USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 984 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 118 CYS SG : rot -23:sc= 0.713 USER MOD Set 1.2: A 119 GLN : amide:sc= -2.22! C(o=-1.5!,f=-3.2!) USER MOD Set 2.1: A 105 LYS NZ :NH3+ -166:sc= -0.0871 (180deg=-0.544) USER MOD Set 2.2: A 108 THR OG1 : rot 160:sc= 0 USER MOD Set 3.1: A 39 SER OG : rot 151:sc= 0.624 USER MOD Set 3.2: A 75 TYR OH : rot 180:sc= 0.171 USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0581 (180deg=0) USER MOD Single : A 2 SER OG : rot 108:sc= 0.316 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 39:sc= 0.0823 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 162:sc= -0.0344 (180deg=-0.253) USER MOD Single : A 27 LYS NZ :NH3+ 143:sc= -0.744 (180deg=-2.68!) USER MOD Single : A 29 HIS : no HD1:sc= -6.78! C(o=-6.8!,f=-6.9!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= -1.01 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 0:sc= 1.03 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -95:sc= 0.153 USER MOD Single : A 50 CYS SG : rot 180:sc= -2.14 USER MOD Single : A 53 CYS SG : rot 170:sc= -0.393 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.184 X(o=-0.18,f=8.3e-05) USER MOD Single : A 68 THR OG1 : rot -105:sc= 0.552 USER MOD Single : A 71 CYS SG : rot 166:sc= 0.0368 USER MOD Single : A 76 CYS SG : rot 82:sc= 0.0865 USER MOD Single : A 77 GLN : amide:sc= 0.375 K(o=0.37,f=-4.1!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 89 ASN : amide:sc= 0.311 K(o=0.31,f=-2.8!) USER MOD Single : A 93 GLN : amide:sc= 0.0374 X(o=0.037,f=-0.22) USER MOD Single : A 94 LYS NZ :NH3+ -109:sc= 0.189 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -159:sc= 1.22 (180deg=0.993) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -29:sc= -1.06! USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 163:sc= -0.0172 (180deg=-0.196) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 CYS SG : rot 37:sc= -0.0781 USER MOD Single : A 120 SER OG : rot 180:sc= 0.023 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -160:sc= -0.0333 (180deg=-0.311) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.341 17.894 15.359 1.00 0.00 N ATOM 2 CA GLY A 1 2.545 19.107 15.344 1.00 0.00 C ATOM 3 C GLY A 1 1.776 19.311 16.635 1.00 0.00 C ATOM 4 O GLY A 1 2.103 18.715 17.661 1.00 0.00 O ATOM 0 H1 GLY A 1 4.348 18.138 15.265 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.189 17.390 16.256 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.057 17.283 14.567 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.197 19.964 15.174 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.845 19.068 14.510 1.00 0.00 H new ATOM 8 N SER A 2 0.751 20.156 16.584 1.00 0.00 N ATOM 9 CA SER A 2 -0.063 20.441 17.760 1.00 0.00 C ATOM 10 C SER A 2 -1.249 19.485 17.844 1.00 0.00 C ATOM 11 O SER A 2 -1.540 18.933 18.904 1.00 0.00 O ATOM 12 CB SER A 2 -0.561 21.888 17.723 1.00 0.00 C ATOM 13 OG SER A 2 -1.422 22.102 16.618 1.00 0.00 O ATOM 0 H SER A 2 0.465 20.655 15.742 1.00 0.00 H new ATOM 0 HA SER A 2 0.558 20.300 18.645 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.088 22.118 18.649 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.289 22.567 17.663 1.00 0.00 H new ATOM 0 HG SER A 2 -2.344 22.197 16.936 1.00 0.00 H new ATOM 19 N GLU A 3 -1.930 19.296 16.717 1.00 0.00 N ATOM 20 CA GLU A 3 -3.085 18.408 16.664 1.00 0.00 C ATOM 21 C GLU A 3 -2.833 17.245 15.709 1.00 0.00 C ATOM 22 O GLU A 3 -2.828 16.083 16.115 1.00 0.00 O ATOM 23 CB GLU A 3 -4.331 19.181 16.227 1.00 0.00 C ATOM 24 CG GLU A 3 -5.088 19.817 17.380 1.00 0.00 C ATOM 25 CD GLU A 3 -4.447 21.105 17.858 1.00 0.00 C ATOM 26 OE1 GLU A 3 -4.343 22.051 17.049 1.00 0.00 O ATOM 27 OE2 GLU A 3 -4.050 21.168 19.040 1.00 0.00 O ATOM 0 H GLU A 3 -1.702 19.745 15.830 1.00 0.00 H new ATOM 0 HA GLU A 3 -3.248 18.006 17.664 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -4.037 19.960 15.523 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.999 18.505 15.694 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -6.113 20.019 17.069 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.139 19.111 18.209 1.00 0.00 H new ATOM 34 N GLY A 4 -2.624 17.567 14.435 1.00 0.00 N ATOM 35 CA GLY A 4 -2.375 16.539 13.441 1.00 0.00 C ATOM 36 C GLY A 4 -1.011 16.675 12.796 1.00 0.00 C ATOM 37 O GLY A 4 0.010 16.378 13.418 1.00 0.00 O ATOM 0 H GLY A 4 -2.623 18.521 14.074 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.456 15.558 13.909 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.144 16.589 12.671 1.00 0.00 H new ATOM 41 N ALA A 5 -0.991 17.123 11.545 1.00 0.00 N ATOM 42 CA ALA A 5 0.259 17.298 10.816 1.00 0.00 C ATOM 43 C ALA A 5 1.009 15.976 10.688 1.00 0.00 C ATOM 44 O ALA A 5 2.232 15.931 10.821 1.00 0.00 O ATOM 45 CB ALA A 5 1.130 18.338 11.503 1.00 0.00 C ATOM 0 H ALA A 5 -1.827 17.371 11.015 1.00 0.00 H new ATOM 0 HA ALA A 5 0.020 17.648 9.812 1.00 0.00 H new ATOM 0 HB1 ALA A 5 2.060 18.458 10.947 1.00 0.00 H new ATOM 0 HB2 ALA A 5 0.602 19.291 11.536 1.00 0.00 H new ATOM 0 HB3 ALA A 5 1.354 18.012 12.519 1.00 0.00 H new ATOM 51 N ALA A 6 0.269 14.903 10.431 1.00 0.00 N ATOM 52 CA ALA A 6 0.865 13.581 10.285 1.00 0.00 C ATOM 53 C ALA A 6 1.553 13.436 8.931 1.00 0.00 C ATOM 54 O ALA A 6 0.895 13.335 7.895 1.00 0.00 O ATOM 55 CB ALA A 6 -0.194 12.502 10.459 1.00 0.00 C ATOM 0 H ALA A 6 -0.745 14.923 10.320 1.00 0.00 H new ATOM 0 HA ALA A 6 1.620 13.462 11.062 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.265 11.520 10.347 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -0.638 12.584 11.451 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.969 12.628 9.703 1.00 0.00 H new ATOM 61 N THR A 7 2.883 13.426 8.947 1.00 0.00 N ATOM 62 CA THR A 7 3.660 13.296 7.721 1.00 0.00 C ATOM 63 C THR A 7 4.226 11.888 7.576 1.00 0.00 C ATOM 64 O THR A 7 5.405 11.711 7.272 1.00 0.00 O ATOM 65 CB THR A 7 4.819 14.309 7.680 1.00 0.00 C ATOM 66 OG1 THR A 7 4.447 15.508 8.369 1.00 0.00 O ATOM 67 CG2 THR A 7 5.198 14.641 6.244 1.00 0.00 C ATOM 0 H THR A 7 3.444 13.506 9.795 1.00 0.00 H new ATOM 0 HA THR A 7 2.980 13.499 6.893 1.00 0.00 H new ATOM 0 HB THR A 7 5.681 13.860 8.172 1.00 0.00 H new ATOM 0 HG1 THR A 7 5.190 16.146 8.340 1.00 0.00 H new ATOM 0 HG21 THR A 7 6.019 15.358 6.241 1.00 0.00 H new ATOM 0 HG22 THR A 7 5.509 13.731 5.730 1.00 0.00 H new ATOM 0 HG23 THR A 7 4.338 15.071 5.731 1.00 0.00 H new ATOM 75 N MET A 8 3.377 10.889 7.796 1.00 0.00 N ATOM 76 CA MET A 8 3.794 9.495 7.688 1.00 0.00 C ATOM 77 C MET A 8 2.648 8.622 7.187 1.00 0.00 C ATOM 78 O MET A 8 1.515 9.085 7.055 1.00 0.00 O ATOM 79 CB MET A 8 4.288 8.981 9.042 1.00 0.00 C ATOM 80 CG MET A 8 5.766 9.238 9.286 1.00 0.00 C ATOM 81 SD MET A 8 6.286 8.771 10.949 1.00 0.00 S ATOM 82 CE MET A 8 8.063 8.952 10.811 1.00 0.00 C ATOM 0 H MET A 8 2.398 11.018 8.050 1.00 0.00 H new ATOM 0 HA MET A 8 4.610 9.441 6.968 1.00 0.00 H new ATOM 0 HB2 MET A 8 3.709 9.455 9.835 1.00 0.00 H new ATOM 0 HB3 MET A 8 4.098 7.910 9.106 1.00 0.00 H new ATOM 0 HG2 MET A 8 6.353 8.681 8.556 1.00 0.00 H new ATOM 0 HG3 MET A 8 5.978 10.295 9.126 1.00 0.00 H new ATOM 0 HE1 MET A 8 8.530 8.698 11.763 1.00 0.00 H new ATOM 0 HE2 MET A 8 8.437 8.286 10.034 1.00 0.00 H new ATOM 0 HE3 MET A 8 8.305 9.983 10.552 1.00 0.00 H new ATOM 92 N ALA A 9 2.950 7.358 6.910 1.00 0.00 N ATOM 93 CA ALA A 9 1.944 6.421 6.425 1.00 0.00 C ATOM 94 C ALA A 9 1.503 5.468 7.532 1.00 0.00 C ATOM 95 O ALA A 9 2.126 5.400 8.592 1.00 0.00 O ATOM 96 CB ALA A 9 2.480 5.639 5.236 1.00 0.00 C ATOM 0 H ALA A 9 3.883 6.959 7.013 1.00 0.00 H new ATOM 0 HA ALA A 9 1.074 6.994 6.106 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.718 4.943 4.885 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.739 6.329 4.433 1.00 0.00 H new ATOM 0 HB3 ALA A 9 3.368 5.083 5.537 1.00 0.00 H new ATOM 102 N THR A 10 0.423 4.735 7.279 1.00 0.00 N ATOM 103 CA THR A 10 -0.102 3.788 8.255 1.00 0.00 C ATOM 104 C THR A 10 -0.435 2.452 7.600 1.00 0.00 C ATOM 105 O THR A 10 -1.189 2.397 6.628 1.00 0.00 O ATOM 106 CB THR A 10 -1.364 4.336 8.947 1.00 0.00 C ATOM 107 OG1 THR A 10 -2.287 4.825 7.967 1.00 0.00 O ATOM 108 CG2 THR A 10 -1.008 5.452 9.917 1.00 0.00 C ATOM 0 H THR A 10 -0.105 4.779 6.407 1.00 0.00 H new ATOM 0 HA THR A 10 0.677 3.639 9.002 1.00 0.00 H new ATOM 0 HB THR A 10 -1.826 3.523 9.507 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.287 4.227 7.191 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.915 5.823 10.394 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.329 5.069 10.679 1.00 0.00 H new ATOM 0 HG23 THR A 10 -0.524 6.265 9.375 1.00 0.00 H new ATOM 116 N PHE A 11 0.130 1.377 8.138 1.00 0.00 N ATOM 117 CA PHE A 11 -0.107 0.040 7.605 1.00 0.00 C ATOM 118 C PHE A 11 -0.749 -0.859 8.658 1.00 0.00 C ATOM 119 O PHE A 11 -0.364 -0.836 9.826 1.00 0.00 O ATOM 120 CB PHE A 11 1.206 -0.579 7.121 1.00 0.00 C ATOM 121 CG PHE A 11 1.956 -1.312 8.196 1.00 0.00 C ATOM 122 CD1 PHE A 11 1.699 -2.650 8.449 1.00 0.00 C ATOM 123 CD2 PHE A 11 2.916 -0.663 8.954 1.00 0.00 C ATOM 124 CE1 PHE A 11 2.388 -3.327 9.438 1.00 0.00 C ATOM 125 CE2 PHE A 11 3.608 -1.335 9.944 1.00 0.00 C ATOM 126 CZ PHE A 11 3.343 -2.669 10.187 1.00 0.00 C ATOM 0 H PHE A 11 0.756 1.405 8.943 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.792 0.128 6.761 1.00 0.00 H new ATOM 0 HB2 PHE A 11 0.994 -1.268 6.303 1.00 0.00 H new ATOM 0 HB3 PHE A 11 1.843 0.208 6.718 1.00 0.00 H new ATOM 0 HD1 PHE A 11 0.952 -3.170 7.867 1.00 0.00 H new ATOM 0 HD2 PHE A 11 3.126 0.380 8.770 1.00 0.00 H new ATOM 0 HE1 PHE A 11 2.179 -4.370 9.625 1.00 0.00 H new ATOM 0 HE2 PHE A 11 4.355 -0.818 10.527 1.00 0.00 H new ATOM 0 HZ PHE A 11 3.882 -3.196 10.961 1.00 0.00 H new ATOM 136 N GLU A 12 -1.729 -1.650 8.234 1.00 0.00 N ATOM 137 CA GLU A 12 -2.425 -2.556 9.140 1.00 0.00 C ATOM 138 C GLU A 12 -2.267 -4.005 8.689 1.00 0.00 C ATOM 139 O GLU A 12 -2.507 -4.333 7.528 1.00 0.00 O ATOM 140 CB GLU A 12 -3.910 -2.193 9.218 1.00 0.00 C ATOM 141 CG GLU A 12 -4.688 -3.026 10.223 1.00 0.00 C ATOM 142 CD GLU A 12 -4.039 -3.044 11.593 1.00 0.00 C ATOM 143 OE1 GLU A 12 -3.072 -3.811 11.783 1.00 0.00 O ATOM 144 OE2 GLU A 12 -4.498 -2.289 12.476 1.00 0.00 O ATOM 0 H GLU A 12 -2.059 -1.682 7.269 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.980 -2.452 10.130 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -4.005 -1.140 9.481 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.358 -2.317 8.232 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.700 -2.631 10.310 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.775 -4.048 9.853 1.00 0.00 H new ATOM 151 N GLU A 13 -1.861 -4.866 9.616 1.00 0.00 N ATOM 152 CA GLU A 13 -1.669 -6.280 9.314 1.00 0.00 C ATOM 153 C GLU A 13 -2.975 -7.053 9.476 1.00 0.00 C ATOM 154 O GLU A 13 -3.626 -6.982 10.518 1.00 0.00 O ATOM 155 CB GLU A 13 -0.593 -6.877 10.222 1.00 0.00 C ATOM 156 CG GLU A 13 0.113 -8.080 9.620 1.00 0.00 C ATOM 157 CD GLU A 13 -0.704 -9.353 9.731 1.00 0.00 C ATOM 158 OE1 GLU A 13 -1.169 -9.664 10.847 1.00 0.00 O ATOM 159 OE2 GLU A 13 -0.879 -10.037 8.701 1.00 0.00 O ATOM 0 H GLU A 13 -1.659 -4.610 10.582 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.345 -6.363 8.277 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.146 -6.109 10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.049 -7.170 11.168 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.329 -7.882 8.570 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.071 -8.223 10.121 1.00 0.00 H new ATOM 166 N VAL A 14 -3.352 -7.791 8.437 1.00 0.00 N ATOM 167 CA VAL A 14 -4.579 -8.578 8.463 1.00 0.00 C ATOM 168 C VAL A 14 -4.307 -10.032 8.094 1.00 0.00 C ATOM 169 O VAL A 14 -3.568 -10.316 7.151 1.00 0.00 O ATOM 170 CB VAL A 14 -5.635 -8.004 7.500 1.00 0.00 C ATOM 171 CG1 VAL A 14 -6.943 -8.769 7.625 1.00 0.00 C ATOM 172 CG2 VAL A 14 -5.847 -6.522 7.766 1.00 0.00 C ATOM 0 H VAL A 14 -2.825 -7.860 7.566 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.964 -8.531 9.482 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.272 -8.118 6.479 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.677 -8.349 6.937 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.776 -9.818 7.381 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.315 -8.689 8.646 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.596 -6.132 7.077 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.189 -6.382 8.791 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.908 -5.988 7.621 1.00 0.00 H new ATOM 182 N SER A 15 -4.910 -10.950 8.843 1.00 0.00 N ATOM 183 CA SER A 15 -4.730 -12.376 8.596 1.00 0.00 C ATOM 184 C SER A 15 -6.038 -13.018 8.143 1.00 0.00 C ATOM 185 O SER A 15 -7.089 -12.805 8.747 1.00 0.00 O ATOM 186 CB SER A 15 -4.217 -13.073 9.858 1.00 0.00 C ATOM 187 OG SER A 15 -4.280 -14.482 9.723 1.00 0.00 O ATOM 0 H SER A 15 -5.527 -10.732 9.625 1.00 0.00 H new ATOM 0 HA SER A 15 -3.994 -12.492 7.801 1.00 0.00 H new ATOM 0 HB2 SER A 15 -3.189 -12.769 10.053 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.810 -12.760 10.717 1.00 0.00 H new ATOM 0 HG SER A 15 -3.945 -14.904 10.542 1.00 0.00 H new ATOM 193 N VAL A 16 -5.965 -13.806 7.075 1.00 0.00 N ATOM 194 CA VAL A 16 -7.141 -14.480 6.540 1.00 0.00 C ATOM 195 C VAL A 16 -6.752 -15.742 5.778 1.00 0.00 C ATOM 196 O VAL A 16 -5.676 -15.815 5.183 1.00 0.00 O ATOM 197 CB VAL A 16 -7.942 -13.555 5.605 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.529 -12.387 6.383 1.00 0.00 C ATOM 199 CG2 VAL A 16 -7.064 -13.060 4.466 1.00 0.00 C ATOM 0 H VAL A 16 -5.103 -13.993 6.563 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.765 -14.751 7.392 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.766 -14.126 5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -9.091 -11.745 5.706 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.193 -12.765 7.160 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.723 -11.814 6.842 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.646 -12.408 3.815 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -6.218 -12.506 4.873 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.698 -13.911 3.893 1.00 0.00 H new ATOM 209 N LEU A 17 -7.635 -16.734 5.798 1.00 0.00 N ATOM 210 CA LEU A 17 -7.385 -17.995 5.108 1.00 0.00 C ATOM 211 C LEU A 17 -8.527 -18.329 4.154 1.00 0.00 C ATOM 212 O LEU A 17 -9.639 -18.636 4.583 1.00 0.00 O ATOM 213 CB LEU A 17 -7.204 -19.127 6.122 1.00 0.00 C ATOM 214 CG LEU A 17 -6.673 -20.448 5.564 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.345 -21.411 6.695 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.683 -21.069 4.610 1.00 0.00 C ATOM 0 H LEU A 17 -8.530 -16.690 6.284 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.470 -17.887 4.526 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -6.523 -18.785 6.901 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.165 -19.317 6.600 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.757 -20.244 5.009 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.969 -22.346 6.279 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.586 -20.969 7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.245 -21.609 7.277 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -7.288 -22.008 4.223 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.616 -21.259 5.141 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.870 -20.385 3.782 1.00 0.00 H new ATOM 228 N GLY A 18 -8.244 -18.269 2.856 1.00 0.00 N ATOM 229 CA GLY A 18 -9.257 -18.570 1.861 1.00 0.00 C ATOM 230 C GLY A 18 -9.642 -17.355 1.040 1.00 0.00 C ATOM 231 O GLY A 18 -9.200 -16.241 1.322 1.00 0.00 O ATOM 0 H GLY A 18 -7.332 -18.017 2.476 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.889 -19.352 1.197 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.143 -18.965 2.357 1.00 0.00 H new