3.815 -8.424 -6.683 1.00 0.00 C ATOM 1329 CE LYS A 86 -2.913 -9.274 -7.565 1.00 0.00 C ATOM 1330 NZ LYS A 86 -3.697 -10.135 -8.493 1.00 0.00 N ATOM 0 H LYS A 86 -6.565 -5.239 -9.112 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.739 -4.247 -6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.531 -6.112 -5.748 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.106 -6.756 -6.170 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.285 -7.820 -8.125 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.821 -6.856 -8.148 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.221 -7.954 -5.899 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.548 -9.061 -6.189 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.253 -8.626 -8.141 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.277 -9.900 -6.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.046 -10.699 -9.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.308 -10.772 -7.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.285 -9.537 -9.108 1.00 0.00 H new ATOM 1344 N CYS A 87 -3.373 -3.947 -7.519 1.00 0.00 N ATOM 1345 CA CYS A 87 -2.190 -3.469 -8.225 1.00 0.00 C ATOM 1346 C CYS A 87 -0.921 -3.806 -7.449 1.00 0.00 C ATOM 1347 O CYS A 87 -0.980 -4.371 -6.357 1.00 0.00 O ATOM 1348 CB CYS A 87 -2.280 -1.958 -8.448 1.00 0.00 C ATOM 1349 SG CYS A 87 -3.079 -1.488 -10.000 1.00 0.00 S ATOM 0 H CYS A 87 -3.368 -3.764 -6.516 1.00 0.00 H new ATOM 0 HA CYS A 87 -2.147 -3.970 -9.192 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -2.829 -1.511 -7.619 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -1.274 -1.538 -8.428 1.00 0.00 H new ATOM 0 HG CYS A 87 -3.845 -2.457 -10.405 1.00 0.00 H new ATOM 1355 N SER A 88 0.227 -3.457 -8.021 1.00 0.00 N ATOM 1356 CA SER A 88 1.511 -3.727 -7.386 1.00 0.00 C ATOM 1357 C SER A 88 2.502 -2.601 -7.663 1.00 0.00 C ATOM 1358 O SER A 88 2.290 -1.775 -8.552 1.00 0.00 O ATOM 1359 CB SER A 88 2.081 -5.057 -7.884 1.00 0.00 C ATOM 1360 OG SER A 88 1.072 -6.049 -7.953 1.00 0.00 O ATOM 0 H SER A 88 0.294 -2.986 -8.923 1.00 0.00 H new ATOM 0 HA SER A 88 1.350 -3.789 -6.310 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.528 -4.919 -8.869 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.876 -5.388 -7.216 1.00 0.00 H new ATOM 0 HG SER A 88 1.461 -6.889 -8.275 1.00 0.00 H new ATOM 1366 N THR A 89 3.587 -2.573 -6.895 1.00 0.00 N ATOM 1367 CA THR A 89 4.612 -1.549 -7.056 1.00 0.00 C ATOM 1368 C THR A 89 5.983 -2.073 -6.646 1.00 0.00 C ATOM 1369 O THR A 89 6.094 -3.142 -6.047 1.00 0.00 O ATOM 1370 CB THR A 89 4.285 -0.293 -6.226 1.00 0.00 C ATOM 1371 OG1 THR A 89 5.295 0.702 -6.425 1.00 0.00 O ATOM 1372 CG2 THR A 89 4.187 -0.633 -4.746 1.00 0.00 C ATOM 0 H THR A 89 3.778 -3.248 -6.155 1.00 0.00 H new ATOM 0 HA THR A 89 4.630 -1.283 -8.113 1.00 0.00 H new ATOM 0 HB THR A 89 3.322 0.095 -6.559 1.00 0.00 H new ATOM 0 HG1 THR A 89 5.014 1.316 -7.136 1.00 0.00 H