USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 817 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 3 LYS NZ :NH3+ 160:sc= -0.0122 (180deg=-0.173) USER MOD Single : A 4 GLN : amide:sc= -0.81 K(o=-0.81,f=-3.1!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.5 X(o=-0.5,f=-0.15) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= -0.449 USER MOD Single : A 30 THR OG1 : rot 144:sc= 0.0668 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -159:sc=-0.00768 (180deg=-0.511) USER MOD Single : A 39 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0088) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 87:sc= 0.0167 USER MOD Single : A 46 SER OG : rot -62:sc= 1.14 USER MOD Single : A 48 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.364) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0.0417 USER MOD Single : A 51 ASN : amide:sc= -0.367 K(o=-0.37,f=-1.9!) USER MOD Single : A 63 GLN : amide:sc= -0.178 X(o=-0.18,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0281) USER MOD Single : A 69 TYR OH : rot -76:sc= 1.04 USER MOD Single : A 76 THR OG1 : rot -93:sc= 1.2 USER MOD Single : A 81 LYS NZ :NH3+ -169:sc= -0.0278 (180deg=-0.305) USER MOD Single : A 82 ASN :FLIP amide:sc= -0.497 F(o=-1.1,f=-0.5) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0.00807 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -0.0491 K(o=-0.049,f=-3.9!) USER MOD Single : A 99 LYS NZ :NH3+ -122:sc= 0 (180deg=-0.357) USER MOD Single : A 105 ASN : amide:sc= -0.182 K(o=-0.18,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 20 N VAL A 2 0.554 -4.346 -2.546 1.00 0.00 N ATOM 21 CA VAL A 2 -0.838 -4.041 -2.849 1.00 0.00 C ATOM 22 C VAL A 2 -0.985 -3.502 -4.264 1.00 0.00 C ATOM 23 O VAL A 2 -0.112 -2.792 -4.763 1.00 0.00 O ATOM 24 CB VAL A 2 -1.405 -3.010 -1.850 1.00 0.00 C ATOM 25 CG1 VAL A 2 -2.877 -2.716 -2.127 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.206 -3.498 -0.422 1.00 0.00 C ATOM 0 HA VAL A 2 -1.400 -4.971 -2.763 1.00 0.00 H new ATOM 0 HB VAL A 2 -0.858 -2.076 -1.978 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.244 -1.986 -1.405 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -2.985 -2.315 -3.135 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.455 -3.636 -2.039 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.610 -2.762 0.274 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.723 -4.448 -0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.142 -3.634 -0.229 1.00 0.00 H new ATOM 36 N LYS A 3 -2.094 -3.843 -4.910 1.00 0.00 N ATOM 37 CA LYS A 3 -2.347 -3.390 -6.264 1.00 0.00 C ATOM 38 C LYS A 3 -3.834 -3.179 -6.466 1.00 0.00 C ATOM 39 O LYS A 3 -4.636 -4.084 -6.254 1.00 0.00 O ATOM 40 CB LYS A 3 -1.827 -4.410 -7.286 1.00 0.00 C ATOM 41 CG LYS A 3 -2.129 -5.857 -6.919 1.00 0.00 C ATOM 42 CD LYS A 3 -1.350 -6.830 -7.792 1.00 0.00 C ATOM 43 CE LYS A 3 -1.687 -6.659 -9.266 1.00 0.00 C ATOM 44 NZ LYS A 3 -0.687 -5.808 -9.969 1.00 0.00 N ATOM 0 H LYS A 3 -2.828 -4.431 -4.515 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.821 -2.448 -6.415 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.267 -4.192 -8.259 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.749 -4.289 -7.390 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -1.880 -6.027 -5.872 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.197 -6.045 -7.027 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.281 -6.677 -7.643 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.571 -7.852 -7.484 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.731 -7.637 -9.744 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -2.676 -6.212 -9.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.741 -5.982 -10.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.888 -4.806 -9.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.268 -6.041 -9.628 1.00 0.00 H new ATOM 58 N GLN A 4 -4.202 -1.973 -6.864 1.00 0.00 N ATOM 59 CA GLN A 4 -5.598 -1.665 -7.081 1.00 0.00 C ATOM 60 C GLN A 4 -6.060 -2.298 -8.390 1.00 0.00 C ATOM 61 O GLN A 4 -5.389 -2.188 -9.415 1.00 0.00 O ATOM 62 CB GLN A 4 -5.823 -0.154 -7.094 1.00 0.00 C ATOM 63 CG GLN A 4 -7.277 0.237 -7.284 1.00 0.00 C ATOM 64 CD GLN A 4 -7.430 1.569 -7.987 1.00 0.00 C ATOM 65 OE1 GLN A 4 -7.452 1.633 -9.217 1.00 0.00 O ATOM 66 NE2 GLN A 4 -7.537 2.642 -7.214 1.00 0.00 N ATOM 0 H GLN A 4 -3.559 -1.201 -7.041 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.187 -2.078 -6.262 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.460 0.268 -6.157 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.228 0.288 -7.894 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.786 -0.536 -7.861 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.768 0.284 -6.312 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -7.514 2.544 -6.199 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -7.642 3.565 -7.635 1.00 0.00 H new ATOM 75 N ILE A 5 -7.200 -2.971 -8.343 1.00 0.00 N ATOM 76 CA ILE A 5 -7.743 -3.640 -9.519 1.00 0.00 C ATOM 77 C ILE A 5 -8.847 -2.793 -10.157 1.00 0.00 C ATOM 78 O ILE A 5 -9.952 -2.681 -9.628 1.00 0.00 O ATOM 79 CB ILE A 5 -8.240 -5.064 -9.141 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.159 -6.106 -9.463 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.541 -5.429 -9.843 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.759 -5.704 -9.037 1.00 0.00 C ATOM 0 H ILE A 5 -7.769 -3.069 -7.502 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.956 -3.754 -10.264 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.438 -5.061 -8.069 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.419 -7.045 -8.975 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.160 -6.294 -10.537 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.846 -6.432 -9.546 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.317 -4.716 -9.564 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.393 -5.400 -10.922 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.057 -6.495 -9.301 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.475 -4.782 -9.545 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.738 -5.546 -7.959 1.00 0.00 H new ATOM 94 N GLU A 6 -8.521 -2.191 -11.303 1.00 0.00 N ATOM 95 CA GLU A 6 -9.460 -1.341 -12.029 1.00 0.00 C ATOM 96 C GLU A 6 -10.151 -2.096 -13.164 1.00 0.00 C ATOM 97 O GLU A 6 -10.647 -1.482 -14.110 1.00 0.00 O ATOM 98 CB GLU A 6 -8.733 -0.109 -12.579 1.00 0.00 C ATOM 99 CG GLU A 6 -9.021 1.168 -11.805 1.00 0.00 C ATOM 100 CD GLU A 6 -8.009 2.263 -12.085 1.00 0.00 C ATOM 101 OE1 GLU A 6 -6.799 2.014 -11.901 1.00 0.00 O ATOM 102 OE2 GLU A 6 -8.427 3.369 -12.489 1.00 0.00 O ATOM 0 H GLU A 6 -7.608 -2.279 -11.748 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.232 -1.025 -11.328 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.659 -0.296 -12.567 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.019 0.036 -13.621 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -10.018 1.526 -12.061 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -9.026 0.948 -10.737 1.00 0.00 H new ATOM 109 N SER A 7 -10.173 -3.419 -13.079 1.00 0.00 N ATOM 110 CA SER A 7 -10.797 -4.236 -14.115 1.00 0.00 C ATOM 111 C SER A 7 -11.218 -5.596 -13.566 1.00 0.00 C ATOM 112 O SER A 7 -10.696 -6.054 -12.548 1.00 0.00 O ATOM 113 CB SER A 7 -9.827 -4.425 -15.283 1.00 0.00 C ATOM 114 OG SER A 7 -10.510 -4.420 -16.524 1.00 0.00 O ATOM 0 H SER A 7 -9.768 -3.949 -12.307 1.00 0.00 H new ATOM 0 HA SER A 7 -11.691 -3.718 -14.463 1.00 0.00 H new ATOM 0 HB2 SER A 7 -9.082 -3.630 -15.272 1.00 0.00 H new ATOM 0 HB3 SER A 7 -9.290 -5.366 -15.164 1.00 0.00 H new ATOM 0 HG SER A 7 -9.866 -4.541 -17.252 1.00 0.00 H new ATOM 120 N LYS A 8 -12.153 -6.250 -14.252 1.00 0.00 N ATOM 121 CA LYS A 8 -12.622 -7.566 -13.832 1.00 0.00 C ATOM 122 C LYS A 8 -11.566 -8.627 -14.128 1.00 0.00 C ATOM 123 O LYS A 8 -11.495 -9.655 -13.454 1.00 0.00 O ATOM 124 CB LYS A 8 -13.941 -7.914 -14.533 1.00 0.00 C ATOM 125 CG LYS A 8 -14.510 -9.267 -14.132 1.00 0.00 C ATOM 126 CD LYS A 8 -14.627 -10.203 -15.326 1.00 0.00 C ATOM 127 CE LYS A 8 -13.264 -10.533 -15.911 1.00 0.00 C ATOM 128 NZ LYS A 8 -13.374 -11.338 -17.157 1.00 0.00 N ATOM 0 H LYS A 8 -12.598 -5.891 -15.097 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.798 -7.543 -12.757 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.676 -7.140 -14.310 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.783 -7.902 -15.611 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.871 -9.721 -13.375 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.492 -9.129 -13.679 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.125 -11.123 -15.021 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -15.251 -9.741 -16.092 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -12.727 -9.609 -16.123 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -12.677 -11.082 -15.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -12.422 -11.542 -17.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -13.864 -12.232 -16.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -13.912 -10.804 -17.869 1.00 0.00 H new ATOM 142 N THR A 9 -10.736 -8.362 -15.137 1.00 0.00 N ATOM 143 CA THR A 9 -9.672 -9.283 -15.522 1.00 0.00 C ATOM 144 C THR A 9 -8.474 -9.139 -14.590 1.00 0.00 C ATOM 145 O THR A 9 -7.759 -10.106 -14.325 1.00 0.00 O ATOM 146 CB THR A 9 -9.238 -9.021 -16.966 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.342 -8.616 -17.755 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.613 -10.228 -17.635 1.00 0.00 C ATOM 0 H THR A 9 -10.782 -7.514 -15.702 1.00 0.00 H new ATOM 0 HA THR A 9 -10.057 -10.300 -15.445 1.00 0.00 H new ATOM 0 HB THR A 9 -8.487 -8.234 -16.902 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.044 -8.452 -18.674 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.329 -9.972 -18.656 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.728 -10.535 -17.078 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.332 -11.047 -17.653 1.00 0.00 H new ATOM 156 N ALA A 10 -8.256 -7.924 -14.096 1.00 0.00 N ATOM 157 CA ALA A 10 -7.143 -7.659 -13.196 1.00 0.00 C ATOM 158 C ALA A 10 -7.343 -8.387 -11.873 1.00 0.00 C ATOM 159 O ALA A 10 -6.389 -8.895 -11.284 1.00 0.00 O ATOM 160 CB ALA A 10 -6.983 -6.162 -12.970 1.00 0.00 C ATOM 0 H ALA A 10 -8.835 -7.110 -14.304 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.229 -8.033 -13.657 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.146 -5.983 -12.295 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.792 -5.669 -13.923 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -7.896 -5.761 -12.530 1.00 0.00 H new ATOM 166 N PHE A 11 -8.593 -8.468 -11.424 1.00 0.00 N ATOM 167 CA PHE A 11 -8.912 -9.158 -10.179 1.00 0.00 C ATOM 168 C PHE A 11 -8.450 -10.609 -10.249 1.00 0.00 C ATOM 169 O PHE A 11 -7.873 -11.139 -9.300 1.00 0.00 O ATOM 170 CB PHE A 11 -10.416 -9.094 -9.901 1.00 0.00 C ATOM 171 CG PHE A 11 -10.768 -9.346 -8.463 1.00 0.00 C ATOM 172 CD1 PHE A 11 -10.109 -8.672 -7.448 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.749 -10.262 -8.127 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.421 -8.911 -6.125 1.00 0.00 C ATOM 175 CE2 PHE A 11 -12.067 -10.504 -6.804 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.401 -9.828 -5.802 1.00 0.00 C ATOM 0 H PHE A 11 -9.399 -8.065 -11.903 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.388 -8.661 -9.363 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.790 -8.113 -10.192 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.925 -9.828 -10.526 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.343 -7.952 -7.695 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.272 -10.794 -8.908 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.899 -8.381 -5.343 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.835 -11.221 -6.555 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.646 -10.016 -4.767 1.00 0.00 H new ATOM 186 N GLN A 12 -8.690 -11.236 -11.395 1.00 0.00 N ATOM 187 CA GLN A 12 -8.279 -12.617 -11.606 1.00 0.00 C ATOM 188 C GLN A 12 -6.758 -12.710 -11.624 1.00 0.00 C ATOM 189 O GLN A 12 -6.171 -13.631 -11.056 1.00 0.00 O ATOM 190 CB GLN A 12 -8.862 -13.152 -12.915 1.00 0.00 C ATOM 191 CG GLN A 12 -10.382 -13.140 -12.951 1.00 0.00 C ATOM 192 CD GLN A 12 -10.999 -13.972 -11.843 1.00 0.00 C ATOM 193 OE1 GLN A 12 -11.320 -15.144 -12.037 1.00 0.00 O ATOM 194 NE2 GLN A 12 -11.166 -13.367 -10.672 1.00 0.00 N ATOM 0 H GLN A 12 -9.166 -10.810 -12.190 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.659 -13.227 -10.786 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.482 -12.555 -13.744 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.511 -14.172 -13.070 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.735 -12.112 -12.868 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.722 -13.517 -13.916 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.885 -12.393 -10.556 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.575 -13.876 -9.889 1.00 0.00 H new ATOM 203 N GLU A 13 -6.126 -11.743 -12.287 1.00 0.00 N ATOM 204 CA GLU A 13 -4.672 -11.700 -12.396 1.00 0.00 C ATOM 205 C GLU A 13 -4.010 -11.611 -11.024 1.00 0.00 C ATOM 206 O GLU A 13 -3.077 -12.357 -10.728 1.00 0.00 O ATOM 207 CB GLU A 13 -4.242 -10.511 -13.257 1.00 0.00 C ATOM 208 CG GLU A 13 -4.057 -10.858 -14.724 1.00 0.00 C ATOM 209 CD GLU A 13 -3.398 -9.740 -15.509 1.00 0.00 C ATOM 210 OE1 GLU A 13 -3.958 -8.624 -15.534 1.00 0.00 O ATOM 211 OE2 GLU A 13 -2.323 -9.981 -16.096 1.00 0.00 O ATOM 0 H GLU A 13 -6.603 -10.975 -12.759 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.348 -12.627 -12.869 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.989 -9.722 -13.170 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.307 -10.110 -12.866 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.452 -11.761 -14.807 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.028 -11.084 -15.165 1.00 0.00 H new ATOM 218 N ALA A 14 -4.494 -10.698 -10.186 1.00 0.00 N ATOM 219 CA ALA A 14 -3.938 -10.526 -8.850 1.00 0.00 C ATOM 220 C ALA A 14 -4.200 -11.759 -7.996 1.00 0.00 C ATOM 221 O ALA A 14 -3.379 -12.135 -7.159 1.00 0.00 O ATOM 222 CB ALA A 14 -4.520 -9.287 -8.189 1.00 0.00 C ATOM 0 H ALA A 14 -5.266 -10.070 -10.408 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.860 -10.396 -8.941 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.095 -9.173 -7.192 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.281 -8.409 -8.788 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.602 -9.390 -8.112 1.00 0.00 H new ATOM 228 N LEU A 15 -5.345 -12.396 -8.223 1.00 0.00 N ATOM 229 CA LEU A 15 -5.698 -13.595 -7.480 1.00 0.00 C ATOM 230 C LEU A 15 -4.711 -14.707 -7.810 1.00 0.00 C ATOM 231 O LEU A 15 -4.268 -15.445 -6.930 1.00 0.00 O ATOM 232 CB LEU A 15 -7.127 -14.036 -7.819 1.00 0.00 C ATOM 233 CG LEU A 15 -8.233 -13.369 -6.996 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.579 -14.009 -7.296 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.925 -13.455 -5.508 1.00 0.00 C ATOM 0 H LEU A 15 -6.038 -12.102 -8.911 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.652 -13.378 -6.413 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.311 -13.834 -8.874 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -7.198 -15.115 -7.684 1.00 0.00 H new ATOM 0 HG LEU A 15 -8.278 -12.317 -7.276 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.353 -13.523 -6.703 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.808 -13.895 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.542 -15.069 -7.045 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.724 -12.975 -4.943 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.849 -14.501 -5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.981 -12.950 -5.302 1.00 0.00 H new ATOM 247 N ASP A 16 -4.353 -14.800 -9.088 1.00 0.00 N ATOM 248 CA ASP A 16 -3.398 -15.799 -9.552 1.00 0.00 C ATOM 249 C ASP A 16 -2.009 -15.519 -8.985 1.00 0.00 C ATOM 250 O ASP A 16 -1.188 -16.427 -8.846 1.00 0.00 O ATOM 251 CB ASP A 16 -3.347 -15.810 -11.081 1.00 0.00 C ATOM 252 CG ASP A 16 -4.673 -16.205 -11.701 1.00 0.00 C ATOM 253 OD1 ASP A 16 -5.508 -16.799 -10.987 1.00 0.00 O ATOM 254 OD2 ASP A 16 -4.878 -15.918 -12.899 1.00 0.00 O ATOM 0 H ASP A 16 -4.713 -14.191 -9.823 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.725 -16.777 -9.200 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.062 -14.821 -11.439 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.574 -16.504 -11.411 1.00 0.00 H new ATOM 259 N ALA A 17 -1.743 -14.249 -8.690 1.00 0.00 N ATOM 260 CA ALA A 17 -0.443 -13.845 -8.170 1.00 0.00 C ATOM 261 C ALA A 17 -0.175 -14.491 -6.818 1.00 0.00 C ATOM 262 O ALA A 17 0.885 -15.083 -6.613 1.00 0.00 O ATOM 263 CB ALA A 17 -0.363 -12.329 -8.058 1.00 0.00 C ATOM 0 H ALA A 17 -2.409 -13.485 -8.802 1.00 0.00 H new ATOM 0 HA ALA A 17 0.322 -14.184 -8.868 1.00 0.00 H new ATOM 0 HB1 ALA A 17 0.614 -12.044 -7.668 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -0.505 -11.883 -9.043 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -1.141 -11.972 -7.383 1.00 0.00 H new ATOM 269 N ALA A 18 -1.134 -14.405 -5.902 1.00 0.00 N ATOM 270 CA ALA A 18 -0.957 -15.022 -4.595 1.00 0.00 C ATOM 271 C ALA A 18 -0.942 -16.539 -4.745 1.00 0.00 C ATOM 272 O ALA A 18 0.063 -17.197 -4.477 1.00 0.00 O ATOM 273 CB ALA A 18 -2.080 -14.600 -3.661 1.00 0.00 C ATOM 0 H ALA A 18 -2.024 -13.924 -6.036 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.009 -14.694 -4.169 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -1.938 -15.067 -2.687 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -2.072 -13.516 -3.548 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.037 -14.914 -4.078 1.00 0.00 H new ATOM 279 N GLY A 19 -2.075 -17.078 -5.177 1.00 0.00 N ATOM 280 CA GLY A 19 -2.200 -18.512 -5.366 1.00 0.00 C ATOM 281 C GLY A 19 -2.514 -19.251 -4.076 1.00 0.00 C ATOM 282 O GLY A 19 -3.679 -19.501 -3.765 1.00 0.00 O ATOM 0 H GLY A 19 -2.915 -16.545 -5.401 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -2.987 -18.711 -6.094 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -1.272 -18.901 -5.785 1.00 0.00 H new ATOM 286 N ASP A 20 -1.475 -19.603 -3.323 1.00 0.00 N ATOM 287 CA ASP A 20 -1.652 -20.328 -2.066 1.00 0.00 C ATOM 288 C ASP A 20 -1.701 -19.381 -0.869 1.00 0.00 C ATOM 289 O ASP A 20 -2.160 -19.759 0.209 1.00 0.00 O ATOM 290 CB ASP A 20 -0.516 -21.334 -1.875 1.00 0.00 C ATOM 291 CG ASP A 20 -0.864 -22.418 -0.875 1.00 0.00 C ATOM 292 OD1 ASP A 20 -1.990 -22.954 -0.947 1.00 0.00 O ATOM 293 OD2 ASP A 20 -0.009 -22.733 -0.020 1.00 0.00 O ATOM 0 H ASP A 20 -0.504 -19.399 -3.560 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.605 -20.853 -2.122 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.276 -21.792 -2.834 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.378 -20.808 -1.540 1.00 0.00 H new ATOM 298 N LYS A 21 -1.244 -18.149 -1.063 1.00 0.00 N ATOM 299 CA LYS A 21 -1.256 -17.164 0.002 1.00 0.00 C ATOM 300 C LYS A 21 -2.674 -16.662 0.218 1.00 0.00 C ATOM 301 O LYS A 21 -3.511 -16.741 -0.679 1.00 0.00 O ATOM 302 CB LYS A 21 -0.334 -15.991 -0.342 1.00 0.00 C ATOM 303 CG LYS A 21 1.146 -16.339 -0.313 1.00 0.00 C ATOM 304 CD LYS A 21 1.987 -15.244 -0.953 1.00 0.00 C ATOM 305 CE LYS A 21 3.382 -15.738 -1.304 1.00 0.00 C ATOM 306 NZ LYS A 21 4.142 -14.734 -2.100 1.00 0.00 N ATOM 0 H LYS A 21 -0.862 -17.813 -1.947 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.894 -17.632 0.918 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.590 -15.620 -1.334 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.520 -15.178 0.360 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.466 -16.489 0.718 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.310 -17.280 -0.838 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.491 -14.884 -1.854 1.00 0.00 H new ATOM 0 HD3 LYS A 21 2.062 -14.397 -0.271 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.928 -15.964 -0.388 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.307 -16.667 -1.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.087 -15.108 -2.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.634 -14.537 -2.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 4.236 -13.855 -1.552 1.00 0.00 H new ATOM 320 N LEU A 22 -2.937 -16.133 1.400 1.00 0.00 N ATOM 321 CA LEU A 22 -4.258 -15.606 1.715 1.00 0.00 C ATOM 322 C LEU A 22 -4.416 -14.218 1.107 1.00 0.00 C ATOM 323 O LEU A 22 -3.517 -13.383 1.201 1.00 0.00 O ATOM 324 CB LEU A 22 -4.467 -15.566 3.236 1.00 0.00 C ATOM 325 CG LEU A 22 -5.728 -14.840 3.726 1.00 0.00 C ATOM 326 CD1 LEU A 22 -6.932 -15.170 2.853 1.00 0.00 C ATOM 327 CD2 LEU A 22 -6.014 -15.201 5.174 1.00 0.00 C ATOM 0 H LEU A 22 -2.258 -16.056 2.157 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.017 -16.261 1.288 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.496 -16.591 3.605 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.598 -15.088 3.689 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.546 -13.768 3.656 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.808 -14.640 3.227 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.732 -14.863 1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.118 -16.244 2.880 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.911 -14.679 5.509 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.168 -16.277 5.257 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.169 -14.906 5.796 1.00 0.00 H new ATOM 339 N VAL A 23 -5.551 -13.983 0.463 1.00 0.00 N ATOM 340 CA VAL A 23 -5.807 -12.702 -0.175 1.00 0.00 C ATOM 341 C VAL A 23 -6.954 -11.965 0.493 1.00 0.00 C ATOM 342 O VAL A 23 -8.117 -12.356 0.386 1.00 0.00 O ATOM 343 CB VAL A 23 -6.115 -12.868 -1.675 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.129 -11.514 -2.370 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.109 -13.801 -2.334 1.00 0.00 C ATOM 0 H VAL A 23 -6.307 -14.662 0.369 1.00 0.00 H new ATOM 0 HA VAL A 23 -4.896 -12.114 -0.064 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.104 -13.315 -1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.348 -11.651 -3.429 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.894 -10.882 -1.920 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.154 -11.038 -2.260 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.347 -13.903 -3.393 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.106 -13.389 -2.225 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.153 -14.780 -1.856 1.00 0.00 H new ATOM 355 N VAL A 24 -6.612 -10.882 1.173 1.00 0.00 N ATOM 356 CA VAL A 24 -7.598 -10.061 1.848 1.00 0.00 C ATOM 357 C VAL A 24 -7.784 -8.778 1.059 1.00 0.00 C ATOM 358 O VAL A 24 -6.858 -7.982 0.915 1.00 0.00 O ATOM 359 CB VAL A 24 -7.178 -9.740 3.296 1.00 0.00 C ATOM 360 CG1 VAL A 24 -5.843 -9.013 3.321 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.253 -8.930 4.004 1.00 0.00 C ATOM 0 H VAL A 24 -5.652 -10.552 1.271 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.537 -10.612 1.900 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.059 -10.681 3.833 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.566 -8.796 4.353 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.078 -9.641 2.864 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -5.926 -8.080 2.764 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -7.934 -8.716 5.024 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.414 -7.994 3.470 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.182 -9.499 4.026 1.00 0.00 H new ATOM 371 N VAL A 25 -8.978 -8.600 0.520 1.00 0.00 N ATOM 372 CA VAL A 25 -9.275 -7.436 -0.294 1.00 0.00 C ATOM 373 C VAL A 25 -10.461 -6.651 0.254 1.00 0.00 C ATOM 374 O VAL A 25 -11.192 -7.128 1.123 1.00 0.00 O ATOM 375 CB VAL A 25 -9.541 -7.858 -1.752 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.233 -8.150 -2.467 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.429 -9.085 -1.799 1.00 0.00 C ATOM 0 H VAL A 25 -9.758 -9.248 0.632 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.404 -6.781 -0.264 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.048 -7.034 -2.255 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.439 -8.447 -3.495 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.610 -7.256 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.710 -8.958 -1.954 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.605 -9.367 -2.837 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.940 -9.908 -1.277 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.381 -8.864 -1.317 1.00 0.00 H new ATOM 387 N ASP A 26 -10.638 -5.438 -0.252 1.00 0.00 N ATOM 388 CA ASP A 26 -11.726 -4.577 0.194 1.00 0.00 C ATOM 389 C ASP A 26 -12.486 -3.980 -0.984 1.00 0.00 C ATOM 390 O ASP A 26 -11.887 -3.427 -1.905 1.00 0.00 O ATOM 391 CB ASP A 26 -11.172 -3.456 1.077 1.00 0.00 C ATOM 392 CG ASP A 26 -12.244 -2.790 1.916 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.419 -2.794 1.494 1.00 0.00 O ATOM 394 OD2 ASP A 26 -11.908 -2.262 2.998 1.00 0.00 O ATOM 0 H ASP A 26 -10.043 -5.028 -0.971 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.423 -5.187 0.768 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.403 -3.862 1.733 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.691 -2.707 0.448 1.00 0.00 H new ATOM 399 N PHE A 27 -13.813 -4.062 -0.928 1.00 0.00 N ATOM 400 CA PHE A 27 -14.664 -3.501 -1.976 1.00 0.00 C ATOM 401 C PHE A 27 -15.167 -2.128 -1.538 1.00 0.00 C ATOM 402 O PHE A 27 -15.938 -2.021 -0.585 1.00 0.00 O ATOM 403 CB PHE A 27 -15.844 -4.429 -2.262 1.00 0.00 C ATOM 404 CG PHE A 27 -15.597 -5.336 -3.431 1.00 0.00 C ATOM 405 CD1 PHE A 27 -14.947 -6.547 -3.256 1.00 0.00 C ATOM 406 CD2 PHE A 27 -15.989 -4.966 -4.708 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.696 -7.376 -4.335 1.00 0.00 C ATOM 408 CE2 PHE A 27 -15.743 -5.792 -5.789 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.095 -6.998 -5.602 1.00 0.00 C ATOM 0 H PHE A 27 -14.323 -4.512 -0.168 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.081 -3.398 -2.892 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.050 -5.031 -1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.734 -3.830 -2.454 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.633 -6.847 -2.267 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.492 -4.022 -4.860 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -14.189 -8.318 -4.187 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.057 -5.495 -6.779 1.00 0.00 H new ATOM 0 HZ PHE A 27 -14.901 -7.644 -6.445 1.00 0.00 H new ATOM 419 N SER A 28 -14.706 -1.077 -2.208 1.00 0.00 N ATOM 420 CA SER A 28 -15.097 0.279 -1.843 1.00 0.00 C ATOM 421 C SER A 28 -15.860 0.987 -2.960 1.00 0.00 C ATOM 422 O SER A 28 -16.237 0.382 -3.964 1.00 0.00 O ATOM 423 CB SER A 28 -13.854 1.089 -1.467 1.00 0.00 C ATOM 424 OG SER A 28 -14.208 2.366 -0.962 1.00 0.00 O ATOM 0 H SER A 28 -14.066 -1.137 -3.000 1.00 0.00 H new ATOM 0 HA SER A 28 -15.770 0.206 -0.989 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.276 0.547 -0.719 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.214 1.205 -2.342 1.00 0.00 H new ATOM 0 HG SER A 28 -13.396 2.862 -0.728 1.00 0.00 H new ATOM 430 N ALA A 29 -16.069 2.285 -2.763 1.00 0.00 N ATOM 431 CA ALA A 29 -16.771 3.124 -3.727 1.00 0.00 C ATOM 432 C ALA A 29 -16.294 4.567 -3.623 1.00 0.00 C ATOM 433 O ALA A 29 -15.834 4.998 -2.565 1.00 0.00 O ATOM 434 CB ALA A 29 -18.276 3.044 -3.511 1.00 0.00 C ATOM 0 H ALA A 29 -15.756 2.784 -1.930 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.548 2.757 -4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.782 3.677 -4.240 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.607 2.013 -3.634 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -18.518 3.385 -2.504 1.00 0.00 H new ATOM 440 N THR A 30 -16.435 5.323 -4.704 1.00 0.00 N ATOM 441 CA THR A 30 -16.044 6.728 -4.704 1.00 0.00 C ATOM 442 C THR A 30 -17.034 7.550 -3.886 1.00 0.00 C ATOM 443 O THR A 30 -16.668 8.520 -3.223 1.00 0.00 O ATOM 444 CB THR A 30 -15.978 7.263 -6.134 1.00 0.00 C ATOM 445 OG1 THR A 30 -15.594 6.241 -7.036 1.00 0.00 O ATOM 446 CG2 THR A 30 -15.005 8.409 -6.295 1.00 0.00 C ATOM 0 H THR A 30 -16.816 4.989 -5.589 1.00 0.00 H new ATOM 0 HA THR A 30 -15.055 6.812 -4.253 1.00 0.00 H new ATOM 0 HB THR A 30 -16.982 7.625 -6.356 1.00 0.00 H new ATOM 0 HG1 THR A 30 -16.067 6.360 -7.886 1.00 0.00 H new ATOM 0 HG21 THR A 30 -15.005 8.743 -7.332 1.00 0.00 H new ATOM 0 HG22 THR A 30 -15.304 9.234 -5.648 1.00 0.00 H new ATOM 0 HG23 THR A 30 -14.004 8.077 -6.021 1.00 0.00 H new ATOM 454 N TRP A 31 -18.300 7.153 -3.970 1.00 0.00 N ATOM 455 CA TRP A 31 -19.388 7.842 -3.279 1.00 0.00 C ATOM 456 C TRP A 31 -19.554 7.354 -1.834 1.00 0.00 C ATOM 457 O TRP A 31 -20.544 7.678 -1.177 1.00 0.00 O ATOM 458 CB TRP A 31 -20.689 7.613 -4.054 1.00 0.00 C ATOM 459 CG TRP A 31 -21.102 6.172 -4.069 1.00 0.00 C ATOM 460 CD1 TRP A 31 -20.677 5.202 -4.937 1.00 0.00 C ATOM 461 CD2 TRP A 31 -22.008 5.532 -3.165 1.00 0.00 C ATOM 462 NE1 TRP A 31 -21.257 3.999 -4.613 1.00 0.00 N ATOM 463 CE2 TRP A 31 -22.077 4.177 -3.534 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.764 5.969 -2.073 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.871 3.258 -2.856 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -23.553 5.054 -1.400 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.598 3.712 -1.793 1.00 0.00 C ATOM 0 H TRP A 31 -18.602 6.347 -4.517 1.00 0.00 H new ATOM 0 HA TRP A 31 -19.147 8.904 -3.237 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -21.484 8.211 -3.608 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -20.564 7.963 -5.079 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -19.989 5.359 -5.754 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -21.101 3.116 -5.099 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -22.732 7.002 -1.761 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.911 2.222 -3.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -24.144 5.381 -0.557 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -24.221 3.021 -1.244 1.00 0.00 H new ATOM 478 N CYS A 32 -18.585 6.586 -1.338 1.00 0.00 N ATOM 479 CA CYS A 32 -18.644 6.080 0.030 1.00 0.00 C ATOM 480 C CYS A 32 -17.840 6.959 0.981 1.00 0.00 C ATOM 481 O CYS A 32 -16.931 7.676 0.564 1.00 0.00 O ATOM 482 CB CYS A 32 -18.127 4.642 0.102 1.00 0.00 C ATOM 483 SG CYS A 32 -18.606 3.762 1.627 1.00 0.00 S ATOM 0 H CYS A 32 -17.756 6.303 -1.860 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.690 6.099 0.337 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -18.501 4.088 -0.759 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -17.040 4.653 0.026 1.00 0.00 H new ATOM 488 N GLY A 33 -18.171 6.877 2.266 1.00 0.00 N ATOM 489 CA GLY A 33 -17.466 7.651 3.271 1.00 0.00 C ATOM 490 C GLY A 33 -16.656 6.768 4.205 1.00 0.00 C ATOM 491 O GLY A 33 -15.426 6.823 4.196 1.00 0.00 O ATOM 0 H GLY A 33 -18.918 6.286 2.630 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.803 8.364 2.780 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.184 8.231 3.852 1.00 0.00 H new ATOM 495 N PRO A 34 -17.319 5.932 5.027 1.00 0.00 N ATOM 496 CA PRO A 34 -16.629 5.034 5.961 1.00 0.00 C ATOM 497 C PRO A 34 -15.701 4.060 5.244 1.00 0.00 C ATOM 498 O PRO A 34 -14.752 3.543 5.835 1.00 0.00 O ATOM 499 CB PRO A 34 -17.767 4.267 6.644 1.00 0.00 C ATOM 500 CG PRO A 34 -18.980 5.105 6.434 1.00 0.00 C ATOM 501 CD PRO A 34 -18.783 5.791 5.112 1.00 0.00 C ATOM 0 HA PRO A 34 -15.996 5.587 6.654 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -17.892 3.276 6.208 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.565 4.125 7.706 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.881 4.492 6.425 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -19.096 5.832 7.238 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -19.180 5.199 4.287 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.284 6.758 5.081 1.00 0.00 H new ATOM 509 N CYS A 35 -15.982 3.812 3.968 1.00 0.00 N ATOM 510 CA CYS A 35 -15.174 2.895 3.171 1.00 0.00 C ATOM 511 C CYS A 35 -13.722 3.356 3.120 1.00 0.00 C ATOM 512 O CYS A 35 -12.800 2.555 3.270 1.00 0.00 O ATOM 513 CB CYS A 35 -15.728 2.794 1.748 1.00 0.00 C ATOM 514 SG CYS A 35 -17.417 2.115 1.646 1.00 0.00 S ATOM 0 H CYS A 35 -16.763 4.233 3.464 1.00 0.00 H new ATOM 0 HA CYS A 35 -15.216 1.914 3.644 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.720 3.786 1.296 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -15.061 2.168 1.155 1.00 0.00 H new ATOM 519 N LYS A 36 -13.528 4.650 2.901 1.00 0.00 N ATOM 520 CA LYS A 36 -12.189 5.218 2.821 1.00 0.00 C ATOM 521 C LYS A 36 -11.454 5.110 4.156 1.00 0.00 C ATOM 522 O LYS A 36 -10.224 5.089 4.192 1.00 0.00 O ATOM 523 CB LYS A 36 -12.262 6.683 2.382 1.00 0.00 C ATOM 524 CG LYS A 36 -12.467 6.855 0.884 1.00 0.00 C ATOM 525 CD LYS A 36 -13.565 7.863 0.579 1.00 0.00 C ATOM 526 CE LYS A 36 -13.030 9.285 0.563 1.00 0.00 C ATOM 527 NZ LYS A 36 -14.108 10.287 0.783 1.00 0.00 N ATOM 0 H LYS A 36 -14.281 5.326 2.776 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.629 4.646 2.081 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.079 7.173 2.912 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.342 7.189 2.676 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.534 7.182 0.424 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.722 5.893 0.439 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -14.014 7.632 -0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -14.355 7.779 1.326 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -12.269 9.395 1.336 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.544 9.479 -0.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -13.701 11.244 0.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -14.822 10.200 0.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.555 10.118 1.707 1.00 0.00 H new ATOM 541 N MET A 37 -12.206 5.065 5.253 1.00 0.00 N ATOM 542 CA MET A 37 -11.608 4.989 6.583 1.00 0.00 C ATOM 543 C MET A 37 -10.885 3.665 6.823 1.00 0.00 C ATOM 544 O MET A 37 -10.065 3.565 7.735 1.00 0.00 O ATOM 545 CB MET A 37 -12.678 5.196 7.655 1.00 0.00 C ATOM 546 CG MET A 37 -13.196 6.622 7.721 1.00 0.00 C ATOM 547 SD MET A 37 -13.938 7.022 9.313 1.00 0.00 S ATOM 548 CE MET A 37 -15.496 7.726 8.781 1.00 0.00 C ATOM 0 H MET A 37 -13.226 5.080 5.248 1.00 0.00 H new ATOM 0 HA MET A 37 -10.864 5.783 6.644 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.513 4.523 7.460 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.267 4.921 8.626 1.00 0.00 H new ATOM 0 HG2 MET A 37 -12.375 7.311 7.524 1.00 0.00 H new ATOM 0 HG3 MET A 37 -13.934 6.772 6.933 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.904 8.349 9.577 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.336 8.333 7.890 1.00 0.00 H new ATOM 0 HE3 MET A 37 -16.198 6.924 8.552 1.00 0.00 H new ATOM 558 N ILE A 38 -11.171 2.651 6.010 1.00 0.00 N ATOM 559 CA ILE A 38 -10.518 1.352 6.171 1.00 0.00 C ATOM 560 C ILE A 38 -9.181 1.311 5.425 1.00 0.00 C ATOM 561 O ILE A 38 -8.313 0.499 5.739 1.00 0.00 O ATOM 562 CB ILE A 38 -11.414 0.201 5.658 1.00 0.00 C ATOM 563 CG1 ILE A 38 -12.830 0.314 6.238 1.00 0.00 C ATOM 564 CG2 ILE A 38 -10.799 -1.149 6.004 1.00 0.00 C ATOM 565 CD1 ILE A 38 -12.919 -0.007 7.716 1.00 0.00 C ATOM 0 H ILE A 38 -11.841 2.700 5.243 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.342 1.218 7.238 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.484 0.280 4.573 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.199 1.327 6.074 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.490 -0.358 5.690 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.443 -1.947 5.635 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.817 -1.231 5.539 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.697 -1.236 7.086 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -13.952 0.096 8.049 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.583 -1.030 7.887 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.287 0.681 8.277 1.00 0.00 H new ATOM 577 N LYS A 39 -9.028 2.191 4.436 1.00 0.00 N ATOM 578 CA LYS A 39 -7.804 2.257 3.634 1.00 0.00 C ATOM 579 C LYS A 39 -6.539 2.347 4.492 1.00 0.00 C ATOM 580 O LYS A 39 -5.656 1.496 4.389 1.00 0.00 O ATOM 581 CB LYS A 39 -7.857 3.454 2.682 1.00 0.00 C ATOM 582 CG LYS A 39 -8.603 3.174 1.388 1.00 0.00 C ATOM 583 CD LYS A 39 -8.021 3.965 0.228 1.00 0.00 C ATOM 584 CE LYS A 39 -8.789 3.711 -1.058 1.00 0.00 C ATOM 585 NZ LYS A 39 -10.111 4.395 -1.057 1.00 0.00 N ATOM 0 H LYS A 39 -9.739 2.872 4.169 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.753 1.328 3.067 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.334 4.291 3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.839 3.763 2.444 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.556 2.108 1.163 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -9.656 3.428 1.511 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.045 5.029 0.463 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.975 3.692 0.089 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.201 4.058 -1.907 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.935 2.639 -1.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.576 4.254 -1.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.707 3.997 -0.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.975 5.413 -0.890 1.00 0.00 H new ATOM 599 N PRO A 40 -6.415 3.390 5.338 1.00 0.00 N ATOM 600 CA PRO A 40 -5.233 3.580 6.184 1.00 0.00 C ATOM 601 C PRO A 40 -4.861 2.328 6.973 1.00 0.00 C ATOM 602 O PRO A 40 -3.687 1.965 7.050 1.00 0.00 O ATOM 603 CB PRO A 40 -5.625 4.727 7.129 1.00 0.00 C ATOM 604 CG PRO A 40 -7.089 4.937 6.924 1.00 0.00 C ATOM 605 CD PRO A 40 -7.390 4.471 5.529 1.00 0.00 C ATOM 0 HA PRO A 40 -4.350 3.800 5.585 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -5.408 4.471 8.166 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.064 5.633 6.899 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.669 4.374 7.656 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.352 5.987 7.048 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.415 4.114 5.433 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -7.260 5.269 4.798 1.00 0.00 H new ATOM 613 N PHE A 41 -5.853 1.680 7.576 1.00 0.00 N ATOM 614 CA PHE A 41 -5.598 0.485 8.380 1.00 0.00 C ATOM 615 C PHE A 41 -5.399 -0.752 7.507 1.00 0.00 C ATOM 616 O PHE A 41 -4.643 -1.655 7.868 1.00 0.00 O ATOM 617 CB PHE A 41 -6.759 0.231 9.345 1.00 0.00 C ATOM 618 CG PHE A 41 -7.279 1.464 10.033 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.482 2.175 10.917 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.570 1.905 9.798 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.967 3.303 11.553 1.00 0.00 C ATOM 622 CE2 PHE A 41 -9.058 3.032 10.431 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.257 3.731 11.308 1.00 0.00 C ATOM 0 H PHE A 41 -6.833 1.957 7.525 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.681 0.667 8.941 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.577 -0.235 8.795 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.436 -0.483 10.102 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.472 1.845 11.111 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.203 1.362 9.112 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.338 3.849 12.241 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -10.067 3.365 10.239 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.638 4.612 11.803 1.00 0.00 H new ATOM 633 N PHE A 42 -6.070 -0.799 6.360 1.00 0.00 N ATOM 634 CA PHE A 42 -5.945 -1.940 5.456 1.00 0.00 C ATOM 635 C PHE A 42 -4.533 -2.021 4.890 1.00 0.00 C ATOM 636 O PHE A 42 -3.932 -3.095 4.839 1.00 0.00 O ATOM 637 CB PHE A 42 -6.956 -1.838 4.311 1.00 0.00 C ATOM 638 CG PHE A 42 -7.411 -3.167 3.772 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.314 -3.942 4.482 1.00 0.00 C ATOM 640 CD2 PHE A 42 -6.946 -3.637 2.550 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.745 -5.158 3.987 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.373 -4.854 2.053 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.275 -5.614 2.771 1.00 0.00 C ATOM 0 H PHE A 42 -6.702 -0.067 6.035 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.151 -2.845 6.027 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.827 -1.282 4.658 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.512 -1.262 3.499 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.685 -3.591 5.434 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.243 -3.045 1.982 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.449 -5.752 4.551 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.001 -5.210 1.104 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.612 -6.563 2.382 1.00 0.00 H new ATOM 653 N HIS A 43 -4.013 -0.878 4.459 1.00 0.00 N ATOM 654 CA HIS A 43 -2.676 -0.813 3.883 1.00 0.00 C ATOM 655 C HIS A 43 -1.602 -1.120 4.924 1.00 0.00 C ATOM 656 O HIS A 43 -0.608 -1.778 4.620 1.00 0.00 O ATOM 657 CB HIS A 43 -2.432 0.564 3.265 1.00 0.00 C ATOM 658 CG HIS A 43 -1.810 0.500 1.905 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.461 0.856 0.745 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.566 0.109 1.530 1.00 0.00 C ATOM 661 CE1 HIS A 43 -1.611 0.672 -0.276 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.447 0.221 0.149 1.00 0.00 N ATOM 0 H HIS A 43 -4.498 0.018 4.498 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.613 -1.572 3.103 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.380 1.098 3.199 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.786 1.142 3.926 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.209 -0.235 2.199 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -1.849 0.868 -1.311 1.00 0.00 H new ATOM 0 HE2 HIS A 43 0.372 -0.000 -0.418 1.00 0.00 H new ATOM 670 N SER A 44 -1.801 -0.644 6.149 1.00 0.00 N ATOM 671 CA SER A 44 -0.836 -0.876 7.218 1.00 0.00 C ATOM 672 C SER A 44 -0.652 -2.370 7.465 1.00 0.00 C ATOM 673 O SER A 44 0.470 -2.847 7.646 1.00 0.00 O ATOM 674 CB SER A 44 -1.295 -0.188 8.506 1.00 0.00 C ATOM 675 OG SER A 44 -0.917 1.178 8.516 1.00 0.00 O ATOM 0 H SER A 44 -2.617 -0.098 6.425 1.00 0.00 H new ATOM 0 HA SER A 44 0.121 -0.454 6.910 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.378 -0.270 8.600 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.861 -0.695 9.368 1.00 0.00 H new ATOM 0 HG SER A 44 -1.607 1.712 8.069 1.00 0.00 H new ATOM 681 N LEU A 45 -1.758 -3.105 7.473 1.00 0.00 N ATOM 682 CA LEU A 45 -1.709 -4.544 7.701 1.00 0.00 C ATOM 683 C LEU A 45 -0.879 -5.227 6.617 1.00 0.00 C ATOM 684 O LEU A 45 -0.064 -6.105 6.906 1.00 0.00 O ATOM 685 CB LEU A 45 -3.128 -5.127 7.731 1.00 0.00 C ATOM 686 CG LEU A 45 -3.964 -4.736 8.954 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.444 -4.694 8.601 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.720 -5.705 10.103 1.00 0.00 C ATOM 0 H LEU A 45 -2.695 -2.731 7.325 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.236 -4.726 8.666 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.655 -4.807 6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.059 -6.214 7.690 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.657 -3.740 9.272 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.021 -4.414 9.483 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.609 -3.960 7.812 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.764 -5.677 8.255 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.323 -5.410 10.962 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.997 -6.713 9.794 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.665 -5.687 10.377 1.00 0.00 H new ATOM 700 N SER A 46 -1.081 -4.810 5.370 1.00 0.00 N ATOM 701 CA SER A 46 -0.342 -5.372 4.243 1.00 0.00 C ATOM 702 C SER A 46 1.167 -5.275 4.462 1.00 0.00 C ATOM 703 O SER A 46 1.932 -6.068 3.911 1.00 0.00 O ATOM 704 CB SER A 46 -0.724 -4.656 2.946 1.00 0.00 C ATOM 705 OG SER A 46 -0.058 -3.410 2.833 1.00 0.00 O ATOM 0 H SER A 46 -1.751 -4.084 5.114 1.00 0.00 H new ATOM 0 HA SER A 46 -0.609 -6.426 4.165 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.471 -5.285 2.092 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.802 -4.499 2.918 1.00 0.00 H new ATOM 0 HG SER A 46 -0.329 -2.826 3.572 1.00 0.00 H new ATOM 711 N GLU A 47 1.599 -4.302 5.267 1.00 0.00 N ATOM 712 CA GLU A 47 3.023 -4.120 5.542 1.00 0.00 C ATOM 713 C GLU A 47 3.478 -4.990 6.709 1.00 0.00 C ATOM 714 O GLU A 47 4.658 -5.319 6.822 1.00 0.00 O ATOM 715 CB GLU A 47 3.333 -2.651 5.836 1.00 0.00 C ATOM 716 CG GLU A 47 4.815 -2.317 5.759 1.00 0.00 C ATOM 717 CD GLU A 47 5.077 -0.958 5.139 1.00 0.00 C ATOM 718 OE1 GLU A 47 4.357 -0.592 4.187 1.00 0.00 O ATOM 719 OE2 GLU A 47 6.002 -0.260 5.605 1.00 0.00 O ATOM 0 H GLU A 47 0.988 -3.634 5.736 1.00 0.00 H new ATOM 0 HA GLU A 47 3.571 -4.427 4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.790 -2.025 5.128 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.964 -2.402 6.831 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.242 -2.343 6.762 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.326 -3.083 5.175 1.00 0.00 H new ATOM 726 N LYS A 48 2.538 -5.372 7.566 1.00 0.00 N ATOM 727 CA LYS A 48 2.862 -6.216 8.709 1.00 0.00 C ATOM 728 C LYS A 48 2.631 -7.683 8.358 1.00 0.00 C ATOM 729 O LYS A 48 3.161 -8.581 9.010 1.00 0.00 O ATOM 730 CB LYS A 48 2.008 -5.825 9.920 1.00 0.00 C ATOM 731 CG LYS A 48 2.397 -6.549 11.199 1.00 0.00 C ATOM 732 CD LYS A 48 1.179 -6.878 12.046 1.00 0.00 C ATOM 733 CE LYS A 48 0.700 -8.300 11.803 1.00 0.00 C ATOM 734 NZ LYS A 48 -0.142 -8.800 12.924 1.00 0.00 N ATOM 0 H LYS A 48 1.554 -5.113 7.492 1.00 0.00 H new ATOM 0 HA LYS A 48 3.913 -6.073 8.962 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.092 -4.750 10.081 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.961 -6.034 9.698 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.928 -7.468 10.951 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.085 -5.929 11.774 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.423 -6.750 13.101 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.375 -6.178 11.817 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.129 -8.337 10.875 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.561 -8.956 11.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.777 -9.546 12.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 0.469 -9.187 13.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.707 -8.017 13.310 1.00 0.00 H new ATOM 748 N TYR A 49 1.843 -7.911 7.309 1.00 0.00 N ATOM 749 CA TYR A 49 1.537 -9.260 6.847 1.00 0.00 C ATOM 750 C TYR A 49 2.397 -9.633 5.643 1.00 0.00 C ATOM 751 O TYR A 49 1.990 -9.437 4.499 1.00 0.00 O ATOM 752 CB TYR A 49 0.063 -9.357 6.461 1.00 0.00 C ATOM 753 CG TYR A 49 -0.847 -9.680 7.621 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.230 -8.694 8.520 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.319 -10.971 7.822 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.059 -8.983 9.586 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.148 -11.269 8.886 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.516 -10.271 9.764 1.00 0.00 C ATOM 759 OH TYR A 49 -3.342 -10.564 10.825 1.00 0.00 O ATOM 0 H TYR A 49 1.403 -7.172 6.761 1.00 0.00 H new ATOM 0 HA TYR A 49 1.752 -9.952 7.661 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.250 -8.412 6.017 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.053 -10.123 5.695 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -0.874 -7.684 8.383 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -1.033 -11.754 7.135 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.348 -8.204 10.276 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.506 -12.278 9.030 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.574 -11.516 10.806 1.00 0.00 H new ATOM 769 N SER A 50 3.579 -10.179 5.903 1.00 0.00 N ATOM 770 CA SER A 50 4.482 -10.584 4.829 1.00 0.00 C ATOM 771 C SER A 50 4.167 -12.008 4.375 1.00 0.00 C ATOM 772 O SER A 50 5.055 -12.857 4.287 1.00 0.00 O ATOM 773 CB SER A 50 5.936 -10.486 5.297 1.00 0.00 C ATOM 774 OG SER A 50 6.052 -10.803 6.674 1.00 0.00 O ATOM 0 H SER A 50 3.935 -10.352 6.843 1.00 0.00 H new ATOM 0 HA SER A 50 4.339 -9.912 3.983 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.556 -11.164 4.711 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.311 -9.478 5.120 1.00 0.00 H new ATOM 0 HG SER A 50 6.991 -10.735 6.947 1.00 0.00 H new ATOM 780 N ASN A 51 2.892 -12.257 4.082 1.00 0.00 N ATOM 781 CA ASN A 51 2.444 -13.570 3.629 1.00 0.00 C ATOM 782 C ASN A 51 1.186 -13.445 2.774 1.00 0.00 C ATOM 783 O ASN A 51 1.047 -14.113 1.748 1.00 0.00 O ATOM 784 CB ASN A 51 2.164 -14.477 4.828 1.00 0.00 C ATOM 785 CG ASN A 51 2.592 -15.910 4.583 1.00 0.00 C ATOM 786 OD1 ASN A 51 3.507 -16.175 3.804 1.00 0.00 O ATOM 787 ND2 ASN A 51 1.927 -16.845 5.253 1.00 0.00 N ATOM 0 H ASN A 51 2.149 -11.562 4.151 1.00 0.00 H new ATOM 0 HA ASN A 51 3.237 -14.010 3.024 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.686 -14.089 5.703 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.099 -14.453 5.057 1.00 0.00 H new ATOM 0 HD21 ASN A 51 2.169 -17.829 5.132 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.175 -16.579 5.889 1.00 0.00 H new ATOM 794 N VAL A 52 0.265 -12.594 3.221 1.00 0.00 N ATOM 795 CA VAL A 52 -0.996 -12.385 2.521 1.00 0.00 C ATOM 796 C VAL A 52 -0.912 -11.211 1.556 1.00 0.00 C ATOM 797 O VAL A 52 -0.100 -10.304 1.734 1.00 0.00 O ATOM 798 CB VAL A 52 -2.142 -12.123 3.521 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.194 -13.220 4.566 1.00 0.00 C ATOM 800 CG2 VAL A 52 -1.983 -10.762 4.187 1.00 0.00 C ATOM 0 H VAL A 52 0.371 -12.037 4.069 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.199 -13.295 1.957 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.081 -12.123 2.968 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.008 -13.020 5.263 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.362 -14.180 4.078 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.250 -13.250 5.109 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.803 -10.601 4.887 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.035 -10.728 4.724 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -1.997 -9.981 3.427 1.00 0.00 H new ATOM 810 N ILE A 53 -1.751 -11.240 0.528 1.00 0.00 N ATOM 811 CA ILE A 53 -1.769 -10.182 -0.470 1.00 0.00 C ATOM 812 C ILE A 53 -2.967 -9.253 -0.264 1.00 0.00 C ATOM 813 O ILE A 53 -4.120 -9.654 -0.410 1.00 0.00 O ATOM 814 CB ILE A 53 -1.759 -10.778 -1.908 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.034 -9.842 -2.875 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.163 -11.081 -2.417 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.461 -10.061 -2.914 1.00 0.00 C ATOM 0 H ILE A 53 -2.428 -11.986 0.365 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.864 -9.586 -0.348 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.220 -11.724 -1.857 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.440 -9.981 -3.877 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.235 -8.810 -2.589 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.104 -11.495 -3.424 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.642 -11.803 -1.756 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.749 -10.162 -2.436 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.913 -9.364 -3.620 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.879 -9.894 -1.921 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.671 -11.083 -3.229 1.00 0.00 H new ATOM 829 N PHE A 54 -2.668 -8.004 0.086 1.00 0.00 N ATOM 830 CA PHE A 54 -3.690 -6.986 0.327 1.00 0.00 C ATOM 831 C PHE A 54 -3.880 -6.136 -0.928 1.00 0.00 C ATOM 832 O PHE A 54 -2.950 -5.449 -1.346 1.00 0.00 O ATOM 833 CB PHE A 54 -3.244 -6.047 1.459 1.00 0.00 C ATOM 834 CG PHE A 54 -3.618 -6.449 2.866 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.137 -7.611 3.460 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.443 -5.619 3.609 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.479 -7.927 4.767 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.789 -5.934 4.907 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.307 -7.087 5.487 1.00 0.00 C ATOM 0 H PHE A 54 -1.713 -7.669 0.211 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.618 -7.492 0.595 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.160 -5.949 1.411 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.663 -5.059 1.266 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.493 -8.272 2.900 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.821 -4.710 3.164 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.098 -8.830 5.222 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.437 -5.277 5.468 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.576 -7.334 6.503 1.00 0.00 H new ATOM 849 N LEU A 55 -5.070 -6.154 -1.527 1.00 0.00 N ATOM 850 CA LEU A 55 -5.295 -5.343 -2.719 1.00 0.00 C ATOM 851 C LEU A 55 -6.569 -4.517 -2.626 1.00 0.00 C ATOM 852 O LEU A 55 -7.403 -4.725 -1.743 1.00 0.00 O ATOM 853 CB LEU A 55 -5.244 -6.190 -3.995 1.00 0.00 C ATOM 854 CG LEU A 55 -6.574 -6.558 -4.660 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.799 -5.694 -5.891 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.567 -8.029 -5.047 1.00 0.00 C ATOM 0 H LEU A 55 -5.871 -6.704 -1.217 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.474 -4.629 -2.776 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.639 -5.656 -4.728 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.718 -7.116 -3.762 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.386 -6.380 -3.955 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.747 -5.964 -6.356 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.824 -4.644 -5.599 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.988 -5.854 -6.601 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.515 -8.285 -5.519 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.751 -8.218 -5.745 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.430 -8.639 -4.154 1.00 0.00 H new ATOM 868 N GLU A 56 -6.676 -3.536 -3.513 1.00 0.00 N ATOM 869 CA GLU A 56 -7.804 -2.616 -3.507 1.00 0.00 C ATOM 870 C GLU A 56 -8.703 -2.759 -4.723 1.00 0.00 C ATOM 871 O GLU A 56 -8.291 -2.479 -5.848 1.00 0.00 O ATOM 872 CB GLU A 56 -7.258 -1.198 -3.489 1.00 0.00 C ATOM 873 CG GLU A 56 -8.046 -0.234 -2.618 1.00 0.00 C ATOM 874 CD GLU A 56 -7.807 1.215 -2.997 1.00 0.00 C ATOM 875 OE1 GLU A 56 -6.681 1.710 -2.768 1.00 0.00 O ATOM 876 OE2 GLU A 56 -8.741 1.854 -3.524 1.00 0.00 O ATOM 0 H GLU A 56 -5.992 -3.357 -4.248 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.406 -2.846 -2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.226 -1.223 -3.140 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.240 -0.815 -4.509 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.109 -0.458 -2.703 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.771 -0.384 -1.574 1.00 0.00 H new ATOM 883 N VAL A 57 -9.946 -3.158 -4.498 1.00 0.00 N ATOM 884 CA VAL A 57 -10.891 -3.288 -5.594 1.00 0.00 C ATOM 885 C VAL A 57 -12.021 -2.275 -5.465 1.00 0.00 C ATOM 886 O VAL A 57 -12.799 -2.308 -4.515 1.00 0.00 O ATOM 887 CB VAL A 57 -11.507 -4.693 -5.688 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.060 -4.899 -7.083 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.492 -5.774 -5.351 1.00 0.00 C ATOM 0 H VAL A 57 -10.319 -3.394 -3.579 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.317 -3.102 -6.501 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.312 -4.770 -4.957 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.499 -5.894 -7.157 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.825 -4.149 -7.286 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.255 -4.802 -7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.964 -6.753 -5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.656 -5.718 -6.048 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.127 -5.626 -4.335 1.00 0.00 H new ATOM 899 N ASP A 58 -12.104 -1.374 -6.433 1.00 0.00 N ATOM 900 CA ASP A 58 -13.140 -0.354 -6.440 1.00 0.00 C ATOM 901 C ASP A 58 -14.267 -0.781 -7.373 1.00 0.00 C ATOM 902 O ASP A 58 -14.045 -1.020 -8.559 1.00 0.00 O ATOM 903 CB ASP A 58 -12.553 0.990 -6.875 1.00 0.00 C ATOM 904 CG ASP A 58 -13.601 2.080 -6.989 1.00 0.00 C ATOM 905 OD1 ASP A 58 -14.359 2.279 -6.017 1.00 0.00 O ATOM 906 OD2 ASP A 58 -13.660 2.737 -8.050 1.00 0.00 O ATOM 0 H ASP A 58 -11.464 -1.329 -7.226 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.543 -0.238 -5.434 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.792 1.298 -6.158 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.055 0.869 -7.837 1.00 0.00 H new ATOM 911 N VAL A 59 -15.468 -0.913 -6.821 1.00 0.00 N ATOM 912 CA VAL A 59 -16.624 -1.346 -7.595 1.00 0.00 C ATOM 913 C VAL A 59 -16.943 -0.385 -8.737 1.00 0.00 C ATOM 914 O VAL A 59 -17.611 -0.762 -9.701 1.00 0.00 O ATOM 915 CB VAL A 59 -17.862 -1.504 -6.691 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.218 -0.178 -6.042 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.040 -2.064 -7.476 1.00 0.00 C ATOM 0 H VAL A 59 -15.666 -0.726 -5.838 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.367 -2.313 -8.028 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.622 -2.216 -5.901 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.094 -0.307 -5.407 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.380 0.168 -5.437 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.436 0.559 -6.815 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.901 -2.166 -6.816 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.287 -1.387 -8.293 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.776 -3.041 -7.882 1.00 0.00 H new ATOM 927 N ASP A 60 -16.454 0.845 -8.640 1.00 0.00 N ATOM 928 CA ASP A 60 -16.683 1.829 -9.691 1.00 0.00 C ATOM 929 C ASP A 60 -16.062 1.342 -10.993 1.00 0.00 C ATOM 930 O ASP A 60 -16.646 1.478 -12.069 1.00 0.00 O ATOM 931 CB ASP A 60 -16.080 3.179 -9.297 1.00 0.00 C ATOM 932 CG ASP A 60 -16.903 4.350 -9.793 1.00 0.00 C ATOM 933 OD1 ASP A 60 -18.116 4.167 -10.031 1.00 0.00 O ATOM 934 OD2 ASP A 60 -16.336 5.453 -9.944 1.00 0.00 O ATOM 0 H ASP A 60 -15.901 1.183 -7.852 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.757 1.955 -9.829 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -15.996 3.232 -8.212 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.070 3.253 -9.699 1.00 0.00 H new ATOM 939 N ASP A 61 -14.873 0.761 -10.873 1.00 0.00 N ATOM 940 CA ASP A 61 -14.152 0.227 -12.023 1.00 0.00 C ATOM 941 C ASP A 61 -14.327 -1.285 -12.103 1.00 0.00 C ATOM 942 O ASP A 61 -14.373 -1.862 -13.190 1.00 0.00 O ATOM 943 CB ASP A 61 -12.666 0.579 -11.932 1.00 0.00 C ATOM 944 CG ASP A 61 -12.433 2.064 -11.726 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.493 2.817 -12.720 1.00 0.00 O ATOM 946 OD2 ASP A 61 -12.189 2.471 -10.571 1.00 0.00 O ATOM 0 H ASP A 61 -14.385 0.647 -9.984 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.564 0.677 -12.927 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.215 0.026 -11.108 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.163 0.259 -12.845 1.00 0.00 H new ATOM 951 N ALA A 62 -14.424 -1.918 -10.937 1.00 0.00 N ATOM 952 CA ALA A 62 -14.598 -3.361 -10.858 1.00 0.00 C ATOM 953 C ALA A 62 -16.076 -3.716 -10.736 1.00 0.00 C ATOM 954 O ALA A 62 -16.461 -4.567 -9.932 1.00 0.00 O ATOM 955 CB ALA A 62 -13.812 -3.921 -9.680 1.00 0.00 C ATOM 0 H ALA A 62 -14.385 -1.450 -10.032 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.215 -3.809 -11.775 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -13.950 -5.001 -9.631 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.753 -3.696 -9.809 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.169 -3.467 -8.756 1.00 0.00 H new ATOM 961 N GLN A 63 -16.899 -3.048 -11.535 1.00 0.00 N ATOM 962 CA GLN A 63 -18.339 -3.276 -11.520 1.00 0.00 C ATOM 963 C GLN A 63 -18.700 -4.625 -12.137 1.00 0.00 C ATOM 964 O GLN A 63 -19.847 -5.063 -12.050 1.00 0.00 O ATOM 965 CB GLN A 63 -19.050 -2.151 -12.272 1.00 0.00 C ATOM 966 CG GLN A 63 -20.535 -2.053 -11.964 1.00 0.00 C ATOM 967 CD GLN A 63 -20.994 -0.619 -11.774 1.00 0.00 C ATOM 968 OE1 GLN A 63 -21.632 -0.038 -12.652 1.00 0.00 O ATOM 969 NE2 GLN A 63 -20.672 -0.044 -10.622 1.00 0.00 N ATOM 0 H GLN A 63 -16.593 -2.341 -12.204 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.667 -3.286 -10.481 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.573 -1.203 -12.024 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -18.920 -2.303 -13.343 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -21.102 -2.508 -12.776 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -20.755 -2.624 -11.062 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -20.142 -0.564 -9.923 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -20.955 0.918 -10.436 1.00 0.00 H new ATOM 978 N ASP A 64 -17.726 -5.281 -12.764 1.00 0.00 N ATOM 979 CA ASP A 64 -17.968 -6.575 -13.391 1.00 0.00 C ATOM 980 C ASP A 64 -17.591 -7.721 -12.457 1.00 0.00 C ATOM 981 O ASP A 64 -18.082 -8.840 -12.612 1.00 0.00 O ATOM 982 CB ASP A 64 -17.192 -6.684 -14.704 1.00 0.00 C ATOM 983 CG ASP A 64 -18.017 -6.236 -15.897 1.00 0.00 C ATOM 984 OD1 ASP A 64 -18.128 -5.012 -16.117 1.00 0.00 O ATOM 985 OD2 ASP A 64 -18.556 -7.111 -16.606 1.00 0.00 O ATOM 0 H ASP A 64 -16.769 -4.940 -12.850 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.034 -6.650 -13.604 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.288 -6.078 -14.641 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.874 -7.716 -14.851 1.00 0.00 H new ATOM 990 N VAL A 65 -16.735 -7.444 -11.472 1.00 0.00 N ATOM 991 CA VAL A 65 -16.332 -8.474 -10.519 1.00 0.00 C ATOM 992 C VAL A 65 -17.411 -8.674 -9.462 1.00 0.00 C ATOM 993 O VAL A 65 -17.783 -9.806 -9.152 1.00 0.00 O ATOM 994 CB VAL A 65 -14.981 -8.169 -9.828 1.00 0.00 C ATOM 995 CG1 VAL A 65 -13.825 -8.581 -10.724 1.00 0.00 C ATOM 996 CG2 VAL A 65 -14.863 -6.703 -9.441 1.00 0.00 C ATOM 0 H VAL A 65 -16.314 -6.528 -11.316 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.200 -9.389 -11.097 1.00 0.00 H new ATOM 0 HB VAL A 65 -14.940 -8.752 -8.908 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -12.881 -8.361 -10.225 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -13.886 -9.650 -10.929 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.877 -8.029 -11.662 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -13.901 -6.530 -8.959 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -14.937 -6.084 -10.335 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.666 -6.443 -8.751 1.00 0.00 H new ATOM 1006 N ALA A 66 -17.900 -7.573 -8.892 1.00 0.00 N ATOM 1007 CA ALA A 66 -18.922 -7.631 -7.851 1.00 0.00 C ATOM 1008 C ALA A 66 -20.102 -8.516 -8.251 1.00 0.00 C ATOM 1009 O ALA A 66 -20.416 -9.487 -7.563 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.409 -6.222 -7.545 1.00 0.00 C ATOM 0 H ALA A 66 -17.603 -6.628 -9.136 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.472 -8.075 -6.963 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.172 -6.262 -6.768 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.572 -5.614 -7.201 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -19.832 -5.779 -8.447 1.00 0.00 H new ATOM 1016 N PRO A 67 -20.773 -8.200 -9.371 1.00 0.00 N ATOM 1017 CA PRO A 67 -21.917 -8.985 -9.851 1.00 0.00 C ATOM 1018 C PRO A 67 -21.591 -10.469 -9.933 1.00 0.00 C ATOM 1019 O PRO A 67 -22.467 -11.321 -9.783 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.175 -8.413 -11.244 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.669 -7.014 -11.165 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.475 -7.062 -10.259 1.00 0.00 C ATOM 0 HA PRO A 67 -22.777 -8.916 -9.185 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.651 -8.983 -12.012 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.235 -8.439 -11.495 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.396 -6.641 -12.152 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.433 -6.344 -10.770 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.552 -7.218 -10.817 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -20.357 -6.134 -9.699 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.317 -10.767 -10.150 1.00 0.00 N ATOM 1031 CA LYS A 68 -19.860 -12.145 -10.231 1.00 0.00 C ATOM 1032 C LYS A 68 -19.835 -12.782 -8.844 1.00 0.00 C ATOM 1033 O LYS A 68 -19.944 -14.000 -8.710 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.469 -12.210 -10.867 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.328 -13.326 -11.887 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.402 -12.935 -13.028 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.707 -13.740 -14.281 1.00 0.00 C ATOM 1038 NZ LYS A 68 -16.583 -13.706 -15.258 1.00 0.00 N ATOM 0 H LYS A 68 -19.582 -10.071 -10.273 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.557 -12.702 -10.857 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.252 -11.257 -11.349 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -17.724 -12.347 -10.083 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -17.943 -14.220 -11.397 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.310 -13.579 -12.286 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.510 -11.871 -13.240 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.366 -13.097 -12.731 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -17.915 -14.774 -14.005 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -18.608 -13.348 -14.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.799 -14.335 -16.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.455 -12.734 -15.