ATOM 235 N PHE A 19 -10.468 -17.569 0.021 1.00 0.00 N ATOM 236 CA PHE A 19 -10.910 -16.483 -0.845 1.00 0.00 C ATOM 237 C PHE A 19 -12.046 -15.698 -0.196 1.00 0.00 C ATOM 238 O PHE A 19 -12.120 -14.476 -0.322 1.00 0.00 O ATOM 239 CB PHE A 19 -11.365 -17.035 -2.198 1.00 0.00 C ATOM 240 CG PHE A 19 -11.706 -15.966 -3.197 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.859 -15.211 -3.058 1.00 0.00 C ATOM 242 CD2 PHE A 19 -10.872 -15.716 -4.275 1.00 0.00 C ATOM 243 CE1 PHE A 19 -13.175 -14.228 -3.976 1.00 0.00 C ATOM 244 CE2 PHE A 19 -11.182 -14.733 -5.196 1.00 0.00 C ATOM 245 CZ PHE A 19 -12.335 -13.988 -5.046 1.00 0.00 C ATOM 0 H PHE A 19 -10.844 -18.485 -0.225 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.068 -15.809 -0.999 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.576 -17.666 -2.608 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.237 -17.672 -2.047 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.519 -15.393 -2.222 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -9.969 -16.296 -4.397 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -14.078 -13.648 -3.857 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.523 -14.548 -6.032 1.00 0.00 H new ATOM 0 HZ PHE A 19 -12.580 -13.219 -5.764 1.00 0.00 H new ATOM 255 N GLU A 20 -12.928 -16.409 0.499 1.00 0.00 N ATOM 256 CA GLU A 20 -14.061 -15.779 1.167 1.00 0.00 C ATOM 257 C GLU A 20 -13.593 -14.658 2.090 1.00 0.00 C ATOM 258 O GLU A 20 -13.843 -13.481 1.830 1.00 0.00 O ATOM 259 CB GLU A 20 -14.851 -16.816 1.967 1.00 0.00 C ATOM 260 CG GLU A 20 -15.808 -17.639 1.120 1.00 0.00 C ATOM 261 CD GLU A 20 -15.158 -18.883 0.547 1.00 0.00 C ATOM 262 OE1 GLU A 20 -14.085 -19.277 1.049 1.00 0.00 O ATOM 263 OE2 GLU A 20 -15.723 -19.463 -0.404 1.00 0.00 O ATOM 0 H GLU A 20 -12.880 -17.421 0.614 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.709 -15.351 0.402 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.152 -17.487 2.466 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.416 -16.307 2.748 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -16.666 -17.929 1.726 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.187 -17.023 0.304 1.00 0.00 H new ATOM 270 N GLU A 21 -12.912 -15.032 3.169 1.00 0.00 N ATOM 271 CA GLU A 21 -12.411 -14.058 4.131 1.00 0.00 C ATOM 272 C GLU A 21 -11.602 -12.970 3.432 1.00 0.00 C ATOM 273 O GLU A 21 -11.778 -11.781 3.700 1.00 0.00 O ATOM 274 CB GLU A 21 -11.548 -14.751 5.188 1.00 0.00 C ATOM 275 CG GLU A 21 -12.331 -15.681 6.099 1.00 0.00 C ATOM 276 CD GLU A 21 -13.055 -14.940 7.207 1.00 0.00 C ATOM 277 OE1 GLU A 21 -13.747 -13.946 6.903 1.00 0.00 O ATOM 278 OE2 GLU A 21 -12.929 -15.354 8.378 1.00 0.00 O ATOM 0 H GLU A 21 -12.695 -16.002 3.398 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.268 -13.593 4.619 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.764 -15.320 4.689 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -11.053 -13.993 5.795 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -13.056 -16.239 5.506 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.651 -16.410 6.539 1.00 0.00 H new ATOM 285 N PHE A 22 -10.714 -13.385 2.535 1.00 0.00 N ATOM 286 CA PHE A 22 -9.876 -12.446 1.798 1.00 0.00 C ATOM 287 C PHE A 22 -10.707 -11.291 1.247 1.00 0.00 C ATOM 288 O PHE A 22 -10.397 -10.123 1.480 1.00 0.00 O ATOM 289 CB PHE A 22 -9.156 -13.163 0.653 1.00 0.00 C ATOM 290 CG PHE A 22 -8.663 -12.234 -0.419 1.00 0.00 C ATOM 291 CD1 PHE A 22 -8.013 -11.055 -0.089 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.848 -12.539 -1.758 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.559 -10.199 -1.074 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.396 -11.687 -2.748 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.749 -10.515 -2.405 1.00 0.00 C ATOM 0 H PHE A 22 -10.556 -14.365 2.301 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.135 -12.040 2.487 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.311 -13.719 1.058 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.833 -13.892 0.208 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.860 -10.803 0.950 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.352 -13.454 -2.032 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.056 -9.283 -0.803 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.548 -11.937 -3.788 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.393 -9.848 -3.176 1.00 0.00 H new ATOM 305 N ASP A 23 -11.764 -11.627 0.515 1.00 0.00 N ATOM 306 CA ASP A 23 -12.641 -10.619 -0.069 1.00 0.00 C ATOM 307 C ASP A 23 -13.195 -9.692 1.008 1.00 0.00 C ATOM 308 O ASP A 23 -13.062 -8.471 0.920 1.00 0.00 O ATOM 309 CB ASP A 23 -13.790 -11.289 -0.824 1.00 0.00 C ATOM 310 CG ASP A 23 -14.552 -10.314 -1.701 1.00 0.00 C ATOM 311 OD1 ASP A 23 -14.910 -9.226 -1.205 1.00 0.00 O ATOM 312 OD2 ASP A 23 -14.790 -10.641 -2.883 1.00 0.00 O ATOM 0 H ASP A 23 -12.034 -12.589 0.312 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.055 -10.023 -0.769 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.394 -12.096 -1.441 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.476 -11.742 -0.108 1.00 0.00 H new ATOM 317 N LYS A 24 -13.819 -10.279 2.024 1.00 0.00 N ATOM 318 CA LYS A 24 -14.394 -9.507 3.119 1.00 0.00 C ATOM 319 C LYS A 24 -13.406 -8.461 3.625 1.00 0.00 C ATOM 320 O LYS A 24 -13.761 -7.298 3.814 1.00 0.00 O ATOM 321 CB LYS A 24 -14.803 -10.435 4.265 1.00 0.00 C ATOM 322 CG LYS A 24 -15.747 -9.788 5.264 1.00 0.00 C ATOM 323 CD LYS A 24 -17.184 -9.817 4.772 1.00 0.00 C ATOM 324 CE LYS A 24 -17.844 -11.157 5.058 1.00 0.00 C ATOM 325 NZ LYS A 24 -18.091 -11.355 6.513 1.00 0.00 N ATOM 0 H LYS A 24 -13.939 -11.288 2.112 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.279 -8.993 2.743 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.280 -11.323 3.850 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.907 -10.769 4.788 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.678 -10.307 6.220 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.442 -8.756 5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.751 -9.021 5.254 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.207 -9.620 3.700 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.789 -11.219 4.518 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.210 -11.961 4.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -18.795 -12.108 6.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -17.203 -11.624 6.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.447 -10.471 6.928 1.00 0.00 H new ATOM 339 N ALA A 25 -12.164 -8.882 3.840 1.00 0.00 N ATOM 340 CA ALA A 25 -11.124 -7.980 4.321 1.00 0.00 C ATOM 341 C ALA A 25 -10.819 -6.897 3.292 1.00 0.00 C ATOM 342 O ALA A 25 -10.498 -5.763 3.647 1.00 0.00 O ATOM 343 CB ALA A 25 -9.863 -8.762 4.658 1.00 0.00 C ATOM 0 H ALA A 25 -11.853 -9.842 3.689 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.488 -7.493 5.225 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.095 -8.077 5.016 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.086 -9.495 5.434 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.504 -9.276 3.766 1.00 0.00 H new ATOM 349 N VAL A 26 -10.921 -7.253 2.016 1.00 0.00 N ATOM 350 CA VAL A 26 -10.656 -6.311 0.935 1.00 0.00 C ATOM 351 C VAL A 26 -11.755 -5.258 0.842 1.00 0.00 C ATOM 352 O VAL A 26 -11.485 -4.058 0.876 1.00 0.00 O ATOM 353 CB VAL A 26 -10.534 -7.032 -0.421 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.486 -6.023 -1.559 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.306 -7.928 -0.439 1.00 0.00 C ATOM 0 H VAL A 26 -11.185 -8.188 1.705 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.709 -5.824 1.165 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.414 -7.659 -0.561 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -10.400 -6.550 -2.509 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -11.399 -5.427 -1.556 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.625 -5.368 -1.428 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.236 -8.429 -1.404 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.413 -7.324 -0.278 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.388 -8.674 0.352 1.00 0.00 H new ATOM 365 N LYS A 27 -12.997 -5.716 0.726 1.00 0.00 N ATOM 366 CA LYS A 27 -14.139 -4.815 0.630 1.00 0.00 C ATOM 367 C LYS A 27 -14.220 -3.907 1.852 1.00 0.00 C ATOM 368 O LYS A 27 -14.874 -2.865 1.820 1.00 0.00 O ATOM 369 CB LYS A 27 -15.436 -5.616 0.489 1.00 0.00 C ATOM 370 CG LYS A 27 -15.637 -6.209 -0.894 1.00 0.00 C ATOM 371 CD LYS A 27 -16.081 -5.154 -1.894 1.00 0.00 C ATOM 372 CE LYS A 27 -17.551 -4.803 -1.718 1.00 0.00 C ATOM 373 NZ LYS A 27 -17.747 -3.730 -0.705 1.00 0.00 N ATOM 0 H LYS A 27 -13.238 -6.707 0.696 1.00 0.00 H new ATOM 0 HA LYS A 27 -14.006 -4.192 -0.255 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.438 -6.421 1.224 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.281 -4.968 0.724 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -14.707 -6.665 -1.234 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.383 -7.003 -0.846 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -15.474 -4.257 -1.771 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -15.911 -5.517 -2.908 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -17.964 -4.480 -2.674 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -18.103 -5.693 -1.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -18.520 -3.103 -1.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -17.988 -4.158 0.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -16.871 -3.178 -0.610 1.00 0.00 H new ATOM 387 N GLU A 28 -13.551 -4.309 2.928 1.00 0.00 N ATOM 388 CA GLU A 28 -13.548 -3.530 4.161 1.00 0.00 C ATOM 389 C GLU A 28 -12.609 -2.333 4.045 1.00 0.00 C ATOM 390 O GLU A 28 -12.926 -1.234 4.503 1.00 0.00 O ATOM 391 CB GLU A 28 -13.130 -4.406 5.343 1.00 0.00 C ATOM 392 CG GLU A 28 -14.297 -5.095 6.032 1.00 0.00 C ATOM 393 CD GLU A 28 -13.890 -5.780 7.323 1.00 0.00 C ATOM 394 OE1 GLU A 28 -12.688 -6.079 7.482 1.00 0.00 O ATOM 395 OE2 GLU A 28 -14.774 -6.017 8.172 1.00 0.00 O ATOM 0 H GLU A 28 -13.004 -5.169 2.971 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.560 -3.162 4.331 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.427 -5.162 4.993 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -12.601 -3.791 6.071 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.074 -4.361 6.244 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.730 -5.831 5.355 1.00 0.00 H new ATOM 402 N HIS A 29 -11.451 -2.553 3.430 1.00 0.00 N ATOM 403 CA HIS A 29 -10.465 -1.493 3.253 1.00 0.00 C ATOM 404 C HIS A 29 -10.472 -0.978 1.817 1.00 0.00 C ATOM 405 O HIS A 29 -9.505 -0.368 1.362 1.00 0.00 O ATOM 406 CB HIS A 29 -9.070 -1.999 3.619 1.00 0.00 C ATOM 407 CG HIS A 29 -9.055 -2.906 4.811 1.00 0.00 C ATOM 408 ND1 HIS A 29 -9.414 -2.492 6.076 1.00 0.00 N ATOM 409 CD2 HIS A 29 -8.724 -4.213 4.924 1.00 0.00 C ATOM 410 CE1 HIS A 29 -9.302 -3.505 6.917 1.00 0.00 C ATOM 411 NE2 HIS A 29 -8.886 -4.562 6.243 1.00 0.00 N ATOM 0 H HIS A 29 -11.173 -3.456 3.046 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.730 -0.670 3.916 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.649 -2.529 2.764 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.422 -1.144 3.815 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -8.394 -4.861 4.126 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -9.514 -3.474 7.975 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -8.713 -5.487 6.637 1.00 0.00 H new ATOM 420 N GLU A 30 -11.568 -1.231 1.108 1.00 0.00 N ATOM 421 CA GLU A 30 -11.699 -0.794 -0.277 1.00 0.00 C ATOM 422 C GLU A 30 -11.509 0.716 -0.392 1.00 0.00 C ATOM 423 O GLU A 30 -11.295 1.244 -1.483 1.00 0.00 O ATOM 424 CB GLU A 30 -13.067 -1.191 -0.834 1.00 0.00 C ATOM 425 CG GLU A 30 -14.201 -0.300 -0.354 1.00 0.00 C ATOM 426 CD GLU A 30 -15.513 -0.597 -1.054 1.00 0.00 C ATOM 427 OE1 GLU A 30 -15.674 -1.730 -1.555 1.00 0.00 O ATOM 428 OE2 GLU A 30 -16.378 0.302 -1.101 1.00 0.00 O ATOM 0 H GLU A 30 -12.377 -1.736 1.470 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.921 -1.286 -0.861 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -13.029 -1.162 -1.923 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -13.281 -2.221 -0.550 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.330 -0.429 0.721 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -13.933 0.744 -0.520 1.00 0.00 H new ATOM 435 N SER A 31 -11.591 1.405 0.742 1.00 0.00 N ATOM 436 CA SER A 31 -11.433 2.854 0.769 1.00 0.00 C ATOM 437 C SER A 31 -9.962 3.242 0.659 1.00 0.00 C ATOM 438 O SER A 31 -9.621 4.273 0.078 1.00 0.00 O ATOM 439 CB SER A 31 -12.029 3.429 2.056 1.00 0.00 C ATOM 440 OG SER A 31 -13.445 3.430 2.006 1.00 0.00 O ATOM 0 H SER A 31 -11.766 0.983 1.654 1.00 0.00 H new ATOM 0 HA SER A 31 -11.965 3.269 -0.087 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.693 2.842 2.910 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.667 4.446 2.206 1.00 0.00 H new ATOM 0 HG SER A 31 -13.802 3.800 2.840 1.00 0.00 H new ATOM 446 N LYS A 32 -9.093 2.409 1.221 1.00 0.00 N ATOM 447 CA LYS A 32 -7.657 2.662 1.186 1.00 0.00 C ATOM 448 C LYS A 32 -6.929 1.561 0.422 1.00 0.00 C ATOM 449 O LYS A 32 -7.511 0.525 0.099 1.00 0.00 O ATOM 450 CB LYS A 32 -7.102 2.763 2.609 1.00 0.00 C ATOM 451 CG LYS A 32 -7.414 1.553 3.471 1.00 0.00 C ATOM 452 CD LYS A 32 -8.724 1.725 4.221 1.00 0.00 C ATOM 453 CE LYS A 32 -8.713 0.973 5.543 1.00 0.00 C ATOM 454 NZ LYS A 32 -9.583 1.625 6.560 1.00 0.00 N ATOM 0 H LYS A 32 -9.358 1.552 1.707 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.492 3.608 0.670 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.021 2.894 2.560 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.510 3.654 3.087 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.467 0.663 2.844 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.604 1.394 4.183 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.902 2.784 4.405 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.548 1.366 3.604 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.049 -0.051 5.381 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.692 0.918 5.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.548 1.082 7.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.247 2.594 6.