new ATOM 0 HG21 THR A 89 3.955 0.269 -4.180 1.00 0.00 H new ATOM 0 HG22 THR A 89 3.398 -1.370 -4.593 1.00 0.00 H new ATOM 0 HG23 THR A 89 5.137 -1.043 -4.403 1.00 0.00 H new ATOM 1380 N GLU A 90 7.024 -1.314 -6.973 1.00 0.00 N ATOM 1381 CA GLU A 90 8.388 -1.704 -6.638 1.00 0.00 C ATOM 1382 C GLU A 90 9.064 -0.638 -5.780 1.00 0.00 C ATOM 1383 O GLU A 90 9.035 0.549 -6.108 1.00 0.00 O ATOM 1384 CB GLU A 90 9.203 -1.940 -7.912 1.00 0.00 C ATOM 1385 CG GLU A 90 9.086 -3.354 -8.455 1.00 0.00 C ATOM 1386 CD GLU A 90 10.085 -3.639 -9.559 1.00 0.00 C ATOM 1387 OE1 GLU A 90 10.180 -2.821 -10.498 1.00 0.00 O ATOM 1388 OE2 GLU A 90 10.771 -4.680 -9.485 1.00 0.00 O ATOM 0 H GLU A 90 6.949 -0.426 -7.469 1.00 0.00 H new ATOM 0 HA GLU A 90 8.343 -2.631 -6.067 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.876 -1.237 -8.678 1.00 0.00 H new ATOM 0 HB3 GLU A 90 10.252 -1.724 -7.708 1.00 0.00 H new ATOM 0 HG2 GLU A 90 9.236 -4.065 -7.642 1.00 0.00 H new ATOM 0 HG3 GLU A 90 8.076 -3.511 -8.834 1.00 0.00 H new ATOM 1395 N LEU A 91 9.670 -1.069 -4.679 1.00 0.00 N ATOM 1396 CA LEU A 91 10.353 -0.153 -3.773 1.00 0.00 C ATOM 1397 C LEU A 91 11.860 -0.174 -4.010 1.00 0.00 C ATOM 1398 O LEU A 91 12.475 -1.239 -4.069 1.00 0.00 O ATOM 1399 CB LEU A 91 10.049 -0.521 -2.320 1.00 0.00 C ATOM 1400 CG LEU A 91 10.521 0.477 -1.262 1.00 0.00 C ATOM 1401 CD1 LEU A 91 12.027 0.385 -1.075 1.00 0.00 C ATOM 1402 CD2 LEU A 91 10.115 1.893 -1.645 1.00 0.00 C ATOM 0 H LEU A 91 9.702 -2.047 -4.392 1.00 0.00 H new ATOM 0 HA LEU A 91 9.987 0.854 -3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.971 -0.648 -2.216 1.00 0.00 H new ATOM 0 HB3 LEU A 91 10.505 -1.488 -2.108 1.00 0.00 H new ATOM 0 HG LEU A 91 10.042 0.226 -0.315 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.344 1.103 -0.318 1.00 0.00 H new ATOM 0 HD12 LEU A 91 12.293 -0.622 -0.754 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.525 0.609 -2.018 1.00 0.00 H new ATOM 0 HD21 LEU A 91 10.459 2.590 -0.881 1.00 0.00 H new ATOM 0 HD22 LEU A 91 10.565 2.154 -2.603 1.00 0.00 H new ATOM 0 HD23 LEU A 91 9.030 1.951 -1.726 1.00 0.00 H new ATOM 1414 N PHE A 92 12.450 1.009 -4.143 1.00 0.00 N ATOM 1415 CA PHE A 92 13.885 1.127 -4.372 1.00 0.00 C ATOM 1416 C PHE A 92 14.540 1.984 -3.293 1.00 0.00 C ATOM 1417 O PHE A 92 14.590 3.209 -3.403 1.00 0.00 O ATOM 1418 CB PHE A 92 14.155 1.730 -5.752 1.00 0.00 C ATOM 1419 CG PHE A 92 13.986 0.750 -6.878 1.00 0.00 C ATOM 1420 CD1 PHE A 92 14.970 -0.187 -7.152 1.00 0.00 C ATOM 1421 CD2 PHE A 92 12.844 0.765 -7.662 1.00 0.00 C ATOM 1422 CE1 PHE A 92 14.817 -1.089 -8.187 1.00 0.00 C ATOM 1423 CE2 PHE A 92 12.686 -0.135 -8.699 1.00 0.00 C ATOM 1424 CZ PHE A 92 13.674 -1.063 -8.961 1.00 0.00 C ATOM 0 H PHE A 92 11.956 1.900 -4.096 1.00 0.00 H new ATOM 0 HA PHE A 92 14.317 0.127 -4.329 1.00 0.00 H new ATOM 0 HB2 PHE A 92 13.481 2.572 -5.910 1.00 0.00 H new ATOM 0 HB3 PHE A 92 15.170 2.126 -5.775 