USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 930 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 34 TYR OH : rot 76:sc= 0.537 USER MOD Set 1.2: A 53 HIS : no HE2:sc= -0.148 K(o=0.39,f=-2.5) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.009) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN :FLIP amide:sc= -0.687 F(o=-3.2!,f=-0.69) USER MOD Single : A 16 TYR OH : rot 90:sc= -0.646 USER MOD Single : A 17 ASN : amide:sc= 0.0612 X(o=0.061,f=-0.0057) USER MOD Single : A 25 MET CE :methyl -153:sc= -1.07 (180deg=-2.28!) USER MOD Single : A 32 CYS SG : rot -143:sc= -0.321! USER MOD Single : A 33 GLN : amide:sc= -0.15 X(o=-0.15,f=0) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.12 K(o=-1.1,f=-5!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN :FLIP amide:sc= -0.016 F(o=-0.62,f=-0.016) USER MOD Single : A 79 HIS : no HE2:sc= 0.138 K(o=0.14,f=-2.8!) USER MOD Single : A 81 THR OG1 : rot -98:sc= 0.387 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN :FLIP amide:sc= 0.00365 F(o=-1.2,f=0.0036) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 78:sc= 0.227 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.412 X(o=-0.41,f=-0.6) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ASN A 2 2.146 -2.918 0.138 1.00 0.00 N ATOM 21 CA ASN A 2 2.256 -3.843 -1.000 1.00 0.00 C ATOM 22 C ASN A 2 0.948 -4.633 -1.126 1.00 0.00 C ATOM 23 O ASN A 2 0.899 -5.837 -0.859 1.00 0.00 O ATOM 24 CB ASN A 2 3.478 -4.779 -0.805 1.00 0.00 C ATOM 25 CG ASN A 2 4.816 -4.059 -0.896 1.00 0.00 C ATOM 26 OD1 ASN A 2 5.292 -3.480 0.076 1.00 0.00 O ATOM 27 ND2 ASN A 2 5.445 -4.116 -2.055 1.00 0.00 N ATOM 0 HA ASN A 2 2.415 -3.289 -1.925 1.00 0.00 H new ATOM 0 HB2 ASN A 2 3.402 -5.265 0.168 1.00 0.00 H new ATOM 0 HB3 ASN A 2 3.446 -5.566 -1.558 1.00 0.00 H new ATOM 0 HD21 ASN A 2 6.356 -3.670 -2.163 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.020 -4.606 -2.842 1.00 0.00 H new ATOM 34 N SER A 3 -0.110 -3.906 -1.521 1.00 0.00 N ATOM 35 CA SER A 3 -1.487 -4.418 -1.606 1.00 0.00 C ATOM 36 C SER A 3 -1.570 -5.640 -2.535 1.00 0.00 C ATOM 37 O SER A 3 -2.079 -6.678 -2.139 1.00 0.00 O ATOM 38 CB SER A 3 -2.428 -3.299 -2.108 1.00 0.00 C ATOM 39 OG SER A 3 -2.266 -2.114 -1.347 1.00 0.00 O ATOM 0 H SER A 3 -0.030 -2.927 -1.795 1.00 0.00 H new ATOM 0 HA SER A 3 -1.799 -4.734 -0.611 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.222 -3.091 -3.158 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.463 -3.635 -2.046 1.00 0.00 H new ATOM 0 HG SER A 3 -2.871 -1.422 -1.686 1.00 0.00 H new ATOM 45 N GLU A 4 -0.993 -5.507 -3.744 1.00 0.00 N ATOM 46 CA GLU A 4 -0.968 -6.581 -4.779 1.00 0.00 C ATOM 47 C GLU A 4 -0.315 -7.896 -4.277 1.00 0.00 C ATOM 48 O GLU A 4 -0.481 -8.948 -4.899 1.00 0.00 O ATOM 49 CB GLU A 4 -0.214 -6.071 -6.037 1.00 0.00 C ATOM 50 CG GLU A 4 1.204 -5.532 -5.737 1.00 0.00 C ATOM 51 CD GLU A 4 2.017 -5.176 -6.989 1.00 0.00 C ATOM 52 OE1 GLU A 4 1.671 -4.194 -7.678 1.00 0.00 O ATOM 53 OE2 GLU A 4 3.026 -5.854 -7.271 1.00 0.00 O ATOM 0 H GLU A 4 -0.526 -4.650 -4.041 1.00 0.00 H new ATOM 0 HA GLU A 4 -2.005 -6.815 -5.020 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -0.139 -6.884 -6.759 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -0.801 -5.282 -6.506 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.119 -4.646 -5.108 1.00 0.00 H new ATOM 0 HG3 GLU A 4 1.751 -6.279 -5.162 1.00 0.00 H new ATOM 60 N ILE A 5 0.448 -7.808 -3.173 1.00 0.00 N ATOM 61 CA ILE A 5 1.127 -8.957 -2.548 1.00 0.00 C ATOM 62 C ILE A 5 0.271 -9.519 -1.392 1.00 0.00 C ATOM 63 O ILE A 5 0.240 -10.728 -1.152 1.00 0.00 O ATOM 64 CB ILE A 5 2.536 -8.530 -1.987 1.00 0.00 C ATOM 65 CG1 ILE A 5 3.334 -7.681 -3.032 1.00 0.00 C ATOM 66 CG2 ILE A 5 3.361 -9.751 -1.521 1.00 0.00 C ATOM 67 CD1 ILE A 5 3.564 -8.344 -4.377 1.00 0.00 C ATOM 0 H ILE A 5 0.612 -6.928 -2.685 1.00 0.00 H new ATOM 0 HA ILE A 5 1.262 -9.725 -3.309 1.00 0.00 H new ATOM 0 HB ILE A 5 2.355 -7.903 -1.114 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.801 -6.744 -3.195 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.303 -7.426 -2.602 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.326 -9.415 -1.141 1.00 0.00 H new ATOM 0 HG22 ILE A 5 2.822 -10.274 -0.731 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.518 -10.427 -2.362 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.125 -7.670 -5.024 1.00 0.00 H new ATOM 0 HD12 ILE A 5 4.128 -9.266 -4.236 1.00 0.00 H new ATOM 0 HD13 ILE A 5 2.604 -8.573 -4.839 1.00 0.00 H new ATOM 79 N GLU A 6 -0.432 -8.615 -0.696 1.00 0.00 N ATOM 80 CA GLU A 6 -1.206 -8.939 0.518 1.00 0.00 C ATOM 81 C GLU A 6 -2.608 -9.487 0.192 1.00 0.00 C ATOM 82 O GLU A 6 -3.181 -10.220 1.012 1.00 0.00 O ATOM 83 CB GLU A 6 -1.296 -7.680 1.419 1.00 0.00 C ATOM 84 CG GLU A 6 0.071 -7.182 1.921 1.00 0.00 C ATOM 85 CD GLU A 6 -0.008 -5.891 2.755 1.00 0.00 C ATOM 86 OE1 GLU A 6 -0.004 -4.783 2.166 1.00 0.00 O ATOM 87 OE2 GLU A 6 -0.080 -5.977 4.003 1.00 0.00 O ATOM 0 H GLU A 6 -0.482 -7.631 -0.959 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.684 -9.734 1.051 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -1.783 -6.879 0.862 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -1.930 -7.902 2.277 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.534 -7.964 2.522 1.00 0.00 H new ATOM 0 HG3 GLU A 6 0.722 -7.011 1.064 1.00 0.00 H new ATOM 94 N LEU A 7 -3.157 -9.143 -0.998 1.00 0.00 N ATOM 95 CA LEU A 7 -4.489 -9.636 -1.425 1.00 0.00 C ATOM 96 C LEU A 7 -4.446 -11.179 -1.658 1.00 0.00 C ATOM 97 O LEU A 7 -5.254 -11.880 -1.047 1.00 0.00 O ATOM 98 CB LEU A 7 -5.038 -8.909 -2.695 1.00 0.00 C ATOM 99 CG LEU A 7 -5.072 -7.354 -2.656 1.00 0.00 C ATOM 100 CD1 LEU A 7 -5.644 -6.764 -3.964 1.00 0.00 C ATOM 101 CD2 LEU A 7 -5.821 -6.823 -1.412 1.00 0.00 C ATOM 0 H LEU A 7 -2.702 -8.531 -1.675 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.180 -9.406 -0.614 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.433 -9.214 -3.549 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -6.051 -9.266 -2.879 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.040 -7.014 -2.573 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.652 -5.676 -3.899 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.023 -7.073 -4.805 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.661 -7.126 -4.112 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -5.821 -5.733 -1.425 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -6.849 -7.186 -1.424 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -5.322 -7.175 -0.509 1.00 0.00 H new ATOM 113 N PRO A 8 -3.490 -11.747 -2.507 1.00 0.00 N ATOM 114 CA PRO A 8 -3.351 -13.219 -2.686 1.00 0.00 C ATOM 115 C PRO A 8 -3.206 -13.956 -1.346 1.00 0.00 C ATOM 116 O PRO A 8 -3.958 -14.881 -1.050 1.00 0.00 O ATOM 117 CB PRO A 8 -2.071 -13.387 -3.580 1.00 0.00 C ATOM 118 CG PRO A 8 -1.406 -12.049 -3.576 1.00 0.00 C ATOM 119 CD PRO A 8 -2.507 -11.035 -3.378 1.00 0.00 C ATOM 0 HA PRO A 8 -4.238 -13.655 -3.146 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.410 -14.155 -3.179 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.336 -13.691 -4.593 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.667 -11.983 -2.777 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.878 -11.873 -4.513 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.135 -10.127 -2.903 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.954 -10.738 -4.327 1.00 0.00 H new ATOM 127 N VAL A 9 -2.270 -13.457 -0.538 1.00 0.00 N ATOM 128 CA VAL A 9 -1.908 -14.007 0.775 1.00 0.00 C ATOM 129 C VAL A 9 -3.118 -14.148 1.735 1.00 0.00 C ATOM 130 O VAL A 9 -3.335 -15.221 2.322 1.00 0.00 O ATOM 131 CB VAL A 9 -0.767 -13.103 1.377 1.00 0.00 C ATOM 132 CG1 VAL A 9 -0.635 -13.238 2.907 1.00 0.00 C ATOM 133 CG2 VAL A 9 0.570 -13.416 0.656 1.00 0.00 C ATOM 0 H VAL A 9 -1.723 -12.632 -0.785 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.548 -15.028 0.647 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.036 -12.062 1.202 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.167 -12.591 3.261 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.572 -12.946 3.380 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.406 -14.273 3.163 1.00 0.00 H new ATOM 0 HG21 VAL A 9 1.362 -12.792 1.070 1.00 0.00 H new ATOM 0 HG22 VAL A 9 0.823 -14.466 0.799 1.00 0.00 H new ATOM 0 HG23 VAL A 9 0.466 -13.210 -0.409 1.00 0.00 H new ATOM 143 N GLN A 10 -3.918 -13.081 1.853 1.00 0.00 N ATOM 144 CA GLN A 10 -5.063 -13.044 2.795 1.00 0.00 C ATOM 145 C GLN A 10 -6.196 -13.992 2.338 1.00 0.00 C ATOM 146 O GLN A 10 -6.741 -14.754 3.150 1.00 0.00 O ATOM 147 CB GLN A 10 -5.591 -11.577 2.988 1.00 0.00 C ATOM 148 CG GLN A 10 -5.638 -11.099 4.460 1.00 0.00 C ATOM 149 CD GLN A 10 -6.523 -11.956 5.391 1.00 0.00 C ATOM 150 OE1 GLN A 10 -6.216 -12.113 6.568 1.00 0.00 O ATOM 151 NE2 GLN A 10 -7.643 -12.476 4.891 1.00 0.00 N ATOM 0 H GLN A 10 -3.800 -12.226 1.310 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.708 -13.398 3.763 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -4.956 -10.898 2.419 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -6.593 -11.506 2.564 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -4.623 -11.088 4.856 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -6.000 -10.071 4.482 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -7.878 -12.332 3.909 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.266 -13.018 5.490 1.00 0.00 H new ATOM 160 N LYS A 11 -6.521 -13.957 1.030 1.00 0.00 N ATOM 161 CA LYS A 11 -7.618 -14.774 0.453 1.00 0.00 C ATOM 162 C LYS A 11 -7.288 -16.276 0.539 1.00 0.00 C ATOM 163 O LYS A 11 -8.183 -17.095 0.762 1.00 0.00 O ATOM 164 CB LYS A 11 -7.897 -14.389 -1.016 1.00 0.00 C ATOM 165 CG LYS A 11 -8.179 -12.894 -1.255 1.00 0.00 C ATOM 166 CD LYS A 11 -9.407 -12.347 -0.503 1.00 0.00 C ATOM 167 CE LYS A 11 -9.615 -10.847 -0.780 1.00 0.00 C ATOM 168 NZ LYS A 11 -10.787 -10.300 -0.063 1.00 0.00 N ATOM 0 H LYS A 11 -6.040 -13.371 0.348 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.513 -14.571 1.040 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.040 -14.683 -1.622 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -8.751 -14.966 -1.371 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.301 -12.320 -0.958 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.320 -12.730 -2.323 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.296 -12.901 -0.805 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.280 -12.506 0.568 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.722 -10.298 -0.483 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.743 -10.692 -1.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -10.886 -9.288 -0.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.645 -10.805 -0.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -10.655 -10.422 0.961 1.00 0.00 H new ATOM 182 N GLN A 12 -5.987 -16.606 0.370 1.00 0.00 N ATOM 183 CA GLN A 12 -5.479 -17.984 0.510 1.00 0.00 C ATOM 184 C GLN A 12 -5.759 -18.526 1.913 1.00 0.00 C ATOM 185 O GLN A 12 -6.235 -19.638 2.067 1.00 0.00 O ATOM 186 CB GLN A 12 -3.949 -18.066 0.320 1.00 0.00 C ATOM 187 CG GLN A 12 -3.423 -17.938 -1.103 1.00 0.00 C ATOM 188 CD GLN A 12 -1.911 -18.063 -1.097 1.00 0.00 C ATOM 189 OE1 GLN A 12 -1.221 -16.965 -0.835 1.00 0.00 O flip ATOM 190 NE2 GLN A 12 -1.373 -19.144 -1.264 1.00 0.00 N flip ATOM 0 H GLN A 12 -5.265 -15.925 0.134 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.989 -18.564 -0.259 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -3.490 -17.282 0.923 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -3.608 -19.020 0.723 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -3.860 -18.712 -1.734 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -3.717 -16.977 -1.526 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.938 -19.969 -1.464 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -0.358 -19.223 -1.203 1.00 0.00 H new ATOM 199 N LEU A 13 -5.388 -17.715 2.917 1.00 0.00 N ATOM 200 CA LEU A 13 -5.447 -18.087 4.337 1.00 0.00 C ATOM 201 C LEU A 13 -6.860 -18.524 4.739 1.00 0.00 C ATOM 202 O LEU A 13 -7.056 -19.605 5.319 1.00 0.00 O ATOM 203 CB LEU A 13 -5.001 -16.884 5.195 1.00 0.00 C ATOM 204 CG LEU A 13 -5.031 -17.113 6.732 1.00 0.00 C ATOM 205 CD1 LEU A 13 -4.026 -18.199 7.164 1.00 0.00 C ATOM 206 CD2 LEU A 13 -4.845 -15.783 7.479 1.00 0.00 C ATOM 0 H LEU A 13 -5.034 -16.771 2.762 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.778 -18.931 4.505 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.987 -16.609 4.906 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -5.641 -16.034 4.959 1.00 0.00 H new ATOM 0 HG LEU A 13 -6.014 -17.495 7.008 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -4.076 -18.331 8.245 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.273 -19.140 6.672 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.018 -17.895 6.882 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.869 -15.963 8.554 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.886 -15.343 7.206 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -5.648 -15.098 7.208 1.00 0.00 H new ATOM 218 N GLU A 14 -7.823 -17.659 4.407 1.00 0.00 N ATOM 219 CA GLU A 14 -9.255 -17.916 4.607 1.00 0.00 C ATOM 220 C GLU A 14 -9.676 -19.208 3.890 1.00 0.00 C ATOM 221 O GLU A 14 -10.298 -20.088 4.483 1.00 0.00 O ATOM 222 CB GLU A 14 -10.071 -16.707 4.085 1.00 0.00 C ATOM 223 CG GLU A 14 -9.689 -15.361 4.737 1.00 0.00 C ATOM 224 CD GLU A 14 -9.816 -15.377 6.271 1.00 0.00 C ATOM 225 OE1 GLU A 14 -10.953 -15.278 6.780 1.00 0.00 O ATOM 226 OE2 GLU A 14 -8.786 -15.518 6.974 1.00 0.00 O ATOM 0 H GLU A 14 -7.629 -16.750 3.987 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.452 -18.046 5.671 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.934 -16.628 3.007 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -11.131 -16.895 4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.663 -15.110 4.466 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.327 -14.574 4.334 1.00 0.00 H new ATOM 233 N ALA A 15 -9.239 -19.320 2.634 1.00 0.00 N ATOM 234 CA ALA A 15 -9.542 -20.451 1.749 1.00 0.00 C ATOM 235 C ALA A 15 -8.882 -21.764 2.227 1.00 0.00 C ATOM 236 O ALA A 15 -9.374 -22.848 1.939 1.00 0.00 O ATOM 237 CB ALA A 15 -9.086 -20.106 0.327 1.00 0.00 C ATOM 0 H ALA A 15 -8.652 -18.613 2.192 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.619 -20.620 1.767 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.307 -20.941 -0.338 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.613 -19.217 -0.019 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.013 -19.915 0.325 1.00 0.00 H new ATOM 243 N TYR A 16 -7.761 -21.646 2.962 1.00 0.00 N ATOM 244 CA TYR A 16 -6.946 -22.803 3.380 1.00 0.00 C ATOM 245 C TYR A 16 -7.671 -23.609 4.470 1.00 0.00 C ATOM 246 O TYR A 16 -7.796 -24.837 4.373 1.00 0.00 O ATOM 247 CB TYR A 16 -5.561 -22.317 3.877 1.00 0.00 C ATOM 248 CG TYR A 16 -4.603 -23.440 4.301 1.00 0.00 C ATOM 249 CD1 TYR A 16 -4.127 -24.367 3.370 1.00 0.00 C ATOM 250 CD2 TYR A 16 -4.176 -23.574 5.624 1.00 0.00 C ATOM 251 CE1 TYR A 16 -3.265 -25.382 3.743 1.00 0.00 C ATOM 252 CE2 TYR A 16 -3.313 -24.588 5.997 1.00 0.00 C ATOM 253 CZ TYR A 16 -2.860 -25.488 5.053 1.00 0.00 C ATOM 254 OH TYR A 16 -2.001 -26.499 5.423 1.00 0.00 O ATOM 0 H TYR A 16 -7.395 -20.749 3.282 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.797 -23.461 2.524 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -5.089 -21.735 3.085 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -5.708 -21.645 4.722 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.438 -24.289 2.339 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -4.526 -22.874 6.368 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.911 -26.089 3.008 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.994 -24.676 7.025 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.075 -26.192 5.331 1.00 0.00 H new ATOM 264 N ASN A 17 -8.167 -22.893 5.494 1.00 0.00 N ATOM 265 CA ASN A 17 -8.860 -23.519 6.638 1.00 0.00 C ATOM 266 C ASN A 17 -10.328 -23.831 6.281 1.00 0.00 C ATOM 267 O ASN A 17 -10.906 -24.792 6.795 1.00 0.00 O ATOM 268 CB ASN A 17 -8.770 -22.617 7.901 1.00 0.00 C ATOM 269 CG ASN A 17 -9.531 -21.288 7.795 1.00 0.00 C ATOM 270 OD1 ASN A 17 -10.713 -21.210 8.135 1.00 0.00 O ATOM 271 ND2 ASN A 17 -8.861 -20.239 7.338 1.00 0.00 N ATOM 0 H ASN A 17 -8.101 -21.877 5.554 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.361 -24.461 6.866 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -9.154 -23.173 8.756 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -7.721 -22.404 8.105 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.323 -19.333 7.259 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -7.883 -20.338 7.065 1.00 0.00 H new ATOM 278 N ALA A 18 -10.908 -23.020 5.366 1.00 0.00 N ATOM 279 CA ALA A 18 -12.296 -23.200 4.880 1.00 0.00 C ATOM 280 C ALA A 18 -12.362 -24.194 3.706 1.00 0.00 C ATOM 281 O ALA A 18 -13.453 -24.493 3.209 1.00 0.00 O ATOM 282 CB ALA A 18 -12.894 -21.847 4.480 1.00 0.00 C ATOM 0 H ALA A 18 -10.428 -22.224 4.945 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.886 -23.620 5.695 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.914 -21.991 4.124 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.901 -21.183 5.344 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.292 -21.404 3.687 1.00 0.00 H new ATOM 288 N ARG A 19 -11.173 -24.673 3.270 1.00 0.00 N ATOM 289 CA ARG A 19 -10.997 -25.747 2.259 1.00 0.00 C ATOM 290 C ARG A 19 -11.352 -25.289 0.815 1.00 0.00 C ATOM 291 O ARG A 19 -11.433 -26.121 -0.099 1.00 0.00 O ATOM 292 CB ARG A 19 -11.768 -27.048 2.645 1.00 0.00 C ATOM 293 CG ARG A 19 -11.472 -27.603 4.060 1.00 0.00 C ATOM 294 CD ARG A 19 -10.008 -28.034 4.276 1.00 0.00 C ATOM 295 NE ARG A 19 -9.821 -28.609 5.628 1.00 0.00 N ATOM 296 CZ ARG A 19 -9.782 -29.924 5.922 1.00 0.00 C ATOM 297 NH1 ARG A 19 -9.848 -30.845 4.967 1.00 0.00 N ATOM 298 NH2 ARG A 19 -9.668 -30.312 7.185 1.00 0.00 N ATOM 0 H ARG A 19 -10.285 -24.315 3.620 1.00 0.00 H new ATOM 0 HA ARG A 19 -9.932 -25.980 2.259 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -12.837 -26.853 2.567 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -11.531 -27.821 1.914 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -11.728 -26.842 4.797 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -12.122 -28.458 4.246 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -9.726 -28.769 3.522 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.349 -27.175 4.147 1.00 0.00 H new ATOM 0 HE ARG A 19 -9.712 -27.954 6.403 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -9.930 -30.562 3.990 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -9.817 -31.835 5.210 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -9.610 -29.617 7.929 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.638 -31.306 7.412 1.00 0.00 H new ATOM 312 N ASP A 20 -11.508 -23.967 0.612 1.00 0.00 N ATOM 313 CA ASP A 20 -11.816 -23.381 -0.708 1.00 0.00 C ATOM 314 C ASP A 20 -10.585 -23.423 -1.635 1.00 0.00 C ATOM 315 O ASP A 20 -9.719 -22.553 -1.571 1.00 0.00 O ATOM 316 CB ASP A 20 -12.326 -21.917 -0.565 1.00 0.00 C ATOM 317 CG ASP A 20 -13.703 -21.819 0.100 1.00 0.00 C ATOM 318 OD1 ASP A 20 -13.773 -21.812 1.341 1.00 0.00 O ATOM 319 OD2 ASP A 20 -14.727 -21.764 -0.620 1.00 0.00 O ATOM 0 H ASP A 20 -11.424 -23.275 1.357 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.607 -23.982 -1.156 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.606 -21.344 0.019 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.373 -21.458 -1.552 1.00 0.00 H new ATOM 324 N ILE A 21 -10.520 -24.450 -2.489 1.00 0.00 N ATOM 325 CA ILE A 21 -9.459 -24.597 -3.507 1.00 0.00 C ATOM 326 C ILE A 21 -9.542 -23.487 -4.585 1.00 0.00 C ATOM 327 O ILE A 21 -8.507 -23.075 -5.126 1.00 0.00 O ATOM 328 CB ILE A 21 -9.495 -26.054 -4.142 1.00 0.00 C ATOM 329 CG1 ILE A 21 -8.841 -27.087 -3.171 1.00 0.00 C ATOM 330 CG2 ILE A 21 -8.846 -26.137 -5.551 1.00 0.00 C ATOM 331 CD1 ILE A 21 -7.337 -26.899 -2.978 1.00 0.00 C ATOM 0 H ILE A 21 -11.202 -25.209 -2.498 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.495 -24.475 -3.014 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.547 -26.301 -4.282 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.332 -27.018 -2.200 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.025 -28.092 -3.550 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.908 -27.161 -5.920 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -9.374 -25.472 -6.235 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -7.800 -25.836 -5.488 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.961 -27.656 -2.290 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.832 -26.999 -3.939 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -7.144 -25.908 -2.568 1.00 0.00 H new ATOM 343 N ASP A 22 -10.766 -22.979 -4.857 1.00 0.00 N ATOM 344 CA ASP A 22 -10.998 -21.935 -5.886 1.00 0.00 C ATOM 345 C ASP A 22 -10.196 -20.648 -5.599 1.00 0.00 C ATOM 346 O ASP A 22 -9.500 -20.148 -6.482 1.00 0.00 O ATOM 347 CB ASP A 22 -12.515 -21.600 -5.991 1.00 0.00 C ATOM 348 CG ASP A 22 -13.324 -22.692 -6.710 1.00 0.00 C ATOM 349 OD1 ASP A 22 -13.538 -23.776 -6.129 1.00 0.00 O ATOM 350 OD2 ASP A 22 -13.749 -22.472 -7.867 1.00 0.00 O ATOM 0 H ASP A 22 -11.614 -23.277 -4.375 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.649 -22.339 -6.836 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.920 -21.456 -4.989 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.637 -20.656 -6.522 1.00 0.00 H new ATOM 355 N ALA A 23 -10.263 -20.149 -4.352 1.00 0.00 N ATOM 356 CA ALA A 23 -9.527 -18.927 -3.931 1.00 0.00 C ATOM 357 C ALA A 23 -8.069 -19.256 -3.594 1.00 0.00 C ATOM 358 O ALA A 23 -7.176 -18.423 -3.781 1.00 0.00 O ATOM 359 CB ALA A 23 -10.238 -18.245 -2.748 1.00 0.00 C ATOM 0 H ALA A 23 -10.821 -20.571 -3.609 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.521 -18.225 -4.765 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.684 -17.353 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.248 -17.963 -3.044 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -10.286 -18.935 -1.906 1.00 0.00 H new ATOM 365 N PHE A 24 -7.835 -20.491 -3.117 1.00 0.00 N ATOM 366 CA PHE A 24 -6.483 -20.977 -2.788 1.00 0.00 C ATOM 367 C PHE A 24 -5.667 -21.266 -4.080 1.00 0.00 C ATOM 368 O PHE A 24 -4.486 -21.593 -4.005 1.00 0.00 O ATOM 369 CB PHE A 24 -6.562 -22.227 -1.864 1.00 0.00 C ATOM 370 CG PHE A 24 -5.271 -22.513 -1.097 1.00 0.00 C ATOM 371 CD1 PHE A 24 -4.862 -21.659 -0.076 1.00 0.00 C ATOM 372 CD2 PHE A 24 -4.447 -23.591 -1.412 1.00 0.00 C ATOM 373 CE1 PHE A 24 -3.683 -21.871 0.607 1.00 0.00 C ATOM 374 CE2 PHE A 24 -3.262 -23.796 -0.728 1.00 0.00 C ATOM 375 CZ PHE A 24 -2.880 -22.938 0.280 1.00 0.00 C ATOM 0 H PHE A 24 -8.572 -21.176 -2.950 1.00 0.00 H new ATOM 0 HA PHE A 24 -5.957 -20.194 -2.242 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -7.374 -22.088 -1.150 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.814 -23.098 -2.469 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.481 -20.814 0.186 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.736 -24.273 -2.198 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -3.390 -21.198 1.400 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.632 -24.634 -0.986 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.954 -23.103 0.811 1.00 0.00 H new ATOM 385 N MET A 25 -6.329 -21.200 -5.261 1.00 0.00 N ATOM 386 CA MET A 25 -5.652 -21.306 -6.579 1.00 0.00 C ATOM 387 C MET A 25 -5.739 -19.989 -7.389 1.00 0.00 C ATOM 388 O MET A 25 -4.820 -19.677 -8.157 1.00 0.00 O ATOM 389 CB MET A 25 -6.248 -22.481 -7.409 1.00 0.00 C ATOM 390 CG MET A 25 -5.632 -22.687 -8.821 1.00 0.00 C ATOM 391 SD MET A 25 -4.168 -23.766 -8.880 1.00 0.00 S ATOM 392 CE MET A 25 -2.951 -22.993 -7.809 1.00 0.00 C ATOM 0 H MET A 25 -7.339 -21.073 -5.328 1.00 0.00 H new ATOM 0 HA MET A 25 -4.599 -21.503 -6.380 1.00 0.00 H new ATOM 0 HB2 MET A 25 -6.125 -23.403 -6.841 1.00 0.00 H new ATOM 0 HB3 MET A 25 -7.320 -22.316 -7.520 1.00 0.00 H new ATOM 0 HG2 MET A 25 -6.397 -23.104 -9.476 1.00 0.00 H new ATOM 0 HG3 MET A 25 -5.361 -21.712 -9.227 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.949 -23.268 -8.139 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.063 -21.910 -7.853 1.00 0.00 H new ATOM 0 HE3 MET A 25 -3.101 -23.332 -6.784 1.00 0.00 H new ATOM 402 N ALA A 26 -6.829 -19.220 -7.191 1.00 0.00 N ATOM 403 CA ALA A 26 -7.172 -18.024 -8.021 1.00 0.00 C ATOM 404 C ALA A 26 -6.042 -16.982 -8.098 1.00 0.00 C ATOM 405 O ALA A 26 -5.860 -16.310 -9.122 1.00 0.00 O ATOM 406 CB ALA A 26 -8.439 -17.347 -7.469 1.00 0.00 C ATOM 0 H ALA A 26 -7.506 -19.403 -6.450 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.336 -18.396 -9.032 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.682 -16.477 -8.079 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.270 -18.052 -7.496 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.264 -17.031 -6.440 1.00 0.00 H new ATOM 412 N TRP A 27 -5.291 -16.874 -7.003 1.00 0.00 N ATOM 413 CA TRP A 27 -4.297 -15.819 -6.795 1.00 0.00 C ATOM 414 C TRP A 27 -2.862 -16.291 -7.087 1.00 0.00 C ATOM 415 O TRP A 27 -1.894 -15.603 -6.744 1.00 0.00 O ATOM 416 CB TRP A 27 -4.433 -15.339 -5.349 1.00 0.00 C ATOM 417 CG TRP A 27 -5.765 -14.699 -5.037 1.00 0.00 C ATOM 418 CD1 TRP A 27 -6.865 -15.304 -4.509 1.00 0.00 C ATOM 419 CD2 TRP A 27 -6.125 -13.324 -5.241 1.00 0.00 C ATOM 420 NE1 TRP A 27 -7.877 -14.399 -4.364 1.00 0.00 N ATOM 421 CE2 TRP A 27 -7.451 -13.172 -4.812 1.00 0.00 C ATOM 422 CE3 TRP A 27 -5.444 -12.206 -5.741 1.00 0.00 C ATOM 423 CZ2 TRP A 27 -8.120 -11.950 -4.870 1.00 0.00 C ATOM 424 CZ3 TRP A 27 -6.106 -10.995 -5.797 1.00 0.00 C ATOM 425 CH2 TRP A 27 -7.432 -10.872 -5.362 1.00 0.00 C ATOM 0 H TRP A 27 -5.356 -17.527 -6.222 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.485 -15.005 -7.495 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.283 -16.186 -4.680 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.639 -14.622 -5.139 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.928 -16.349 -4.243 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.802 -14.601 -3.984 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.421 -12.290 -6.076 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -9.144 -11.857 -4.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.592 -10.127 -6.183 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -7.921 -9.910 -5.415 1.00 0.00 H new ATOM 436 N TRP A 28 -2.737 -17.444 -7.750 1.00 0.00 N ATOM 437 CA TRP A 28 -1.442 -18.029 -8.142 1.00 0.00 C ATOM 438 C TRP A 28 -1.220 -17.847 -9.651 1.00 0.00 C ATOM 439 O TRP A 28 -2.178 -17.690 -10.416 1.00 0.00 O ATOM 440 CB TRP A 28 -1.404 -19.531 -7.780 1.00 0.00 C ATOM 441 CG TRP A 28 -1.500 -19.837 -6.297 1.00 0.00 C ATOM 442 CD1 TRP A 28 -2.547 -19.570 -5.448 1.00 0.00 C ATOM 443 CD2 TRP A 28 -0.512 -20.505 -5.501 1.00 0.00 C ATOM 444 NE1 TRP A 28 -2.255 -20.029 -4.191 1.00 0.00 N ATOM 445 CE2 TRP A 28 -1.018 -20.612 -4.200 1.00 0.00 C ATOM 446 CE3 TRP A 28 0.750 -21.027 -5.772 1.00 0.00 C ATOM 447 CZ2 TRP A 28 -0.305 -21.217 -3.169 1.00 0.00 C ATOM 448 CZ3 TRP A 28 1.458 -21.625 -4.749 1.00 0.00 C ATOM 449 CH2 TRP A 28 0.927 -21.718 -3.460 1.00 0.00 C ATOM 0 H TRP A 28 -3.538 -18.007 -8.035 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.646 -17.517 -7.601 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -2.224 -20.034 -8.293 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.478 -19.958 -8.164 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -3.463 -19.073 -5.730 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.864 -19.949 -3.377 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.168 -20.965 -6.