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.562 1.655 6.211 1.00 0.00 H new ATOM 468 N THR A 33 -5.651 1.790 0.137 1.00 0.00 N ATOM 469 CA THR A 33 -4.843 0.818 -0.589 1.00 0.00 C ATOM 470 C THR A 33 -4.887 -0.547 0.088 1.00 0.00 C ATOM 471 O THR A 33 -4.875 -0.642 1.315 1.00 0.00 O ATOM 472 CB THR A 33 -3.377 1.277 -0.700 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.320 2.621 -1.190 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.592 0.360 -1.626 1.00 0.00 C ATOM 0 H THR A 33 -5.153 2.641 0.398 1.00 0.00 H new ATOM 0 HA THR A 33 -5.267 0.738 -1.590 1.00 0.00 H new ATOM 0 HB THR A 33 -2.930 1.234 0.293 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.385 2.906 -1.256 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.560 0.704 -1.689 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.613 -0.657 -1.234 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.041 0.375 -2.619 1.00 0.00 H new ATOM 482 N ILE A 34 -4.937 -1.601 -0.720 1.00 0.00 N ATOM 483 CA ILE A 34 -4.980 -2.961 -0.198 1.00 0.00 C ATOM 484 C ILE A 34 -3.889 -3.825 -0.822 1.00 0.00 C ATOM 485 O ILE A 34 -3.645 -3.761 -2.027 1.00 0.00 O ATOM 486 CB ILE A 34 -6.349 -3.619 -0.454 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.448 -2.874 0.307 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.317 -5.085 -0.048 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.843 -3.183 -0.189 1.00 0.00 C ATOM 0 H ILE A 34 -4.949 -1.539 -1.738 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.814 -2.891 0.877 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.569 -3.562 -1.520 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.383 -3.129 1.365 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.272 -1.801 0.226 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.292 -5.536 -0.235 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.558 -5.607 -0.630 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.078 -5.164 1.013 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.570 -2.620 0.396 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.926 -2.902 -1.239 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.039 -4.250 -0.082 1.00 0.00 H new ATOM 501 N PHE A 35 -3.236 -4.634 0.006 1.00 0.00 N ATOM 502 CA PHE A 35 -2.171 -5.512 -0.465 1.00 0.00 C ATOM 503 C PHE A 35 -2.435 -6.957 -0.051 1.00 0.00 C ATOM 504 O PHE A 35 -2.384 -7.294 1.131 1.00 0.00 O ATOM 505 CB PHE A 35 -0.820 -5.050 0.086 1.00 0.00 C ATOM 506 CG PHE A 35 -0.209 -3.921 -0.694 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.392 -4.155 -1.920 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.237 -2.627 -0.200 1.00 0.00 C ATOM 509 CE1 PHE A 35 0.956 -3.117 -2.639 1.00 0.00 C ATOM 510 CE2 PHE A 35 0.325 -1.586 -0.915 1.00 0.00 C ATOM 511 CZ PHE A 35 0.921 -1.831 -2.136 1.00 0.00 C ATOM 0 H PHE A 35 -3.426 -4.700 1.006 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.148 -5.463 -1.554 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.947 -4.738 1.123 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.130 -5.894 0.089 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.420 -5.158 -2.318 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.703 -2.429 0.754 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.423 -3.312 -3.593 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.298 -0.582 -0.519 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.359 -1.019 -2.697 1.00 0.00 H new ATOM 521 N ALA A 36 -2.718 -7.805 -1.035 1.00 0.00 N ATOM 522 CA ALA A 36 -2.988 -9.214 -0.774 1.00 0.00 C ATOM 523 C ALA A 36 -1.734 -10.059 -0.970 1.00 0.00 C ATOM 524 O ALA A 36 -1.090 -9.997 -2.018 1.00 0.00 O ATOM 525 CB ALA A 36 -4.109 -9.711 -1.675 1.00 0.00 C ATOM 0 H ALA A 36 -2.766 -7.541 -2.019 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.301 -9.313 0.265 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.301 -10.764 -1.470 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.013 -9.134 -1.483 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.817 -9.592 -2.718 1.00 0.00 H new ATOM 531 N TYR A 37 -1.393 -10.847 0.043 1.00 0.00 N ATOM 532 CA TYR A 37 -0.214 -11.702 -0.017 1.00 0.00 C ATOM 533 C TYR A 37 -0.611 -13.172 -0.113 1.00 0.00 C ATOM 534 O TYR A 37 -0.597 -13.898 0.881 1.00 0.00 O ATOM 535 CB TYR A 37 0.667 -11.480 1.214 1.00 0.00 C ATOM 536 CG TYR A 37 1.959 -12.265 1.184 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.807 -12.202 0.085 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.331 -13.070 2.253 1.00 0.00 C ATOM 539 CE1 TYR A 37 3.988 -12.918 0.053 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.511 -13.788 2.230 1.00 0.00 C ATOM 541 CZ TYR A 37 4.336 -13.709 1.128 1.00 0.00 C ATOM 542 OH TYR A 37 5.511 -14.424 1.101 1.00 0.00 O ATOM 0 H TYR A 37 -1.917 -10.911 0.916 1.00 0.00 H new ATOM 0 HA TYR A 37 0.350 -11.437 -0.912 1.00 0.00 H new ATOM 0 HB2 TYR A 37 0.899 -10.418 1.298 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.105 -11.755 2.107 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.538 -11.583 -0.758 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.687 -13.136 3.117 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.635 -12.859 -0.809 1.00 0.00 H new ATOM 0 HE2 TYR A 37 3.786 -14.408 3.071 1.00 0.00 H new ATOM 0 HH TYR A 37 5.606 -14.928 1.936 1.00 0.00 H new ATOM 552 N PHE A 38 -0.966 -13.604 -1.319 1.00 0.00 N ATOM 553 CA PHE A 38 -1.368 -14.987 -1.547 1.00 0.00 C ATOM 554 C PHE A 38 -0.176 -15.930 -1.412 1.00 0.00 C ATOM 555 O PHE A 38 0.662 -16.021 -2.309 1.00 0.00 O ATOM 556 CB PHE A 38 -1.995 -15.136 -2.935 1.00 0.00 C ATOM 557 CG PHE A 38 -2.987 -14.057 -3.264 1.00 0.00 C ATOM 558 CD1 PHE A 38 -4.167 -13.941 -2.547 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.740 -13.159 -4.289 1.00 0.00 C ATOM 560 CE1 PHE A 38 -5.082 -12.949 -2.846 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.651 -12.164 -4.593 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.824 -12.060 -3.871 1.00 0.00 C ATOM 0 H PHE A 38 -0.983 -13.017 -2.153 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.107 -15.253 -0.791 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.204 -15.132 -3.685 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.490 -16.105 -2.999 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.374 -14.634 -1.745 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.825 -13.237 -4.858 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.998 -12.869 -2.279 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.446 -11.469 -5.394 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.538 -11.285 -4.108 1.00 0.00 H new ATOM 572 N SER A 39 -0.107 -16.629 -0.284 1.00 0.00 N ATOM 573 CA SER A 39 0.984 -17.561 -0.027 1.00 0.00 C ATOM 574 C SER A 39 0.451 -18.887 0.508 1.00 0.00 C ATOM 575 O SER A 39 -0.721 -19.000 0.862 1.00 0.00 O ATOM 576 CB SER A 39 1.976 -16.958 0.969 1.00 0.00 C ATOM 577 OG SER A 39 1.314 -16.510 2.139 1.00 0.00 O ATOM 0 H SER A 39 -0.794 -16.567 0.467 1.00 0.00 H new ATOM 0 HA SER A 39 1.497 -17.749 -0.970 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.727 -17.702 1.234 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.503 -16.125 0.504 1.00 0.00 H new ATOM 0 HG SER A 39 1.927 -16.561 2.902 1.00 0.00 H new ATOM 583 N GLY A 40 1.324 -19.889 0.562 1.00 0.00 N ATOM 584 CA GLY A 40 0.924 -21.195 1.055 1.00 0.00 C ATOM 585 C GLY A 40 0.494 -21.160 2.508 1.00 0.00 C ATOM 586 O GLY A 40 0.832 -20.230 3.240 1.00 0.00 O ATOM 0 H GLY A 40 2.300 -19.820 0.274 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.104 -21.574 0.446 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.754 -21.892 0.942 1.00 0.00 H new ATOM 590 N SER A 41 -0.255 -22.175 2.927 1.00 0.00 N ATOM 591 CA SER A 41 -0.736 -22.254 4.301 1.00 0.00 C ATOM 592 C SER A 41 0.428 -22.402 5.276 1.00 0.00 C ATOM 593 O SER A 41 1.499 -22.889 4.914 1.00 0.00 O ATOM 594 CB SER A 41 -1.702 -23.430 4.459 1.00 0.00 C ATOM 595 OG SER A 41 -2.907 -23.198 3.751 1.00 0.00 O ATOM 0 H SER A 41 -0.542 -22.954 2.334 1.00 0.00 H new ATOM 0 HA SER A 41 -1.263 -21.328 4.529 1.00 0.00 H new ATOM 0 HB2 SER A 41 -1.232 -24.343 4.093 1.00 0.00 H new ATOM 0 HB3 SER A 41 -1.921 -23.585 5.515 1.00 0.00 H new ATOM 0 HG SER A 41 -3.507 -23.964 3.866 1.00 0.00 H new ATOM 601 N LYS A 42 0.210 -21.978 6.517 1.00 0.00 N ATOM 602 CA LYS A 42 1.238 -22.064 7.547 1.00 0.00 C ATOM 603 C LYS A 42 1.200 -23.421 8.242 1.00 0.00 C ATOM 604 O LYS A 42 0.248 -24.184 8.082 1.00 0.00 O ATOM 605 CB LYS A 42 1.052 -20.947 8.576 1.00 0.00 C ATOM 606 CG LYS A 42 1.166 -19.552 7.987 1.00 0.00 C ATOM 607 CD LYS A 42 0.452 -18.523 8.847 1.00 0.00 C ATOM 608 CE LYS A 42 1.104 -17.153 8.736 1.00 0.00 C ATOM 609 NZ LYS A 42 0.882 -16.332 9.958 1.00 0.00 N ATOM 0 H LYS A 42 -0.670 -21.571 6.833 1.00 0.00 H new ATOM 0 HA LYS A 42 2.209 -21.949 7.066 1.00 0.00 H new ATOM 0 HB2 LYS A 42 0.074 -21.055 9.045 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.797 -21.062 9.363 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.218 -19.281 7.892 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.743 -19.545 6.983 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.593 -18.455 8.543 1.00 0.00 H new ATOM 0 HD3 LYS A 42 0.461 -18.848 9.887 1.00 0.00 H new ATOM 0 HE2 LYS A 42 2.174 -17.273 8.569 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.702 -16.629 7.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.342 -15.406 9.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.139 -16.196 10.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.288 -16.820 10.782 1.00 0.00 H new ATOM 623 N ASP A 43 2.241 -23.715 9.013 1.00 0.00 N ATOM 624 CA ASP A 43 2.326 -24.979 9.735 1.00 0.00 C ATOM 625 C ASP A 43 2.033 -24.779 11.219 1.00 0.00 C ATOM 626 O ASP A 43 1.767 -23.663 11.665 1.00 0.00 O ATOM 627 CB ASP A 43 3.711 -25.602 9.555 1.00 0.00 C ATOM 628 CG ASP A 43 4.005 -25.953 8.110 1.00 0.00 C ATOM 629 OD1 ASP A 43 3.353 -26.875 7.579 1.00 0.00 O ATOM 630 OD2 ASP A 43 4.888 -25.305 7.510 1.00 0.00 O ATOM 0 H ASP A 43 3.038 -23.095 9.154 1.00 0.00 H new ATOM 0 HA ASP A 43 1.576 -25.655 9.323 1.00 0.00 H new ATOM 0 HB2 ASP A 43 4.468 -24.908 9.918 1.00 0.00 H new ATOM 0 HB3 ASP A 43 3.784 -26.502 10.166 1.00 0.00 H new ATOM 635 N THR A 44 2.083 -25.868 11.979 1.00 0.00 N ATOM 636 CA THR A 44 1.821 -25.813 13.412 1.00 0.00 C ATOM 637 C THR A 44 2.950 -25.103 14.150 1.00 0.00 C ATOM 638 O THR A 44 2.903 -24.946 15.369 1.00 0.00 O ATOM 639 CB THR A 44 1.642 -27.223 14.005 1.00 0.00 C ATOM 640 OG1 THR A 44 1.581 -27.150 15.433 1.00 0.00 O ATOM 641 CG2 THR A 44 2.786 -28.135 13.587 1.00 0.00 C ATOM 0 H THR A 44 2.303 -26.799 11.626 1.00 0.00 H new ATOM 0 HA THR A 44 0.896 -25.252 13.543 1.00 0.00 H new ATOM 0 HB THR A 44 0.709 -27.638 13.623 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.664 -26.216 15.717 1.00 0.00 H new ATOM 0 HG21 THR A 44 2.638 -29.125 14.018 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.811 -28.212 12.500 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.730 -27.722 13.943 1.00 0.00 H new ATOM 649 N GLU A 45 3.963 -24.677 13.402 1.00 0.00 N ATOM 650 CA GLU A 45 5.105 -23.984 13.988 1.00 0.00 C ATOM 651 C GLU A 45 5.065 -22.495 13.657 1.00 0.00 C ATOM 652 O GLU A 45 5.721 -21.685 14.310 1.00 0.00 O ATOM 653 CB GLU A 45 6.414 -24.595 13.485 1.00 0.00 C ATOM 654 CG GLU A 45 7.593 -24.358 14.414 1.00 0.00 C ATOM 655 CD GLU A 45 7.680 -25.391 15.521 1.00 0.00 C ATOM 656 OE1 GLU A 45 6.661 -25.616 16.206 1.00 0.00 O ATOM 657 OE2 GLU A 45 8.770 -25.976 15.701 1.00 0.00 O ATOM 0 H GLU A 45 4.016 -24.799 12.391 1.00 0.00 H new ATOM 0 HA GLU A 45 5.052 -24.100 15.071 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.277 -25.668 13.352 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.646 -24.180 12.504 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.516 -24.373 13.835 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.510 -23.365 14.855 1.00 0.00 H new ATOM 664 N GLY A 46 4.291 -22.142 12.635 1.00 0.00 N ATOM 665 CA GLY A 46 4.180 -20.752 12.233 1.00 0.00 C ATOM 666 C GLY A 46 5.002 -20.438 10.999 1.00 0.00 C ATOM 667 O GLY A 46 5.516 -19.329 10.851 1.00 0.00 O ATOM 0 H GLY A 46 3.739 -22.794 12.078 1.00 0.00 H new ATOM 0 HA2 GLY A 46 3.134 -20.516 12.039 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.504 -20.113 13.054 1.00 0.00 H new ATOM 671 N LYS A 47 5.128 -21.417 10.109 1.00 0.00 N ATOM 672 CA LYS A 47 5.893 -21.242 8.881 1.00 0.00 C ATOM 673 C LYS A 47 5.192 -21.911 7.703 1.00 0.00 C ATOM 674 O LYS A 47 4.370 -22.809 7.886 1.00 0.00 O ATOM 675 CB LYS A 47 7.301 -21.819 9.045 1.00 0.00 C ATOM 676 CG LYS A 47 8.070 -21.223 10.211 1.00 0.00 C ATOM 677 CD LYS A 47 8.448 -19.775 9.947 1.00 0.00 C ATOM 678 CE LYS A 47 8.568 -18.985 11.241 1.00 0.00 C ATOM 679 NZ LYS A 47 8.793 -17.535 10.988 1.00 0.00 N ATOM 0 H LYS A 47 4.709 -22.341 10.216 1.00 0.00 H new ATOM 0 HA LYS A 47 5.967 -20.174 8.678 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.229 -22.898 9.182 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.863 -21.651 8.126 1.00 0.00 H new ATOM 0 HG2 LYS A 47 7.465 -21.283 11.116 1.00 0.00 H new ATOM 0 HG3 LYS A 47 8.972 -21.809 10.391 1.00 0.00 H new ATOM 0 HD2 LYS A 47 9.394 -19.738 9.408 1.00 0.00 H new ATOM 0 HD3 LYS A 47 7.697 -19.313 9.306 1.00 0.00 H new ATOM 0 HE2 LYS A 47 7.660 -19.114 11.830 1.00 0.00 H new ATOM 0 HE3 LYS A 47 9.392 -19.382 11.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 8.869 -17.032 11.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 9.673 -17.409 10.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 7.995 -17.149 10.444 1.00 0.00 H new ATOM 693 N SER A 48 5.524 -21.469 6.494 1.00 0.00 N ATOM 694 CA SER A 48 4.924 -22.024 5.286 1.00 0.00 C ATOM 695 C SER A 48 5.740 -23.204 4.767 1.00 0.00 C ATOM 696 O SER A 48 6.960 -23.247 4.926 1.00 0.00 O ATOM 697 CB SER A 48 4.817 -20.948 4.204 1.00 0.00 C ATOM 698 OG SER A 48 3.625 -20.196 4.348 1.00 0.00 O ATOM 0 H SER A 48 6.205 -20.729 6.325 1.00 0.00 H new ATOM 0 HA SER A 48 3.924 -22.378 5.536 1.00 0.00 H new ATOM 0 HB2 SER A 48 5.679 -20.283 4.261 1.00 0.00 H new ATOM 0 HB3 SER A 48 4.839 -21.415 3.219 1.00 0.00 H new ATOM 0 HG SER A 48 2.928 -20.574 3.772 1.00 0.00 H new ATOM 704 N TRP A 49 5.057 -24.160 4.147 1.00 0.00 N ATOM 705 CA TRP A 49 5.718 -25.341 3.604 1.00 0.00 C ATOM 706 C TRP A 49 6.816 -24.949 2.623 1.00 0.00 C ATOM 707 O TRP A 49 7.819 -25.650 2.487 1.00 0.00 O ATOM 708 CB TRP A 49 4.699 -26.248 2.913 1.00 0.00 C ATOM 709 CG TRP A 49 3.638 -25.492 2.171 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.419 -25.107 2.651 1.00 0.00 C ATOM 711 CD2 TRP A 49 3.702 -25.032 0.817 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.721 -24.435 1.677 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.486 -24.375 0.542 1.00 0.00 C ATOM 714 CE3 TRP A 49 4.668 -25.110 -0.190 1.00 0.00 C ATOM 715 CZ2 TRP A 49 2.214 -23.802 -0.697 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.395 -24.541 -1.420 1.00 0.00 C ATOM 717 CH2 TRP A 49 3.177 -23.893 -1.664 1.00 0.00 C ATOM 0 H TRP A 49 4.047 -24.140 4.008 1.00 0.00 H new ATOM 0 HA TRP A 49 6.175 -25.883 4.432 1.00 0.00 H new ATOM 0 HB2 TRP A 49 5.221 -26.905 2.217 1.00 0.00 H new ATOM 0 HB3 TRP A 49 4.226 -26.886 3.660 1.00 0.00 H new ATOM 0 HD1 TRP A 49 2.057 -25.302 3.650 1.00 0.00 H new ATOM 0 HE1 TRP A 49 0.785 -24.044 1.782 1.00 0.00 H new ATOM 0 HE3 TRP A 49 5.611 -25.606 -0.011 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 1.275 -23.303 -0.888 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 5.133 -24.597 -2.206 1.00 0.00 H new ATOM 0 HH2 TRP A 49 2.995 -23.457 -2.635 1.00 0.00 H new ATOM 728 N CYS A 50 6.621 -23.825 1.942 1.00 0.00 N ATOM 729 CA CYS A 50 7.596 -23.340 0.971 1.00 0.00 C ATOM 730 C CYS A 50 8.676 -22.508 1.656 1.00 0.00 C ATOM 731 O CYS A 50 8.403 -21.701 2.544 1.00 0.00 O ATOM 732 CB CYS A 50 6.901 -22.507 -0.108 1.00 0.00 C ATOM 733 SG CYS A 50 8.036 -21.610 -1.192 1.00 0.00 S ATOM 0 H CYS A 50 5.797 -23.233 2.044 1.00 0.00 H new ATOM 0 HA CYS A 50 8.069 -24.204 0.504 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.279 -23.165 -0.715 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.234 -21.792 0.373 1.00 0.00 H new ATOM 0 HG CYS A 50 7.355 -20.937 -2.072 1.00 0.00 H new ATOM 739 N PRO A 51 9.934 -22.710 1.235 1.00 0.00 N ATOM 740 CA PRO A 51 11.081 -21.990 1.795 1.00 0.00 C ATOM 741 C PRO A 51 11.084 -20.515 1.407 1.00 0.00 C ATOM 742 O PRO A 51 11.485 -19.658 2.194 1.00 0.00 O ATOM 743 CB PRO A 51 12.285 -22.707 1.179 1.00 0.00 C ATOM 744 CG PRO A 51 11.767 -23.298 -0.087 1.00 0.00 C ATOM 745 CD PRO A 51 10.332 -23.658 0.180 1.00 0.00 C ATOM 0 HA PRO A 51 11.075 -21.998 2.885 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.103 -22.013 0.986 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.671 -23.477 1.847 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.844 -22.587 -0.910 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.344 -24.178 -0.371 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.717 -23.547 -0.713 1.00 0.00 H new ATOM 0 HD3 PRO A 51 10.232 -24.692 0.510 1.00 0.00 H new ATOM 753 N ASP A 52 10.635 -20.227 0.191 1.00 0.00 N ATOM 754 CA ASP A 52 