1.00 0.00 H new ATOM 0 HD1 PHE A 92 15.866 -0.212 -6.550 1.00 0.00 H new ATOM 0 HD2 PHE A 92 12.068 1.489 -7.461 1.00 0.00 H new ATOM 0 HE1 PHE A 92 15.591 -1.814 -8.391 1.00 0.00 H new ATOM 0 HE2 PHE A 92 11.791 -0.112 -9.303 1.00 0.00 H new ATOM 0 HZ PHE A 92 13.553 -1.768 -9.770 1.00 0.00 H new ATOM 1434 N VAL A 93 15.039 1.331 -2.249 1.00 0.00 N ATOM 1435 CA VAL A 93 15.692 2.032 -1.149 1.00 0.00 C ATOM 1436 C VAL A 93 17.197 2.126 -1.373 1.00 0.00 C ATOM 1437 O VAL A 93 17.895 1.113 -1.396 1.00 0.00 O ATOM 1438 CB VAL A 93 15.426 1.334 0.198 1.00 0.00 C ATOM 1439 CG1 VAL A 93 15.576 -0.173 0.057 1.00 0.00 C ATOM 1440 CG2 VAL A 93 16.361 1.873 1.270 1.00 0.00 C ATOM 0 H VAL A 93 15.004 0.317 -2.141 1.00 0.00 H new ATOM 0 HA VAL A 93 15.270 3.036 -1.118 1.00 0.00 H new ATOM 0 HB VAL A 93 14.401 1.546 0.502 1.00 0.00 H new ATOM 0 HG11 VAL A 93 15.384 -0.649 1.019 1.00 0.00 H new ATOM 0 HG12 VAL A 93 14.862 -0.542 -0.679 1.00 0.00 H new ATOM 0 HG13 VAL A 93 16.589 -0.409 -0.269 1.00 0.00 H new ATOM 0 HG21 VAL A 93 16.160 1.369 2.215 1.00 0.00 H new ATOM 0 HG22 VAL A 93 17.395 1.692 0.976 1.00 0.00 H new ATOM 0 HG23 VAL A 93 16.200 2.944 1.388 1.00 0.00 H new ATOM 1450 N ARG A 94 17.690 3.349 -1.537 1.00 0.00 N ATOM 1451 CA ARG A 94 19.113 3.575 -1.759 1.00 0.00 C ATOM 1452 C ARG A 94 19.875 3.587 -0.437 1.00 0.00 C ATOM 1453 O ARG A 94 19.276 3.526 0.636 1.00 0.00 O ATOM 1454 CB ARG A 94 19.331 4.897 -2.498 1.00 0.00 C ATOM 1455 CG ARG A 94 18.557 5.001 -3.802 1.00 0.00 C ATOM 1456 CD ARG A 94 18.711 6.376 -4.433 1.00 0.00 C ATOM 1457 NE ARG A 94 20.093 6.651 -4.815 1.00 0.00 N ATOM 1458 CZ ARG A 94 20.539 7.858 -5.145 1.00 0.00 C ATOM 1459 NH1 ARG A 94 19.714 8.897 -5.139 1.00 0.00 N ATOM 1460 NH2 ARG A 94 21.811 8.029 -5.480 1.00 0.00 N ATOM 0 H ARG A 94 17.125 4.198 -1.520 1.00 0.00 H new ATOM 0 HA ARG A 94 19.494 2.757 -2.370 1.00 0.00 H new ATOM 0 HB2 ARG A 94 19.040 5.720 -1.846 1.00 0.00 H new ATOM 0 HB3 ARG A 94 20.394 5.016 -2.706 1.00 0.00 H new ATOM 0 HG2 ARG A 94 18.909 4.239 -4.497 1.00 0.00 H new ATOM 0 HG3 ARG A 94 17.502 4.800 -3.617 1.00 0.00 H new ATOM 0 HD2 ARG A 94 18.071 6.445 -5.313 1.00 0.00 H new ATOM 0 HD3 ARG A 94 18.371 7.137 -3.731 1.00 0.00 H new ATOM 0 HE ARG A 94 20.753 5.873 -4.829 1.00 0.00 H new ATOM 0 HH11 ARG A 94 18.735 8.770 -4.881 1.00 0.00 H new ATOM 0 HH12 ARG A 94 20.058 9.823 -5.393 1.00 0.00 H new ATOM 0 HH21 ARG A 94 22.449 7.233 -5.485 1.00 0.00 H new ATOM 0 HH22 ARG A 94 22.151 8.957 -5.733 1.00 0.00 H new ATOM 1474 N SER A 95 21.199 3.666 -0.524 1.00 0.00 N ATOM 1475 CA SER A 95 22.043 3.682 0.665 1.00 0.00 C ATOM 1476 C SER A 95 22.429 5.110 1.039 1.00 0.00 C ATOM 1477 O SER A 95 23.149 5.783 0.303 1.00 0.00 O ATOM 1478 CB SER A 95 23.303 2.845 0.432 1.00 0.00 C ATOM 1479 OG SER A 95 24.060 2.721 1.624 1.00 0.00 O ATOM 0 H SER A 95 21.710 3.720 -1.405 1.00 0.00 H new ATOM 0 HA SER A 95 21.475 3.251 1.489 1.00 