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.715 -21.287 -2.172 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.440 -22.028 -4.949 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.504 -22.195 -2.681 1.00 0.00 H new ATOM 460 N ALA A 29 0.056 -17.856 -10.064 1.00 0.00 N ATOM 461 CA ALA A 29 0.453 -17.773 -11.483 1.00 0.00 C ATOM 462 C ALA A 29 0.439 -19.176 -12.109 1.00 0.00 C ATOM 463 O ALA A 29 0.727 -20.155 -11.422 1.00 0.00 O ATOM 464 CB ALA A 29 1.852 -17.136 -11.607 1.00 0.00 C ATOM 0 H ALA A 29 0.847 -17.921 -9.423 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.258 -17.144 -12.018 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.134 -17.080 -12.658 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.834 -16.132 -11.182 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.578 -17.745 -11.068 1.00 0.00 H new ATOM 470 N ASP A 30 0.125 -19.252 -13.415 1.00 0.00 N ATOM 471 CA ASP A 30 0.069 -20.527 -14.183 1.00 0.00 C ATOM 472 C ASP A 30 1.420 -21.284 -14.148 1.00 0.00 C ATOM 473 O ASP A 30 1.457 -22.514 -14.172 1.00 0.00 O ATOM 474 CB ASP A 30 -0.348 -20.228 -15.651 1.00 0.00 C ATOM 475 CG ASP A 30 -0.304 -21.452 -16.597 1.00 0.00 C ATOM 476 OD1 ASP A 30 -1.110 -22.393 -16.409 1.00 0.00 O ATOM 477 OD2 ASP A 30 0.537 -21.480 -17.529 1.00 0.00 O ATOM 0 H ASP A 30 -0.100 -18.431 -13.978 1.00 0.00 H new ATOM 0 HA ASP A 30 -0.673 -21.174 -13.714 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.359 -19.821 -15.652 1.00 0.00 H new ATOM 0 HB3 ASP A 30 0.307 -19.454 -16.050 1.00 0.00 H new ATOM 482 N ASP A 31 2.513 -20.521 -14.062 1.00 0.00 N ATOM 483 CA ASP A 31 3.895 -21.047 -14.103 1.00 0.00 C ATOM 484 C ASP A 31 4.533 -21.089 -12.697 1.00 0.00 C ATOM 485 O ASP A 31 5.762 -21.177 -12.575 1.00 0.00 O ATOM 486 CB ASP A 31 4.731 -20.152 -15.061 1.00 0.00 C ATOM 487 CG ASP A 31 4.185 -20.142 -16.505 1.00 0.00 C ATOM 488 OD1 ASP A 31 3.212 -19.399 -16.783 1.00 0.00 O ATOM 489 OD2 ASP A 31 4.718 -20.876 -17.367 1.00 0.00 O ATOM 0 H ASP A 31 2.471 -19.507 -13.961 1.00 0.00 H new ATOM 0 HA ASP A 31 3.876 -22.074 -14.469 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.746 -19.132 -14.677 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.763 -20.504 -15.071 1.00 0.00 H new ATOM 494 N CYS A 32 3.691 -21.052 -11.641 1.00 0.00 N ATOM 495 CA CYS A 32 4.162 -20.941 -10.242 1.00 0.00 C ATOM 496 C CYS A 32 4.992 -22.164 -9.794 1.00 0.00 C ATOM 497 O CYS A 32 4.587 -23.309 -9.998 1.00 0.00 O ATOM 498 CB CYS A 32 2.985 -20.734 -9.281 1.00 0.00 C ATOM 499 SG CYS A 32 3.484 -20.578 -7.546 1.00 0.00 S ATOM 0 H CYS A 32 2.676 -21.098 -11.732 1.00 0.00 H new ATOM 0 HA CYS A 32 4.815 -20.069 -10.208 1.00 0.00 H new ATOM 0 HB2 CYS A 32 2.440 -19.837 -9.576 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.296 -21.573 -9.378 1.00 0.00 H new ATOM 0 HG CYS A 32 2.604 -21.161 -6.787 1.00 0.00 H new ATOM 505 N GLN A 33 6.155 -21.898 -9.172 1.00 0.00 N ATOM 506 CA GLN A 33 7.105 -22.939 -8.735 1.00 0.00 C ATOM 507 C GLN A 33 6.968 -23.184 -7.216 1.00 0.00 C ATOM 508 O GLN A 33 7.415 -22.366 -6.409 1.00 0.00 O ATOM 509 CB GLN A 33 8.549 -22.502 -9.085 1.00 0.00 C ATOM 510 CG GLN A 33 8.806 -22.237 -10.580 1.00 0.00 C ATOM 511 CD GLN A 33 8.673 -23.477 -11.465 1.00 0.00 C ATOM 512 OE1 GLN A 33 9.621 -24.246 -11.618 1.00 0.00 O ATOM 513 NE2 GLN A 33 7.513 -23.657 -12.080 1.00 0.00 N ATOM 0 H GLN A 33 6.464 -20.950 -8.957 1.00 0.00 H new ATOM 0 HA GLN A 33 6.880 -23.871 -9.253 1.00 0.00 H new ATOM 0 HB2 GLN A 33 8.784 -21.596 -8.526 1.00 0.00 H new ATOM 0 HB3 GLN A 33 9.239 -23.275 -8.745 1.00 0.00 H new ATOM 0 HG2 GLN A 33 8.106 -21.478 -10.929 1.00 0.00 H new ATOM 0 HG3 GLN A 33 9.808 -21.825 -10.698 1.00 0.00 H new ATOM 0 HE21 GLN A 33 6.748 -22.999 -11.929 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.385 -24.454 -12.704 1.00 0.00 H new ATOM 522 N TYR A 34 6.344 -24.311 -6.847 1.00 0.00 N ATOM 523 CA TYR A 34 6.090 -24.690 -5.445 1.00 0.00 C ATOM 524 C TYR A 34 7.186 -25.650 -4.945 1.00 0.00 C ATOM 525 O TYR A 34 7.292 -26.792 -5.417 1.00 0.00 O ATOM 526 CB TYR A 34 4.691 -25.345 -5.330 1.00 0.00 C ATOM 527 CG TYR A 34 4.194 -25.574 -3.895 1.00 0.00 C ATOM 528 CD1 TYR A 34 3.714 -24.509 -3.130 1.00 0.00 C ATOM 529 CD2 TYR A 34 4.193 -26.848 -3.310 1.00 0.00 C ATOM 530 CE1 TYR A 34 3.255 -24.697 -1.844 1.00 0.00 C ATOM 531 CE2 TYR A 34 3.734 -27.038 -2.018 1.00 0.00 C ATOM 532 CZ TYR A 34 3.267 -25.962 -1.292 1.00 0.00 C ATOM 533 OH TYR A 34 2.791 -26.150 -0.008 1.00 0.00 O ATOM 0 H TYR A 34 5.996 -24.995 -7.519 1.00 0.00 H new ATOM 0 HA TYR A 34 6.112 -23.797 -4.820 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.969 -24.717 -5.852 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.712 -26.304 -5.848 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.702 -23.516 -3.555 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.556 -27.694 -3.876 1.00 0.00 H new ATOM 0 HE1 TYR A 34 2.888 -23.858 -1.271 1.00 0.00 H new ATOM 0 HE2 TYR A 34 3.741 -28.025 -1.580 1.00 0.00 H new ATOM 0 HH TYR A 34 1.811 -26.122 -0.015 1.00 0.00 H new ATOM 543 N TYR A 35 8.001 -25.162 -3.996 1.00 0.00 N ATOM 544 CA TYR A 35 9.087 -25.923 -3.370 1.00 0.00 C ATOM 545 C TYR A 35 8.769 -26.249 -1.903 1.00 0.00 C ATOM 546 O TYR A 35 8.008 -25.543 -1.231 1.00 0.00 O ATOM 547 CB TYR A 35 10.412 -25.125 -3.413 1.00 0.00 C ATOM 548 CG TYR A 35 10.913 -24.770 -4.818 1.00 0.00 C ATOM 549 CD1 TYR A 35 10.514 -23.595 -5.455 1.00 0.00 C ATOM 550 CD2 TYR A 35 11.786 -25.611 -5.504 1.00 0.00 C ATOM 551 CE1 TYR A 35 10.968 -23.277 -6.714 1.00 0.00 C ATOM 552 CE2 TYR A 35 12.240 -25.297 -6.766 1.00 0.00 C ATOM 553 CZ TYR A 35 11.828 -24.127 -7.367 1.00 0.00 C ATOM 554 OH TYR A 35 12.271 -23.812 -8.627 1.00 0.00 O ATOM 0 H TYR A 35 7.920 -24.210 -3.638 1.00 0.00 H new ATOM 0 HA TYR A 35 9.190 -26.850 -3.934 1.00 0.00 H new ATOM 0 HB2 TYR A 35 10.281 -24.203 -2.847 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.183 -25.704 -2.905 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.836 -22.922 -4.950 1.00 0.00 H new ATOM 0 HD2 TYR A 35 12.114 -26.528 -5.037 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.649 -22.361 -7.189 1.00 0.00 H new ATOM 0 HE2 TYR A 35 12.915 -25.964 -7.282 1.00 0.00 H new ATOM 0 HH TYR A 35 12.873 -24.516 -8.948 1.00 0.00 H new ATOM 564 N ALA A 36 9.376 -27.347 -1.447 1.00 0.00 N ATOM 565 CA ALA A 36 9.481 -27.708 -0.035 1.00 0.00 C ATOM 566 C ALA A 36 10.902 -27.357 0.433 1.00 0.00 C ATOM 567 O ALA A 36 11.838 -27.371 -0.369 1.00 0.00 O ATOM 568 CB ALA A 36 9.183 -29.205 0.144 1.00 0.00 C ATOM 0 H ALA A 36 9.819 -28.026 -2.067 1.00 0.00 H new ATOM 0 HA ALA A 36 8.756 -27.159 0.565 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.263 -29.468 1.199 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.174 -29.420 -0.208 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.900 -29.790 -0.431 1.00 0.00 H new ATOM 574 N PHE A 37 11.034 -27.039 1.720 1.00 0.00 N ATOM 575 CA PHE A 37 12.296 -26.590 2.354 1.00 0.00 C ATOM 576 C PHE A 37 13.522 -27.515 2.061 1.00 0.00 C ATOM 577 O PHE A 37 13.416 -28.735 2.229 1.00 0.00 O ATOM 578 CB PHE A 37 12.082 -26.458 3.887 1.00 0.00 C ATOM 579 CG PHE A 37 11.525 -27.704 4.598 1.00 0.00 C ATOM 580 CD1 PHE A 37 10.170 -28.044 4.506 1.00 0.00 C ATOM 581 CD2 PHE A 37 12.346 -28.517 5.375 1.00 0.00 C ATOM 582 CE1 PHE A 37 9.661 -29.147 5.162 1.00 0.00 C ATOM 583 CE2 PHE A 37 11.836 -29.625 6.030 1.00 0.00 C ATOM 584 CZ PHE A 37 10.495 -29.938 5.924 1.00 0.00 C ATOM 0 H PHE A 37 10.254 -27.084 2.376 1.00 0.00 H new ATOM 0 HA PHE A 37 12.541 -25.625 1.911 1.00 0.00 H new ATOM 0 HB2 PHE A 37 13.036 -26.197 4.346 1.00 0.00 H new ATOM 0 HB3 PHE A 37 11.402 -25.625 4.069 1.00 0.00 H new ATOM 0 HD1 PHE A 37 9.510 -27.431 3.910 1.00 0.00 H new ATOM 0 HD2 PHE A 37 13.396 -28.280 5.468 1.00 0.00 H new ATOM 0 HE1 PHE A 37 8.612 -29.390 5.079 1.00 0.00 H new ATOM 0 HE2 PHE A 37 12.489 -30.246 6.625 1.00 0.00 H new ATOM 0 HZ PHE A 37 10.100 -30.802 6.438 1.00 0.00 H new ATOM 594 N PRO A 38 14.699 -26.962 1.584 1.00 0.00 N ATOM 595 CA PRO A 38 14.853 -25.551 1.128 1.00 0.00 C ATOM 596 C PRO A 38 14.311 -25.313 -0.310 1.00 0.00 C ATOM 597 O PRO A 38 13.712 -24.265 -0.593 1.00 0.00 O ATOM 598 CB PRO A 38 16.388 -25.337 1.187 1.00 0.00 C ATOM 599 CG PRO A 38 16.959 -26.690 0.881 1.00 0.00 C ATOM 600 CD PRO A 38 16.005 -27.687 1.524 1.00 0.00 C ATOM 0 HA PRO A 38 14.283 -24.856 1.744 1.00 0.00 H new ATOM 0 HB2 PRO A 38 16.715 -24.593 0.461 1.00 0.00 H new ATOM 0 HB3 PRO A 38 16.704 -24.984 2.169 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.030 -26.852 -0.195 1.00 0.00 H new ATOM 0 HG3 PRO A 38 17.966 -26.792 1.286 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.926 -28.600 0.934 1.00 0.00 H new ATOM 0 HD3 PRO A 38 16.344 -27.978 2.518 1.00 0.00 H new ATOM 608 N ALA A 39 14.499 -26.312 -1.195 1.00 0.00 N ATOM 609 CA ALA A 39 14.149 -26.211 -2.620 1.00 0.00 C ATOM 610 C ALA A 39 13.919 -27.616 -3.201 1.00 0.00 C ATOM 611 O ALA A 39 14.829 -28.220 -3.778 1.00 0.00 O ATOM 612 CB ALA A 39 15.235 -25.442 -3.403 1.00 0.00 C ATOM 0 H ALA A 39 14.900 -27.214 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 39 13.223 -25.645 -2.718 1.00 0.00 H new ATOM 0 HB1 ALA A 39 14.952 -25.382 -4.454 1.00 0.00 H new ATOM 0 HB2 ALA A 39 15.334 -24.436 -2.995 1.00 0.00 H new ATOM 0 HB3 ALA A 39 16.187 -25.965 -3.313 1.00 0.00 H new ATOM 618 N THR A 40 12.713 -28.146 -2.975 1.00 0.00 N ATOM 619 CA THR A 40 12.262 -29.430 -3.526 1.00 0.00 C ATOM 620 C THR A 40 10.995 -29.171 -4.352 1.00 0.00 C ATOM 621 O THR A 40 9.914 -29.019 -3.780 1.00 0.00 O ATOM 622 CB THR A 40 11.962 -30.460 -2.379 1.00 0.00 C ATOM 623 OG1 THR A 40 13.105 -30.594 -1.521 1.00 0.00 O ATOM 624 CG2 THR A 40 11.570 -31.842 -2.931 1.00 0.00 C ATOM 0 H THR A 40 12.010 -27.688 -2.395 1.00 0.00 H new ATOM 0 HA THR A 40 13.045 -29.858 -4.152 1.00 0.00 H new ATOM 0 HB THR A 40 11.116 -30.072 -1.812 1.00 0.00 H new ATOM 0 HG1 THR A 40 12.906 -31.237 -0.809 1.00 0.00 H new ATOM 0 HG21 THR A 40 11.372 -32.522 -2.102 1.00 0.00 H new ATOM 0 HG22 THR A 40 10.675 -31.748 -3.545 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.386 -32.237 -3.537 1.00 0.00 H new ATOM 632 N LEU A 41 11.133 -29.092 -5.689 1.00 0.00 N ATOM 633 CA LEU A 41 10.023 -28.699 -6.579 1.00 0.00 C ATOM 634 C LEU A 41 8.984 -29.830 -6.639 1.00 0.00 C ATOM 635 O LEU A 41 9.187 -30.828 -7.340 1.00 0.00 O ATOM 636 CB LEU A 41 10.565 -28.354 -8.002 1.00 0.00 C ATOM 637 CG LEU A 41 9.540 -27.737 -9.013 1.00 0.00 C ATOM 638 CD1 LEU A 41 8.978 -26.391 -8.501 1.00 0.00 C ATOM 639 CD2 LEU A 41 10.168 -27.580 -10.423 1.00 0.00 C ATOM 0 H LEU A 41 12.005 -29.296 -6.178 1.00 0.00 H new ATOM 0 HA LEU A 41 9.539 -27.806 -6.182 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.395 -27.657 -7.890 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.971 -29.265 -8.442 1.00 0.00 H new ATOM 0 HG LEU A 41 8.704 -28.432 -9.095 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.270 -25.992 -9.228 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.471 -26.547 -7.549 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.796 -25.683 -8.365 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.433 -27.149 -11.103 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.036 -26.923 -10.364 1.00 0.00 H new ATOM 0 HD23 LEU A 41 10.477 -28.557 -10.794 1.00 0.00 H new ATOM 651 N LEU A 42 7.876 -29.677 -5.882 1.00 0.00 N ATOM 652 CA LEU A 42 6.764 -30.646 -5.909 1.00 0.00 C ATOM 653 C LEU A 42 5.958 -30.396 -7.177 1.00 0.00 C ATOM 654 O LEU A 42 5.625 -31.323 -7.926 1.00 0.00 O ATOM 655 CB LEU A 42 5.804 -30.537 -4.678 1.00 0.00 C ATOM 656 CG LEU A 42 6.425 -30.614 -3.248 1.00 0.00 C ATOM 657 CD1 LEU A 42 7.544 -31.669 -3.145 1.00 0.00 C ATOM 658 CD2 LEU A 42 6.889 -29.231 -2.761 1.00 0.00 C ATOM 0 H LEU A 42 7.730 -28.893 -5.247 1.00 0.00 H new ATOM 0 HA LEU A 42 7.200 -31.645 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.267 -29.592 -4.757 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.063 -31.332 -4.762 1.00 0.00 H new ATOM 0 HG LEU A 42 5.632 -30.946 -2.578 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.941 -31.681 -2.130 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.141 -32.652 -3.388 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.343 -31.421 -3.844 1.00 0.00 H new ATOM 0 HD21 LEU A 42 7.316 -29.321 -1.762 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.643 -28.839 -3.444 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.037 -28.551 -2.731 1.00 0.00 H new ATOM 670 N ALA A 43 5.701 -29.106 -7.418 1.00 0.00 N ATOM 671 CA ALA A 43 4.815 -28.646 -8.486 1.00 0.00 C ATOM 672 C ALA A 43 5.459 -27.499 -9.278 1.00 0.00 C ATOM 673 O ALA A 43 5.686 -26.423 -8.728 1.00 0.00 O ATOM 674 CB ALA A 43 3.508 -28.207 -7.834 1.00 0.00 C ATOM 0 H ALA A 43 6.107 -28.347 -6.871 1.00 0.00 H new ATOM 0 HA ALA A 43 4.627 -29.447 -9.201 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.818 -27.856 -8.602 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.064 -29.050 -7.306 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.706 -27.400 -7.128 1.00 0.00 H new ATOM 680 N GLY A 44 5.734 -27.734 -10.574 1.00 0.00 N ATOM 681 CA GLY A 44 6.398 -26.745 -11.439 1.00 0.00 C ATOM 682 C GLY A 44 5.425 -25.997 -12.339 1.00 0.00 C ATOM 683 O GLY A 44 5.713 -25.798 -13.527 1.00 0.00 O ATOM 0 H GLY A 44 5.504 -28.608 -11.047 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.934 -26.028 -10.817 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.141 -27.250 -12.056 1.00 0.00 H new ATOM 687 N ASN A 45 4.308 -25.545 -11.729 1.00 0.00 N ATOM 688 CA ASN A 45 3.124 -24.916 -12.393 1.00 0.00 C ATOM 689 C ASN A 45 1.913 -25.005 -11.438 1.00 0.00 C ATOM 690 O ASN A 45 1.881 -25.872 -10.555 1.00 0.00 O ATOM 691 CB ASN A 45 2.737 -25.542 -13.773 1.00 0.00 C ATOM 692 CG ASN A 45 2.307 -27.006 -13.693 1.00 0.00 C ATOM 693 OD1 ASN A 45 1.135 -27.318 -13.497 1.00 0.00 O ATOM 694 ND2 ASN A 45 3.253 -27.914 -13.855 1.00 0.00 N ATOM 0 H ASN A 45 4.192 -25.607 -10.717 1.00 0.00 H new ATOM 0 HA ASN A 45 3.406 -23.884 -12.604 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.926 -24.959 -14.210 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.588 -25.461 -14.449 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.019 -28.906 -13.819 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.217 -27.623 -14.016 1.00 0.00 H new ATOM 701 N ALA A 46 0.898 -24.150 -11.674 1.00 0.00 N ATOM 702 CA ALA A 46 -0.270 -23.982 -10.772 1.00 0.00 C ATOM 703 C ALA A 46 -1.174 -25.232 -10.710 1.00 0.00 C ATOM 704 O ALA A 46 -1.780 -25.504 -9.668 1.00 0.00 O ATOM 705 CB ALA A 46 -1.090 -22.754 -11.200 1.00 0.00 C ATOM 0 H ALA A 46 0.861 -23.551 -12.499 1.00 0.00 H new ATOM 0 HA ALA A 46 0.125 -23.835 -9.767 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.945 -22.637 -10.534 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.465 -21.863 -11.148 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.443 -22.890 -12.222 1.00 0.00 H new ATOM 711 N ALA A 47 -1.254 -25.985 -11.822 1.00 0.00 N ATOM 712 CA ALA A 47 -2.142 -27.169 -11.938 1.00 0.00 C ATOM 713 C ALA A 47 -1.763 -28.249 -10.914 1.00 0.00 C ATOM 714 O ALA A 47 -2.630 -28.832 -10.248 1.00 0.00 O ATOM 715 CB ALA A 47 -2.082 -27.743 -13.363 1.00 0.00 C ATOM 0 H ALA A 47 -0.710 -25.796 -12.664 