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.709 -14.025 -14.793 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.691 -11.946 -7.814 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.643 -12.414 -6.426 1.00 0.00 C ATOM 1054 C TYR A 69 -20.920 -12.048 -5.660 1.00 0.00 C ATOM 1055 O TYR A 69 -21.120 -12.476 -4.523 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.443 -11.789 -5.724 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.108 -12.266 -6.254 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -16.640 -13.544 -5.973 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.319 -11.438 -7.043 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.424 -13.982 -6.464 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -15.102 -11.868 -7.537 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.659 -13.141 -7.244 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.447 -13.574 -7.733 1.00 0.00 O ATOM 0 H TYR A 69 -19.605 -10.935 -7.916 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.555 -13.500 -6.441 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.498 -10.705 -5.827 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.501 -12.012 -4.659 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.236 -14.206 -5.361 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.663 -10.441 -7.274 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.075 -14.979 -6.238 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.501 -11.211 -8.149 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.781 -13.563 -7.014 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.785 -11.280 -6.306 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.048 -10.881 -5.701 1.00 0.00 C ATOM 1075 C GLY A 70 -22.904 -9.952 -4.503 1.00 0.00 C ATOM 1076 O GLY A 70 -23.683 -10.040 -3.554 1.00 0.00 O ATOM 0 H GLY A 70 -21.636 -10.921 -7.249 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.659 -10.388 -6.457 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.587 -11.776 -5.389 1.00 0.00 H new ATOM 1080 N ILE A 71 -21.927 -9.050 -4.544 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.721 -8.104 -3.447 1.00 0.00 C ATOM 1082 C ILE A 71 -22.792 -7.010 -3.469 1.00 0.00 C ATOM 1083 O ILE A 71 -23.134 -6.489 -4.529 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.320 -7.455 -3.518 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.235 -8.533 -3.471 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -20.127 -6.460 -2.380 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.874 -8.042 -3.909 1.00 0.00 C ATOM 0 H ILE A 71 -21.269 -8.953 -5.318 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.797 -8.665 -2.516 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.239 -6.915 -4.461 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.163 -8.920 -2.454 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.534 -9.365 -4.108 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -19.134 -6.015 -2.450 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.881 -5.676 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -20.227 -6.976 -1.425 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.156 -8.860 -3.850 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.930 -7.682 -4.936 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.553 -7.229 -3.257 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.325 -6.677 -2.295 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.363 -5.653 -2.191 1.00 0.00 C ATOM 1101 C ARG A 72 -24.326 -4.964 -0.828 1.00 0.00 C ATOM 1102 O ARG A 72 -25.327 -4.919 -0.113 1.00 0.00 O ATOM 1103 CB ARG A 72 -25.742 -6.275 -2.430 1.00 0.00 C ATOM 1104 CG ARG A 72 -26.865 -5.254 -2.552 1.00 0.00 C ATOM 1105 CD ARG A 72 -28.158 -5.769 -1.936 1.00 0.00 C ATOM 1106 NE ARG A 72 -29.329 -5.434 -2.747 1.00 0.00 N ATOM 1107 CZ ARG A 72 -29.842 -4.208 -2.844 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -29.291 -3.196 -2.186 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -30.910 -3.995 -3.601 1.00 0.00 N ATOM 0 H ARG A 72 -23.057 -7.099 -1.406 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.172 -4.900 -2.955 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -25.707 -6.873 -3.340 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -25.970 -6.956 -1.610 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -26.570 -4.327 -2.060 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -27.031 -5.018 -3.603 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -28.097 -6.851 -1.819 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -28.276 -5.347 -0.938 1.00 0.00 H new ATOM 0 HE ARG A 72 -29.780 -6.185 -3.270 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -28.470 -3.354 -1.602 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -29.688 -2.260 -2.264 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -31.338 -4.769 -4.108 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -31.303 -3.057 -3.676 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.160 -4.431 -0.476 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.008 -3.751 0.798 1.00 0.00 C ATOM 1125 C GLY A 73 -21.570 -3.373 1.083 1.00 0.00 C ATOM 1126 O GLY A 73 -20.763 -4.216 1.474 1.00 0.00 O ATOM 0 H GLY A 73 -22.317 -4.458 -1.050 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.625 -2.852 0.803 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.377 -4.395 1.597 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.247 -2.100 0.886 1.00 0.00 N ATOM 1131 CA ILE A 74 -19.897 -1.609 1.123 1.00 0.00 C ATOM 1132 C ILE A 74 -19.821 -0.845 2.442 1.00 0.00 C ATOM 1133 O ILE A 74 -20.827 -0.310 2.910 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.432 -0.696 -0.028 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -20.488 0.373 -0.318 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.158 -1.525 -1.276 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -19.950 1.571 -1.071 1.00 0.00 C ATOM 0 H ILE A 74 -21.903 -1.389 0.562 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.237 -2.475 1.175 1.00 0.00 H new ATOM 0 HB ILE A 74 -18.509 -0.198 0.270 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -21.297 -0.075 -0.896 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -20.919 0.711 0.625 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -18.830 -0.870 -2.083 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.379 -2.257 -1.063 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.069 -2.043 -1.576 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -20.755 2.286 -1.240 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -19.162 2.044 -0.486 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -19.545 1.246 -2.030 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.631 -0.780 3.072 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.399 -1.400 2.559 1.00 0.00 C ATOM 1151 C PRO A 75 -17.344 -2.905 2.793 1.00 0.00 C ATOM 1152 O PRO A 75 -17.265 -3.359 3.935 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.308 -0.716 3.383 1.00 0.00 C ATOM 1154 CG PRO A 75 -16.967 -0.405 4.681 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.399 -0.078 4.350 1.00 0.00 C ATOM 0 HA PRO A 75 -17.308 -1.277 1.480 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.446 -1.369 3.521 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -15.948 0.189 2.893 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.908 -1.254 5.362 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.479 0.435 5.175 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -19.079 -0.426 5.127 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -18.552 0.997 4.250 1.00 0.00 H new ATOM 1163 N THR A 76 -17.369 -3.681 1.713 1.00 0.00 N ATOM 1164 CA THR A 76 -17.300 -5.132 1.818 1.00 0.00 C ATOM 1165 C THR A 76 -15.852 -5.614 1.873 1.00 0.00 C ATOM 1166 O THR A 76 -15.008 -5.166 1.097 1.00 0.00 O ATOM 1167 CB THR A 76 -18.016 -5.796 0.636 1.00 0.00 C ATOM 1168 OG1 THR A 76 -18.819 -4.861 -0.060 1.00 0.00 O ATOM 1169 CG2 THR A 76 -18.906 -6.949 1.048 1.00 0.00 C ATOM 0 H THR A 76 -17.436 -3.329 0.758 1.00 0.00 H new ATOM 0 HA THR A 76 -17.798 -5.416 2.745 1.00 0.00 H new ATOM 0 HB THR A 76 -17.220 -6.180 -0.002 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.730 -4.881 0.299 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.383 -7.374 0.165 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.306 -7.714 1.540 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.671 -6.590 1.736 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.581 -6.557 2.762 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.253 -7.132 2.881 1.00 0.00 C ATOM 1179 C LEU A 77 -14.300 -8.542 2.314 1.00 0.00 C ATOM 1180 O LEU A 77 -15.120 -9.361 2.729 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.789 -7.144 4.344 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.522 -6.332 4.640 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -12.787 -4.840 4.489 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -12.009 -6.641 6.039 1.00 0.00 C ATOM 0 H LEU A 77 -16.266 -6.940 3.413 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.535 -6.530 2.325 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.598 -6.763 4.967 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.616 -8.178 4.644 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.758 -6.617 3.917 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.874 -4.285 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.108 -4.629 3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.568 -4.537 5.186 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.110 -6.057 6.234 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.774 -6.385 6.772 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.775 -7.703 6.115 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.446 -8.812 1.335 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.434 -10.117 0.688 1.00 0.00 C ATOM 1198 C LEU A 78 -12.119 -10.854 0.920 1.00 0.00 C ATOM 1199 O LEU A 78 -11.036 -10.276 0.816 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.670 -9.953 -0.822 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.136 -9.879 -1.285 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.230 -10.165 -2.777 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.016 -10.850 -0.510 1.00 0.00 C ATOM 0 H LEU A 78 -12.758 -8.151 0.974 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.235 -10.711 1.129 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.163 -9.046 -1.150 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.192 -10.788 -1.334 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.497 -8.870 -1.088 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.272 -10.110 -3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.645 -9.428 -3.326 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.841 -11.163 -2.981 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.044 -10.771 -0.863 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.657 -11.868 -0.663 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -15.977 -10.608 0.552 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.231 -12.140 1.228 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.071 -12.982 1.468 1.00 0.00 C ATOM 1217 C LEU A 79 -11.001 -14.078 0.415 1.00 0.00 C ATOM 1218 O LEU A 79 -11.951 -14.841 0.244 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.154 -13.608 2.863 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.466 -12.824 3.982 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -8.956 -12.881 3.826 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -10.951 -11.382 4.001 1.00 0.00 C ATOM 0 H LEU A 79 -13.124 -12.624 1.318 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.172 -12.369 1.408 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.205 -13.732 3.124 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.716 -14.605 2.821 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.727 -13.285 4.934 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.485 -12.317 4.632 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.625 -13.919 3.868 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.673 -12.448 2.867 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.450 -10.840 4.804 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.722 -10.909 3.046 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -12.028 -11.363 4.167 1.00 0.00 H new ATOM 1234 N PHE A 80 -9.881 -14.150 -0.296 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.709 -15.150 -1.342 1.00 0.00 C ATOM 1236 C PHE A 80 -8.616 -16.145 -0.974 1.00 0.00 C ATOM 1237 O PHE A 80 -7.622 -15.790 -0.342 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.393 -14.456 -2.668 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.615 -13.896 -3.334 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.084 -12.641 -2.985 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.300 -14.625 -4.294 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.216 -12.119 -3.580 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.432 -14.107 -4.896 1.00 0.00 C ATOM 1244 CZ PHE A 80 -12.891 -12.852 -4.538 1.00 0.00 C ATOM 0 H PHE A 80 -9.081 -13.530 -0.167 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.638 -15.711 -1.449 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.680 -13.651 -2.491 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -8.912 -15.167 -3.340 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -10.559 -12.063 -2.239 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -10.946 -15.606 -4.574 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -12.573 -11.140 -3.297 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -12.957 -14.681 -5.645 1.00 0.00 H new ATOM 0 HZ PHE A 80 -13.775 -12.446 -5.006 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.816 -17.396 -1.373 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.864 -18.462 -1.089 1.00 0.00 C ATOM 1256 C LYS A 81 -7.842 -19.464 -2.239 1.00 0.00 C ATOM 1257 O LYS A 81 -8.815 -20.184 -2.462 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.251 -19.171 0.211 1.00 0.00 C ATOM 1259 CG LYS A 81 -7.069 -19.521 1.100 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.343 -19.168 2.555 1.00 0.00 C ATOM 1261 CE LYS A 81 -6.108 -19.360 3.421 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.475 -20.689 3.197 1.00 0.00 N ATOM 0 H LYS A 81 -9.636 -17.698 -1.899 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.870 -18.029 -0.978 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.937 -18.534 0.770 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.792 -20.085 -0.033 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.853 -20.586 1.017 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.183 -18.988 0.756 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.677 -18.133 2.622 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.154 -19.790 2.934 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.386 -18.573 3.204 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.382 -19.261 4.