0.00 H new ATOM 0 HB2 SER A 95 23.024 1.855 0.070 1.00 0.00 H new ATOM 0 HB3 SER A 95 23.913 3.308 -0.344 1.00 0.00 H new ATOM 0 HG SER A 95 24.859 2.181 1.450 1.00 0.00 H new ATOM 1485 N GLY A 96 21.942 5.565 2.189 1.00 0.00 N ATOM 1486 CA GLY A 96 22.246 6.910 2.642 1.00 0.00 C ATOM 1487 C GLY A 96 22.606 6.960 4.113 1.00 0.00 C ATOM 1488 O GLY A 96 22.739 5.931 4.777 1.00 0.00 O ATOM 0 H GLY A 96 21.343 5.027 2.815 1.00 0.00 H new ATOM 0 HA2 GLY A 96 23.073 7.309 2.055 1.00 0.00 H new ATOM 0 HA3 GLY A 96 21.386 7.554 2.460 1.00 0.00 H new ATOM 1492 N PRO A 97 22.771 8.179 4.646 1.00 0.00 N ATOM 1493 CA PRO A 97 23.121 8.388 6.054 1.00 0.00 C ATOM 1494 C PRO A 97 21.978 8.024 6.996 1.00 0.00 C ATOM 1495 O PRO A 97 20.845 7.819 6.562 1.00 0.00 O ATOM 1496 CB PRO A 97 23.418 9.888 6.128 1.00 0.00 C ATOM 1497 CG PRO A 97 22.638 10.483 5.006 1.00 0.00 C ATOM 1498 CD PRO A 97 22.627 9.450 3.915 1.00 0.00 C ATOM 0 HA PRO A 97 23.956 7.759 6.364 1.00 0.00 H new ATOM 0 HB2 PRO A 97 23.113 10.305 7.088 1.00 0.00 H new ATOM 0 HB3 PRO A 97 24.484 10.087 6.018 1.00 0.00 H new ATOM 0 HG2 PRO A 97 21.624 10.727 5.322 1.00 0.00 H new ATOM 0 HG3 PRO A 97 23.096 11.410 4.661 1.00 0.00 H new ATOM 0 HD2 PRO A 97 21.700 9.481 3.342 1.00 0.00 H new ATOM 0 HD3 PRO A 97 23.444 9.602 3.209 1.00 0.00 H new ATOM 1506 N SER A 98 22.284 7.946 8.287 1.00 0.00 N ATOM 1507 CA SER A 98 21.282 7.603 9.290 1.00 0.00 C ATOM 1508 C SER A 98 21.424 8.490 10.524 1.00 0.00 C ATOM 1509 O SER A 98 22.529 8.712 11.019 1.00 0.00 O ATOM 1510 CB SER A 98 21.411 6.132 9.688 1.00 0.00 C ATOM 1511 OG SER A 98 22.582 5.911 10.455 1.00 0.00 O ATOM 0 H SER A 98 23.217 8.115 8.663 1.00 0.00 H new ATOM 0 HA SER A 98 20.296 7.769 8.855 1.00 0.00 H new ATOM 0 HB2 SER A 98 20.535 5.829 10.261 1.00 0.00 H new ATOM 0 HB3 SER A 98 21.437 5.511 8.793 1.00 0.00 H new ATOM 0 HG SER A 98 22.640 4.963 10.698 1.00 0.00 H new ATOM 1517 N SER A 99 20.296 8.994 11.015 1.00 0.00 N ATOM 1518 CA SER A 99 20.293 9.859 12.189 1.00 0.00 C ATOM 1519 C SER A 99 19.063 9.599 13.053 1.00 0.00 C ATOM 1520 O SER A 99 18.148 8.881 12.650 1.00 0.00 O ATOM 1521 CB SER A 99 20.331 11.329 11.765 1.00 0.00 C ATOM 1522 OG SER A 99 20.642 12.169 12.863 1.00 0.00 O ATOM 0 H SER A 99 19.373 8.818 10.618 1.00 0.00 H new ATOM 0 HA SER A 99 21.182 9.634 12.778 1.00 0.00 H new ATOM 0 HB2 SER A 99 21.073 11.465 10.978 1.00 0.00 H new ATOM 0 HB3 SER A 99 19.366 11.615 11.346 1.00 0.00 H new ATOM 0 HG SER A 99 20.662 13.103 12.565 1.00 0.00 H new ATOM 1528 N GLY A 100 19.049 10.188 14.244 1.00 0.00 N ATOM 1529 CA GLY A 100 17.927 10.009 15.148 1.00 0.00 C ATOM 1530 C GLY A 100 16.592 10.063 14.432 1.00 0.00 C ATOM 1531 O GLY A 100 16.082 11.143 14.136 1.00 0.00 O ATOM 0 H GLY A 100 19.795 10.786 14.600 1.00 0.00 H new ATOM 0 HA2 GLY A 100 18.024 9.050 15.657 1.00 0.00 H new ATOM 0 HA3 GLY A 100 17.956 10.782 15.916 1.00 0.00 H new TER 1535 GLY A 100