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.162 -26.847 -11.728 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.738 -28.611 -13.434 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.406 -26.984 -14.075 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.059 -28.042 -13.592 1.00 0.00 H new ATOM 721 N GLU A 48 -0.447 -28.482 -10.790 1.00 0.00 N ATOM 722 CA GLU A 48 0.112 -29.487 -9.874 1.00 0.00 C ATOM 723 C GLU A 48 0.058 -28.992 -8.408 1.00 0.00 C ATOM 724 O GLU A 48 -0.074 -29.796 -7.481 1.00 0.00 O ATOM 725 CB GLU A 48 1.560 -29.839 -10.279 1.00 0.00 C ATOM 726 CG GLU A 48 1.740 -30.248 -11.750 1.00 0.00 C ATOM 727 CD GLU A 48 3.143 -30.809 -12.034 1.00 0.00 C ATOM 728 OE1 GLU A 48 4.116 -30.024 -12.015 1.00 0.00 O ATOM 729 OE2 GLU A 48 3.284 -32.039 -12.237 1.00 0.00 O ATOM 0 H GLU A 48 0.261 -27.977 -11.324 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.496 -30.389 -9.946 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.198 -28.979 -10.076 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.911 -30.653 -9.645 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.992 -30.997 -12.010 1.00 0.00 H new ATOM 0 HG3 GLU A 48 1.561 -29.384 -12.389 1.00 0.00 H new ATOM 736 N ILE A 49 0.159 -27.662 -8.221 1.00 0.00 N ATOM 737 CA ILE A 49 0.046 -27.009 -6.890 1.00 0.00 C ATOM 738 C ILE A 49 -1.351 -27.237 -6.308 1.00 0.00 C ATOM 739 O ILE A 49 -1.507 -27.579 -5.126 1.00 0.00 O ATOM 740 CB ILE A 49 0.316 -25.462 -7.009 1.00 0.00 C ATOM 741 CG1 ILE A 49 1.777 -25.212 -7.467 1.00 0.00 C ATOM 742 CG2 ILE A 49 0.007 -24.711 -5.692 1.00 0.00 C ATOM 743 CD1 ILE A 49 2.150 -23.769 -7.701 1.00 0.00 C ATOM 0 H ILE A 49 0.321 -27.005 -8.984 1.00 0.00 H new ATOM 0 HA ILE A 49 0.791 -27.451 -6.229 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.364 -25.062 -7.761 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.450 -25.625 -6.716 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.950 -25.767 -8.389 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.208 -23.648 -5.823 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.042 -24.852 -5.430 1.00 0.00 H new ATOM 0 HG23 ILE A 49 0.636 -25.103 -4.893 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.191 -23.709 -8.017 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.510 -23.349 -8.477 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.018 -23.205 -6.778 1.00 0.00 H new ATOM 755 N ARG A 50 -2.344 -27.043 -7.179 1.00 0.00 N ATOM 756 CA ARG A 50 -3.759 -27.158 -6.844 1.00 0.00 C ATOM 757 C ARG A 50 -4.078 -28.556 -6.334 1.00 0.00 C ATOM 758 O ARG A 50 -4.562 -28.712 -5.217 1.00 0.00 O ATOM 759 CB ARG A 50 -4.591 -26.865 -8.107 1.00 0.00 C ATOM 760 CG ARG A 50 -6.110 -26.869 -7.897 1.00 0.00 C ATOM 761 CD ARG A 50 -6.870 -26.511 -9.176 1.00 0.00 C ATOM 762 NE ARG A 50 -8.327 -26.478 -8.953 1.00 0.00 N ATOM 763 CZ ARG A 50 -9.159 -25.466 -9.258 1.00 0.00 C ATOM 764 NH1 ARG A 50 -8.708 -24.339 -9.802 1.00 0.00 N ATOM 765 NH2 ARG A 50 -10.451 -25.604 -9.021 1.00 0.00 N ATOM 0 H ARG A 50 -2.180 -26.797 -8.155 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.002 -26.443 -6.058 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.296 -25.892 -8.501 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.342 -27.605 -8.868 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.425 -27.854 -7.553 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.369 -26.159 -7.112 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.535 -25.539 -9.538 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.637 -27.239 -9.954 1.00 0.00 H new ATOM 0 HE ARG A 50 -8.745 -27.304 -8.525 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -7.713 -24.229 -9.996 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.357 -23.585 -10.025 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -10.805 -26.469 -8.612 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -11.095 -24.846 -9.247 1.00 0.00 H new ATOM 779 N VAL A 51 -3.734 -29.558 -7.162 1.00 0.00 N ATOM 780 CA VAL A 51 -4.038 -30.972 -6.882 1.00 0.00 C ATOM 781 C VAL A 51 -3.277 -31.515 -5.663 1.00 0.00 C ATOM 782 O VAL A 51 -3.818 -32.332 -4.920 1.00 0.00 O ATOM 783 CB VAL A 51 -3.790 -31.902 -8.123 1.00 0.00 C ATOM 784 CG1 VAL A 51 -4.695 -31.493 -9.311 1.00 0.00 C ATOM 785 CG2 VAL A 51 -2.305 -31.928 -8.545 1.00 0.00 C ATOM 0 H VAL A 51 -3.239 -29.411 -8.042 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.103 -30.990 -6.651 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.055 -32.915 -7.821 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.504 -32.152 -10.158 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.741 -31.575 -9.016 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -4.478 -30.464 -9.596 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -2.183 -32.584 -9.407 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.984 -30.920 -8.808 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.698 -32.298 -7.718 1.00 0.00 H new ATOM 795 N ARG A 52 -2.038 -31.043 -5.450 1.00 0.00 N ATOM 796 CA ARG A 52 -1.214 -31.483 -4.312 1.00 0.00 C ATOM 797 C ARG A 52 -1.772 -30.914 -2.990 1.00 0.00 C ATOM 798 O ARG A 52 -1.682 -31.553 -1.933 1.00 0.00 O ATOM 799 CB ARG A 52 0.265 -31.066 -4.517 1.00 0.00 C ATOM 800 CG ARG A 52 1.236 -31.594 -3.429 1.00 0.00 C ATOM 801 CD ARG A 52 1.255 -33.139 -3.367 1.00 0.00 C ATOM 802 NE ARG A 52 2.049 -33.656 -2.235 1.00 0.00 N ATOM 803 CZ ARG A 52 1.904 -34.877 -1.682 1.00 0.00 C ATOM 804 NH1 ARG A 52 1.008 -35.743 -2.154 1.00 0.00 N ATOM 805 NH2 ARG A 52 2.661 -35.224 -0.653 1.00 0.00 N ATOM 0 H ARG A 52 -1.584 -30.356 -6.052 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.252 -32.571 -4.255 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.599 -31.425 -5.490 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.323 -29.978 -4.541 1.00 0.00 H new ATOM 0 HG2 ARG A 52 2.242 -31.227 -3.633 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.942 -31.196 -2.458 1.00 0.00 H new ATOM 0 HD2 ARG A 52 0.232 -33.507 -3.286 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.662 -33.531 -4.299 1.00 0.00 H new ATOM 0 HE ARG A 52 2.762 -33.042 -1.841 1.00 0.00 H new ATOM 0 HH11 ARG A 52 0.419 -35.486 -2.946 1.00 0.00 H new ATOM 0 HH12 ARG A 52 0.912 -36.663 -1.723 1.00 0.00 H new ATOM 0 HH21 ARG A 52 3.350 -34.569 -0.283 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.556 -36.146 -0.231 1.00 0.00 H new ATOM 819 N HIS A 53 -2.349 -29.703 -3.061 1.00 0.00 N ATOM 820 CA HIS A 53 -3.052 -29.095 -1.915 1.00 0.00 C ATOM 821 C HIS A 53 -4.417 -29.763 -1.708 1.00 0.00 C ATOM 822 O HIS A 53 -4.842 -29.924 -0.578 1.00 0.00 O ATOM 823 CB HIS A 53 -3.192 -27.566 -2.084 1.00 0.00 C ATOM 824 CG HIS A 53 -1.905 -26.816 -1.852 1.00 0.00 C ATOM 825 ND1 HIS A 53 -1.381 -25.904 -2.745 1.00 0.00 N ATOM 826 CD2 HIS A 53 -1.063 -26.814 -0.784 1.00 0.00 C ATOM 827 CE1 HIS A 53 -0.281 -25.376 -2.238 1.00 0.00 C ATOM 828 NE2 HIS A 53 -0.068 -25.910 -1.053 1.00 0.00 N ATOM 0 H HIS A 53 -2.343 -29.124 -3.900 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.452 -29.264 -1.021 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.553 -27.351 -3.090 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -3.948 -27.199 -1.389 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -1.781 -25.673 -3.655 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -1.160 -27.413 0.109 1.00 0.00 H new ATOM 0 HE1 HIS A 53 0.339 -24.632 -2.715 1.00 0.00 H new ATOM 837 N ILE A 54 -5.065 -30.184 -2.807 1.00 0.00 N ATOM 838 CA ILE A 54 -6.321 -30.959 -2.773 1.00 0.00 C ATOM 839 C ILE A 54 -6.135 -32.246 -1.924 1.00 0.00 C ATOM 840 O ILE A 54 -7.017 -32.599 -1.136 1.00 0.00 O ATOM 841 CB ILE A 54 -6.801 -31.285 -4.252 1.00 0.00 C ATOM 842 CG1 ILE A 54 -7.458 -30.033 -4.927 1.00 0.00 C ATOM 843 CG2 ILE A 54 -7.729 -32.509 -4.328 1.00 0.00 C ATOM 844 CD1 ILE A 54 -7.745 -30.179 -6.415 1.00 0.00 C ATOM 0 H ILE A 54 -4.731 -29.996 -3.752 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.101 -30.365 -2.298 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.903 -31.545 -4.813 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.393 -29.811 -4.412 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.802 -29.175 -4.782 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.022 -32.680 -5.364 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.205 -33.387 -3.950 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.619 -32.329 -3.724 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.199 -29.261 -6.790 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -6.813 -30.367 -6.948 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.429 -31.013 -6.574 1.00 0.00 H new ATOM 856 N GLU A 55 -4.953 -32.893 -2.063 1.00 0.00 N ATOM 857 CA GLU A 55 -4.569 -34.074 -1.257 1.00 0.00 C ATOM 858 C GLU A 55 -4.566 -33.742 0.248 1.00 0.00 C ATOM 859 O GLU A 55 -5.120 -34.483 1.065 1.00 0.00 O ATOM 860 CB GLU A 55 -3.165 -34.588 -1.676 1.00 0.00 C ATOM 861 CG GLU A 55 -3.001 -34.843 -3.184 1.00 0.00 C ATOM 862 CD GLU A 55 -4.045 -35.813 -3.757 1.00 0.00 C ATOM 863 OE1 GLU A 55 -4.032 -37.010 -3.371 1.00 0.00 O ATOM 864 OE2 GLU A 55 -4.880 -35.392 -4.587 1.00 0.00 O ATOM 0 H GLU A 55 -4.241 -32.610 -2.736 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.308 -34.853 -1.442 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.417 -33.861 -1.360 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -2.956 -35.513 -1.139 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -3.069 -33.893 -3.715 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -2.004 -35.242 -3.371 1.00 0.00 H new ATOM 871 N ARG A 56 -3.946 -32.605 0.587 1.00 0.00 N ATOM 872 CA ARG A 56 -3.852 -32.112 1.975 1.00 0.00 C ATOM 873 C ARG A 56 -5.258 -31.730 2.514 1.00 0.00 C ATOM 874 O ARG A 56 -5.535 -31.874 3.708 1.00 0.00 O ATOM 875 CB ARG A 56 -2.848 -30.919 2.016 1.00 0.00 C ATOM 876 CG ARG A 56 -2.587 -30.284 3.404 1.00 0.00 C ATOM 877 CD ARG A 56 -2.107 -31.288 4.477 1.00 0.00 C ATOM 878 NE ARG A 56 -0.911 -32.052 4.062 1.00 0.00 N ATOM 879 CZ ARG A 56 0.348 -31.834 4.486 1.00 0.00 C ATOM 880 NH1 ARG A 56 0.638 -30.824 5.299 1.00 0.00 N ATOM 881 NH2 ARG A 56 1.328 -32.624 4.075 1.00 0.00 N ATOM 0 H ARG A 56 -3.492 -31.995 -0.093 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.475 -32.896 2.632 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -1.895 -31.261 1.612 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -3.216 -30.140 1.348 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.840 -29.498 3.297 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.504 -29.807 3.752 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -1.885 -30.748 5.398 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -2.915 -31.984 4.703 1.00 0.00 H new ATOM 0 HE ARG A 56 -1.052 -32.811 3.396 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -0.100 -30.195 5.614 1.00 0.00 H new ATOM 0 HH12 ARG A 56 1.599 -30.678 5.608 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.128 -33.396 3.439 1.00 0.00 H new ATOM 0 HH22 ARG A 56 2.283 -32.461 4.395 1.00 0.00 H new ATOM 895 N PHE A 57 -6.143 -31.294 1.599 1.00 0.00 N ATOM 896 CA PHE A 57 -7.538 -30.903 1.917 1.00 0.00 C ATOM 897 C PHE A 57 -8.472 -32.144 2.025 1.00 0.00 C ATOM 898 O PHE A 57 -9.620 -32.009 2.462 1.00 0.00 O ATOM 899 CB PHE A 57 -8.080 -29.894 0.850 1.00 0.00 C ATOM 900 CG PHE A 57 -7.523 -28.455 0.907 1.00 0.00 C ATOM 901 CD1 PHE A 57 -6.222 -28.177 1.328 1.00 0.00 C ATOM 902 CD2 PHE A 57 -8.313 -27.378 0.513 1.00 0.00 C ATOM 903 CE1 PHE A 57 -5.740 -26.883 1.354 1.00 0.00 C ATOM 904 CE2 PHE A 57 -7.826 -26.081 0.539 1.00 0.00 C ATOM 905 CZ PHE A 57 -6.544 -25.835 0.957 1.00 0.00 C ATOM 0 H PHE A 57 -5.913 -31.201 0.610 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.531 -30.413 2.891 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.870 -30.301 -0.139 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.164 -29.843 0.950 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.580 -28.988 1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.325 -27.557 0.181 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.730 -26.691 1.686 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.458 -25.262 0.229 1.00 0.00 H new ATOM 0 HZ PHE A 57 -6.165 -24.824 0.975 1.00 0.00 H new ATOM 915 N LYS A 58 -7.988 -33.341 1.604 1.00 0.00 N ATOM 916 CA LYS A 58 -8.698 -34.627 1.844 1.00 0.00 C ATOM 917 C LYS A 58 -8.632 -35.036 3.324 1.00 0.00 C ATOM 918 O LYS A 58 -9.451 -35.838 3.793 1.00 0.00 O ATOM 919 CB LYS A 58 -8.103 -35.773 0.977 1.00 0.00 C ATOM 920 CG LYS A 58 -8.165 -35.527 -0.536 1.00 0.00 C ATOM 921 CD LYS A 58 -9.607 -35.287 -1.043 1.00 0.00 C ATOM 922 CE LYS A 58 -9.630 -34.818 -2.496 1.00 0.00 C ATOM 923 NZ LYS A 58 -11.002 -34.659 -3.028 1.00 0.00 N ATOM 0 H LYS A 58 -7.109 -33.443 1.097 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.739 -34.467 1.562 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -7.063 -35.926 1.265 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -8.636 -36.697 1.204 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -7.548 -34.664 -0.785 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.739 -36.384 -1.057 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -10.182 -36.208 -0.950 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.094 -34.542 -0.413 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.103 -33.867 -2.574 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.087 -35.535 -3.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.956 -34.339 -4.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -11.500 -35.571 -2.