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.756 -20.859 3.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.201 -21.432 3.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.026 -20.706 2.259 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.735 -19.503 -2.970 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.609 -20.420 -4.099 1.00 0.00 C ATOM 1278 C ASN A 82 -7.667 -20.115 -5.159 1.00 0.00 C ATOM 1279 O ASN A 82 -8.296 -21.024 -5.701 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.746 -21.871 -3.627 1.00 0.00 C ATOM 1281 CG ASN A 82 -6.043 -22.132 -2.308 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -4.749 -21.836 -2.257 1.00 0.00 O flip ATOM 1283 ND2 ASN A 82 -6.656 -22.593 -1.345 1.00 0.00 N flip ATOM 0 H ASN A 82 -5.917 -18.916 -2.805 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.622 -20.284 -4.540 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.803 -22.116 -3.524 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.337 -22.535 -4.388 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -7.650 -22.806 -1.428 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -6.170 -22.762 -0.464 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.835 -18.832 -5.470 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.797 -18.432 -6.482 1.00 0.00 C ATOM 1292 C GLY A 83 -10.243 -18.552 -6.026 1.00 0.00 C ATOM 1293 O GLY A 83 -11.162 -18.310 -6.810 1.00 0.00 O ATOM 0 H GLY A 83 -7.322 -18.063 -5.039 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.600 -17.400 -6.771 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.653 -19.045 -7.372 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.457 -18.942 -4.772 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.811 -19.105 -4.251 1.00 0.00 C ATOM 1299 C GLU A 84 -12.038 -18.273 -2.992 1.00 0.00 C ATOM 1300 O GLU A 84 -11.169 -18.183 -2.126 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.078 -20.580 -3.950 1.00 0.00 C ATOM 1302 CG GLU A 84 -13.532 -20.990 -4.121 1.00 0.00 C ATOM 1303 CD GLU A 84 -13.880 -22.237 -3.333 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -13.539 -22.295 -2.133 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -14.491 -23.157 -3.915 1.00 0.00 O ATOM 0 H GLU A 84 -9.716 -19.150 -4.102 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.504 -18.752 -5.014 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.459 -21.192 -4.605 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.768 -20.794 -2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.177 -20.171 -3.802 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.735 -21.163 -5.178 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.226 -17.684 -2.895 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.589 -16.868 -1.741 1.00 0.00 C ATOM 1314 C VAL A 85 -13.772 -17.742 -0.497 1.00 0.00 C ATOM 1315 O VAL A 85 -14.600 -18.654 -0.493 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.884 -16.075 -2.002 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -15.166 -15.123 -0.850 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -14.781 -15.315 -3.317 1.00 0.00 C ATOM 0 H VAL A 85 -13.956 -17.757 -3.604 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.775 -16.164 -1.572 1.00 0.00 H new ATOM 0 HB VAL A 85 -15.715 -16.777 -2.074 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.084 -14.571 -1.051 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.279 -15.692 0.073 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -14.337 -14.423 -0.745 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.703 -14.759 -3.489 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -13.942 -14.621 -3.271 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.625 -16.020 -4.133 1.00 0.00 H new ATOM 1328 N ALA A 86 -12.993 -17.476 0.551 1.00 0.00 N ATOM 1329 CA ALA A 86 -13.084 -18.267 1.780 1.00 0.00 C ATOM 1330 C ALA A 86 -13.581 -17.449 2.968 1.00 0.00 C ATOM 1331 O ALA A 86 -13.572 -17.920 4.106 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.739 -18.904 2.097 1.00 0.00 C ATOM 0 H ALA A 86 -12.299 -16.728 0.576 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.822 -19.050 1.604 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.820 -19.489 3.013 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.442 -19.556 1.275 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -10.989 -18.124 2.230 1.00 0.00 H new ATOM 1338 N ALA A 87 -14.019 -16.233 2.696 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.533 -15.350 3.738 1.00 0.00 C ATOM 1340 C ALA A 87 -15.109 -14.073 3.136 1.00 0.00 C ATOM 1341 O ALA A 87 -14.510 -13.475 2.243 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.439 -15.026 4.747 1.00 0.00 C ATOM 0 H ALA A 87 -14.031 -15.829 1.759 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.339 -15.868 4.257 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.838 -14.367 5.518 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.084 -15.948 5.207 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.611 -14.531 4.240 1.00 0.00 H new ATOM 1348 N THR A 88 -16.266 -13.649 3.632 1.00 0.00 N ATOM 1349 CA THR A 88 -16.902 -12.432 3.135 1.00 0.00 C ATOM 1350 C THR A 88 -17.432 -11.591 4.287 1.00 0.00 C ATOM 1351 O THR A 88 -18.200 -12.075 5.120 1.00 0.00 O ATOM 1352 CB THR A 88 -18.035 -12.779 2.166 1.00 0.00 C ATOM 1353 OG1 THR A 88 -17.545 -13.541 1.077 1.00 0.00 O ATOM 1354 CG2 THR A 88 -18.731 -11.562 1.596 1.00 0.00 C ATOM 0 H THR A 88 -16.781 -14.125 4.373 1.00 0.00 H new ATOM 0 HA THR A 88 -16.152 -11.849 2.601 1.00 0.00 H new ATOM 0 HB THR A 88 -18.755 -13.346 2.755 1.00 0.00 H new ATOM 0 HG1 THR A 88 -18.283 -13.755 0.469 1.00 0.00 H new ATOM 0 HG21 THR A 88 -19.523 -11.880 0.918 1.00 0.00 H new ATOM 0 HG22 THR A 88 -19.162 -10.976 2.408 1.00 0.00 H new ATOM 0 HG23 THR A 88 -18.010 -10.952 1.052 1.00 0.00 H new ATOM 1362 N LYS A 89 -17.014 -10.330 4.336 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.441 -9.425 5.392 1.00 0.00 C ATOM 1364 C LYS A 89 -18.069 -8.161 4.814 1.00 0.00 C ATOM 1365 O LYS A 89 -17.659 -7.673 3.763 1.00 0.00 O ATOM 1366 CB LYS A 89 -16.249 -9.058 6.276 1.00 0.00 C ATOM 1367 CG LYS A 89 -16.136 -9.909 7.527 1.00 0.00 C ATOM 1368 CD LYS A 89 -16.892 -9.291 8.692 1.00 0.00 C ATOM 1369 CE LYS A 89 -15.965 -8.500 9.600 1.00 0.00 C ATOM 1370 NZ LYS A 89 -15.302 -9.371 10.609 1.00 0.00 N ATOM 0 H LYS A 89 -16.379 -9.913 3.655 1.00 0.00 H new ATOM 0 HA LYS A 89 -18.195 -9.934 5.992 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.332 -9.157 5.695 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -16.331 -8.010 6.565 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -16.527 -10.906 7.326 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -15.086 -10.026 7.795 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -17.676 -8.637 8.312 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -17.383 -10.077 9.267 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -15.207 -8.000 8.998 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.533 -7.721 10.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -14.678 -8.794 11.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -16.024 -9.829 11.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -14.740 -10.099 10.123 1.00 0.00 H new ATOM 1384 N VAL A 90 -19.071 -7.645 5.513 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.774 -6.440 5.085 1.00 0.00 C ATOM 1386 C VAL A 90 -19.652 -5.332 6.126 1.00 0.00 C ATOM 1387 O VAL A 90 -19.628 -5.600 7.327 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.264 -6.725 4.828 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.943 -5.511 4.215 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.426 -7.945 3.935 1.00 0.00 C ATOM 0 H VAL A 90 -19.418 -8.044 6.385 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.307 -6.113 4.156 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.745 -6.936 5.783 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -22.996 -5.732 4.041 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.858 -4.664 4.896 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.462 -5.265 3.268 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.486 -8.132 3.764 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.930 -7.766 2.981 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -20.978 -8.813 4.420 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.589 -4.087 5.663 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.479 -2.965 6.573 1.00 0.00 C ATOM 1402 C GLY A 91 -18.082 -2.778 7.129 1.00 0.00 C ATOM 1403 O GLY A 91 -17.257 -3.692 7.091 1.00 0.00 O ATOM 0 H GLY A 91 -19.612 -3.837 4.674 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -19.781 -2.055 6.055 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.175 -3.107 7.399 1.00 0.00 H new ATOM 1407 N ALA A 92 -17.818 -1.576 7.634 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.512 -1.240 8.189 1.00 0.00 C ATOM 1409 C ALA A 92 -16.208 -2.059 9.437 1.00 0.00 C ATOM 1410 O ALA A 92 -17.038 -2.841 9.901 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.445 0.247 8.509 1.00 0.00 C ATOM 0 H ALA A 92 -18.496 -0.815 7.670 1.00 0.00 H new ATOM 0 HA ALA A 92 -15.759 -1.481 7.439 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.465 0.486 8.923 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.604 0.823 7.597 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.217 0.498 9.236 1.00 0.00 H new ATOM 1417 N LEU A 93 -15.004 -1.875 9.972 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.575 -2.599 11.161 1.00 0.00 C ATOM 1419 C LEU A 93 -13.262 -2.031 11.694 1.00 0.00 C ATOM 1420 O LEU A 93 -12.472 -1.462 10.941 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.413 -4.087 10.842 1.00 0.00 C ATOM 1422 CG LEU A 93 -13.801 -4.398 9.472 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -12.893 -5.615 9.555 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -14.896 -4.620 8.438 1.00 0.00 C ATOM 0 H LEU A 93 -14.308 -1.229 9.599 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.339 -2.482 11.930 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.790 -4.541 11.612 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.391 -4.564 10.902 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.201 -3.543 9.162 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.468 -5.820 8.572 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.089 -5.421 10.265 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.470 -6.478 9.887 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.444 -4.840 7.471 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.522 -5.458 8.745 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.507 -3.721 8.357 1.00 0.00 H new ATOM 1436 N SER A 94 -13.037 -2.183 12.996 1.00 0.00 N ATOM 1437 CA SER A 94 -11.819 -1.679 13.619 1.00 0.00 C ATOM 1438 C SER A 94 -10.595 -2.438 13.120 1.00 0.00 C ATOM 1439 O SER A 94 -10.710 -3.359 12.311 1.00 0.00 O ATOM 1440 CB SER A 94 -11.913 -1.787 15.144 1.00 0.00 C ATOM 1441 OG SER A 94 -11.073 -0.835 15.775 1.00 0.00 O ATOM 0 H SER A 94 -13.679 -2.649 13.637 1.00 0.00 H new ATOM 0 HA SER A 94 -11.711 -0.630 13.343 1.00 0.00 H new ATOM 0 HB2 SER A 94 -12.945 -1.632 15.460 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.630 -2.792 15.459 1.00 0.00 H new ATOM 0 HG SER A 94 -11.152 -0.923 16.748 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.423 -2.045 13.610 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.174 -2.686 13.215 1.00 0.00 C ATOM 1449 C LYS A 95 -8.047 -4.070 13.840 1.00 0.00 C ATOM 1450 O LYS A 95 -7.382 -4.950 13.292 1.00 0.00 O ATOM 1451 CB LYS A 95 -6.981 -1.822 13.624 1.00 0.00 C ATOM 1452 CG LYS A 95 -5.639 -2.402 13.205 1.00 0.00 C ATOM 1453 CD LYS A 95 -4.643 -1.303 12.871 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.309 -1.872 12.415 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.256 -0.820 12.351 1.00 0.00 N ATOM 0 H LYS A 95 -9.313 -1.285 14.282 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.182 -2.796 12.131 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.093 -0.831 13.184 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.990 -1.693 14.706 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.242 -3.024 14.008 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.775 -3.049 12.338 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.054 -0.666 12.088 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.489 -0.673 13.747 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.996 -2.660 13.100 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.425 -2.331 11.