10.585 -18.855 -0.301 1.00 0.00 C ATOM 755 C ASP A 52 9.656 -18.003 0.559 1.00 0.00 C ATOM 756 O ASP A 52 10.035 -16.925 1.020 1.00 0.00 O ATOM 757 CB ASP A 52 10.118 -18.829 -1.757 1.00 0.00 C ATOM 758 CG ASP A 52 11.096 -19.515 -2.691 1.00 0.00 C ATOM 759 OD1 ASP A 52 12.316 -19.438 -2.434 1.00 0.00 O ATOM 760 OD2 ASP A 52 10.641 -20.130 -3.678 1.00 0.00 O ATOM 0 H ASP A 52 10.300 -20.925 -0.473 1.00 0.00 H new ATOM 0 HA ASP A 52 11.590 -18.438 -0.243 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.146 -19.316 -1.832 1.00 0.00 H new ATOM 0 HB3 ASP A 52 9.982 -17.795 -2.074 1.00 0.00 H new ATOM 765 N CYS A 53 8.440 -18.493 0.771 1.00 0.00 N ATOM 766 CA CYS A 53 7.456 -17.776 1.575 1.00 0.00 C ATOM 767 C CYS A 53 8.064 -17.314 2.895 1.00 0.00 C ATOM 768 O CYS A 53 7.772 -16.220 3.377 1.00 0.00 O ATOM 769 CB CYS A 53 6.240 -18.664 1.842 1.00 0.00 C ATOM 770 SG CYS A 53 5.187 -18.930 0.397 1.00 0.00 S ATOM 0 H CYS A 53 8.111 -19.384 0.398 1.00 0.00 H new ATOM 0 HA CYS A 53 7.138 -16.896 1.016 1.00 0.00 H new ATOM 0 HB2 CYS A 53 6.584 -19.631 2.210 1.00 0.00 H new ATOM 0 HB3 CYS A 53 5.643 -18.215 2.635 1.00 0.00 H new ATOM 0 HG CYS A 53 4.313 -19.856 0.661 1.00 0.00 H new ATOM 776 N VAL A 54 8.911 -18.158 3.477 1.00 0.00 N ATOM 777 CA VAL A 54 9.561 -17.837 4.742 1.00 0.00 C ATOM 778 C VAL A 54 10.629 -16.765 4.556 1.00 0.00 C ATOM 779 O VAL A 54 10.782 -15.876 5.392 1.00 0.00 O ATOM 780 CB VAL A 54 10.206 -19.084 5.374 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.830 -18.741 6.718 1.00 0.00 C ATOM 782 CG2 VAL A 54 9.180 -20.198 5.522 1.00 0.00 C ATOM 0 H VAL A 54 9.163 -19.069 3.093 1.00 0.00 H new ATOM 0 HA VAL A 54 8.785 -17.461 5.409 1.00 0.00 H new ATOM 0 HB VAL A 54 10.998 -19.436 4.713 1.00 0.00 H new ATOM 0 HG11 VAL A 54 11.281 -19.635 7.149 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.597 -17.979 6.579 1.00 0.00 H new ATOM 0 HG13 VAL A 54 10.060 -18.363 7.391 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.653 -21.071 5.970 1.00 0.00 H new ATOM 0 HG22 VAL A 54 8.365 -19.859 6.161 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.786 -20.462 4.541 1.00 0.00 H new ATOM 792 N GLU A 55 11.365 -16.856 3.452 1.00 0.00 N ATOM 793 CA GLU A 55 12.419 -15.894 3.156 1.00 0.00 C ATOM 794 C GLU A 55 11.841 -14.631 2.523 1.00 0.00 C ATOM 795 O GLU A 55 12.527 -13.617 2.398 1.00 0.00 O ATOM 796 CB GLU A 55 13.461 -16.515 2.223 1.00 0.00 C ATOM 797 CG GLU A 55 14.715 -15.673 2.064 1.00 0.00 C ATOM 798 CD GLU A 55 15.772 -16.354 1.216 1.00 0.00 C ATOM 799 OE1 GLU A 55 15.398 -17.116 0.301 1.00 0.00 O ATOM 800 OE2 GLU A 55 16.973 -16.124 1.468 1.00 0.00 O ATOM 0 H GLU A 55 11.250 -17.586 2.749 1.00 0.00 H new ATOM 0 HA GLU A 55 12.900 -15.621 4.095 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.739 -17.497 2.605 1.00 0.00 H new ATOM 0 HB3 GLU A 55 13.011 -16.670 1.242 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.451 -14.717 1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 55 15.129 -15.455 3.048 1.00 0.00 H new ATOM 807 N ALA A 56 10.575 -14.702 2.126 1.00 0.00 N ATOM 808 CA ALA A 56 9.904 -13.566 1.507 1.00 0.00 C ATOM 809 C ALA A 56 9.079 -12.792 2.530 1.00 0.00 C ATOM 810 O ALA A 56 8.968 -11.569 2.453 1.00 0.00 O ATOM 811 CB ALA A 56 9.021 -14.035 0.360 1.00 0.00 C ATOM 0 H ALA A 56 9.993 -15.534 2.222 1.00 0.00 H new ATOM 0 HA ALA A 56 10.667 -12.896 1.112 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.526 -13.176 -0.093 1.00 0.00 H new ATOM 0 HB2 ALA A 56 9.633 -14.537 -0.389 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.270 -14.728 0.739 1.00 0.00 H new ATOM 817 N GLU A 57 8.503 -13.513 3.486 1.00 0.00 N ATOM 818 CA GLU A 57 7.687 -12.892 4.523 1.00 0.00 C ATOM 819 C GLU A 57 8.373 -11.650 5.084 1.00 0.00 C ATOM 820 O GLU A 57 7.794 -10.565 5.146 1.00 0.00 O ATOM 821 CB GLU A 57 7.411 -13.889 5.651 1.00 0.00 C ATOM 822 CG GLU A 57 6.013 -13.775 6.236 1.00 0.00 C ATOM 823 CD GLU A 57 5.941 -12.790 7.387 1.00 0.00 C ATOM 824 OE1 GLU A 57 6.989 -12.535 8.016 1.00 0.00 O ATOM 825 OE2 GLU A 57 4.836 -12.276 7.659 1.00 0.00 O ATOM 0 H GLU A 57 8.586 -14.527 3.564 1.00 0.00 H new ATOM 0 HA GLU A 57 6.741 -12.591 4.074 1.00 0.00 H new ATOM 0 HB2 GLU A 57 7.556 -14.901 5.273 1.00 0.00 H new ATOM 0 HB3 GLU A 57 8.142 -13.737 6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 57 5.320 -13.465 5.454 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.686 -14.756 6.581 1.00 0.00 H new ATOM 832 N PRO A 58 9.636 -11.811 5.504 1.00 0.00 N ATOM 833 CA PRO A 58 10.429 -10.714 6.067 1.00 0.00 C ATOM 834 C PRO A 58 10.806 -9.673 5.018 1.00 0.00 C ATOM 835 O PRO A 58 10.979 -8.495 5.332 1.00 0.00 O ATOM 836 CB PRO A 58 11.681 -11.417 6.597 1.00 0.00 C ATOM 837 CG PRO A 58 11.798 -12.654 5.775 1.00 0.00 C ATOM 838 CD PRO A 58 10.389 -13.075 5.460 1.00 0.00 C ATOM 0 HA PRO A 58 9.878 -10.163 6.829 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.564 -10.786 6.491 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.584 -11.654 7.657 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.362 -12.464 4.862 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.327 -13.436 6.320 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.321 -13.549 4.481 1.00 0.00 H new ATOM 0 HD3 PRO A 58 10.012 -13.793 6.189 1.00 0.00 H new ATOM 846 N VAL A 59 10.931 -10.114 3.771 1.00 0.00 N ATOM 847 CA VAL A 59 11.286 -9.220 2.675 1.00 0.00 C ATOM 848 C VAL A 59 10.105 -8.340 2.280 1.00 0.00 C ATOM 849 O VAL A 59 10.286 -7.253 1.730 1.00 0.00 O ATOM 850 CB VAL A 59 11.761 -10.007 1.440 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.295 -9.061 0.376 1.00 0.00 C ATOM 852 CG2 VAL A 59 12.816 -11.030 1.834 1.00 0.00 C ATOM 0 H VAL A 59 10.792 -11.086 3.494 1.00 0.00 H new ATOM 0 HA VAL A 59 12.102 -8.591 3.031 1.00 0.00 H new ATOM 0 HB VAL A 59 10.908 -10.541 1.021 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.626 -9.636 -0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.507 -8.371 0.074 1.00 0.00 H new ATOM 0 HG13 VAL A 59 13.136 -8.497 0.780 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.141 -11.577 0.949 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.670 -10.519 2.278 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.394 -11.728 2.557 1.00 0.00 H new ATOM 862 N ILE A 60 8.898 -8.816 2.564 1.00 0.00 N ATOM 863 CA ILE A 60 7.688 -8.071 2.240 1.00 0.00 C ATOM 864 C ILE A 60 7.220 -7.238 3.429 1.00 0.00 C ATOM 865 O ILE A 60 7.008 -6.031 3.309 1.00 0.00 O ATOM 866 CB ILE A 60 6.548 -9.011 1.806 1.00 0.00 C ATOM 867 CG1 ILE A 60 6.975 -9.842 0.594 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.293 -8.211 1.490 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.838 -10.604 -0.048 1.00 0.00 C ATOM 0 H ILE A 60 8.732 -9.714 3.018 1.00 0.00 H new ATOM 0 HA ILE A 60 7.938 -7.409 1.411 1.00 0.00 H new ATOM 0 HB ILE A 60 6.325 -9.691 2.629 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.424 -9.182 -0.148 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.747 -10.548 0.901 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.496 -8.889 1.185 1.00 0.00 H new ATOM 0 HG22 ILE A 60 4.980 -7.660 2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.502 -7.510 0.682 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.215 -11.170 -0.900 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.403 -11.289 0.679 1.00 0.00 H new ATOM 0 HD13 ILE A 60 5.076 -9.903 -0.387 1.00 0.00 H new ATOM 881 N ARG A 61 7.062 -7.890 4.576 1.00 0.00 N ATOM 882 CA ARG A 61 6.620 -7.210 5.787 1.00 0.00 C ATOM 883 C ARG A 61 7.508 -6.007 6.090 1.00 0.00 C ATOM 884 O ARG A 61 7.070 -5.041 6.714 1.00 0.00 O ATOM 885 CB ARG A 61 6.630 -8.176 6.973 1.00 0.00 C ATOM 886 CG ARG A 61 5.638 -7.809 8.065 1.00 0.00 C ATOM 887 CD ARG A 61 5.248 -9.023 8.893 1.00 0.00 C ATOM 888 NE ARG A 61 4.888 -8.660 10.261 1.00 0.00 N ATOM 889 CZ ARG A 61 5.770 -8.263 11.173 1.00 0.00 C ATOM 890 NH1 ARG A 61 7.056 -8.179 10.863 1.00 0.00 N ATOM 891 NH2 ARG A 61 5.365 -7.949 12.397 1.00 0.00 N ATOM 0 H ARG A 61 7.234 -8.889 4.692 1.00 0.00 H new ATOM 0 HA ARG A 61 5.602 -6.857 5.624 1.00 0.00 H new ATOM 0 HB2 ARG A 61 6.407 -9.181 6.614 1.00 0.00 H new ATOM 0 HB3 ARG A 61 7.633 -8.205 7.399 1.00 0.00 H new ATOM 0 HG2 ARG A 61 6.074 -7.049 8.714 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.746 -7.371 7.616 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.407 -9.530 8.419 1.00 0.00 H new ATOM 0 HD3 ARG A 61 6.077 -9.730 8.912 1.00 0.00 H new ATOM 0 HE ARG A 61 3.906 -8.714 10.532 1.00 0.00 H new ATOM 0 HH11 ARG A 61 7.371 -8.419 9.923 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.731 -7.874 11.564 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.376 -8.012 12.639 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.043 -7.645 13.096 1.00 0.00 H new ATOM 905 N GLU A 62 8.759 -6.074 5.643 1.00 0.00 N ATOM 906 CA GLU A 62 9.709 -4.990 5.868 1.00 0.00 C ATOM 907 C GLU A 62 9.460 -3.838 4.899 1.00 0.00 C ATOM 908 O GLU A 62 9.295 -2.691 5.311 1.00 0.00 O ATOM 909 CB GLU A 62 11.143 -5.500 5.714 1.00 0.00 C ATOM 910 CG GLU A 62 11.604 -6.379 6.864 1.00 0.00 C ATOM 911 CD GLU A 62 11.974 -5.580 8.098 1.00 0.00 C ATOM 912 OE1 GLU A 62 11.456 -4.455 8.254 1.00 0.00 O ATOM 913 OE2 GLU A 62 12.783 -6.080 8.908 1.00 0.00 O ATOM 0 H GLU A 62 9.137 -6.866 5.124 1.00 0.00 H new ATOM 0 HA GLU A 62 9.568 -4.623 6.885 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.221 -6.063 4.784 1.00 0.00 H new ATOM 0 HB3 GLU A 62 11.816 -4.647 5.628 1.00 0.00 H new ATOM 0 HG2 GLU A 62 10.813 -7.085 7.117 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.465 -6.966 6.545 1.00 0.00 H new ATOM 920 N GLY A 63 9.434 -4.154 3.608 1.00 0.00 N ATOM 921 CA GLY A 63 9.206 -3.135 2.599 1.00 0.00 C ATOM 922 C GLY A 63 7.907 -2.384 2.818 1.00 0.00 C ATOM 923 O GLY A 63 7.809 -1.196 2.509 1.00 0.00 O ATOM 0 H GLY A 63 9.567 -5.097 3.242 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.036 -2.429 2.606 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.192 -3.600 1.613 1.00 0.00 H new ATOM 927 N LEU A 64 6.907 -3.077 3.351 1.00 0.00 N ATOM 928 CA LEU A 64 5.607 -2.469 3.609 1.00 0.00 C ATOM 929 C LEU A 64 5.753 -1.216 4.466 1.00 0.00 C ATOM 930 O LEU A 64 4.942 -0.293 4.381 1.00 0.00 O ATOM 931 CB LEU A 64 4.682 -3.470 4.303 1.00 0.00 C ATOM 932 CG LEU A 64 3.962 -4.463 3.389 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.409 -5.627 4.197 1.00 0.00 C ATOM 934 CD2 LEU A 64 2.847 -3.768 2.621 1.00 0.00 C ATOM 0 H LEU A 64 6.972 -4.061 3.613 1.00 0.00 H new ATOM 0 HA LEU A 64 5.170 -2.184 2.652 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.268 -4.034 5.029 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.932 -2.913 4.864 1.00 0.00 H new ATOM 0 HG LEU A 64 4.682 -4.855 2.671 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.900 -6.323 3.530 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.227 -6.140 4.702 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.703 -5.253 4.938 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.345 -4.489 1.976 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.128 -3.348 3.324 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.268 -2.968 2.012 1.00 0.00 H new ATOM 946 N LYS A 65 6.793 -1.188 5.292 1.00 0.00 N ATOM 947 CA LYS A 65 7.049 -0.047 6.163 1.00 0.00 C ATOM 948 C LYS A 65 7.488 1.168 5.353 1.00 0.00 C ATOM 949 O LYS A 65 7.213 2.309 5.728 1.00 0.00 O ATOM 950 CB LYS A 65 8.122 -0.399 7.196 1.00 0.00 C ATOM 951 CG LYS A 65 7.563 -1.007 8.471 1.00 0.00 C ATOM 952 CD LYS A 65 7.256 0.058 9.509 1.00 0.00 C ATOM 953 CE LYS A 65 8.516 0.515 10.229 1.00 0.00 C ATOM 954 NZ LYS A 65 8.238 1.624 11.184 1.00 0.00 N ATOM 0 H LYS A 65 7.473 -1.943 5.377 1.00 0.00 H new ATOM 0 HA LYS A 65 6.122 0.199 6.680 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.829 -1.098 6.749 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.681 0.502 7.448 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.655 -1.565 8.241 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.280 -1.719 8.880 1.00 0.00 H new ATOM 0 HD2 LYS A 65 6.782 0.912 9.026 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.543 -0.334 10.234 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.952 -0.327 10.767 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.254 0.843 9.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.121 1.907 11.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.845 2.437 10.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.553 1.304 11.898 1.00 0.00 H new ATOM 968 N HIS A 66 8.170 0.918 4.240 1.00 0.00 N ATOM 969 CA HIS A 66 8.645 1.992 3.376 1.00 0.00 C ATOM 970 C HIS A 66 7.507 2.545 2.522 1.00 0.00 C ATOM 971 O HIS A 66 7.712 3.437 1.698 1.00 0.00 O ATOM 972 CB HIS A 66 9.775 1.491 2.477 1.00 0.00 C ATOM 973 CG HIS A 66 10.948 0.949 3.236 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.174 1.577 3.275 1.00 0.00 N ATOM 975 CD2 HIS A 66 11.074 -0.169 3.989 1.00 0.00 C ATOM 976 CE1 HIS A 66 13.006 0.868 4.017 1.00 0.00 C ATOM 977 NE2 HIS A 66 12.363 -0.196 4.463 1.00 0.00 N ATOM 0 H HIS A 66 8.406 -0.020 3.915 1.00 0.00 H new ATOM 0 HA HIS A 66 9.024 2.794 4.010 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.387 0.713 1.819 1.00 0.00 H new ATOM 0 HB3 HIS A 66 10.111 2.309 1.840 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.305 -0.902 4.181 1.00 0.00 H new ATOM 0 HE1 HIS A 66 14.037 1.116 4.224 1.00 0.00 H new ATOM 0 HE2 HIS A 66 12.759 -0.920 5.062 1.00 0.00 H new ATOM 986 N VAL A 67 6.308 2.009 2.723 1.00 0.00 N ATOM 987 CA VAL A 67 5.138 2.448 1.972 1.00 0.00 C ATOM 988 C VAL A 67 4.798 3.901 2.285 1.00 0.00 C ATOM 989 O VAL A 67 4.984 4.366 3.410 1.00 0.00 O ATOM 990 CB VAL A 67 3.912 1.568 2.278 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.331 1.916 3.640 1.00 0.00 C ATOM 992 CG2 VAL A 67 2.862 1.720 1.187 1.00 0.00 C ATOM 0 H VAL A 67 6.121 1.269 3.400 1.00 0.00 H new ATOM 0 HA VAL A 67 5.387 2.356 0.915 1.00 0.00 H new ATOM 0 HB VAL A 67 4.231 0.526 2.301 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.466 1.284 3.839 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.085 1.752 4.410 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.026 2.962 3.649 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.002 1.091 1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.545 2.761 1.130 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.286 1.416 0.230 1.00 0.00 H new ATOM 1002 N THR A 68 4.297 4.615 1.282 1.00 0.00 N ATOM 1003 CA THR A 68 3.931 6.016 1.449 1.00 0.00 C ATOM 1004 C THR A 68 2.444 6.231 1.190 1.00 0.00 C ATOM 1005 O THR A 68 2.029 7.308 0.764 1.00 0.00 O ATOM 1006 CB THR A 68 4.742 6.925 0.506 1.00 0.00 C ATOM 1007 OG1 THR A 68 4.311 6.735 -0.847 1.00 0.00 O ATOM 1008 CG2 THR A 68 6.230 6.629 0.616 1.00 0.00 C ATOM 0 H THR A 68 4.135 4.246 0.345 1.00 0.00 H new ATOM 0 HA THR A 68 4.159 6.281 2.481 1.00 0.00 H new ATOM 0 HB THR A 68 4.572 7.961 0.800 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.977 6.203 -1.331 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.782 7.283 -0.059 1.00 0.00 H new ATOM 0 HG22 THR A 68 6.561 6.802 1.640 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.415 5.589 0.346 1.00 0.00 H new ATOM 1016 N GLU A 69 1.648 5.198 1.450 1.00 0.00 N ATOM 1017 CA GLU A 69 0.206 5.276 1.244 1.00 0.00 C ATOM 1018 C GLU A 69 -0.532 4.356 2.212 1.00 0.00 C ATOM 1019 O GLU A 69 -0.371 3.136 2.171 1.00 0.00 O ATOM 1020 CB GLU A 69 -0.146 4.904 -0.198 1.00 0.00 C ATOM 1021 CG GLU A 69 0.357 3.532 -0.613 1.00 0.00 C ATOM 1022 CD GLU A 69 0.430 3.368 -2.119 1.00 0.00 C ATOM 1023 OE1 GLU A 69 -0.448 3.916 -2.818 1.00 0.00 O ATOM 1024 OE2 GLU A 69 1.364 2.691 -2.598 1.00 0.00 O ATOM 0 H GLU A 69 1.976 4.299 1.803 1.00 0.00 H new ATOM 0 HA GLU A 69 -0.108 6.302 