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.515 -33.955 -2.460 1.00 0.00 H new ATOM 937 N GLU A 59 -7.631 -34.504 4.036 1.00 0.00 N ATOM 938 CA GLU A 59 -7.361 -34.841 5.440 1.00 0.00 C ATOM 939 C GLU A 59 -8.303 -34.041 6.379 1.00 0.00 C ATOM 940 O GLU A 59 -8.244 -32.807 6.399 1.00 0.00 O ATOM 941 CB GLU A 59 -5.860 -34.578 5.738 1.00 0.00 C ATOM 942 CG GLU A 59 -4.916 -35.402 4.822 1.00 0.00 C ATOM 943 CD GLU A 59 -3.418 -35.171 5.076 1.00 0.00 C ATOM 944 OE1 GLU A 59 -2.911 -35.637 6.117 1.00 0.00 O ATOM 945 OE2 GLU A 59 -2.734 -34.552 4.225 1.00 0.00 O ATOM 0 H GLU A 59 -6.979 -33.821 3.650 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.564 -35.896 5.623 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -5.649 -33.516 5.610 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.652 -34.821 6.780 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -5.135 -36.461 4.956 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -5.137 -35.160 3.782 1.00 0.00 H new ATOM 952 N PRO A 60 -9.219 -34.739 7.145 1.00 0.00 N ATOM 953 CA PRO A 60 -10.253 -34.075 7.989 1.00 0.00 C ATOM 954 C PRO A 60 -9.665 -33.197 9.120 1.00 0.00 C ATOM 955 O PRO A 60 -10.265 -32.186 9.501 1.00 0.00 O ATOM 956 CB PRO A 60 -11.073 -35.268 8.563 1.00 0.00 C ATOM 957 CG PRO A 60 -10.141 -36.440 8.491 1.00 0.00 C ATOM 958 CD PRO A 60 -9.338 -36.226 7.231 1.00 0.00 C ATOM 0 HA PRO A 60 -10.850 -33.372 7.407 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -11.388 -35.075 9.588 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -11.977 -35.444 7.980 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -9.495 -36.484 9.368 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -10.692 -37.380 8.453 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -8.361 -36.705 7.291 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -9.842 -36.640 6.358 1.00 0.00 H new ATOM 966 N ASP A 61 -8.478 -33.578 9.619 1.00 0.00 N ATOM 967 CA ASP A 61 -7.818 -32.896 10.756 1.00 0.00 C ATOM 968 C ASP A 61 -6.955 -31.700 10.308 1.00 0.00 C ATOM 969 O ASP A 61 -6.293 -31.077 11.145 1.00 0.00 O ATOM 970 CB ASP A 61 -6.960 -33.905 11.568 1.00 0.00 C ATOM 971 CG ASP A 61 -7.812 -34.960 12.295 1.00 0.00 C ATOM 972 OD1 ASP A 61 -8.115 -36.020 11.700 1.00 0.00 O ATOM 973 OD2 ASP A 61 -8.192 -34.726 13.468 1.00 0.00 O ATOM 0 H ASP A 61 -7.945 -34.366 9.250 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.609 -32.499 11.392 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.264 -34.407 10.896 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -6.362 -33.361 12.299 1.00 0.00 H new ATOM 978 N LEU A 62 -6.964 -31.377 8.997 1.00 0.00 N ATOM 979 CA LEU A 62 -6.251 -30.203 8.478 1.00 0.00 C ATOM 980 C LEU A 62 -6.897 -28.899 8.990 1.00 0.00 C ATOM 981 O LEU A 62 -8.071 -28.619 8.704 1.00 0.00 O ATOM 982 CB LEU A 62 -6.229 -30.171 6.925 1.00 0.00 C ATOM 983 CG LEU A 62 -5.582 -28.885 6.305 1.00 0.00 C ATOM 984 CD1 LEU A 62 -4.073 -28.812 6.616 1.00 0.00 C ATOM 985 CD2 LEU A 62 -5.870 -28.769 4.794 1.00 0.00 C ATOM 0 H LEU A 62 -7.458 -31.915 8.285 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.226 -30.279 8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.685 -31.044 6.565 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.252 -30.259 6.559 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.051 -28.022 6.778 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.653 -27.909 6.172 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.925 -28.789 7.696 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.573 -29.687 6.200 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.404 -27.864 4.403 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.463 -29.639 4.278 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.947 -28.722 4.631 1.00 0.00 H new ATOM 997 N TYR A 63 -6.118 -28.119 9.744 1.00 0.00 N ATOM 998 CA TYR A 63 -6.467 -26.741 10.098 1.00 0.00 C ATOM 999 C TYR A 63 -5.178 -25.932 10.284 1.00 0.00 C ATOM 1000 O TYR A 63 -4.357 -26.261 11.143 1.00 0.00 O ATOM 1001 CB TYR A 63 -7.339 -26.693 11.383 1.00 0.00 C ATOM 1002 CG TYR A 63 -7.822 -25.277 11.739 1.00 0.00 C ATOM 1003 CD1 TYR A 63 -8.948 -24.728 11.121 1.00 0.00 C ATOM 1004 CD2 TYR A 63 -7.143 -24.481 12.671 1.00 0.00 C ATOM 1005 CE1 TYR A 63 -9.375 -23.449 11.416 1.00 0.00 C ATOM 1006 CE2 TYR A 63 -7.572 -23.204 12.971 1.00 0.00 C ATOM 1007 CZ TYR A 63 -8.685 -22.692 12.339 1.00 0.00 C ATOM 1008 OH TYR A 63 -9.108 -21.410 12.628 1.00 0.00 O ATOM 0 H TYR A 63 -5.224 -28.427 10.127 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.057 -26.305 9.292 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.205 -27.342 11.250 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.765 -27.094 12.218 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.495 -25.316 10.399 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.267 -24.875 13.164 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -10.247 -23.042 10.925 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.038 -22.609 13.697 1.00 0.00 H new ATOM 0 HH TYR A 63 -8.514 -21.013 13.299 1.00 0.00 H new ATOM 1018 N GLY A 64 -5.007 -24.884 9.464 1.00 0.00 N ATOM 1019 CA GLY A 64 -3.889 -23.960 9.606 1.00 0.00 C ATOM 1020 C GLY A 64 -4.282 -22.761 10.441 1.00 0.00 C ATOM 1021 O GLY A 64 -5.012 -21.883 9.961 1.00 0.00 O ATOM 0 H GLY A 64 -5.637 -24.661 8.693 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.046 -24.471 10.071 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.558 -23.630 8.621 1.00 0.00 H new ATOM 1025 N GLU A 65 -3.832 -22.736 11.703 1.00 0.00 N ATOM 1026 CA GLU A 65 -4.062 -21.600 12.603 1.00 0.00 C ATOM 1027 C GLU A 65 -2.913 -20.609 12.438 1.00 0.00 C ATOM 1028 O GLU A 65 -1.806 -20.901 12.874 1.00 0.00 O ATOM 1029 CB GLU A 65 -4.137 -22.064 14.085 1.00 0.00 C ATOM 1030 CG GLU A 65 -4.465 -20.922 15.082 1.00 0.00 C ATOM 1031 CD GLU A 65 -4.167 -21.268 16.554 1.00 0.00 C ATOM 1032 OE1 GLU A 65 -4.954 -22.014 17.172 1.00 0.00 O ATOM 1033 OE2 GLU A 65 -3.145 -20.785 17.101 1.00 0.00 O ATOM 0 H GLU A 65 -3.302 -23.498 12.126 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.013 -21.133 12.347 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -4.896 -22.841 14.175 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.184 -22.515 14.364 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.893 -20.037 14.805 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.519 -20.663 14.987 1.00 0.00 H new ATOM 1040 N LEU A 66 -3.162 -19.469 11.781 1.00 0.00 N ATOM 1041 CA LEU A 66 -2.145 -18.418 11.628 1.00 0.00 C ATOM 1042 C LEU A 66 -2.091 -17.583 12.911 1.00 0.00 C ATOM 1043 O LEU A 66 -3.127 -17.122 13.407 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.427 -17.547 10.368 1.00 0.00 C ATOM 1045 CG LEU A 66 -1.353 -16.444 10.005 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -1.266 -16.227 8.481 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -1.646 -15.099 10.708 1.00 0.00 C ATOM 0 H LEU A 66 -4.058 -19.250 11.347 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.167 -18.873 11.473 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.532 -18.213 9.512 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.388 -17.052 10.506 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.393 -16.815 10.364 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.519 -15.463 8.264 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.981 -17.161 7.996 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.236 -15.903 8.104 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.884 -14.370 10.431 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.626 -14.734 10.401 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.634 -15.243 11.788 1.00 0.00 H new ATOM 1059 N LEU A 67 -0.874 -17.418 13.453 1.00 0.00 N ATOM 1060 CA LEU A 67 -0.619 -16.620 14.673 1.00 0.00 C ATOM 1061 C LEU A 67 0.257 -15.383 14.358 1.00 0.00 C ATOM 1062 O LEU A 67 0.078 -14.312 14.950 1.00 0.00 O ATOM 1063 CB LEU A 67 -0.040 -17.497 15.856 1.00 0.00 C ATOM 1064 CG LEU A 67 0.944 -18.694 15.569 1.00 0.00 C ATOM 1065 CD1 LEU A 67 0.246 -19.897 14.926 1.00 0.00 C ATOM 1066 CD2 LEU A 67 2.181 -18.272 14.770 1.00 0.00 C ATOM 0 H LEU A 67 -0.031 -17.835 13.058 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.580 -16.247 15.028 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.473 -16.817 16.536 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.893 -17.907 16.397 1.00 0.00 H new ATOM 0 HG LEU A 67 1.296 -19.017 16.549 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.974 -20.690 14.752 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.536 -20.262 15.591 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.197 -19.596 13.977 1.00 0.00 H new ATOM 0 HD21 LEU A 67 2.820 -19.139 14.604 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.871 -17.861 13.809 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.733 -17.515 15.327 1.00 0.00 H new ATOM 1078 N THR A 68 1.194 -15.538 13.415 1.00 0.00 N ATOM 1079 CA THR A 68 2.087 -14.451 12.964 1.00 0.00 C ATOM 1080 C THR A 68 2.115 -14.408 11.422 1.00 0.00 C ATOM 1081 O THR A 68 2.110 -15.445 10.777 1.00 0.00 O ATOM 1082 CB THR A 68 3.542 -14.665 13.521 1.00 0.00 C ATOM 1083 OG1 THR A 68 3.498 -14.816 14.955 1.00 0.00 O ATOM 1084 CG2 THR A 68 4.496 -13.504 13.164 1.00 0.00 C ATOM 0 H THR A 68 1.359 -16.424 12.937 1.00 0.00 H new ATOM 0 HA THR A 68 1.707 -13.504 13.346 1.00 0.00 H new ATOM 0 HB THR A 68 3.932 -15.567 13.050 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.406 -14.951 15.298 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.485 -13.707 13.574 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.565 -13.410 12.080 1.00 0.00 H new ATOM 0 HG23 THR A 68 4.112 -12.575 13.585 1.00 0.00 H new ATOM 1092 N ARG A 69 2.094 -13.197 10.847 1.00 0.00 N ATOM 1093 CA ARG A 69 2.374 -12.973 9.418 1.00 0.00 C ATOM 1094 C ARG A 69 3.234 -11.713 9.276 1.00 0.00 C ATOM 1095 O ARG A 69 3.044 -10.738 10.012 1.00 0.00 O ATOM 1096 CB ARG A 69 1.063 -12.927 8.565 1.00 0.00 C ATOM 1097 CG ARG A 69 -0.085 -11.993 9.069 1.00 0.00 C ATOM 1098 CD ARG A 69 -0.168 -10.605 8.378 1.00 0.00 C ATOM 1099 NE ARG A 69 0.771 -9.621 8.950 1.00 0.00 N ATOM 1100 CZ ARG A 69 0.465 -8.713 9.900 1.00 0.00 C ATOM 1101 NH1 ARG A 69 -0.779 -8.577 10.350 1.00 0.00 N ATOM 1102 NH2 ARG A 69 1.415 -7.932 10.384 1.00 0.00 N ATOM 0 H ARG A 69 1.882 -12.341 11.360 1.00 0.00 H new ATOM 0 HA ARG A 69 2.936 -13.817 9.018 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.329 -12.620 7.553 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.668 -13.941 8.497 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -1.036 -12.507 8.929 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.039 -11.839 10.141 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.039 -10.722 7.314 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -1.185 -10.222 8.465 1.00 0.00 H new ATOM 0 HE ARG A 69 1.729 -9.628 8.599 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -1.524 -9.166 9.976 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.988 -7.884 11.069 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.371 -8.018 10.039 1.00 0.00 H new ATOM 0 HH22 ARG A 69 1.192 -7.243 11.102 1.00 0.00 H new ATOM 1116 N VAL A 70 4.229 -11.773 8.375 1.00 0.00 N ATOM 1117 CA VAL A 70 5.201 -10.690 8.139 1.00 0.00 C ATOM 1118 C VAL A 70 5.385 -10.491 6.623 1.00 0.00 C ATOM 1119 O VAL A 70 5.343 -11.463 5.865 1.00 0.00 O ATOM 1120 CB VAL A 70 6.602 -10.990 8.824 1.00 0.00 C ATOM 1121 CG1 VAL A 70 6.479 -11.061 10.366 1.00 0.00 C ATOM 1122 CG2 VAL A 70 7.246 -12.284 8.273 1.00 0.00 C ATOM 0 H VAL A 70 4.384 -12.587 7.781 1.00 0.00 H new ATOM 0 HA VAL A 70 4.808 -9.779 8.590 1.00 0.00 H new ATOM 0 HB VAL A 70 7.258 -10.156 8.574 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.457 -11.268 10.800 1.00 0.00 H new ATOM 0 HG12 VAL A 70 6.108 -10.109 10.746 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.785 -11.856 10.639 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.203 -12.453 8.767 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.585 -13.129 8.463 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.405 -12.183 7.199 1.00 0.00 H new ATOM 1132 N ILE A 71 5.590 -9.237 6.184 1.00 0.00 N ATOM 1133 CA ILE A 71 5.782 -8.910 4.750 1.00 0.00 C ATOM 1134 C ILE A 71 7.129 -8.184 4.525 1.00 0.00 C ATOM 1135 O ILE A 71 7.560 -7.364 5.340 1.00 0.00 O ATOM 1136 CB ILE A 71 4.576 -8.069 4.168 1.00 0.00 C ATOM 1137 CG1 ILE A 71 4.787 -7.766 2.644 1.00 0.00 C ATOM 1138 CG2 ILE A 71 4.334 -6.777 4.982 1.00 0.00 C ATOM 1139 CD1 ILE A 71 3.626 -7.077 1.959 1.00 0.00 C ATOM 0 H ILE A 71 5.628 -8.426 6.801 1.00 0.00 H new ATOM 0 HA ILE A 71 5.808 -9.852 4.203 1.00 0.00 H new ATOM 0 HB ILE A 71 3.674 -8.674 4.262 1.00 0.00 H new ATOM 0 HG12 ILE A 71 5.675 -7.144 2.533 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.988 -8.704 2.127 1.00 0.00 H new ATOM 0 HG21 ILE A 71 3.498 -6.227 4.551 1.00 0.00 H new ATOM 0 HG22 ILE A 71 4.104 -7.036 6.016 1.00 0.00 H new ATOM 0 HG23 ILE A 71 5.230 -6.156 4.954 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.869 -6.911 0.909 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.737 -7.704 2.031 1.00 0.00 H new ATOM 0 HD13 ILE A 71 3.435 -6.119 2.443 1.00 0.00 H new ATOM 1151 N VAL A 72 7.782 -8.529 3.408 1.00 0.00 N ATOM 1152 CA VAL A 72 9.051 -7.954 2.960 1.00 0.00 C ATOM 1153 C VAL A 72 9.014 -7.851 1.412 1.00 0.00 C ATOM 1154 O VAL A 72 9.200 -8.848 0.699 1.00 0.00 O ATOM 1155 CB VAL A 72 10.284 -8.799 3.490 1.00 0.00 C ATOM 1156 CG1 VAL A 72 10.091 -10.327 3.262 1.00 0.00 C ATOM 1157 CG2 VAL A 72 11.631 -8.294 2.895 1.00 0.00 C ATOM 0 H VAL A 72 7.426 -9.242 2.771 1.00 0.00 H new ATOM 0 HA VAL A 72 9.183 -6.955 3.375 1.00 0.00 H new ATOM 0 HB VAL A 72 10.329 -8.644 4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.961 -10.864 3.641 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.198 -10.664 3.789 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.979 -10.524 2.196 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.450 -8.899 3.283 1.00 0.00 H new ATOM 0 HG22 VAL A 72 11.602 -8.376 1.808 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.785 -7.252 3.176 1.00 0.00 H new ATOM 1167 N GLY A 73 8.685 -6.640 0.917 1.00 0.00 N ATOM 1168 CA GLY A 73 8.603 -6.365 -0.522 1.00 0.00 C ATOM 1169 C GLY A 73 7.487 -7.151 -1.225 1.00 0.00 C ATOM 1170 O GLY A 73 6.313 -7.040 -0.848 1.00 0.00 O ATOM 0 H GLY A 73 8.471 -5.834 1.504 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.438 -5.298 -0.673 1.00 0.00 H new ATOM 0 HA3 GLY A 73 9.558 -6.608 -0.987 1.00 0.00 H new ATOM 1174 N ASN A 74 7.871 -7.978 -2.224 1.00 0.00 N ATOM 1175 CA ASN A 74 6.921 -8.787 -3.028 1.00 0.00 C ATOM 1176 C ASN A 74 6.745 -10.209 -2.453 1.00 0.00 C ATOM 1177 O ASN A 74 6.160 -11.082 -3.102 1.00 0.00 O ATOM 1178 CB ASN A 74 7.382 -8.844 -4.519 1.00 0.00 C ATOM 1179 CG ASN A 74 8.641 -9.684 -4.763 1.00 0.00 C ATOM 1180 OD1 ASN A 74 8.462 -10.959 -5.099 1.00 0.00 O flip ATOM 1181 ND2 ASN A 74 9.754 -9.186 -4.667 1.00 0.00 N flip ATOM 0 H ASN A 74 8.846 -8.105 -2.497 1.00 0.00 H new ATOM 0 HA ASN A 74 5.948 -8.298 -2.980 1.00 