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.360 -1.244 12.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.544 -0.081 11.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.128 -0.399 13.293 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.664 -4.248 15.004 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.590 -5.520 15.686 1.00 0.00 C ATOM 1471 C GLY A 96 -9.504 -6.570 15.088 1.00 0.00 C ATOM 1472 O GLY A 96 -9.182 -7.757 15.105 1.00 0.00 O ATOM 0 H GLY A 96 -9.212 -3.534 15.483 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.562 -5.882 15.656 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.848 -5.378 16.736 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.640 -6.143 14.548 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.580 -7.077 13.941 1.00 0.00 C ATOM 1478 C GLN A 97 -11.089 -7.513 12.569 1.00 0.00 C ATOM 1479 O GLN A 97 -11.327 -8.642 12.142 1.00 0.00 O ATOM 1480 CB GLN A 97 -12.968 -6.454 13.830 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.413 -5.737 15.093 1.00 0.00 C ATOM 1482 CD GLN A 97 -14.676 -4.926 14.887 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -15.105 -4.704 13.755 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -15.274 -4.471 15.981 1.00 0.00 N ATOM 0 H GLN A 97 -10.930 -5.166 14.518 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.647 -7.955 14.584 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -12.975 -5.748 12.999 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.690 -7.235 13.591 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -13.581 -6.470 15.883 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.614 -5.078 15.433 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -14.883 -4.679 16.900 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -16.124 -3.913 15.903 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.390 -6.619 11.884 1.00 0.00 N ATOM 1494 CA LEU A 98 -9.858 -6.942 10.573 1.00 0.00 C ATOM 1495 C LEU A 98 -8.713 -7.936 10.720 1.00 0.00 C ATOM 1496 O LEU A 98 -8.689 -8.977 10.064 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.388 -5.683 9.841 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.860 -5.586 8.390 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -10.114 -4.138 8.002 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -8.842 -6.225 7.456 1.00 0.00 C ATOM 0 H LEU A 98 -10.181 -5.676 12.211 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.651 -7.392 9.976 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.741 -4.807 10.385 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.299 -5.651 9.859 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.800 -6.130 8.297 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.449 -4.092 6.966 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.882 -3.717 8.651 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.193 -3.565 8.111 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.193 -6.147 6.427 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.886 -5.710 7.553 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.717 -7.276 7.718 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.766 -7.603 11.593 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.614 -8.460 11.842 1.00 0.00 C ATOM 1514 C LYS A 99 -7.044 -9.801 12.434 1.00 0.00 C ATOM 1515 O LYS A 99 -6.552 -10.853 12.026 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.629 -7.766 12.787 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.169 -8.010 12.435 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.273 -6.905 12.969 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.008 -7.073 14.457 1.00 0.00 C ATOM 1520 NZ LYS A 99 -4.050 -6.404 15.285 1.00 0.00 N ATOM 0 H LYS A 99 -7.775 -6.743 12.141 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.123 -8.647 10.887 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.822 -6.693 12.775 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.811 -8.111 13.805 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.850 -8.968 12.846 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.061 -8.075 11.352 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.327 -6.908 12.427 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.740 -5.937 12.789 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -2.975 -8.134 14.702 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.029 -6.659 14.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.601 -5.704 15.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -4.733 -5.926 14.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.544 -7.115 15.862 1.00 0.00 H new ATOM 1534 N GLU A 100 -7.974 -9.763 13.388 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.462 -10.989 14.012 1.00 0.00 C ATOM 1536 C GLU A 100 -9.133 -11.884 12.976 1.00 0.00 C ATOM 1537 O GLU A 100 -8.899 -13.092 12.941 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.423 -10.685 15.173 1.00 0.00 C ATOM 1539 CG GLU A 100 -10.817 -10.258 14.743 1.00 0.00 C ATOM 1540 CD GLU A 100 -11.712 -11.433 14.400 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.507 -12.524 14.972 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -12.619 -11.263 13.558 1.00 0.00 O ATOM 0 H GLU A 100 -8.400 -8.906 13.741 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.603 -11.518 14.425 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.506 -11.572 15.801 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -8.990 -9.898 15.790 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.277 -9.678 15.543 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -10.740 -9.601 13.877 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.942 -11.280 12.107 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.620 -12.019 11.049 1.00 0.00 C ATOM 1551 C PHE A 101 -9.597 -12.651 10.114 1.00 0.00 C ATOM 1552 O PHE A 101 -9.756 -13.788 9.661 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.548 -11.083 10.266 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.359 -11.774 9.207 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.130 -12.884 9.515 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.349 -11.313 7.900 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.875 -13.521 8.541 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.092 -11.946 6.920 1.00 0.00 C ATOM 1559 CZ PHE A 101 -13.855 -13.052 7.242 1.00 0.00 C ATOM 0 H PHE A 101 -10.143 -10.280 12.117 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.219 -12.811 11.499 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -12.225 -10.591 10.965 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.949 -10.301 9.799 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.149 -13.256 10.529 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.754 -10.449 7.644 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.472 -14.384 8.795 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.076 -11.577 5.905 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.435 -13.549 6.479 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.533 -11.904 9.842 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.472 -12.380 8.969 1.00 0.00 C ATOM 1571 C LEU A 102 -6.765 -13.568 9.608 1.00 0.00 C ATOM 1572 O LEU A 102 -6.765 -14.666 9.060 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.476 -11.252 8.687 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.594 -10.634 7.295 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -5.669 -9.436 7.158 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -6.292 -11.676 6.229 1.00 0.00 C ATOM 0 H LEU A 102 -8.384 -10.966 10.215 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.908 -12.702 8.023 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.615 -10.468 9.431 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.464 -11.638 8.815 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.617 -10.285 7.156 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.769 -9.011 6.159 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.935 -8.684 7.900 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.638 -9.752 7.316 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.380 -11.222 5.242 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.279 -12.054 6.366 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.001 -12.500 6.314 1.00 0.00 H new ATOM 1588 N ASP A 103 -6.177 -13.342 10.777 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.474 -14.400 11.498 1.00 0.00 C ATOM 1590 C ASP A 103 -6.328 -15.666 11.576 1.00 0.00 C ATOM 1591 O ASP A 103 -5.806 -16.781 11.575 1.00 0.00 O ATOM 1592 CB ASP A 103 -5.120 -13.930 12.911 1.00 0.00 C ATOM 1593 CG ASP A 103 -3.826 -14.535 13.415 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -3.669 -15.770 13.313 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -2.969 -13.776 13.914 1.00 0.00 O ATOM 0 H ASP A 103 -6.172 -12.437 11.247 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.558 -14.630 10.954 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.037 -12.843 12.919 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.930 -14.193 13.592 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.644 -15.479 11.639 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.578 -16.598 11.715 1.00 0.00 C ATOM 1602 C ALA A 104 -8.656 -17.362 10.395 1.00 0.00 C ATOM 1603 O ALA A 104 -8.986 -18.547 10.377 1.00 0.00 O ATOM 1604 CB ALA A 104 -9.959 -16.103 12.116 1.00 0.00 C ATOM 0 H ALA A 104 -8.088 -14.561 11.639 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.207 -17.286 12.474 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.647 -16.947 12.169 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.903 -15.618 13.091 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -10.318 -15.388 11.376 1.00 0.00 H new ATOM 1610 N ASN A 105 -8.363 -16.679 9.290 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.419 -17.305 7.969 1.00 0.00 C ATOM 1612 C ASN A 105 -7.019 -17.568 7.413 1.00 0.00 C ATOM 1613 O ASN A 105 -6.824 -18.476 6.604 1.00 0.00 O ATOM 1614 CB ASN A 105 -9.208 -16.420 6.999 1.00 0.00 C ATOM 1615 CG ASN A 105 -10.008 -17.231 5.996 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.450 -18.341 6.291 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.196 -16.683 4.800 1.00 0.00 N ATOM 0 H ASN A 105 -8.086 -15.697 9.282 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.924 -18.265 8.077 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.884 -15.778 7.565 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.518 -15.766 6.466 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -10.724 -17.185 4.086 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.813 -15.760 4.596 1.00 0.00 H new ATOM 1624 N LEU A 106 -6.047 -16.772 7.849 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.667 -16.923 7.398 1.00 0.00 C ATOM 1626 C LEU A 106 -4.036 -18.167 8.017 1.00 0.00 C ATOM 1627 O LEU A 106 -3.266 -18.876 7.369 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.862 -15.680 7.774 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.607 -15.419 6.937 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -1.862 -14.207 7.472 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -1.699 -16.640 6.927 1.00 0.00 C ATOM 0 H LEU A 106 -6.190 -16.014 8.516 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.661 -17.038 6.314 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.515 -14.811 7.696 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.567 -15.764 8.820 1.00 0.00 H new ATOM 0 HG LEU A 106 -2.914 -15.217 5.911 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.971 -14.032 6.868 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.510 -13.332 7.425 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.569 -14.387 8.506 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.814 -16.430 6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.397 -16.877 7.947 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.235 -17.488 6.501 1.00 0.00 H new