1.434 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.229 4.936 -0.319 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.272 5.653 -0.870 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.346 3.367 -0.185 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.301 2.768 -0.200 1.00 0.00 H new ATOM 1031 N ASP A 70 -1.340 4.951 3.083 1.00 0.00 N ATOM 1032 CA ASP A 70 -2.104 4.186 4.062 1.00 0.00 C ATOM 1033 C ASP A 70 -2.763 2.974 3.411 1.00 0.00 C ATOM 1034 O ASP A 70 -3.798 3.095 2.755 1.00 0.00 O ATOM 1035 CB ASP A 70 -3.168 5.071 4.714 1.00 0.00 C ATOM 1036 CG ASP A 70 -3.788 6.048 3.735 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -3.166 7.099 3.472 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -4.895 5.763 3.232 1.00 0.00 O ATOM 0 H ASP A 70 -1.483 5.960 3.131 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.415 3.834 4.829 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.950 4.441 5.139 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.720 5.624 5.540 1.00 0.00 H new ATOM 1043 N CYS A 71 -2.156 1.807 3.596 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.682 0.572 3.025 1.00 0.00 C ATOM 1045 C CYS A 71 -2.982 -0.448 4.118 1.00 0.00 C ATOM 1046 O CYS A 71 -2.663 -0.232 5.288 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.688 -0.015 2.022 1.00 0.00 C ATOM 1048 SG CYS A 71 -0.255 -0.812 2.783 1.00 0.00 S ATOM 0 H CYS A 71 -1.299 1.690 4.137 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.612 0.808 2.508 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.206 -0.743 1.397 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.340 0.781 1.363 1.00 0.00 H new ATOM 0 HG CYS A 71 0.368 -1.525 1.893 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.599 -1.559 3.730 1.00 0.00 N ATOM 1055 CA VAL A 72 -3.943 -2.613 4.677 1.00 0.00 C ATOM 1056 C VAL A 72 -3.485 -3.977 4.172 1.00 0.00 C ATOM 1057 O VAL A 72 -4.080 -4.543 3.255 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.460 -2.658 4.940 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -5.792 -3.729 5.968 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -5.961 -1.296 5.396 1.00 0.00 C ATOM 0 H VAL A 72 -3.871 -1.753 2.766 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.427 -2.382 5.609 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.966 -2.913 4.009 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.868 -3.746 6.141 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.469 -4.702 5.597 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.278 -3.508 6.903 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.035 -1.345 5.577 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.450 -1.010 6.315 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.757 -0.556 4.622 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.424 -4.500 4.777 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.885 -5.798 4.389 1.00 0.00 C ATOM 1072 C PHE A 73 -2.894 -6.910 4.663 1.00 0.00 C ATOM 1073 O PHE A 73 -3.591 -6.893 5.678 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.583 -6.079 5.141 1.00 0.00 C ATOM 1075 CG PHE A 73 0.172 -7.266 4.611 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.579 -7.309 3.287 1.00 0.00 C ATOM 1077 CD2 PHE A 73 0.473 -8.337 5.436 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.272 -8.400 2.797 1.00 0.00 C ATOM 1079 CE2 PHE A 73 1.167 -9.430 4.952 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.568 -9.461 3.630 1.00 0.00 C ATOM 0 H PHE A 73 -1.920 -4.045 5.538 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.680 -5.773 3.319 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.056 -5.198 5.086 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.809 -6.243 6.194 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.352 -6.481 2.631 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.162 -8.318 6.470 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.582 -8.423 1.763 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.395 -10.258 5.606 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.112 -10.313 3.249 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.966 -7.873 3.751 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.888 -8.993 3.894 1.00 0.00 C ATOM 1092 C ILE A 74 -3.199 -10.317 3.581 1.00 0.00 C ATOM 1093 O ILE A 74 -3.094 -10.715 2.421 1.00 0.00 O ATOM 1094 CB ILE A 74 -5.113 -8.835 2.974 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.742 -7.452 3.158 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -6.133 -9.928 3.256 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -7.021 -7.260 2.374 1.00 0.00 C ATOM 0 H ILE A 74 -2.397 -7.900 2.905 1.00 0.00 H new ATOM 0 HA ILE A 74 -4.221 -8.996 4.932 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.785 -8.930 1.939 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -5.947 -7.293 4.217 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -5.022 -6.691 2.855 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.993 -9.802 2.598 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.680 -10.903 3.079 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.459 -9.863 4.294 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.410 -6.258 2.553 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.818 -7.386 1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.758 -7.997 2.693 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.733 -10.995 4.623 1.00 0.00 N ATOM 1110 CA TYR A 75 -2.053 -12.275 4.460 1.00 0.00 C ATOM 1111 C TYR A 75 -3.054 -13.392 4.184 1.00 0.00 C ATOM 1112 O TYR A 75 -3.551 -14.038 5.108 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.235 -12.604 5.710 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.198 -13.683 5.488 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.577 -14.988 5.198 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.159 -13.397 5.570 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.367 -15.977 4.996 1.00 0.00 C ATOM 1118 CE2 TYR A 75 2.109 -14.379 5.367 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.708 -15.667 5.081 1.00 0.00 C ATOM 1120 OH TYR A 75 2.652 -16.648 4.879 1.00 0.00 O ATOM 0 H TYR A 75 -2.813 -10.680 5.590 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.381 -12.195 3.605 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.737 -11.699 6.057 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.912 -12.920 6.504 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.626 -15.233 5.129 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.477 -12.390 5.796 1.00 0.00 H new ATOM 0 HE1 TYR A 75 0.056 -16.987 4.773 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.160 -14.139 5.432 1.00 0.00 H new ATOM 0 HH TYR A 75 3.549 -16.264 4.973 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.345 -13.615 2.907 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.287 -14.654 2.508 1.00 0.00 C ATOM 1132 C CYS A 76 -3.553 -15.938 2.134 1.00 0.00 C ATOM 1133 O CYS A 76 -2.688 -15.937 1.259 1.00 0.00 O ATOM 1134 CB CYS A 76 -5.136 -14.176 1.329 1.00 0.00 C ATOM 1135 SG CYS A 76 -6.187 -15.459 0.608 1.00 0.00 S ATOM 0 H CYS A 76 -2.942 -13.090 2.131 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.940 -14.863 3.355 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.765 -13.349 1.660 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.476 -13.785 0.555 1.00 0.00 H new ATOM 0 HG CYS A 76 -7.275 -15.574 1.310 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.905 -17.031 2.804 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.278 -18.321 2.543 1.00 0.00 C ATOM 1143 C GLN A 77 -4.063 -19.107 1.498 1.00 0.00 C ATOM 1144 O GLN A 77 -5.205 -19.504 1.733 1.00 0.00 O ATOM 1145 CB GLN A 77 -3.174 -19.132 3.836 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.332 -18.461 4.909 1.00 0.00 C ATOM 1147 CD GLN A 77 -2.598 -19.018 6.293 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -2.020 -20.031 6.689 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -3.477 -18.358 7.038 1.00 0.00 N ATOM 0 H GLN A 77 -4.620 -17.049 3.531 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.276 -18.137 2.156 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.176 -19.305 4.228 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -2.747 -20.109 3.609 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.276 -18.586 4.668 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.535 -17.390 4.907 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.933 -17.523 6.670 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.697 -18.686 7.978 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.444 -19.328 0.342 1.00 0.00 N ATOM 1159 CA VAL A 78 -4.085 -20.067 -0.739 1.00 0.00 C ATOM 1160 C VAL A 78 -4.595 -21.420 -0.254 1.00 0.00 C ATOM 1161 O VAL A 78 -5.762 -21.760 -0.445 1.00 0.00 O ATOM 1162 CB VAL A 78 -3.118 -20.288 -1.918 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.732 -18.959 -2.548 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -1.884 -21.049 -1.458 1.00 0.00 C ATOM 0 H VAL A 78 -2.500 -19.006 0.131 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.928 -19.465 -1.077 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.625 -20.887 -2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.049 -19.135 -3.379 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.627 -18.456 -2.915 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.243 -18.331 -1.803 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -1.212 -21.197 -2.303 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.373 -20.478 -0.683 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.182 -22.018 -1.058 1.00 0.00 H new ATOM 1174 N GLY A 79 -3.711 -22.188 0.376 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.091 -23.495 0.880 1.00 0.00 C ATOM 1176 C GLY A 79 -2.892 -24.383 1.150 1.00 0.00 C ATOM 1177 O GLY A 79 -1.826 -23.899 1.530 1.00 0.00 O ATOM 0 H GLY A 79 -2.739 -21.929 0.546 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.664 -23.374 1.799 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.746 -23.983 0.158 1.00 0.00 H new ATOM 1181 N ASP A 80 -3.066 -25.685 0.954 1.00 0.00 N ATOM 1182 CA ASP A 80 -1.990 -26.643 1.179 1.00 0.00 C ATOM 1183 C ASP A 80 -1.045 -26.690 -0.018 1.00 0.00 C ATOM 1184 O ASP A 80 -1.294 -26.057 -1.044 1.00 0.00 O ATOM 1185 CB ASP A 80 -2.565 -28.035 1.446 1.00 0.00 C ATOM 1186 CG ASP A 80 -3.764 -27.998 2.373 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -3.566 -27.812 3.592 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -4.901 -28.155 1.880 1.00 0.00 O ATOM 0 H ASP A 80 -3.942 -26.102 0.640 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.425 -26.319 2.053 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.855 -28.493 0.500 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.791 -28.667 1.882 1.00 0.00 H new ATOM 1193 N LYS A 81 0.040 -27.444 0.121 1.00 0.00 N ATOM 1194 CA LYS A 81 1.023 -27.575 -0.949 1.00 0.00 C ATOM 1195 C LYS A 81 0.387 -28.168 -2.202 1.00 0.00 C ATOM 1196 O LYS A 81 0.402 -27.569 -3.278 1.00 0.00 O ATOM 1197 CB LYS A 81 2.190 -28.454 -0.491 1.00 0.00 C ATOM 1198 CG LYS A 81 2.830 -29.248 -1.617 1.00 0.00 C ATOM 1199 CD LYS A 81 4.281 -29.580 -1.309 1.00 0.00 C ATOM 1200 CE LYS A 81 4.398 -30.852 -0.484 1.00 0.00 C ATOM 1201 NZ LYS A 81 4.406 -32.070 -1.340 1.00 0.00 N ATOM 0 H LYS A 81 0.261 -27.974 0.964 1.00 0.00 H new ATOM 0 HA LYS A 81 1.397 -26.580 -1.189 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.948 -27.824 -0.025 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.836 -29.145 0.274 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.271 -30.170 -1.777 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.775 -28.677 -2.544 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.834 -29.697 -2.241 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.738 -28.751 -0.769 1.00 0.00 H new ATOM 0 HE2 LYS A 81 5.313 -30.818 0.108 1.00 0.00 H new ATOM 0 HE3 LYS A 81 3.566 -30.907 0.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 4.487 -32.916 -0.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 3.522 -32.116 -1.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 5.215 -32.030 -1.993 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.187 -29.372 -2.063 1.00 0.00 N ATOM 1216 CA PRO A 82 -0.840 -30.071 -3.174 1.00 0.00 C ATOM 1217 C PRO A 82 -2.138 -29.393 -3.602 1.00 0.00 C ATOM 1218 O PRO A 82 -2.569 -29.524 -4.747 1.00 0.00 O ATOM 1219 CB PRO A 82 -1.126 -31.460 -2.600 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.209 -31.252 -1.127 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.242 -30.145 -0.811 1.00 0.00 C ATOM 0 HA PRO A 82 -0.218 -30.085 -4.069 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.056 -31.868 -2.995 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.335 -32.165 -2.856 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.222 -30.983 -0.827 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.949 -32.163 -0.589 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.588 -29.535 0.023 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.738 -30.534 -0.536 1.00 0.00 H new ATOM 1229 N TYR A 83 -2.755 -28.669 -2.675 1.00 0.00 N ATOM 1230 CA TYR A 83 -4.004 -27.973 -2.956 1.00 0.00 C ATOM 1231 C TYR A 83 -3.774 -26.804 -3.909 1.00 0.00 C ATOM 1232 O TYR A 83 -4.523 -26.613 -4.867 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.635 -27.469 -1.657 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.591 -26.315 -1.855 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -5.120 -25.029 -2.088 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -6.966 -26.511 -1.812 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -5.990 -23.971 -2.269 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -7.844 -25.459 -1.994 1.00 0.00 C ATOM 1239 CZ TYR A 83 -7.351 -24.191 -2.221 1.00 0.00 C ATOM 1240 OH TYR A 83 -8.221 -23.140 -2.403 1.00 0.00 O ATOM 0 H TYR A 83 -2.410 -28.549 -1.723 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.684 -28.679 -3.433 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.166 -28.292 -1.178 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.843 -27.161 -0.974 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.055 -24.853 -2.128 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.355 -27.502 -1.633 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.607 -22.977 -2.447 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -8.910 -25.629 -1.959 1.00 0.00 H new ATOM 0 HH TYR A 83 -9.144 -23.464 -2.340 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.732 -26.026 -3.639 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.402 -24.875 -4.472 1.00 0.00 C ATOM 1252 C TRP A 84 -2.184 -25.297 -5.921 1.00 0.00 C ATOM 1253 O TRP A 84 -2.771 -24.725 -6.840 1.00 0.00 O ATOM 1254 CB TRP A 84 -1.151 -24.176 -3.938 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.425 -23.380 -4.981 1.00 0.00 C ATOM 1256 CD1 TRP A 84 0.869 -23.547 -5.386 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.950 -22.291 -5.748 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.179 -22.628 -6.359 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.080 -21.846 -6.599 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -2.190 -21.650 -5.800 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 -0.094 -20.790 -7.490 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.362 -20.602 -6.683 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -1.319 -20.181 -7.519 1.00 0.00 C ATOM 0 H TRP A 84 -2.101 -26.171 -2.850 1.00 0.00 H new ATOM 0 HA TRP A 84 -3.241 -24.180 -4.438 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -1.434 -23.515 -3.119 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.474 -24.924 -3.525 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.548 -24.292 -4.998 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.081 -22.542 -6.827 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -3.000 -21.968 -5.