0.00 H new ATOM 0 HB2 ASN A 74 6.569 -9.247 -5.122 1.00 0.00 H new ATOM 0 HB3 ASN A 74 7.565 -7.828 -4.869 1.00 0.00 H new ATOM 0 HD21 ASN A 74 9.853 -8.205 -4.407 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.583 -9.752 -4.847 1.00 0.00 H new ATOM 1188 N VAL A 75 7.219 -10.411 -1.218 1.00 0.00 N ATOM 1189 CA VAL A 75 7.248 -11.727 -0.542 1.00 0.00 C ATOM 1190 C VAL A 75 6.637 -11.598 0.878 1.00 0.00 C ATOM 1191 O VAL A 75 6.918 -10.631 1.580 1.00 0.00 O ATOM 1192 CB VAL A 75 8.734 -12.272 -0.469 1.00 0.00 C ATOM 1193 CG1 VAL A 75 8.859 -13.512 0.441 1.00 0.00 C ATOM 1194 CG2 VAL A 75 9.296 -12.587 -1.886 1.00 0.00 C ATOM 0 H VAL A 75 7.600 -9.658 -0.646 1.00 0.00 H new ATOM 0 HA VAL A 75 6.654 -12.439 -1.114 1.00 0.00 H new ATOM 0 HB VAL A 75 9.331 -11.474 -0.027 1.00 0.00 H new ATOM 0 HG11 VAL A 75 9.896 -13.848 0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.544 -13.254 1.452 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.225 -14.311 0.056 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.317 -12.959 -1.798 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.674 -13.344 -2.364 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.291 -11.679 -2.489 1.00 0.00 H new ATOM 1204 N VAL A 76 5.780 -12.564 1.275 1.00 0.00 N ATOM 1205 CA VAL A 76 5.168 -12.621 2.630 1.00 0.00 C ATOM 1206 C VAL A 76 5.459 -13.992 3.278 1.00 0.00 C ATOM 1207 O VAL A 76 5.344 -15.020 2.611 1.00 0.00 O ATOM 1208 CB VAL A 76 3.599 -12.398 2.578 1.00 0.00 C ATOM 1209 CG1 VAL A 76 2.937 -12.512 3.983 1.00 0.00 C ATOM 1210 CG2 VAL A 76 3.232 -11.044 1.921 1.00 0.00 C ATOM 0 H VAL A 76 5.490 -13.330 0.667 1.00 0.00 H new ATOM 0 HA VAL A 76 5.609 -11.819 3.222 1.00 0.00 H new ATOM 0 HB VAL A 76 3.201 -13.201 1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.863 -12.351 3.893 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.122 -13.505 4.393 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.362 -11.760 4.648 1.00 0.00 H new ATOM 0 HG21 VAL A 76 2.148 -10.929 1.905 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.674 -10.230 2.495 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.615 -11.019 0.901 1.00 0.00 H new ATOM 1220 N ILE A 77 5.845 -13.992 4.571 1.00 0.00 N ATOM 1221 CA ILE A 77 5.914 -15.209 5.392 1.00 0.00 C ATOM 1222 C ILE A 77 4.658 -15.277 6.269 1.00 0.00 C ATOM 1223 O ILE A 77 4.489 -14.474 7.196 1.00 0.00 O ATOM 1224 CB ILE A 77 7.214 -15.269 6.298 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.496 -15.506 5.420 1.00 0.00 C ATOM 1226 CG2 ILE A 77 7.086 -16.310 7.457 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.653 -16.213 6.111 1.00 0.00 C ATOM 0 H ILE A 77 6.117 -13.146 5.071 1.00 0.00 H new ATOM 0 HA ILE A 77 5.967 -16.066 4.720 1.00 0.00 H new ATOM 0 HB ILE A 77 7.321 -14.298 6.782 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.210 -16.089 4.544 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.849 -14.540 5.059 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.002 -16.312 8.047 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.244 -16.042 8.095 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.922 -17.303 7.038 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.482 -16.323 5.412 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.978 -15.625 6.970 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.329 -17.198 6.447 1.00 0.00 H new ATOM 1239 N ASP A 78 3.768 -16.201 5.929 1.00 0.00 N ATOM 1240 CA ASP A 78 2.629 -16.578 6.768 1.00 0.00 C ATOM 1241 C ASP A 78 3.081 -17.684 7.717 1.00 0.00 C ATOM 1242 O ASP A 78 3.354 -18.800 7.289 1.00 0.00 O ATOM 1243 CB ASP A 78 1.443 -17.048 5.886 1.00 0.00 C ATOM 1244 CG ASP A 78 0.912 -15.912 5.001 1.00 0.00 C ATOM 1245 OD1 ASP A 78 0.091 -15.103 5.495 1.00 0.00 O ATOM 1246 OD2 ASP A 78 1.346 -15.799 3.827 1.00 0.00 O ATOM 0 H ASP A 78 3.815 -16.719 5.051 1.00 0.00 H new ATOM 0 HA ASP A 78 2.285 -15.721 7.346 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.763 -17.880 5.258 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.640 -17.420 6.523 1.00 0.00 H new ATOM 1251 N HIS A 79 3.202 -17.352 9.009 1.00 0.00 N ATOM 1252 CA HIS A 79 3.608 -18.312 10.041 1.00 0.00 C ATOM 1253 C HIS A 79 2.354 -18.817 10.767 1.00 0.00 C ATOM 1254 O HIS A 79 1.687 -18.086 11.513 1.00 0.00 O ATOM 1255 CB HIS A 79 4.615 -17.680 11.038 1.00 0.00 C ATOM 1256 CG HIS A 79 4.973 -18.558 12.226 1.00 0.00 C ATOM 1257 ND1 HIS A 79 4.816 -19.937 12.245 1.00 0.00 N ATOM 1258 CD2 HIS A 79 5.462 -18.233 13.448 1.00 0.00 C ATOM 1259 CE1 HIS A 79 5.183 -20.410 13.416 1.00 0.00 C ATOM 1260 NE2 HIS A 79 5.574 -19.399 14.164 1.00 0.00 N ATOM 0 H HIS A 79 3.022 -16.414 9.366 1.00 0.00 H new ATOM 0 HA HIS A 79 4.118 -19.152 9.569 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.530 -17.431 10.500 1.00 0.00 H new ATOM 0 HB3 HIS A 79 4.198 -16.744 11.409 1.00 0.00 H new ATOM 0 HD1 HIS A 79 4.468 -20.499 11.468 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.716 -17.242 13.794 1.00 0.00 H new ATOM 0 HE1 HIS A 79 5.167 -21.448 13.713 1.00 0.00 H new ATOM 1269 N GLU A 80 2.065 -20.083 10.518 1.00 0.00 N ATOM 1270 CA GLU A 80 0.920 -20.810 11.069 1.00 0.00 C ATOM 1271 C GLU A 80 1.411 -22.087 11.770 1.00 0.00 C ATOM 1272 O GLU A 80 2.576 -22.483 11.642 1.00 0.00 O ATOM 1273 CB GLU A 80 -0.133 -21.138 9.935 1.00 0.00 C ATOM 1274 CG GLU A 80 0.407 -21.144 8.483 1.00 0.00 C ATOM 1275 CD GLU A 80 1.596 -22.103 8.251 1.00 0.00 C ATOM 1276 OE1 GLU A 80 1.427 -23.328 8.419 1.00 0.00 O ATOM 1277 OE2 GLU A 80 2.702 -21.628 7.909 1.00 0.00 O ATOM 0 H GLU A 80 2.640 -20.660 9.904 1.00 0.00 H new ATOM 0 HA GLU A 80 0.416 -20.184 11.806 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.568 -22.116 10.143 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.942 -20.410 9.997 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.403 -21.419 7.808 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.714 -20.132 8.218 1.00 0.00 H new ATOM 1284 N THR A 81 0.520 -22.677 12.566 1.00 0.00 N ATOM 1285 CA THR A 81 0.681 -24.023 13.105 1.00 0.00 C ATOM 1286 C THR A 81 -0.426 -24.906 12.499 1.00 0.00 C ATOM 1287 O THR A 81 -1.600 -24.787 12.881 1.00 0.00 O ATOM 1288 CB THR A 81 0.603 -24.009 14.669 1.00 0.00 C ATOM 1289 OG1 THR A 81 1.518 -23.028 15.178 1.00 0.00 O ATOM 1290 CG2 THR A 81 0.958 -25.372 15.287 1.00 0.00 C ATOM 0 H THR A 81 -0.346 -22.225 12.858 1.00 0.00 H new ATOM 0 HA THR A 81 1.661 -24.422 12.842 1.00 0.00 H new ATOM 0 HB THR A 81 -0.426 -23.772 14.940 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.347 -23.469 15.459 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.889 -25.308 16.373 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.263 -26.129 14.923 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.974 -25.646 15.004 1.00 0.00 H new ATOM 1298 N VAL A 82 -0.061 -25.746 11.505 1.00 0.00 N ATOM 1299 CA VAL A 82 -1.016 -26.657 10.839 1.00 0.00 C ATOM 1300 C VAL A 82 -1.150 -27.960 11.630 1.00 0.00 C ATOM 1301 O VAL A 82 -0.151 -28.583 12.000 1.00 0.00 O ATOM 1302 CB VAL A 82 -0.630 -26.978 9.340 1.00 0.00 C ATOM 1303 CG1 VAL A 82 -0.759 -25.719 8.458 1.00 0.00 C ATOM 1304 CG2 VAL A 82 0.788 -27.593 9.224 1.00 0.00 C ATOM 0 H VAL A 82 0.892 -25.811 11.146 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.972 -26.135 10.816 1.00 0.00 H new ATOM 0 HB VAL A 82 -1.335 -27.726 8.978 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -0.488 -25.965 7.431 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.787 -25.359 8.486 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -0.093 -24.942 8.833 1.00 0.00 H new ATOM 0 HG21 VAL A 82 1.011 -27.798 8.177 1.00 0.00 H new ATOM 0 HG22 VAL A 82 1.522 -26.892 9.621 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.829 -28.522 9.792 1.00 0.00 H new ATOM 1314 N THR A 83 -2.398 -28.359 11.889 1.00 0.00 N ATOM 1315 CA THR A 83 -2.705 -29.587 12.605 1.00 0.00 C ATOM 1316 C THR A 83 -2.578 -30.799 11.665 1.00 0.00 C ATOM 1317 O THR A 83 -3.248 -30.868 10.625 1.00 0.00 O ATOM 1318 CB THR A 83 -4.138 -29.518 13.224 1.00 0.00 C ATOM 1319 OG1 THR A 83 -4.248 -28.354 14.071 1.00 0.00 O ATOM 1320 CG2 THR A 83 -4.491 -30.780 14.041 1.00 0.00 C ATOM 0 H THR A 83 -3.224 -27.832 11.604 1.00 0.00 H new ATOM 0 HA THR A 83 -1.988 -29.703 13.418 1.00 0.00 H new ATOM 0 HB THR A 83 -4.843 -29.454 12.395 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.148 -28.313 14.456 1.00 0.00 H new ATOM 0 HG21 THR A 83 -5.497 -30.680 14.449 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.447 -31.656 13.394 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.778 -30.896 14.858 1.00 0.00 H new ATOM 1328 N ARG A 84 -1.660 -31.707 12.022 1.00 0.00 N ATOM 1329 CA ARG A 84 -1.542 -33.043 11.418 1.00 0.00 C ATOM 1330 C ARG A 84 -1.942 -34.080 12.496 1.00 0.00 C ATOM 1331 O ARG A 84 -2.504 -33.709 13.539 1.00 0.00 O ATOM 1332 CB ARG A 84 -0.080 -33.287 10.917 1.00 0.00 C ATOM 1333 CG ARG A 84 0.512 -32.145 10.056 1.00 0.00 C ATOM 1334 CD ARG A 84 1.878 -32.511 9.443 1.00 0.00 C ATOM 1335 NE ARG A 84 1.751 -33.600 8.450 1.00 0.00 N ATOM 1336 CZ ARG A 84 2.758 -34.317 7.933 1.00 0.00 C ATOM 1337 NH1 ARG A 84 4.014 -34.123 8.316 1.00 0.00 N ATOM 1338 NH2 ARG A 84 2.495 -35.240 7.023 1.00 0.00 N ATOM 0 H ARG A 84 -0.967 -31.532 12.750 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.198 -33.134 10.552 1.00 0.00 H new ATOM 0 HB2 ARG A 84 0.564 -33.441 11.783 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -0.060 -34.209 10.336 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -0.186 -31.899 9.256 1.00 0.00 H new ATOM 0 HG3 ARG A 84 0.621 -31.251 10.670 1.00 0.00 H new ATOM 0 HD2 ARG A 84 2.312 -31.632 8.967 1.00 0.00 H new ATOM 0 HD3 ARG A 84 2.563 -32.816 10.234 1.00 0.00 H new ATOM 0 HE ARG A 84 0.810 -33.826 8.129 1.00 0.00 H new ATOM 0 HH11 ARG A 84 4.229 -33.416 9.018 1.00 0.00 H new ATOM 0 HH12 ARG A 84 4.764 -34.681 7.908 1.00 0.00 H new ATOM 0 HH21 ARG A 84 1.534 -35.400 6.722 1.00 0.00 H new ATOM 0 HH22 ARG A 84 3.253 -35.792 6.622 1.00 0.00 H new ATOM 1352 N ASN A 85 -1.658 -35.375 12.265 1.00 0.00 N ATOM 1353 CA ASN A 85 -1.932 -36.442 13.254 1.00 0.00 C ATOM 1354 C ASN A 85 -0.648 -37.223 13.565 1.00 0.00 C ATOM 1355 O ASN A 85 -0.143 -37.960 12.713 1.00 0.00 O ATOM 1356 CB ASN A 85 -3.049 -37.399 12.749 1.00 0.00 C ATOM 1357 CG ASN A 85 -4.434 -36.749 12.633 1.00 0.00 C ATOM 1358 OD1 ASN A 85 -4.752 -35.806 13.520 1.00 0.00 O flip ATOM 1359 ND2 ASN A 85 -5.226 -37.111 11.761 1.00 0.00 N flip ATOM 0 H ASN A 85 -1.237 -35.712 11.399 1.00 0.00 H new ATOM 0 HA ASN A 85 -2.285 -35.973 14.172 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.762 -37.791 11.773 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.116 -38.250 13.427 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -4.956 -37.835 11.095 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -6.152 -36.687 11.705 1.00 0.00 H new ATOM 1366 N PHE A 86 -0.100 -37.018 14.778 1.00 0.00 N ATOM 1367 CA PHE A 86 1.051 -37.788 15.295 1.00 0.00 C ATOM 1368 C PHE A 86 0.553 -38.776 16.377 1.00 0.00 C ATOM 1369 O PHE A 86 -0.356 -38.433 17.137 1.00 0.00 O ATOM 1370 CB PHE A 86 2.142 -36.848 15.900 1.00 0.00 C ATOM 1371 CG PHE A 86 2.856 -35.891 14.933 1.00 0.00 C ATOM 1372 CD1 PHE A 86 2.651 -35.932 13.553 1.00 0.00 C ATOM 1373 CD2 PHE A 86 3.741 -34.926 15.429 1.00 0.00 C ATOM 1374 CE1 PHE A 86 3.301 -35.049 12.707 1.00 0.00 C ATOM 1375 CE2 PHE A 86 4.387 -34.047 14.579 1.00 0.00 C ATOM 1376 CZ PHE A 86 4.166 -34.110 13.220 1.00 0.00 C ATOM 0 H PHE A 86 -0.443 -36.312 15.430 1.00 0.00 H new ATOM 0 HA PHE A 86 1.503 -38.333 14.466 1.00 0.00 H new ATOM 0 HB2 PHE A 86 1.677 -36.251 16.685 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.898 -37.471 16.379 1.00 0.00 H new ATOM 0 HD1 PHE A 86 1.974 -36.664 13.138 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.922 -34.867 16.492 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.129 -35.098 11.642 1.00 0.00 H new ATOM 0 HE2 PHE A 86 5.066 -33.310 14.981 1.00 0.00 H new ATOM 0 HZ PHE A 86 4.672 -33.423 12.558 1.00 0.00 H new ATOM 1386 N PRO A 87 1.148 -40.013 16.480 1.00 0.00 N ATOM 1387 CA PRO A 87 0.753 -41.014 17.512 1.00 0.00 C ATOM 1388 C PRO A 87 1.168 -40.597 18.948 1.00 0.00 C ATOM 1389 O PRO A 87 0.717 -41.198 19.931 1.00 0.00 O ATOM 1390 CB PRO A 87 1.484 -42.303 17.051 1.00 0.00 C ATOM 1391 CG PRO A 87 2.681 -41.808 16.294 1.00 0.00 C ATOM 1392 CD PRO A 87 2.227 -40.544 15.594 1.00 0.00 C ATOM 0 HA PRO A 87 -0.328 -41.132 17.581 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.779 -42.917 17.902 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.843 -42.919 16.420 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.514 -41.606 16.967 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.025 -42.552 15.575 1.00 0.00 H new ATOM 0 HD2 PRO A 87 3.044 -39.830 15.487 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.854 -40.754 14.592 1.00 0.00 H new ATOM 1400 N GLU A 88 2.026 -39.563 19.047 1.00 0.00 N ATOM 1401 CA GLU A 88 2.502 -39.012 20.336 1.00 0.00 C ATOM 1402 C GLU A 88 1.553 -37.919 20.893 1.00 0.00 C ATOM 1403 O GLU A 88 1.803 -37.380 21.977 1.00 0.00 O ATOM 1404 CB GLU A 88 3.949 -38.473 20.182 1.00 0.00 C ATOM 1405 CG GLU A 88 4.132 -37.406 19.088 1.00 0.00 C ATOM 1406 CD GLU A 88 5.595 -36.959 18.934 1.00 0.00 C ATOM 1407 OE1 GLU A 88 6.395 -37.715 18.343 1.00 0.00 O ATOM 1408 OE2 GLU A 88 5.958 -35.873 19.421 1.00 0.00 O ATOM 0 H GLU A 88 2.411 -39.083 18.234 1.00 0.00 H new ATOM 0 HA GLU A 88 2.503 -39.823 21.064 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.268 -38.052 21.136 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.612 -39.311 19.966 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.775 -37.802 18.137 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.515 -36.539 19.324 1.00 0.00 H new ATOM 1415 N GLY A 89 0.488 -37.574 20.142 1.00 0.00 N ATOM 1416 CA GLY A 89 -0.583 -36.713 20.667 1.00 0.00 C ATOM 1417 C GLY A 89 -1.391 -36.040 19.566 1.00 0.00 C ATOM 1418 O GLY A 89 -2.016 -36.726 18.760 1.00 0.00 O ATOM 0 H GLY A 89 0.350 -37.877 19.178 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.251 -37.309 21.289 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.146 -35.949 21.310 1.00 0.00 H new ATOM 1422 N LYS A 90 -1.389 -34.693 19.551 1.00 0.00 N ATOM 1423 CA LYS A 90 -2.092 -33.885 18.547 1.00 0.00 C ATOM 1424 C LYS A 90 -1.475 -34.101 17.150 1.00 0.00 C ATOM 1425 O LYS A 90 -2.003 -34.870 16.334 1.00 0.00 O ATOM 1426 CB LYS A 90 -2.026 -32.388 18.965 1.00 0.00 C ATOM 1427 CG LYS A 90 -2.731 -31.406 18.006 1.00 0.00 C ATOM 1428 CD LYS A 90 -4.256 -31.614 17.919 1.00 0.00 C ATOM 1429 CE LYS A 90 -4.951 -31.505 19.295 1.00 0.00 C ATOM 1430 NZ LYS A 90 -6.427 -31.418 19.180 1.00 0.00 N ATOM 0 H LYS A 90 -0.893 -34.134 20.245 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.136 -34.193 18.494 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.469 -32.284 19.956 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.979 -32.097 19.052 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.530 -30.386 18.332 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.301 -31.512 17.010 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.682 -30.874 17.242 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.461 -32.594 17.489 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.687 -32.372 19.901 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.578 -30.625 19.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.846 -31.347 20.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.683 -30.577 18.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.789 -32.270 18.705 1.00 0.00 H new ATOM 1444 N GLY A 91 -0.339 -33.433 16.908 1.00 0.00 N ATOM 1445 CA GLY A 91 0.397 -33.547 15.660 1.00 0.00 C ATOM 1446 C GLY A 91 0.489 -32.244 14.898 1.00 0.00 C ATOM 1447 O GLY A 91 0.766 -32.247 13.704 1.00 0.00 O ATOM 0 H GLY A 91 0.090 -32.798 17.581 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.404 -33.908 15.872 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.084 -34.295 15.030 1.00 0.00 H new ATOM 1451 N GLU A 92 0.341 -31.116 15.600 1.00 0.00 N ATOM 1452 CA GLU A 92 0.330 -29.789 14.955 1.00 0.00 C ATOM 1453 C GLU A 92 1.761 -29.263 14.910 1.00 0.00 C ATOM 1454 O GLU A 92 2.526 -29.528 15.816 1.00 0.00 O ATOM 1455 CB GLU A 92 -0.623 -28.827 15.718 1.00 0.00 C ATOM 1456 CG GLU A 92 -0.252 -28.570 17.191 1.00 0.00 C ATOM 1457 CD GLU A 92 -1.258 -27.656 17.910 1.00 0.00 C ATOM 1458 OE1 GLU A 92 -1.223 -26.432 17.692 1.00 0.00 O ATOM 1459 OE2 GLU A 92 -2.099 -28.160 18.677 1.00 0.00 O ATOM 0 H GLU A 92 0.227 -31.090 16.613 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.047 -29.862 13.935 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.646 -27.872 15.193 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.633 -29.236 15.680 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.194 -29.523 17.717 1.00 0.00 H new ATOM 0 HG3 GLU A 92 0.739 -28.119 17.238 1.00 0.00 H new ATOM 1466 N VAL A 93 2.151 -28.587 13.824 1.00 0.00 N ATOM 1467 CA VAL A 93 3.558 -28.198 13.595 1.00 0.00 C ATOM 1468 C VAL A 93 3.666 -26.730 13.169 1.00 0.00 C ATOM 1469 O VAL A 93 2.859 -26.246 12.370 1.00 0.00 O ATOM 1470 CB VAL A 93 4.253 -29.137 12.527 1.00 0.00 C ATOM 1471 CG1 VAL A 93 4.403 -30.579 13.063 1.00 0.00 C ATOM 1472 CG2 VAL A 93 3.485 -29.141 11.180 1.00 0.00 C ATOM 0 H VAL A 93 1.513 -28.294 13.084 1.00 0.00 H new ATOM 0 HA VAL A 93 4.084 -28.319 14.542 1.00 0.00 H new ATOM 0 HB VAL A 93 5.248 -28.730 12.345 1.00 0.00 H new ATOM 0 HG11 VAL A 93 4.884 -31.200 12.307 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.013 -30.570 13.966 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.418 -30.986 13.294 1.00 0.00 H new ATOM 0 HG21 VAL A 93 3.993 -29.797 10.473 1.00 0.00 H new ATOM 0 HG22 VAL A 93 2.469 -29.500 11.342 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.453 -28.129 10.777 1.00 0.00 H new ATOM 1482 N ASP A 94 4.677 -26.034 13.722 1.00 0.00 N ATOM 1483 CA ASP A 94 4.974 -24.632 13.385 1.00 0.00 C ATOM 1484 C ASP A 94 5.653 -24.582 12.019 1.00 0.00 C ATOM 1485 O ASP A 94 6.778 -25.018 11.895 1.00 0.00 O ATOM 1486 CB ASP A 94 5.931 -23.976 14.432 1.00 0.00 C ATOM 1487 CG ASP A 94 5.345 -23.732 15.827 1.00 0.00 C ATOM 1488 OD1 ASP A 94 4.162 -24.039 16.074 1.00 0.00 O ATOM 1489 OD2 ASP A 94 6.085 -23.210 16.693 1.00 0.00 O ATOM 0 H ASP A 94 5.311 -26.430 14.416 1.00 0.00 H new ATOM 0 HA ASP A 94 4.033 -24.082 13.381 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.811 -24.611 14.537 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.273 -23.021 14.032 1.00 0.00 H new ATOM 1494 N VAL A 95 4.951 -24.079 11.005 1.00 0.00 N ATOM 1495 CA VAL A 95 5.483 -23.925 9.639 1.00 0.00 C ATOM 1496 C VAL A 95 5.560 -22.423 9.303 1.00 0.00 C ATOM 1497 O VAL A 95 4.866 -21.602 9.916 1.00 0.00 O ATOM 1498 CB VAL A 95 4.568 -24.679 8.595 1.00 0.00 C ATOM 1499 CG1 VAL A 95 5.179 -24.726 7.174 1.00 0.00 C ATOM 1500 CG2 VAL A 95 4.198 -26.094 9.095 1.00 0.00 C ATOM 0 H VAL A 95 3.987 -23.762 11.103 1.00 0.00 H new ATOM 0 HA VAL A 95 6.479 -24.365 9.585 1.00 0.00 H new ATOM 0 HB VAL A 95 3.652 -24.095 8.513 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.502 -25.257 6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.328 -23.710 6.808 1.00 0.00 H new ATOM 0 HG13 VAL A 95 6.137 -25.244 7.207 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.568 -26.588 8.355 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.107 -26.676 9.244 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.658 -26.017 10.038 1.00 0.00 H new ATOM 1510 N ALA A 96 6.447 -22.068 8.366 1.00 0.00 N ATOM 1511 CA ALA A 96 6.530 -20.723 7.794 1.00 0.00 C ATOM 1512 C ALA A 96 6.395 -20.847 6.273 1.00 0.00 C ATOM 1513 O ALA A 96 7.315 -21.320 5.597 1.00 0.00 O ATOM 1514 CB ALA A 96 7.848 -20.038 8.200 1.00 0.00 C ATOM 0 H ALA A 96 7.134 -22.716 7.981 1.00 0.00 H new ATOM 0 HA ALA A 96 5.725 -20.095 8.177 1.00 0.00 H new ATOM 0 HB1 ALA A 96 7.889 -19.040 7.764 1.00 0.00 H new ATOM 0 HB2 ALA A 96 7.899 -19.962 9.286 1.00 0.00 H new ATOM 0 HB3 ALA A 96 8.691 -20.627 7.838 1.00 0.00 H new ATOM 1520 N CYS A 97 5.228 -20.462 5.754 1.00 0.00 N ATOM 1521 CA CYS A 97 4.918 -20.531 4.325 1.00 0.00 C ATOM 1522 C CYS A 97 5.221 -19.169 3.694 1.00 0.00 C ATOM 1523 O CYS A 97 4.514 -18.188 3.918 1.00 0.00 O ATOM 1524 CB CYS A 97 3.443 -20.942 4.123 1.00 0.00 C ATOM 1525 SG CYS A 97 3.067 -22.606 4.726 1.00 0.00 S ATOM 0 H CYS A 97 4.464 -20.090 6.319 1.00 0.00 H new ATOM 0 HA CYS A 97 5.533 -21.287 3.836 1.00 0.00 H new ATOM 0 HB2 CYS A 97 2.801 -20.225 4.635 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.201 -20.886 3.062 1.00 0.00 H new ATOM 0 HG CYS A 97 2.947 -22.582 6.020 1.00 0.00 H new ATOM 1531 N ILE A 98 6.309 -19.140 2.921 1.00 0.00 N ATOM 1532 CA ILE A 98 6.874 -17.923 2.331 1.00 0.00 C ATOM 1533 C ILE A 98 6.547 -17.878 0.818 1.00 0.00 C ATOM 1534 O ILE A 98 7.091 -18.649 0.029 1.00 0.00 O ATOM 1535 CB ILE A 98 8.434 -17.851 2.641 1.00 0.00 C ATOM 1536 CG1 ILE A 98 9.128 -16.670 1.891 1.00 0.00 C ATOM 1537 CG2 ILE A 98 9.158 -19.198 2.393 1.00 0.00 C ATOM 1538 CD1 ILE A 98 10.612 -16.481 2.198 1.00 0.00 C ATOM 0 H ILE A 98 6.834 -19.981 2.682 1.00 0.00 H new ATOM 0 HA ILE A 98 6.424 -17.036 2.777 1.00 0.00 H new ATOM 0 HB ILE A 98 8.521 -17.648 3.708 1.00 0.00 H new ATOM 0 HG12 ILE A 98 9.013 -16.826 0.818 1.00 0.00 H new ATOM 0 HG13 ILE A 98 8.603 -15.747 2.137 1.00 0.00 H new ATOM 0 HG21 ILE A 98 10.218 -19.089 2.621 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.726 -19.966 3.034 1.00 0.00 H new ATOM 0 HG23 ILE A 98 9.039 -19.488 1.349 1.00 0.00 H new ATOM 0 HD11 ILE A 98 10.997 -15.636 1.627 1.00 0.00 H new ATOM 0 HD12 ILE A 98 10.742 -16.288 3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 98 11.158 -17.384 1.924 1.00 0.00 H new ATOM 1550 N TYR A 99 5.603 -16.992 0.435 1.00 0.00 N ATOM 1551 CA TYR A 99 5.123 -16.855 -0.960 1.00 0.00 C ATOM 1552 C TYR A 99 5.798 -15.665 -1.649 1.00 0.00 C ATOM 1553 O TYR A 99 5.937 -14.597 -1.058 1.00 0.00 O ATOM 1554 CB TYR A 99 3.586 -16.634 -1.013 1.00 0.00 C ATOM 1555 CG TYR A 99 2.759 -17.688 -0.269 1.00 0.00 C ATOM 1556 CD1 TYR A 99 2.324 -18.848 -0.905 1.00 0.00 C ATOM 1557 CD2 TYR A 99 2.417 -17.516 1.076 1.00 0.00 C ATOM 1558 CE1 TYR A 99 1.580 -19.802 -0.232 1.00 0.00 C ATOM 1559 CE2 TYR A 99 1.673 -18.468 1.752 1.00 0.00 C ATOM 1560 CZ TYR A 99 1.257 -19.607 1.095 1.00 0.00 C ATOM 1561 OH TYR A 99 0.511 -20.557 1.764 1.00 0.00 O ATOM 0 H TYR A 99 5.150 -16.349 1.085 1.00 0.00 H new ATOM 0 HA TYR A 99 5.375 -17.783 -1.474 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.360 -15.653 -0.595 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.271 -16.616 -2.056 1.00 0.00 H new ATOM 0 HD1 TYR A 99 2.572 -19.007 -1.944 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.739 -16.626 1.596 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.254 -20.695 -0.744 1.00 0.00 H new ATOM 0 HE2 TYR A 99 1.419 -18.319 2.791 1.00 0.00 H new ATOM 0 HH TYR A 99 0.371 -20.270 2.690 1.00 0.00 H new ATOM 1571 N GLU A 100 6.201 -15.878 -2.903 1.00 0.00 N ATOM 1572 CA GLU A 100 6.645 -14.824 -3.817 1.00 0.00 C ATOM 1573 C GLU A 100 5.500 -14.475 -4.778 1.00 0.00 C ATOM 1574 O GLU A 100 5.083 -15.311 -5.586 1.00 0.00 O ATOM 1575 CB GLU A 100 7.864 -15.304 -4.633 1.00 0.00 C ATOM 1576 CG GLU A 100 8.383 -14.297 -5.678 1.00 0.00 C ATOM 1577 CD GLU A 100 9.393 -14.919 -6.655 1.00 0.00 C ATOM 1578 OE1 GLU A 100 10.581 -15.050 -6.296 1.00 0.00 O ATOM 1579 OE2 GLU A 100 8.993 -15.290 -7.784 1.00 0.00 O ATOM 0 H GLU A 100 6.228 -16.808 -3.320 1.00 0.00 H new ATOM 0 HA GLU A 100 6.929 -13.946 -3.237 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.674 -15.540 -3.943 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.600 -16.230 -5.143 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.539 -13.897 -6.241 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.851 -13.457 -5.165 1.00 0.00 H new ATOM 1586 N VAL A 101 4.991 -13.248 -4.668 1.00 0.00 N ATOM 1587 CA VAL A 101 3.958 -12.719 -5.569 1.00 0.00 C ATOM 1588 C VAL A 101 4.609 -11.765 -6.600 1.00 0.00 C ATOM 1589 O VAL A 101 5.209 -10.749 -6.234 1.00 0.00 O ATOM 1590 CB VAL A 101 2.828 -11.980 -4.762 1.00 0.00 C ATOM 1591 CG1 VAL A 101 1.687 -11.490 -5.696 1.00 0.00 C ATOM 1592 CG2 VAL A 101 2.266 -12.885 -3.632 1.00 0.00 C ATOM 0 H VAL A 101 5.283 -12.587 -3.948 1.00 0.00 H new ATOM 0 HA VAL A 101 3.493 -13.552 -6.097 1.00 0.00 H new ATOM 0 HB VAL A 101 3.279 -11.101 -4.301 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.924 -10.984 -5.104 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.093 -10.797 -6.433 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.243 -12.344 -6.207 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.487 -12.349 -3.090 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.847 -13.792 -4.067 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.069 -13.150 -2.944 1.00 0.00 H new ATOM 1602 N GLU A 102 4.511 -12.135 -7.884 1.00 0.00 N ATOM 1603 CA GLU A 102 4.970 -11.329 -9.030 1.00 0.00 C ATOM 1604 C GLU A 102 3.822 -11.210 -10.058 1.00 0.00 C ATOM 1605 O GLU A 102 3.141 -12.203 -10.332 1.00 0.00 O ATOM 1606 CB GLU A 102 6.192 -12.015 -9.693 1.00 0.00 C ATOM 1607 CG GLU A 102 6.705 -11.329 -10.974 1.00 0.00 C ATOM 1608 CD GLU A 102 7.555 -12.253 -11.861 1.00 0.00 C ATOM 1609 OE1 GLU A 102 6.985 -13.195 -12.457 1.00 0.00 O ATOM 1610 OE2 GLU A 102 8.777 -12.032 -11.991 1.00 0.00 O ATOM 0 H GLU A 102 4.100 -13.025 -8.165 1.00 0.00 H new ATOM 0 HA GLU A 102 5.259 -10.336 -8.687 1.00 0.00 H new ATOM 0 HB2 GLU A 102 7.006 -12.054 -8.969 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.927 -13.045 -9.931 1.00 0.00 H new ATOM 0 HG2 GLU A 102 5.853 -10.967 -11.550 1.00 0.00 H new ATOM 0 HG3 GLU A 102 7.297 -10.456 -10.698 1.00 0.00 H new ATOM 1617 N ASN A 103 3.639 -10.006 -10.642 1.00 0.00 N ATOM 1618 CA ASN A 103 2.590 -9.729 -11.670 1.00 0.00 C ATOM 1619 C ASN A 103 1.163 -9.911 -11.084 1.00 0.00 C ATOM 1620 O ASN A 103 0.216 -10.260 -11.799 1.00 0.00 O ATOM 1621 CB ASN A 103 2.805 -10.623 -12.943 1.00 0.00 C ATOM 1622 CG ASN A 103 4.196 -10.474 -13.577 1.00 0.00 C ATOM 1623 OD1 ASN A 103 4.780 -9.389 -13.574 1.00 0.00 O ATOM 1624 ND2 ASN A 103 4.754 -11.568 -14.082 1.00 0.00 N ATOM 0 H ASN A 103 4.211 -9.192 -10.419 1.00 0.00 H new ATOM 0 HA ASN A 103 2.686 -8.687 -11.974 1.00 0.00 H new ATOM 0 HB2 ASN A 103 2.649 -11.667 -12.673 1.00 0.00 H new ATOM 0 HB3 ASN A 103 2.048 -10.370 -13.686 1.00 0.00 H new ATOM 0 HD21 ASN A 103 5.691 -11.524 -14.482 1.00 0.00 H new ATOM 0 HD22 ASN A 103 4.245 -12.452 -14.070 1.00 0.00 H new ATOM 1631 N GLY A 104 1.037 -9.632 -9.769 1.00 0.00 N ATOM 1632 CA GLY A 104 -0.237 -9.721 -9.035 1.00 0.00 C ATOM 1633 C GLY A 104 -0.679 -11.155 -8.722 1.00 0.00 C ATOM 1634 O GLY A 104 -1.793 -11.377 -8.229 1.00 0.00 O ATOM 0 H GLY A 104 1.821 -9.338 -9.187 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.145 -9.168 -8.100 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -1.016 -9.231 -9.619 1.00 0.00 H new ATOM 1638 N ARG A 105 0.203 -12.126 -9.004 1.00 0.00 N ATOM 1639 CA ARG A 105 -0.054 -13.573 -8.828 1.00 0.00 C ATOM 1640 C ARG A 105 1.189 -14.227 -8.217 1.00 0.00 C ATOM 1641 O ARG A 105 2.285 -13.729 -8.388 1.00 0.00 O ATOM 1642 CB ARG A 105 -0.392 -14.241 -10.196 1.00 0.00 C ATOM 1643 CG ARG A 105 -1.747 -13.825 -10.816 1.00 0.00 C ATOM 1644 CD ARG A 105 -2.936 -14.147 -9.896 1.00 0.00 C ATOM 1645 NE ARG A 105 -4.240 -13.729 -10.447 1.00 0.00 N ATOM 1646 CZ ARG A 105 -5.019 -12.751 -9.947 1.00 0.00 C ATOM 1647 NH1 ARG A 105 -4.590 -11.965 -8.959 1.00 0.00 N ATOM 1648 NH2 ARG A 105 -6.220 -12.543 -10.466 1.00 0.00 N ATOM 0 H ARG A 105 1.135 -11.929 -9.368 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.908 -13.709 -8.164 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.402 -14.003 -10.904 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -0.388 -15.323 -10.065 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.734 -12.756 -11.027 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -1.880 -14.337 -11.769 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -2.958 -15.220 -9.707 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -2.784 -13.657 -8.934 1.00 0.00 H new ATOM 0 HE ARG A 105 -4.579 -14.221 -11.274 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -3.657 -12.099 -8.569 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -5.195 -11.229 -8.593 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -6.549 -13.122 -11.239 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -6.816 -11.804 -10.093 1.00 0.00 H new ATOM 1662 N ILE A 106 1.014 -15.337 -7.505 1.00 0.00 N ATOM 1663 CA ILE A 106 2.128 -16.036 -6.844 1.00 0.00 C ATOM 1664 C ILE