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.709 -20.464 -8.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.316 -20.099 -6.730 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.485 -19.359 -8.200 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.337 -26.302 -6.119 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.042 -26.802 -7.457 1.00 0.00 C ATOM 1276 C LYS A 85 -2.320 -26.948 -8.277 1.00 0.00 C ATOM 1277 O LYS A 85 -2.320 -26.728 -9.488 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.320 -28.149 -7.372 1.00 0.00 C ATOM 1279 CG LYS A 85 0.956 -28.104 -6.551 1.00 0.00 C ATOM 1280 CD LYS A 85 2.156 -27.731 -7.405 1.00 0.00 C ATOM 1281 CE LYS A 85 3.462 -27.932 -6.650 1.00 0.00 C ATOM 1282 NZ LYS A 85 4.630 -27.417 -7.417 1.00 0.00 N ATOM 0 H LYS A 85 -0.843 -26.786 -5.370 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.394 -26.080 -7.954 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -0.995 -28.887 -6.939 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.082 -28.488 -8.380 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.844 -27.381 -5.743 1.00 0.00 H new ATOM 0 HG3 LYS A 85 1.126 -29.076 -6.088 1.00 0.00 H new ATOM 0 HD2 LYS A 85 2.161 -28.337 -8.311 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.072 -26.690 -7.718 1.00 0.00 H new ATOM 0 HE2 LYS A 85 3.407 -27.424 -5.687 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.602 -28.993 -6.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 5.501 -27.572 -6.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.698 -27.919 -8.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.508 -26.399 -7.593 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.406 -27.320 -7.609 1.00 0.00 N ATOM 1297 CA ASP A 86 -4.692 -27.493 -8.276 1.00 0.00 C ATOM 1298 C ASP A 86 -4.966 -26.340 -9.236 1.00 0.00 C ATOM 1299 O ASP A 86 -5.167 -25.196 -8.829 1.00 0.00 O ATOM 1300 CB ASP A 86 -5.816 -27.592 -7.244 1.00 0.00 C ATOM 1301 CG ASP A 86 -5.512 -28.597 -6.150 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -4.641 -29.465 -6.368 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.145 -28.516 -5.077 1.00 0.00 O ATOM 0 H ASP A 86 -3.422 -27.508 -6.607 1.00 0.00 H new ATOM 0 HA ASP A 86 -4.654 -28.419 -8.850 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -5.982 -26.612 -6.797 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.742 -27.874 -7.745 1.00 0.00 H new ATOM 1308 N PRO A 87 -4.973 -26.646 -10.542 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.220 -25.649 -11.588 1.00 0.00 C ATOM 1310 C PRO A 87 -6.665 -25.162 -11.594 1.00 0.00 C ATOM 1311 O PRO A 87 -7.006 -24.213 -12.299 1.00 0.00 O ATOM 1312 CB PRO A 87 -4.905 -26.405 -12.881 1.00 0.00 C ATOM 1313 CG PRO A 87 -5.126 -27.839 -12.544 1.00 0.00 C ATOM 1314 CD PRO A 87 -4.740 -27.990 -11.099 1.00 0.00 C ATOM 0 HA PRO A 87 -4.618 -24.752 -11.446 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.555 -26.085 -13.695 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.879 -26.228 -13.204 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.167 -28.121 -12.701 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.521 -28.487 -13.179 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.347 -28.744 -10.597 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -3.699 -28.295 -10.991 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.509 -25.816 -10.803 1.00 0.00 N ATOM 1323 CA ASN A 88 -8.917 -25.449 -10.718 1.00 0.00 C ATOM 1324 C ASN A 88 -9.194 -24.642 -9.453 1.00 0.00 C ATOM 1325 O ASN A 88 -10.303 -24.661 -8.922 1.00 0.00 O ATOM 1326 CB ASN A 88 -9.795 -26.702 -10.738 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.505 -27.591 -11.933 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -9.372 -27.112 -13.059 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -9.407 -28.893 -11.691 1.00 0.00 N ATOM 0 H ASN A 88 -7.242 -26.603 -10.212 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.157 -24.831 -11.583 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.637 -27.268 -9.820 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.844 -26.407 -10.754 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -9.214 -29.541 -12.455 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -9.525 -29.245 -10.741 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.176 -23.933 -8.976 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.309 -23.119 -7.773 1.00 0.00 C ATOM 1338 C ASN A 89 -8.887 -21.747 -8.106 1.00 0.00 C ATOM 1339 O ASN A 89 -8.641 -21.203 -9.183 1.00 0.00 O ATOM 1340 CB ASN A 89 -6.950 -22.959 -7.087 1.00 0.00 C ATOM 1341 CG ASN A 89 -6.665 -24.077 -6.103 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -7.574 -24.789 -5.674 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -5.398 -24.236 -5.739 1.00 0.00 N ATOM 0 H ASN A 89 -7.250 -23.906 -9.404 1.00 0.00 H new ATOM 0 HA ASN A 89 -8.994 -23.628 -7.094 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.165 -22.935 -7.843 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -6.920 -22.003 -6.565 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -5.146 -24.971 -5.079 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -4.677 -23.623 -6.120 1.00 0.00 H new ATOM 1350 N ASP A 90 -9.655 -21.193 -7.175 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.267 -19.883 -7.368 1.00 0.00 C ATOM 1352 C ASP A 90 -9.202 -18.799 -7.496 1.00 0.00 C ATOM 1353 O ASP A 90 -9.478 -17.696 -7.968 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.206 -19.559 -6.205 1.00 0.00 C ATOM 1355 CG ASP A 90 -12.529 -20.293 -6.307 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -13.192 -20.176 -7.358 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -12.901 -20.983 -5.335 1.00 0.00 O ATOM 0 H ASP A 90 -9.869 -21.630 -6.279 1.00 0.00 H new ATOM 0 HA ASP A 90 -10.843 -19.911 -8.293 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.720 -19.821 -5.265 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.391 -18.485 -6.179 1.00 0.00 H new ATOM 1362 N PHE A 91 -7.985 -19.120 -7.071 1.00 0.00 N ATOM 1363 CA PHE A 91 -6.878 -18.173 -7.136 1.00 0.00 C ATOM 1364 C PHE A 91 -6.337 -18.065 -8.558 1.00 0.00 C ATOM 1365 O PHE A 91 -5.908 -16.995 -8.991 1.00 0.00 O ATOM 1366 CB PHE A 91 -5.758 -18.598 -6.183 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.120 -18.456 -4.732 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -5.990 -17.236 -4.088 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.590 -19.543 -4.012 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.322 -17.103 -2.753 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -6.923 -19.416 -2.677 1.00 0.00 C ATOM 1372 CZ PHE A 91 -6.790 -18.194 -2.047 1.00 0.00 C ATOM 0 H PHE A 91 -7.740 -20.029 -6.678 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.252 -17.195 -6.833 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.495 -19.637 -6.384 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.870 -17.999 -6.388 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.625 -16.379 -4.635 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.697 -20.500 -4.500 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.216 -16.147 -2.262 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.287 -20.271 -2.127 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.052 -18.092 -1.004 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.360 -19.181 -9.280 1.00 0.00 N ATOM 1383 CA ARG A 92 -5.870 -19.213 -10.653 1.00 0.00 C ATOM 1384 C ARG A 92 -7.017 -19.028 -11.643 1.00 0.00 C ATOM 1385 O ARG A 92 -6.791 -18.805 -12.832 1.00 0.00 O ATOM 1386 CB ARG A 92 -5.152 -20.535 -10.930 1.00 0.00 C ATOM 1387 CG ARG A 92 -4.132 -20.908 -9.866 1.00 0.00 C ATOM 1388 CD ARG A 92 -3.786 -22.388 -9.921 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.441 -22.654 -9.417 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.333 -22.347 -10.083 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.410 -21.764 -11.271 1.00 0.00 N ATOM 1392 NH2 ARG A 92 -0.145 -22.621 -9.559 1.00 0.00 N ATOM 0 H ARG A 92 -6.713 -20.075 -8.937 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.165 -18.391 -10.781 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -5.892 -21.332 -11.007 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.651 -20.471 -11.896 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.227 -20.316 -10.004 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.526 -20.662 -8.880 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.511 -22.952 -9.334 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.864 -22.741 -10.949 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.347 -23.100 -8.504 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.321 -21.550 -11.676 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.558 -21.529 -11.780 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.082 -23.068 -8.644 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.705 -22.385 -10.071 1.00 0.00 H new ATOM 1406 N GLN A 93 -8.245 -19.122 -11.144 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.425 -18.967 -11.985 1.00 0.00 C ATOM 1408 C GLN A 93 -9.997 -17.558 -11.865 1.00 0.00 C ATOM 1409 O GLN A 93 -10.340 -16.928 -12.866 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.490 -19.996 -11.602 1.00 0.00 C ATOM 1411 CG GLN A 93 -10.021 -21.436 -11.740 1.00 0.00 C ATOM 1412 CD GLN A 93 -10.292 -22.009 -13.117 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -11.402 -21.899 -13.640 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -9.278 -22.624 -13.712 1.00 0.00 N ATOM 0 H GLN A 93 -8.448 -19.305 -10.161 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.126 -19.132 -13.020 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -10.799 -19.820 -10.572 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.369 -19.847 -12.229 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -8.952 -21.487 -11.533 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.520 -22.050 -10.991 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.376 -22.692 -13.241 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.401 -23.029 -14.640 1.00 0.00 H new ATOM 1423 N LYS A 94 -10.097 -17.068 -10.634 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.626 -15.733 -10.382 1.00 0.00 C ATOM 1425 C LYS A 94 -9.497 -14.715 -10.254 1.00 0.00 C ATOM 1426 O LYS A 94 -9.473 -13.707 -10.962 1.00 0.00 O ATOM 1427 CB LYS A 94 -11.476 -15.731 -9.109 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.646 -16.698 -9.157 1.00 0.00 C ATOM 1429 CD LYS A 94 -13.736 -16.303 -8.175 1.00 0.00 C ATOM 1430 CE LYS A 94 -13.476 -16.883 -6.792 1.00 0.00 C ATOM 1431 NZ LYS A 94 -14.663 -16.748 -5.903 1.00 0.00 N ATOM 0 H LYS A 94 -9.818 -17.576 -9.795 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.251 -15.451 -11.229 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.842 -15.983 -8.259 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.855 -14.724 -8.937 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.056 -16.724 -10.166 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.297 -17.705 -8.929 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.793 -15.216 -8.110 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.702 -16.652 -8.542 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.209 -17.936 -6.884 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -12.624 -16.376 -6.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -14.470 -16.034 -5.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -15.486 -16.453 -6.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -14.863 -17.662 -5.450 1.00 0.00 H new ATOM 1445 N LEU A 95 -8.563 -14.986 -9.349 1.00 0.00 N ATOM 1446 CA LEU A 95 -7.430 -14.094 -9.130 1.00 0.00 C ATOM 1447 C LEU A 95 -6.396 -14.244 -10.242 1.00 0.00 C ATOM 1448 O LEU A 95 -5.573 -13.355 -10.464 1.00 0.00 O ATOM 1449 CB LEU A 95 -6.783 -14.383 -7.774 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.498 -13.804 -6.553 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -6.762 -14.179 -5.276 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -7.623 -12.292 -6.674 1.00 0.00 C ATOM 0 H LEU A 95 -8.568 -15.816 -8.756 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.799 -13.069 -9.138 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.713 -15.464 -7.650 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -5.764 -13.997 -7.790 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.501 -14.229 -6.509 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.285 -13.758 -4.417 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.725 -15.264 -5.182 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.747 -13.784 -5.312 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.134 -11.898 -5.796 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.629 -11.849 -6.745 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.195 -12.045 -7.568 1.00 0.00 H new ATOM 1464 N LYS A 96 -6.445 -15.374 -10.939 1.00 0.00 N ATOM 1465 CA LYS A 96 -5.515 -15.640 -12.031 1.00 0.00 C ATOM 1466 C LYS A 96 -4.070 -15.527 -11.555 1.00 0.00 C ATOM 1467 O LYS A 96 -3.261 -14.825 -12.161 1.00 0.00 O ATOM 1468 CB LYS A 96 -5.760 -14.667 -13.186 1.00 0.00 C ATOM 1469 CG LYS A 96 -7.133 -14.809 -13.820 1.00 0.00 C ATOM 1470 CD LYS A 96 -7.240 -16.085 -14.638 1.00 0.00 C ATOM 1471 CE LYS A 96 -8.298 -15.964 -15.724 1.00 0.00 C ATOM 1472 NZ LYS A 96 -9.605 -15.508 -15.176 1.00 0.00 N ATOM 0 H LYS A 96 -7.119 -16.120 -10.767 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.686 -16.658 -12.380 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.641 -13.647 -12.822 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -4.998 -14.824 -13.950 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -7.896 -14.810 -13.042 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.330 -13.948 -14.459 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -6.275 -16.309 -15.092 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.485 -16.920 -13.981 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -7.958 -15.262 -16.485 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -8.427 -16.929 -16.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -10.367 -15.770 -15.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -9.772 -15.960 -14.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -9.590 -14.475 -15.057 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.754 -16.224 -10.468 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.406 -16.203 -9.914 1.00 0.00 C ATOM 1488 C ILE A 97 -1.431 -16.956 -10.812 1.00 0.00 C ATOM 1489 O ILE A 97 -1.810 -17.898 -11.508 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.368 -16.819 -8.503 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.227 -15.997 -7.540 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -0.934 -16.905 -8.001 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -2.768 -14.563 -7.395 1.00 0.00 C ATOM 0 H ILE A 97 -4.413 -16.809 -9.954 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.106 -15.157 -9.853 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.776 -17.828 -8.552 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.260 -16.006 -7.889 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.218 -16.474 -6.560 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -0.924 -17.342 -7.003 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.349 -17.529 -8.677 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.501 -15.905 -7.964 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.423 -14.040 -6.698 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -1.746 -14.545 -7.017 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -2.804 -14.069 -8.366 1.00 0.00 H new ATOM 1505 N THR A 98 -0.170 -16.536 -10.791 1.00 0.00 N ATOM 1506 CA THR A 98 0.862 -17.170 -11.602 1.00 0.00 C ATOM 1507 C THR A 98 1.707 -18.126 -10.768 1.00 0.00 C ATOM 1508 O THR A 98 1.948 -19.265 -11.166 1.00 0.00 O ATOM 1509 CB THR A 98 1.784 -16.124 -12.257 1.00 0.00 C ATOM 1510 OG1 THR A 98 2.597 -16.747 -13.258 1.00 0.00 O ATOM 1511 CG2 THR A 98 2.672 -15.460 -11.216 1.00 0.00 C ATOM 0 H THR A 98 0.161 -15.758 -10.220 1.00 0.00 H new ATOM 0 HA THR A 98 0.349 -17.731 -12.384 1.00 0.00 H new ATOM 0 HB THR A 98 1.160 -15.360 -12.720 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.179 -16.076 -13.671 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.315 -14.725 -11.701 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.050 -14.963 -10.471 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.288 -16.215 -10.728 1.00 0.00 H new ATOM 1519 N ALA A 99 2.155 -17.654 -9.609 1.00 0.00 N ATOM 1520 CA ALA A 99 2.971 -18.469 -8.717 1.00 0.00 C ATOM 1521 C ALA A 99 3.087 -17.826 -7.339 1.00 0.00 C ATOM 1522 O ALA A 99 3.461 -16.660 -7.216 1.00 0.00 O ATOM 1523 CB ALA A 99 4.352 -18.686 -9.318 1.00 0.00 C ATOM 0 H ALA A 99 1.967 -16.712 -9.266 1.00 0.00 H new ATOM 0 HA ALA A 99 2.482 -19.436 -8.598 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.951 -19.296 -8.642 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.256 -19.195 -10.277 1.00 0.00 H new ATOM 0 HB3 ALA A 99 4.840 -17.723 -9.466 1.00 0.00 H new ATOM 1529 N VAL A 100 2.762 -18.595 -6.304 1.00 0.00 N ATOM 1530 CA VAL A 100 2.830 -18.101 -4.934 1.00 0.00 C ATOM 1531 C VAL A 100 4.246 -18.209 -4.380 1.00 0.00 C ATOM 1532 O VAL A 100 5.018 -19.095 -4.749 1.00 0.00 O ATOM 1533 CB VAL A 100 1.869 -18.873 -4.011 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.451 -18.831 -4.561 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.339 -20.309 -3.834 1.00 0.00 C ATOM 0 H VAL A 100 2.449 -19.562 -6.389 1.00 0.00 H new ATOM 0 HA VAL A 100 2.533 -17.053 -4.961 1.00 0.00 H new ATOM 0 HB VAL A 100 1.868 -18.392 -3.033 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.214 -19.382 -3.896 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.118 -17.795 -4.631 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.431 -19.286 -5.551 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.648 -20.840 -3.179 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.371 -20.804 -4.805 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.335 -20.314 -3.391 1.00 0.00 H new ATOM 1545 N PRO A 101 4.599 -17.287 -3.472 1.00 0.00 N ATOM 1546 CA PRO A 101 3.689 -16.228 -3.026 1.00 0.00 C ATOM 1547 C PRO A 101 3.424 -15.195 -4.115 1.00 0.00 C ATOM 1548 O PRO A 101 4.299 -14.893 -4.927 1.00 0.00 O ATOM 1549 CB PRO A 101 4.438 -15.588 -1.854 1.00 0.00 C ATOM 1550 CG PRO A 101 5.876 -15.872 -2.122 1.00 0.00 C ATOM 1551 CD PRO A 101 5.912 -17.208 -2.811 1.00 0.00 C ATOM 0 HA PRO A 101 2.707 -16.620 -2.760 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.249 -14.516 -1.802 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.121 -16.014 -0.902 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.317 -15.097 -2.749 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.449 -15.895 -1.195 1.00 0.00 H new ATOM 0 HD2 PRO A 101 6.728 -17.267 -3.531 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.054 -18.023 -2.101 1.00 0.00 H new ATOM 1559 N THR A 102 2.209 -14.654 -4.128 1.00 0.00 N ATOM 1560 CA THR A 102 1.828 -13.655 -5.119 1.00 0.00 C ATOM 1561 C THR A 102 1.370 -12.364 -4.450 1.00 0.00 C ATOM 1562 O THR A 102 0.306 -12.318 -3.831 1.00 0.00 O ATOM 1563 CB THR A 102 0.703 -14.173 -6.035 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.051 -15.459 -6.559 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.449 -13.205 -7.181 1.00 0.00 C ATOM 0 H THR A 102 1.472 -14.891 -3.463 1.00 0.00 H new ATOM 0 HA THR A 102 2.713 -13.454 -5.722 1.00 0.00 H new ATOM 0 HB THR A 102 -0.208 -14.257 -5.442 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.026 -15.530 -6.632 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.349 -13.592 -7.814 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.156 -12.235 -6.780 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.358 -13.093 -7.771 1.00 0.00 H new ATOM 1573 N LEU A 103 2.178 -11.318 -4.578 1.00 0.00 N ATOM 1574 CA LEU A 103 1.854 -10.024 -3.986 1.00 0.00 C ATOM 1575 C LEU A 103 1.164 -9.118 -5.001 1.00 0.00 C ATOM 1576 O LEU A 103 1.822 -8.438 -5.790 1.00 0.00 O ATOM 1577 CB LEU A 103 3.123 -9.349 -3.462 1.00 0.00 C ATOM 1578 CG LEU A 103 2.922 -8.030 -2.716 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.197 -8.266 -1.400 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.260 -7.345 -2.475 1.00 0.00 C ATOM 0 H LEU A 103 3.062 -11.340 -5.086 1.00 0.00 H new ATOM 0 HA LEU A 103 1.170 -10.193 -3.154 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.633 -10.046 -2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.789 -9.168 -4.306 1.00 0.00 H new ATOM 0 HG LEU A 103 2.307 -7.375 -3.333 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.063 -7.316 -0.883 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.222 -8.713 -1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.785 -8.939 -0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 103 4.098 -6.408 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.899 -7.995 -1.878 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.742 -7.141 -3.431 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.164 -9.112 -4.973 1.00 0.00 N ATOM 1593 CA LEU A 104 -0.944 -8.287 -5.890 1.00 0.00 C ATOM 1594 C LEU A 104 -1.410 -7.006 -5.206 1.00 0.00 C ATOM 1595 O LEU A 104 -2.040 -7.047 -4.149 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.151 -9.070 -6.409 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.354 -8.234 -6.848 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -3.084 -7.574 -8.191 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.606 -9.097 -6.918 1.00 0.00 C ATOM 0 H LEU A 104 -0.723 -9.668 -4.326 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.305 -8.016 -6.731 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.828 -9.678 -7.254 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.477 -9.757 -5.628 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.517 -7.451 -6.108 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.951 -6.983 -8.487 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.213 -6.924 -8.108 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.894 -8.341 -8.942 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.452 -8.486 -7.232 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.453 -9.902 -7.637 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.810 -9.522 -5.935 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.098 -5.868 -5.817 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.488 -4.574 -5.271 1.00 0.00 C ATOM 1613 C LYS A 105 -2.885 -4.183 -5.741 1.00 0.00 C ATOM 1614 O LYS A 105 -3.044 -3.526 -6.770 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.480 -3.498 -5.684 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.823 -2.112 -5.167 1.00 0.00 C ATOM 1617 CD LYS A 105 0.350 -1.157 -5.310 1.00 0.00 C ATOM 1618 CE LYS A 105 0.002 0.234 -4.802 1.00 0.00 C ATOM 1619 NZ LYS A 105 -0.772 1.014 -5.807 1.00 0.00 N ATOM 0 H LYS A 105 -0.576 -5.816 -6.692 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.499 -4.655 -4.184 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.508 -3.778 -5.319 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.421 -3.466 -6.772 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.681 -1.721 -5.714 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.116 -2.176 -4.119 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.205 -1.544 -4.756 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.648 -1.099 -6.357 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.577 0.150 -3.883 1.00 0.00 H new ATOM 0 HE3 LYS A 105 0.918 0.770 -4.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -0.786 2.017 -5.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.325 0.917 -6.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.747 0.653 -5.851 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.895 -4.589 -4.980 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.280 -4.282 -5.319 1.00 0.00 C ATOM 1635 C TYR A 106 -5.411 -2.849 -5.825 1.00 0.00 C ATOM 1636 O TYR A 106 -5.303 -1.894 -5.056 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.183 -4.490 -4.102 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.610 -4.841 -4.460 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.893 -5.905 -5.307 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.675 -4.108 -3.951 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.195 -6.228 -5.637 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -9.980 -4.425 -4.275 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.235 -5.485 -5.119 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.533 -5.805 -5.444 1.00 0.00 O ATOM 0 H TYR A 106 -3.781 -5.132 -4.124 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.592 -4.959 -6.114 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.767 -5.284 -3.483 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.181 -3.582 -3.499 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.081 -6.490 -5.714 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.479 -3.276 -3.291 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.397 -7.058 -6.297 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.796 -3.846 -3.869 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.145 -5.185 -4.995 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.648 -2.706 -7.126 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.791 -1.387 -7.714 1.00 0.00 C ATOM 1656 C GLY A 107 -4.894 -1.190 -8.920 1.00 0.00 C ATOM 1657 O GLY A 107 -5.246 -0.467 -9.853 1.00 0.00 O ATOM 0 H GLY A 107 -5.743 -3.480 -7.783 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.829 -1.234 -8.008 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.558 -0.631 -6.964 1.00 0.00 H new ATOM 1661 N THR A 108 -3.731 -1.832 -8.902 1.00 0.00 N ATOM 1662 CA THR A 108 -2.779 -1.721 -10.000 1.00 0.00 C ATOM 1663 C THR A 108 -2.305 -3.095 -10.458 1.00 0.00 C ATOM 1664 O THR A 108 -2.216 -4.041 -9.674 1.00 0.00 O ATOM 1665 CB THR A 108 -1.555 -0.875 -9.600 1.00 0.00 C ATOM 1666 OG1 THR A 108 -0.858 -1.504 -8.519 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.977 0.527 -9.190 1.00 0.00 C ATOM 0 H THR A 108 -3.425 -2.435 -8.138 1.00 0.00 H new ATOM 0 HA THR A 108 -3.300 -1.227 -10.820 1.00 0.00 H new ATOM 0 HB THR A 108 -0.894 -0.800 -10.464 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.060 -1.162 -8.479 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.096 1.105 -8.912 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.482 1.014 -10.024 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.656 0.468 -8.339 1.00 0.00 H new ATOM 1675 N PRO A 109 -1.993 -3.212 -11.757 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.521 -4.468 -12.348 1.00 0.00 C ATOM 1677 C PRO A 109 -0.120 -4.840 -11.877 1.00 0.00 C ATOM 1678 O PRO A 109 0.447 -5.840 -12.317 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.520 -4.174 -13.851 1.00 0.00 C ATOM 1680 CG PRO A 109 -1.368 -2.696 -13.948 1.00 0.00 C ATOM 1681 CD PRO A 109 -2.076 -2.127 -12.749 1.00 0.00 C ATOM 0 HA PRO A 109 -2.149 -5.313 -12.065 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.702 -4.690 -14.355 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.445 -4.508 -14.320 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -0.316 -2.411 -13.951 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.803 -2.319 -14.873 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.593 -1.218 -12.391 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -3.110 -1.870 -12.978 1.00 0.00 H new ATOM 1689 N GLN A 110 0.433 -4.029 -10.981 1.00 0.00 N ATOM 1690 CA GLN A 110 1.769 -4.274 -10.452 1.00 0.00 C ATOM 1691 C GLN A 110 1.734 -5.333 -9.355 1.00 0.00 C ATOM 1692 O GLN A 110 1.148 -5.123 -8.292 1.00 0.00 O ATOM 1693 CB GLN A 110 2.370 -2.977 -9.906 1.00 0.00 C ATOM 1694 CG GLN A 110 3.084 -2.147 -10.961 1.00 0.00 C ATOM 1695 CD GLN A 110 4.202 -1.303 -10.381 1.00 0.00 C ATOM 1696 OE1 GLN A 110 5.352 -1.397 -10.809 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.868 -0.471 -9.401 1.00 0.00 N ATOM 0 H GLN A 110 -0.023 -3.197 -10.607 1.00 0.00 H new ATOM 0 HA GLN A 110 2.393 -4.641 -11.267 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.576 -2.378 -9.460 1.00 0.00 H new ATOM 0 HB3 GLN A 110 3.073 -3.219 -9.109 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.492 -2.810 -11.724 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.363 -1.497 -11.456 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.902 -0.426 -9.077 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.578 0.123 -8.972 1.00 0.00 H new ATOM 1706 N LYS A 111 2.365 -6.472 -9.619 1.00 0.00 N ATOM 1707 CA LYS A 111 2.407 -7.565 -8.654 1.00 0.00 C ATOM 1708 C LYS A 111 3.812 -8.152 -8.559 1.00 0.00 C ATOM 1709 O LYS A 111 4.571 -8.134 -9.529 1.00 0.00 O ATOM 1710 CB LYS A 111 1.411 -8.659 -9.048 1.00 0.00 C ATOM 1711 CG LYS A 111 1.749 -9.346 -10.359 1.00 0.00 C ATOM 1712 CD LYS A 111 2.641 -10.557 -10.141 1.00 0.00 C ATOM 1713 CE LYS A 111 1.831 -11.780 -9.738 1.00 0.00 C ATOM 1714 NZ LYS A 111 1.028 -12.312 -10.874 1.00 0.00 N ATOM 0 H LYS A 111 2.855 -6.663 -10.493 1.00 0.00 H new ATOM 0 HA LYS A 111 2.132 -7.166 -7.678 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.373 -9.406 -8.255 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.415 -8.222 -9.123 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.830 -9.655 -10.856 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.248 -8.640 -11.022 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.195 -10.771 -11.055 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.376 -10.335 -9.367 1.00 0.00 H new ATOM 0 HE2 LYS A 111 2.503 -12.557 -9.373 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.167 -11.520 -8.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.724 -13.283 -10.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.191 -11.712 -11.