A 106 2.983 -16.763 -7.893 1.00 0.00 C ATOM 1665 O ILE A 106 2.555 -17.766 -8.454 1.00 0.00 O ATOM 1666 CB ILE A 106 1.593 -17.031 -5.756 1.00 0.00 C ATOM 1667 CG1 ILE A 106 0.719 -16.258 -4.729 1.00 0.00 C ATOM 1668 CG2 ILE A 106 2.743 -17.784 -5.044 1.00 0.00 C ATOM 1669 CD1 ILE A 106 0.085 -17.125 -3.677 1.00 0.00 C ATOM 0 H ILE A 106 0.106 -15.780 -7.367 1.00 0.00 H new ATOM 0 HA ILE A 106 2.755 -15.303 -6.336 1.00 0.00 H new ATOM 0 HB ILE A 106 0.984 -17.785 -6.255 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.336 -15.505 -4.239 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -0.066 -15.726 -5.266 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.327 -18.462 -4.299 1.00 0.00 H new ATOM 0 HG22 ILE A 106 3.313 -18.355 -5.777 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.400 -17.065 -4.554 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.506 -16.505 -3.003 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.562 -17.862 -4.154 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.863 -17.637 -3.111 1.00 0.00 H new ATOM 1681 N ALA A 107 4.174 -16.206 -8.177 1.00 0.00 N ATOM 1682 CA ALA A 107 5.106 -16.748 -9.186 1.00 0.00 C ATOM 1683 C ALA A 107 5.898 -17.939 -8.632 1.00 0.00 C ATOM 1684 O ALA A 107 6.303 -18.827 -9.388 1.00 0.00 O ATOM 1685 CB ALA A 107 6.061 -15.648 -9.672 1.00 0.00 C ATOM 0 H ALA A 107 4.519 -15.366 -7.713 1.00 0.00 H new ATOM 0 HA ALA A 107 4.517 -17.104 -10.031 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.743 -16.061 -10.416 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.485 -14.837 -10.118 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.634 -15.264 -8.828 1.00 0.00 H new ATOM 1691 N LYS A 108 6.121 -17.944 -7.307 1.00 0.00 N ATOM 1692 CA LYS A 108 6.825 -19.033 -6.595 1.00 0.00 C ATOM 1693 C LYS A 108 6.274 -19.103 -5.177 1.00 0.00 C ATOM 1694 O LYS A 108 5.821 -18.094 -4.646 1.00 0.00 O ATOM 1695 CB LYS A 108 8.367 -18.801 -6.517 1.00 0.00 C ATOM 1696 CG LYS A 108 9.109 -18.787 -7.871 1.00 0.00 C ATOM 1697 CD LYS A 108 10.586 -18.375 -7.730 1.00 0.00 C ATOM 1698 CE LYS A 108 11.261 -18.097 -9.079 1.00 0.00 C ATOM 1699 NZ LYS A 108 12.686 -17.718 -8.904 1.00 0.00 N ATOM 0 H LYS A 108 5.817 -17.189 -6.692 1.00 0.00 H new ATOM 0 HA LYS A 108 6.660 -19.959 -7.146 1.00 0.00 H new ATOM 0 HB2 LYS A 108 8.548 -17.851 -6.014 1.00 0.00 H new ATOM 0 HB3 LYS A 108 8.803 -19.581 -5.892 1.00 0.00 H new ATOM 0 HG2 LYS A 108 9.053 -19.777 -8.323 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.606 -18.098 -8.550 1.00 0.00 H new ATOM 0 HD2 LYS A 108 10.651 -17.483 -7.107 1.00 0.00 H new ATOM 0 HD3 LYS A 108 11.130 -19.165 -7.213 1.00 0.00 H new ATOM 0 HE2 LYS A 108 11.193 -18.983 -9.711 1.00 0.00 H new ATOM 0 HE3 LYS A 108 10.731 -17.296 -9.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 13.114 -17.537 -9.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 12.748 -16.859 -8.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 13.196 -18.493 -8.434 1.00 0.00 H new ATOM 1713 N ALA A 109 6.326 -20.283 -4.568 1.00 0.00 N ATOM 1714 CA ALA A 109 5.938 -20.467 -3.169 1.00 0.00 C ATOM 1715 C ALA A 109 6.816 -21.535 -2.533 1.00 0.00 C ATOM 1716 O ALA A 109 7.049 -22.584 -3.118 1.00 0.00 O ATOM 1717 CB ALA A 109 4.455 -20.839 -3.063 1.00 0.00 C ATOM 0 H ALA A 109 6.637 -21.139 -5.027 1.00 0.00 H new ATOM 0 HA ALA A 109 6.082 -19.529 -2.632 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.187 -20.971 -2.015 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.848 -20.043 -3.495 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.273 -21.768 -3.604 1.00 0.00 H new ATOM 1723 N TRP A 110 7.300 -21.240 -1.335 1.00 0.00 N ATOM 1724 CA TRP A 110 8.164 -22.123 -0.549 1.00 0.00 C ATOM 1725 C TRP A 110 7.507 -22.292 0.834 1.00 0.00 C ATOM 1726 O TRP A 110 6.747 -21.418 1.265 1.00 0.00 O ATOM 1727 CB TRP A 110 9.596 -21.497 -0.415 1.00 0.00 C ATOM 1728 CG TRP A 110 10.149 -20.866 -1.690 1.00 0.00 C ATOM 1729 CD1 TRP A 110 10.676 -21.510 -2.769 1.00 0.00 C ATOM 1730 CD2 TRP A 110 10.231 -19.461 -2.001 1.00 0.00 C ATOM 1731 NE1 TRP A 110 11.067 -20.610 -3.722 1.00 0.00 N ATOM 1732 CE2 TRP A 110 10.814 -19.347 -3.273 1.00 0.00 C ATOM 1733 CE3 TRP A 110 9.881 -18.294 -1.320 1.00 0.00 C ATOM 1734 CZ2 TRP A 110 11.036 -18.121 -3.887 1.00 0.00 C ATOM 1735 CZ3 TRP A 110 10.103 -17.071 -1.928 1.00 0.00 C ATOM 1736 CH2 TRP A 110 10.682 -16.996 -3.199 1.00 0.00 C ATOM 0 H TRP A 110 7.100 -20.357 -0.866 1.00 0.00 H new ATOM 0 HA TRP A 110 8.277 -23.093 -1.034 1.00 0.00 H new ATOM 0 HB2 TRP A 110 9.572 -20.738 0.367 1.00 0.00 H new ATOM 0 HB3 TRP A 110 10.285 -22.274 -0.084 1.00 0.00 H new ATOM 0 HD1 TRP A 110 10.772 -22.582 -2.859 1.00 0.00 H new ATOM 0 HE1 TRP A 110 11.481 -20.846 -4.624 1.00 0.00 H new ATOM 0 HE3 TRP A 110 9.444 -18.345 -0.334 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 11.473 -18.060 -4.873 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 9.826 -16.162 -1.414 1.00 0.00 H new ATOM 0 HH2 TRP A 110 10.853 -16.028 -3.646 1.00 0.00 H new ATOM 1747 N PHE A 111 7.758 -23.415 1.514 1.00 0.00 N ATOM 1748 CA PHE A 111 7.309 -23.600 2.909 1.00 0.00 C ATOM 1749 C PHE A 111 8.386 -24.369 3.682 1.00 0.00 C ATOM 1750 O PHE A 111 9.084 -25.213 3.103 1.00 0.00 O ATOM 1751 CB PHE A 111 5.918 -24.310 2.986 1.00 0.00 C ATOM 1752 CG PHE A 111 5.930 -25.827 2.771 1.00 0.00 C ATOM 1753 CD1 PHE A 111 5.912 -26.386 1.493 1.00 0.00 C ATOM 1754 CD2 PHE A 111 5.956 -26.696 3.867 1.00 0.00 C ATOM 1755 CE1 PHE A 111 5.919 -27.760 1.321 1.00 0.00 C ATOM 1756 CE2 PHE A 111 5.968 -28.062 3.694 1.00 0.00 C ATOM 1757 CZ PHE A 111 5.948 -28.599 2.422 1.00 0.00 C ATOM 0 H PHE A 111 8.267 -24.210 1.128 1.00 0.00 H new ATOM 0 HA PHE A 111 7.171 -22.622 3.369 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.480 -24.104 3.963 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.261 -23.862 2.241 1.00 0.00 H new ATOM 0 HD1 PHE A 111 5.892 -25.740 0.628 1.00 0.00 H new ATOM 0 HD2 PHE A 111 5.967 -26.288 4.867 1.00 0.00 H new ATOM 0 HE1 PHE A 111 5.902 -28.178 0.325 1.00 0.00 H new ATOM 0 HE2 PHE A 111 5.993 -28.714 4.554 1.00 0.00 H new ATOM 0 HZ PHE A 111 5.955 -29.670 2.286 1.00 0.00 H new ATOM 1767 N LYS A 112 8.522 -24.064 4.982 1.00 0.00 N ATOM 1768 CA LYS A 112 9.519 -24.698 5.854 1.00 0.00 C ATOM 1769 C LYS A 112 8.880 -25.095 7.193 1.00 0.00 C ATOM 1770 O LYS A 112 8.410 -24.236 7.944 1.00 0.00 O ATOM 1771 CB LYS A 112 10.747 -23.758 6.031 1.00 0.00 C ATOM 1772 CG LYS A 112 10.422 -22.321 6.504 1.00 0.00 C ATOM 1773 CD LYS A 112 11.627 -21.362 6.393 1.00 0.00 C ATOM 1774 CE LYS A 112 12.850 -21.831 7.205 1.00 0.00 C ATOM 1775 NZ LYS A 112 14.003 -20.919 7.036 1.00 0.00 N ATOM 0 H LYS A 112 7.943 -23.371 5.457 1.00 0.00 H new ATOM 0 HA LYS A 112 9.881 -25.616 5.391 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.430 -24.212 6.749 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.277 -23.698 5.080 1.00 0.00 H new ATOM 0 HG2 LYS A 112 9.596 -21.928 5.912 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.084 -22.353 7.540 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.910 -21.264 5.345 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.328 -20.372 6.737 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.585 -21.890 8.261 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.132 -22.836 6.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.806 -21.267 7.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.272 -20.882 6.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.742 -19.966 7.360 1.00 0.00 H new ATOM 1789 N ILE A 113 8.865 -26.413 7.493 1.00 0.00 N ATOM 1790 CA ILE A 113 8.227 -26.942 8.708 1.00 0.00 C ATOM 1791 C ILE A 113 9.253 -26.948 9.846 1.00 0.00 C ATOM 1792 O ILE A 113 10.233 -27.697 9.822 1.00 0.00 O ATOM 1793 CB ILE A 113 7.635 -28.379 8.495 1.00 0.00 C ATOM 1794 CG1 ILE A 113 6.494 -28.339 7.436 1.00 0.00 C ATOM 1795 CG2 ILE A 113 7.107 -28.982 9.831 1.00 0.00 C ATOM 1796 CD1 ILE A 113 5.966 -29.698 7.039 1.00 0.00 C ATOM 0 H ILE A 113 9.291 -27.129 6.904 1.00 0.00 H new ATOM 0 HA ILE A 113 7.388 -26.294 8.961 1.00 0.00 H new ATOM 0 HB ILE A 113 8.438 -29.021 8.133 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.670 -27.743 7.829 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.859 -27.830 6.544 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.704 -29.978 9.647 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.925 -29.049 10.548 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.322 -28.342 10.234 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.175 -29.579 6.299 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.775 -30.292 6.614 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.567 -30.204 7.918 1.00 0.00 H new ATOM 1808 N GLY A 114 9.007 -26.066 10.808 1.00 0.00 N ATOM 1809 CA GLY A 114 9.888 -25.832 11.957 1.00 0.00 C ATOM 1810 C GLY A 114 9.942 -26.992 12.958 1.00 0.00 C ATOM 1811 O GLY A 114 10.732 -27.930 12.778 1.00 0.00 O ATOM 0 H GLY A 114 8.173 -25.479 10.815 1.00 0.00 H new ATOM 0 HA2 GLY A 114 10.896 -25.635 11.593 1.00 0.00 H new ATOM 0 HA3 GLY A 114 9.556 -24.934 12.477 1.00 0.00 H new ATOM 1815 N GLU A 115 9.088 -26.940 14.005 1.00 0.00 N ATOM 1816 CA GLU A 115 9.162 -27.849 15.156 1.00 0.00 C ATOM 1817 C GLU A 115 7.796 -28.546 15.413 1.00 0.00 C ATOM 1818 O GLU A 115 6.742 -27.914 15.270 1.00 0.00 O ATOM 1819 CB GLU A 115 9.662 -27.040 16.397 1.00 0.00 C ATOM 1820 CG GLU A 115 9.321 -27.648 17.776 1.00 0.00 C ATOM 1821 CD GLU A 115 10.319 -27.291 18.895 1.00 0.00 C ATOM 1822 OE1 GLU A 115 10.266 -26.171 19.442 1.00 0.00 O ATOM 1823 OE2 GLU A 115 11.171 -28.140 19.225 1.00 0.00 O ATOM 0 H GLU A 115 8.328 -26.262 14.069 1.00 0.00 H new ATOM 0 HA GLU A 115 9.872 -28.651 14.952 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.744 -26.933 16.326 1.00 0.00 H new ATOM 0 HB3 GLU A 115 9.238 -26.037 16.348 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.327 -27.312 18.072 1.00 0.00 H new ATOM 0 HG3 GLU A 115 9.275 -28.733 17.680 1.00 0.00 H new ATOM 1830 N PRO A 116 7.810 -29.879 15.776 1.00 0.00 N ATOM 1831 CA PRO A 116 6.593 -30.624 16.183 1.00 0.00 C ATOM 1832 C PRO A 116 6.031 -30.120 17.535 1.00 0.00 C ATOM 1833 O PRO A 116 6.751 -30.043 18.534 1.00 0.00 O ATOM 1834 CB PRO A 116 7.075 -32.102 16.268 1.00 0.00 C ATOM 1835 CG PRO A 116 8.548 -32.004 16.520 1.00 0.00 C ATOM 1836 CD PRO A 116 9.011 -30.762 15.787 1.00 0.00 C ATOM 0 HA PRO A 116 5.769 -30.493 15.481 1.00 0.00 H new ATOM 0 HB2 PRO A 116 6.570 -32.638 17.071 1.00 0.00 H new ATOM 0 HB3 PRO A 116 6.866 -32.641 15.344 1.00 0.00 H new ATOM 0 HG2 PRO A 116 8.758 -31.929 17.587 1.00 0.00 H new ATOM 0 HG3 PRO A 116 9.067 -32.890 16.154 1.00 0.00 H new ATOM 0 HD2 PRO A 116 9.850 -30.288 16.296 1.00 0.00 H new ATOM 0 HD3 PRO A 116 9.343 -30.996 14.776 1.00 0.00 H new ATOM 1844 N ARG A 117 4.744 -29.750 17.523 1.00 0.00 N ATOM 1845 CA ARG A 117 4.001 -29.279 18.707 1.00 0.00 C ATOM 1846 C ARG A 117 2.942 -30.325 19.092 1.00 0.00 C ATOM 1847 O ARG A 117 2.109 -30.721 18.266 1.00 0.00 O ATOM 1848 CB ARG A 117 3.305 -27.910 18.429 1.00 0.00 C ATOM 1849 CG ARG A 117 4.258 -26.746 18.104 1.00 0.00 C ATOM 1850 CD ARG A 117 5.140 -26.327 19.297 1.00 0.00 C ATOM 1851 NE ARG A 117 6.018 -25.204 18.937 1.00 0.00 N ATOM 1852 CZ ARG A 117 7.191 -24.898 19.513 1.00 0.00 C ATOM 1853 NH1 ARG A 117 7.643 -25.578 20.567 1.00 0.00 N ATOM 1854 NH2 ARG A 117 7.913 -23.905 19.011 1.00 0.00 N ATOM 0 H ARG A 117 4.176 -29.769 16.676 1.00 0.00 H new ATOM 0 HA ARG A 117 4.708 -29.142 19.525 1.00 0.00 H new ATOM 0 HB2 ARG A 117 2.612 -28.035 17.597 1.00 0.00 H new ATOM 0 HB3 ARG A 117 2.710 -27.639 19.301 1.00 0.00 H new ATOM 0 HG2 ARG A 117 4.899 -27.033 17.270 1.00 0.00 H new ATOM 0 HG3 ARG A 117 3.672 -25.887 17.775 1.00 0.00 H new ATOM 0 HD2 ARG A 117 4.508 -26.043 20.139 1.00 0.00 H new ATOM 0 HD3 ARG A 117 5.743 -27.174 19.623 1.00 0.00 H new ATOM 0 HE ARG A 117 5.706 -24.600 18.177 1.00 0.00 H new ATOM 0 HH11 ARG A 117 7.094 -26.348 20.951 1.00 0.00 H new ATOM 0 HH12 ARG A 117 8.537 -25.329 20.989 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.574 -23.388 18.200 1.00 0.00 H new ATOM 0 HH22 ARG A 117 8.807 -23.659 19.436 1.00 0.00 H new ATOM 1868 N ILE A 118 2.994 -30.778 20.339 1.00 0.00 N ATOM 1869 CA ILE A 118 2.001 -31.683 20.919 1.00 0.00 C ATOM 1870 C ILE A 118 1.453 -31.013 22.178 1.00 0.00 C ATOM 1871 O ILE A 118 2.230 -30.639 23.061 1.00 0.00 O ATOM 1872 CB ILE A 118 2.621 -33.096 21.253 1.00 0.00 C ATOM 1873 CG1 ILE A 118 3.180 -33.783 19.968 1.00 0.00 C ATOM 1874 CG2 ILE A 118 1.591 -34.008 21.951 1.00 0.00 C ATOM 1875 CD1 ILE A 118 2.123 -34.138 18.936 1.00 0.00 C ATOM 0 H ILE A 118 3.738 -30.524 20.989 1.00 0.00 H new ATOM 0 HA ILE A 118 1.201 -31.865 20.201 1.00 0.00 H new ATOM 0 HB ILE A 118 3.451 -32.935 21.941 1.00 0.00 H new ATOM 0 HG12 ILE A 118 3.913 -33.121 19.507 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.708 -34.692 20.257 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.048 -34.974 22.168 1.00 0.00 H new ATOM 0 HG22 ILE A 118 1.265 -33.543 22.882 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.731 -34.152 21.297 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.598 -34.611 18.076 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.402 -34.826 19.376 1.00 0.00 H new ATOM 0 HD13 ILE A 118 1.610 -33.232 18.614 1.00 0.00 H new ATOM 1887 N VAL A 119 0.123 -30.862 22.237 1.00 0.00 N ATOM 1888 CA VAL A 119 -0.568 -30.115 23.313 1.00 0.00 C ATOM 1889 C VAL A 119 -0.269 -30.725 24.700 1.00 0.00 C ATOM 1890 O VAL A 119 0.003 -29.999 25.662 1.00 0.00 O ATOM 1891 CB VAL A 119 -2.123 -30.063 23.066 1.00 0.00 C ATOM 1892 CG1 VAL A 119 -2.866 -29.290 24.189 1.00 0.00 C ATOM 1893 CG2 VAL A 119 -2.437 -29.460 21.676 1.00 0.00 C ATOM 0 H VAL A 119 -0.512 -31.253 21.541 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.183 -29.095 23.296 1.00 0.00 H new ATOM 0 HB VAL A 119 -2.490 -31.089 23.088 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.935 -29.279 23.977 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.690 -29.781 25.146 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.495 -28.266 24.233 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.516 -29.434 21.526 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.038 -28.447 21.620 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.978 -30.074 20.901 1.00 0.00 H new