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 1.607 -12.313 -11.738 1.00 0.00 H new ATOM 1728 N LEU A 112 4.151 -8.674 -7.386 1.00 0.00 N ATOM 1729 CA LEU A 112 5.465 -9.269 -7.164 1.00 0.00 C ATOM 1730 C LEU A 112 5.350 -10.773 -6.938 1.00 0.00 C ATOM 1731 O LEU A 112 4.701 -11.222 -5.994 1.00 0.00 O ATOM 1732 CB LEU A 112 6.148 -8.612 -5.964 1.00 0.00 C ATOM 1733 CG LEU A 112 6.256 -7.087 -6.004 1.00 0.00 C ATOM 1734 CD1 LEU A 112 6.940 -6.566 -4.750 1.00 0.00 C ATOM 1735 CD2 LEU A 112 7.008 -6.639 -7.249 1.00 0.00 C ATOM 0 H LEU A 112 3.535 -8.698 -6.574 1.00 0.00 H new ATOM 0 HA LEU A 112 6.069 -9.099 -8.055 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.604 -8.894 -5.063 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.153 -9.025 -5.872 1.00 0.00 H new ATOM 0 HG LEU A 112 5.249 -6.672 -6.042 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.007 -5.479 -4.797 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.362 -6.856 -3.873 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.942 -6.989 -4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.076 -5.551 -7.261 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.011 -7.065 -7.241 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.476 -6.980 -8.137 1.00 0.00 H new ATOM 1747 N VAL A 113 5.988 -11.548 -7.810 1.00 0.00 N ATOM 1748 CA VAL A 113 5.961 -13.001 -7.704 1.00 0.00 C ATOM 1749 C VAL A 113 7.019 -13.501 -6.727 1.00 0.00 C ATOM 1750 O VAL A 113 7.815 -12.720 -6.207 1.00 0.00 O ATOM 1751 CB VAL A 113 6.187 -13.669 -9.074 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.458 -15.001 -9.146 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.739 -12.745 -10.196 1.00 0.00 C ATOM 0 H VAL A 113 6.530 -11.193 -8.598 1.00 0.00 H new ATOM 0 HA VAL A 113 4.972 -13.272 -7.335 1.00 0.00 H new ATOM 0 HB VAL A 113 7.253 -13.860 -9.195 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.630 -15.457 -10.121 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.831 -15.663 -8.365 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.389 -14.839 -9.004 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.906 -13.232 -11.157 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.678 -12.521 -10.082 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.312 -11.818 -10.155 1.00 0.00 H new ATOM 1763 N GLU A 114 7.021 -14.808 -6.482 1.00 0.00 N ATOM 1764 CA GLU A 114 7.982 -15.411 -5.566 1.00 0.00 C ATOM 1765 C GLU A 114 9.313 -14.667 -5.606 1.00 0.00 C ATOM 1766 O GLU A 114 9.745 -14.092 -4.607 1.00 0.00 O ATOM 1767 CB GLU A 114 8.198 -16.885 -5.917 1.00 0.00 C ATOM 1768 CG GLU A 114 6.911 -17.633 -6.223 1.00 0.00 C ATOM 1769 CD GLU A 114 7.097 -19.138 -6.220 1.00 0.00 C ATOM 1770 OE1 GLU A 114 7.500 -19.685 -5.172 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.839 -19.769 -7.266 1.00 0.00 O ATOM 0 H GLU A 114 6.369 -15.468 -6.905 1.00 0.00 H new ATOM 0 HA GLU A 114 7.577 -15.340 -4.557 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.861 -16.951 -6.780 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.706 -17.377 -5.087 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.154 -17.363 -5.487 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.535 -17.319 -7.197 1.00 0.00 H new ATOM 1778 N SER A 115 9.958 -14.682 -6.768 1.00 0.00 N ATOM 1779 CA SER A 115 11.242 -14.012 -6.938 1.00 0.00 C ATOM 1780 C SER A 115 11.149 -12.546 -6.528 1.00 0.00 C ATOM 1781 O SER A 115 12.039 -12.018 -5.862 1.00 0.00 O ATOM 1782 CB SER A 115 11.709 -14.119 -8.391 1.00 0.00 C ATOM 1783 OG SER A 115 13.123 -14.109 -8.475 1.00 0.00 O ATOM 0 H SER A 115 9.613 -15.151 -7.606 1.00 0.00 H new ATOM 0 HA SER A 115 11.969 -14.506 -6.293 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.322 -15.037 -8.834 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.302 -13.290 -8.969 1.00 0.00 H new ATOM 0 HG SER A 115 13.395 -14.180 -9.414 1.00 0.00 H new ATOM 1789 N GLU A 116 10.063 -11.893 -6.932 1.00 0.00 N ATOM 1790 CA GLU A 116 9.853 -10.487 -6.608 1.00 0.00 C ATOM 1791 C GLU A 116 9.408 -10.324 -5.157 1.00 0.00 C ATOM 1792 O GLU A 116 9.360 -9.210 -4.633 1.00 0.00 O ATOM 1793 CB GLU A 116 8.810 -9.875 -7.545 1.00 0.00 C ATOM 1794 CG GLU A 116 9.112 -10.095 -9.018 1.00 0.00 C ATOM 1795 CD GLU A 116 8.400 -9.101 -9.914 1.00 0.00 C ATOM 1796 OE1 GLU A 116 8.823 -7.926 -9.950 1.00 0.00 O ATOM 1797 OE2 GLU A 116 7.420 -9.496 -10.580 1.00 0.00 O ATOM 0 H GLU A 116 9.316 -12.315 -7.484 1.00 0.00 H new ATOM 0 HA GLU A 116 10.800 -9.964 -6.740 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.833 -10.301 -7.315 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.744 -8.804 -7.352 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.187 -10.019 -9.180 1.00 0.00 H new ATOM 0 HG3 GLU A 116 8.818 -11.107 -9.298 1.00 0.00 H new ATOM 1804 N CYS A 117 9.082 -11.440 -4.515 1.00 0.00 N ATOM 1805 CA CYS A 117 8.639 -11.422 -3.126 1.00 0.00 C ATOM 1806 C CYS A 117 9.826 -11.541 -2.175 1.00 0.00 C ATOM 1807 O CYS A 117 9.718 -11.224 -0.990 1.00 0.00 O ATOM 1808 CB CYS A 117 7.649 -12.559 -2.870 1.00 0.00 C ATOM 1809 SG CYS A 117 6.018 -12.296 -3.605 1.00 0.00 S ATOM 0 H CYS A 117 9.116 -12.369 -4.934 1.00 0.00 H new ATOM 0 HA CYS A 117 8.143 -10.469 -2.941 1.00 0.00 H new ATOM 0 HB2 CYS A 117 8.067 -13.486 -3.262 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.534 -12.691 -1.794 1.00 0.00 H new ATOM 0 HG CYS A 117 6.151 -11.709 -4.757 1.00 0.00 H new ATOM 1815 N CYS A 118 10.955 -12.000 -2.702 1.00 0.00 N ATOM 1816 CA CYS A 118 12.162 -12.163 -1.899 1.00 0.00 C ATOM 1817 C CYS A 118 13.162 -11.047 -2.187 1.00 0.00 C ATOM 1818 O CYS A 118 14.201 -10.950 -1.535 1.00 0.00 O ATOM 1819 CB CYS A 118 12.804 -13.523 -2.177 1.00 0.00 C ATOM 1820 SG CYS A 118 14.392 -13.773 -1.349 1.00 0.00 S ATOM 0 H CYS A 118 11.060 -12.266 -3.681 1.00 0.00 H new ATOM 0 HA CYS A 118 11.879 -12.110 -0.848 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.116 -14.308 -1.864 1.00 0.00 H new ATOM 0 HB3 CYS A 118 12.946 -13.633 -3.252 1.00 0.00 H new ATOM 0 HG CYS A 118 14.930 -12.619 -1.085 1.00 0.00 H new ATOM 1826 N GLN A 119 12.839 -10.210 -3.167 1.00 0.00 N ATOM 1827 CA GLN A 119 13.711 -9.102 -3.541 1.00 0.00 C ATOM 1828 C GLN A 119 13.220 -7.793 -2.931 1.00 0.00 C ATOM 1829 O GLN A 119 12.439 -7.066 -3.544 1.00 0.00 O ATOM 1830 CB GLN A 119 13.781 -8.974 -5.064 1.00 0.00 C ATOM 1831 CG GLN A 119 14.845 -9.854 -5.700 1.00 0.00 C ATOM 1832 CD GLN A 119 15.061 -11.149 -4.943 1.00 0.00 C ATOM 1833 OE1 GLN A 119 15.703 -11.167 -3.892 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.524 -12.242 -5.473 1.00 0.00 N ATOM 0 H GLN A 119 11.982 -10.277 -3.716 1.00 0.00 H new ATOM 0 HA GLN A 119 14.708 -9.310 -3.154 1.00 0.00 H new ATOM 0 HB2 GLN A 119 12.809 -9.230 -5.487 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.978 -7.934 -5.324 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.557 -10.081 -6.726 1.00 0.00 H new ATOM 0 HG3 GLN A 119 15.785 -9.304 -5.747 1.00 0.00 H new ATOM 0 HE21 GLN A 119 14.000 -12.181 -6.346 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.636 -13.143 -5.007 1.00 0.00 H new ATOM 1843 N SER A 120 13.684 -7.500 -1.721 1.00 0.00 N ATOM 1844 CA SER A 120 13.290 -6.281 -1.025 1.00 0.00 C ATOM 1845 C SER A 120 13.296 -5.087 -1.976 1.00 0.00 C ATOM 1846 O SER A 120 12.364 -4.283 -1.986 1.00 0.00 O ATOM 1847 CB SER A 120 14.228 -6.014 0.153 1.00 0.00 C ATOM 1848 OG SER A 120 15.513 -6.561 -0.085 1.00 0.00 O ATOM 0 H SER A 120 14.334 -8.091 -1.202 1.00 0.00 H new ATOM 0 HA SER A 120 12.277 -6.419 -0.648 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.312 -4.940 0.319 1.00 0.00 H new ATOM 0 HB3 SER A 120 13.808 -6.446 1.062 1.00 0.00 H new ATOM 0 HG SER A 120 16.095 -6.376 0.682 1.00 0.00 H new ATOM 1854 N SER A 121 14.353 -4.979 -2.773 1.00 0.00 N ATOM 1855 CA SER A 121 14.484 -3.883 -3.725 1.00 0.00 C ATOM 1856 C SER A 121 13.157 -3.612 -4.428 1.00 0.00 C ATOM 1857 O SER A 121 12.792 -2.460 -4.667 1.00 0.00 O ATOM 1858 CB SER A 121 15.565 -4.203 -4.759 1.00 0.00 C ATOM 1859 OG SER A 121 16.062 -3.020 -5.361 1.00 0.00 O ATOM 0 H SER A 121 15.132 -5.638 -2.779 1.00 0.00 H new ATOM 0 HA SER A 121 14.773 -2.989 -3.173 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.382 -4.742 -4.280 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.156 -4.861 -5.526 1.00 0.00 H new ATOM 0 HG SER A 121 16.752 -3.252 -6.017 1.00 0.00 H new ATOM 1865 N LEU A 122 12.440 -4.681 -4.756 1.00 0.00 N ATOM 1866 CA LEU A 122 11.152 -4.560 -5.431 1.00 0.00 C ATOM 1867 C LEU A 122 10.033 -4.306 -4.427 1.00 0.00 C ATOM 1868 O LEU A 122 9.132 -3.504 -4.675 1.00 0.00 O ATOM 1869 CB LEU A 122 10.855 -5.828 -6.234 1.00 0.00 C ATOM 1870 CG LEU A 122 11.813 -6.134 -7.385 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.834 -7.625 -7.680 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.423 -5.347 -8.628 1.00 0.00 C ATOM 0 H LEU A 122 12.728 -5.641 -4.566 1.00 0.00 H new ATOM 0 HA LEU A 122 11.204 -3.710 -6.111 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.859 -6.676 -5.550 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.846 -5.749 -6.639 1.00 0.00 H new ATOM 0 HG LEU A 122 12.816 -5.830 -7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.521 -7.824 -8.502 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.163 -8.167 -6.793 1.00 0.00 H new ATOM 0 HD13 LEU A 122 10.833 -7.955 -7.956 1.00 0.00 H new ATOM 0 HD21 LEU A 122 12.116 -5.578 -9.437 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.411 -5.619 -8.928 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.462 -4.280 -8.410 1.00 0.00 H new ATOM 1884 N VAL A 123 10.096 -4.992 -3.291 1.00 0.00 N ATOM 1885 CA VAL A 123 9.090 -4.838 -2.247 1.00 0.00 C ATOM 1886 C VAL A 123 8.921 -3.374 -1.857 1.00 0.00 C ATOM 1887 O VAL A 123 7.802 -2.876 -1.748 1.00 0.00 O ATOM 1888 CB VAL A 123 9.454 -5.654 -0.992 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.430 -5.424 0.110 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.562 -7.133 -1.330 1.00 0.00 C ATOM 0 H VAL A 123 10.834 -5.661 -3.070 1.00 0.00 H new ATOM 0 HA VAL A 123 8.151 -5.212 -2.655 1.00 0.00 H new ATOM 0 HB VAL A 123 10.425 -5.316 -0.630 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.703 -6.008 0.989 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.407 -4.366 0.371 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.445 -5.733 -0.239 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.820 -7.694 -0.432 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.607 -7.488 -1.718 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.336 -7.279 -2.083 1.00 0.00 H new ATOM 1900 N GLU A 124 10.042 -2.690 -1.650 1.00 0.00 N ATOM 1901 CA GLU A 124 10.018 -1.282 -1.272 1.00 0.00 C ATOM 1902 C GLU A 124 9.576 -0.411 -2.446 1.00 0.00 C ATOM 1903 O GLU A 124 9.019 0.669 -2.255 1.00 0.00 O ATOM 1904 CB GLU A 124 11.398 -0.837 -0.785 1.00 0.00 C ATOM 1905 CG GLU A 124 12.434 -0.744 -1.893 1.00 0.00 C ATOM 1906 CD GLU A 124 13.647 0.072 -1.490 1.00 0.00 C ATOM 1907 OE1 GLU A 124 14.417 -0.399 -0.626 1.00 0.00 O ATOM 1908 OE2 GLU A 124 13.827 1.179 -2.037 1.00 0.00 O ATOM 0 H GLU A 124 10.977 -3.088 -1.738 1.00 0.00 H new ATOM 0 HA GLU A 124 9.299 -1.163 -0.461 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.307 0.136 -0.302 1.00 0.00 H new ATOM 0 HB3 GLU A 124 11.750 -1.538 -0.028 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.753 -1.748 -2.173 1.00 0.00 H new ATOM 0 HG3 GLU A 124 11.977 -0.297 -2.776 1.00 0.00 H new ATOM 1915 N MET A 125 9.830 -0.890 -3.659 1.00 0.00 N ATOM 1916 CA MET A 125 9.459 -0.157 -4.863 1.00 0.00 C ATOM 1917 C MET A 125 7.943 -0.119 -5.031 1.00 0.00 C ATOM 1918 O MET A 125 7.329 0.946 -4.964 1.00 0.00 O ATOM 1919 CB MET A 125 10.104 -0.795 -6.095 1.00 0.00 C ATOM 1920 CG MET A 125 9.912 0.012 -7.369 1.00 0.00 C ATOM 1921 SD MET A 125 8.414 -0.446 -8.261 1.00 0.00 S ATOM 1922 CE MET A 125 8.887 -2.043 -8.921 1.00 0.00 C ATOM 0 H MET A 125 10.291 -1.783 -3.834 1.00 0.00 H new ATOM 0 HA MET A 125 9.822 0.866 -4.761 1.00 0.00 H new ATOM 0 HB2 MET A 125 11.171 -0.921 -5.912 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.686 -1.791 -6.239 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.872 1.073 -7.120 1.00 0.00 H new ATOM 0 HG3 MET A 125 10.775 -0.131 -8.019 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.241 -2.295 -9.762 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.923 -2.005 -9.258 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.785 -2.802 -8.145 1.00 0.00 H new ATOM 1932 N ILE A 126 7.347 -1.286 -5.249 1.00 0.00 N ATOM 1933 CA ILE A 126 5.904 -1.385 -5.425 1.00 0.00 C ATOM 1934 C ILE A 126 5.165 -0.532 -4.400 1.00 0.00 C ATOM 1935 O ILE A 126 4.095 0.008 -4.681 1.00 0.00 O ATOM 1936 CB ILE A 126 5.421 -2.843 -5.307 1.00 0.00 C ATOM 1937 CG1 ILE A 126 3.949 -2.950 -5.710 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.626 -3.356 -3.890 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.517 -4.358 -6.055 1.00 0.00 C ATOM 0 H ILE A 126 7.841 -2.176 -5.308 1.00 0.00 H new ATOM 0 HA ILE A 126 5.683 -1.017 -6.427 1.00 0.00 H new ATOM 0 HB ILE A 126 6.010 -3.461 -5.985 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.329 -2.578 -4.894 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.768 -2.303 -6.568 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.280 -4.387 -3.823 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.685 -3.311 -3.637 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.060 -2.737 -3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.463 -4.358 -6.331 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.111 -4.726 -6.892 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.666 -5.006 -5.191 1.00 0.00 H new ATOM 1951 N PHE A 127 5.744 -0.414 -3.210 1.00 0.00 N ATOM 1952 CA PHE A 127 5.141 0.375 -2.141 1.00 0.00 C ATOM 1953 C PHE A 127 5.450 1.859 -2.320 1.00 0.00 C ATOM 1954 O PHE A 127 4.551 2.699 -2.292 1.00 0.00 O ATOM 1955 CB PHE A 127 5.647 -0.103 -0.779 1.00 0.00 C ATOM 1956 CG PHE A 127 5.164 -1.476 -0.407 1.00 0.00 C ATOM 1957 CD1 PHE A 127 3.841 -1.837 -0.607 1.00 0.00 C ATOM 1958 CD2 PHE A 127 6.033 -2.405 0.140 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.394 -3.099 -0.265 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.592 -3.670 0.483 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.271 -4.017 0.279 1.00 0.00 C ATOM 0 H PHE A 127 6.630 -0.854 -2.961 1.00 0.00 H new ATOM 0 HA PHE A 127 4.060 0.239 -2.187 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.737 -0.099 -0.784 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.329 0.605 -0.014 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.152 -1.124 -1.035 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.067 -2.139 0.301 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.360 -3.367 -0.423 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.280 -4.385 0.910 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.924 -5.005 0.544 1.00 0.00 H new ATOM 1971 N SER A 128 6.728 2.173 -2.503 1.00 0.00 N ATOM 1972 CA SER A 128 7.158 3.555 -2.681 1.00 0.00 C ATOM 1973 C SER A 128 6.133 4.342 -3.493 1.00 0.00 C ATOM 1974 O SER A 128 5.569 5.324 -3.013 1.00 0.00 O ATOM 1975 CB SER A 128 8.520 3.602 -3.376 1.00 0.00 C ATOM 1976 OG SER A 128 8.966 4.938 -3.534 1.00 0.00 O ATOM 0 H SER A 128 7.484 1.489 -2.532 1.00 0.00 H new ATOM 0 HA SER A 128 7.245 4.013 -1.696 1.00 0.00 H new ATOM 0 HB2 SER A 128 9.249 3.039 -2.793 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.451 3.121 -4.351 1.00 0.00 H new ATOM 0 HG SER A 128 9.839 4.941 -3.979 1.00 0.00 H new ATOM 1982 N GLU A 129 5.898 3.901 -4.725 1.00 0.00 N ATOM 1983 CA GLU A 129 4.942 4.564 -5.603 1.00 0.00 C ATOM 1984 C GLU A 129 3.766 3.645 -5.920 1.00 0.00 C ATOM 1985 O GLU A 129 3.929 2.431 -6.044 1.00 0.00 O ATOM 1986 CB GLU A 129 5.626 5.001 -6.901 1.00 0.00 C ATOM 1987 CG GLU A 129 6.250 3.853 -7.676 1.00 0.00 C ATOM 1988 CD GLU A 129 7.617 3.466 -7.148 1.00 0.00 C ATOM 1989 OE1 GLU A 129 8.359 4.369 -6.707 1.00 0.00 O ATOM 1990 OE2 GLU A 129 7.945 2.262 -7.174 1.00 0.00 O ATOM 0 H GLU A 129 6.356 3.088 -5.137 1.00 0.00 H new ATOM 0 HA GLU A 129 4.563 5.445 -5.085 1.00 0.00 H new ATOM 0 HB2 GLU A 129 4.895 5.502 -7.536 1.00 0.00 H new ATOM 0 HB3 GLU A 129 6.399 5.732 -6.666 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.589 2.987 -7.630 1.00 0.00 H new ATOM 0 HG3 GLU A 129 6.336 4.133 -8.726 1.00 0.00 H new ATOM 1997 N ASP A 130 2.582 4.233 -6.050 1.00 0.00 N ATOM 1998 CA ASP A 130 1.378 3.468 -6.352 1.00 0.00 C ATOM 1999 C ASP A 130 1.610 2.534 -7.536 1.00 0.00 C ATOM 2000 O ASP A 130 2.331 2.874 -8.475 1.00 0.00 O ATOM 2001 CB ASP A 130 0.211 4.411 -6.652 1.00 0.00 C ATOM 2002 CG ASP A 130 -0.199 5.228 -5.443 1.00 0.00 C ATOM 2003 OD1 ASP A 130 0.686 5.855 -4.822 1.00 0.00 O ATOM 2004 OD2 ASP A 130 -1.404 5.241 -5.117 1.00 0.00 O ATOM 0 H ASP A 130 2.430 5.237 -5.951 1.00 0.00 H new ATOM 0 HA ASP A 130 1.132 2.864 -5.478 1.00 0.00 H new ATOM 0 HB2 ASP A 130 0.490 5.083 -7.463 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -0.642 3.829 -7.000 1.00 0.00 H new TER 2009 ASP A 130