USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 686 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 45 THR OG1 : rot -95:sc= 1.18 USER MOD Set 1.2: A 50 HIS : no HD1:sc= -1.9! C(o=-0.71!,f=-7.1!) USER MOD Set 2.1: A 33 THR OG1 : rot -30:sc= 2.06 USER MOD Set 2.2: A 35 SER OG : rot -57:sc= 1.19 USER MOD Set 2.3: A 60 SER OG : rot 180:sc= 0.166 USER MOD Set 2.4: A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ -130:sc= 0.0795 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0621 USER MOD Single : A 2 MET CE :methyl -150:sc= -0.241 (180deg=-1.62!) USER MOD Single : A 5 GLN : amide:sc= -0.415 X(o=-0.42,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 150:sc= -0.0555 (180deg=-0.684) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -3.31! X(o=-3.3!,f=-3.5) USER MOD Single : A 22 SER OG : rot -150:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.12) USER MOD Single : A 25 LYS NZ :NH3+ 158:sc= -4.22! (180deg=-4.56!) USER MOD Single : A 31 LYS NZ :NH3+ -162:sc= -0.0198 (180deg=-0.353) USER MOD Single : A 32 SER OG : rot 88:sc= 1.19 USER MOD Single : A 34 ASN : amide:sc= -0.132 K(o=-0.13,f=-1.9!) USER MOD Single : A 36 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.00873) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -53:sc= 0.681 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -161:sc= -3.67! (180deg=-4.44!) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.575 -32.792 -17.797 1.00 0.00 N ATOM 2 CA SER A 1 1.638 -32.823 -18.956 1.00 0.00 C ATOM 3 C SER A 1 1.230 -31.394 -19.319 1.00 0.00 C ATOM 4 O SER A 1 1.514 -30.456 -18.602 1.00 0.00 O ATOM 5 CB SER A 1 0.394 -33.631 -18.584 1.00 0.00 C ATOM 6 OG SER A 1 -0.636 -32.748 -18.165 1.00 0.00 O ATOM 0 H1 SER A 1 3.414 -33.367 -18.013 1.00 0.00 H new ATOM 0 H2 SER A 1 2.866 -31.811 -17.612 1.00 0.00 H new ATOM 0 H3 SER A 1 2.099 -33.176 -16.956 1.00 0.00 H new ATOM 0 HA SER A 1 2.130 -33.288 -19.810 1.00 0.00 H new ATOM 0 HB2 SER A 1 0.059 -34.218 -19.439 1.00 0.00 H new ATOM 0 HB3 SER A 1 0.630 -34.336 -17.787 1.00 0.00 H new ATOM 0 HG SER A 1 -1.434 -33.265 -17.928 1.00 0.00 H new ATOM 14 N MET A 2 0.563 -31.222 -20.427 1.00 0.00 N ATOM 15 CA MET A 2 0.136 -29.854 -20.835 1.00 0.00 C ATOM 16 C MET A 2 -0.775 -29.262 -19.758 1.00 0.00 C ATOM 17 O MET A 2 -0.751 -28.076 -19.494 1.00 0.00 O ATOM 18 CB MET A 2 -0.624 -29.930 -22.161 1.00 0.00 C ATOM 19 CG MET A 2 0.328 -30.382 -23.269 1.00 0.00 C ATOM 20 SD MET A 2 -0.520 -30.295 -24.866 1.00 0.00 S ATOM 21 CE MET A 2 -1.876 -31.426 -24.464 1.00 0.00 C ATOM 0 H MET A 2 0.295 -31.969 -21.067 1.00 0.00 H new ATOM 0 HA MET A 2 1.015 -29.221 -20.956 1.00 0.00 H new ATOM 0 HB2 MET A 2 -1.457 -30.628 -22.076 1.00 0.00 H new ATOM 0 HB3 MET A 2 -1.048 -28.956 -22.406 1.00 0.00 H new ATOM 0 HG2 MET A 2 1.215 -29.749 -23.281 1.00 0.00 H new ATOM 0 HG3 MET A 2 0.666 -31.401 -23.080 1.00 0.00 H new ATOM 0 HE1 MET A 2 -2.205 -31.936 -25.369 1.00 0.00 H new ATOM 0 HE2 MET A 2 -1.532 -32.162 -23.737 1.00 0.00 H new ATOM 0 HE3 MET A 2 -2.708 -30.861 -24.043 1.00 0.00 H new ATOM 31 N GLY A 3 -1.579 -30.079 -19.133 1.00 0.00 N ATOM 32 CA GLY A 3 -2.490 -29.562 -18.074 1.00 0.00 C ATOM 33 C GLY A 3 -3.500 -28.596 -18.696 1.00 0.00 C ATOM 34 O GLY A 3 -4.163 -28.912 -19.663 1.00 0.00 O ATOM 0 H GLY A 3 -1.644 -31.081 -19.310 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -3.011 -30.389 -17.592 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -1.914 -29.054 -17.300 1.00 0.00 H new ATOM 38 N GLY A 4 -3.622 -27.417 -18.149 1.00 0.00 N ATOM 39 CA GLY A 4 -4.589 -26.431 -18.708 1.00 0.00 C ATOM 40 C GLY A 4 -5.931 -26.565 -17.985 1.00 0.00 C ATOM 41 O GLY A 4 -6.923 -25.991 -18.386 1.00 0.00 O ATOM 0 H GLY A 4 -3.093 -27.094 -17.339 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.201 -25.419 -18.592 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.721 -26.601 -19.777 1.00 0.00 H new ATOM 45 N GLN A 5 -5.969 -27.319 -16.921 1.00 0.00 N ATOM 46 CA GLN A 5 -7.247 -27.489 -16.173 1.00 0.00 C ATOM 47 C GLN A 5 -7.165 -26.734 -14.845 1.00 0.00 C ATOM 48 O GLN A 5 -6.109 -26.601 -14.259 1.00 0.00 O ATOM 49 CB GLN A 5 -7.484 -28.975 -15.900 1.00 0.00 C ATOM 50 CG GLN A 5 -7.438 -29.750 -17.218 1.00 0.00 C ATOM 51 CD GLN A 5 -8.018 -31.150 -17.007 1.00 0.00 C ATOM 52 OE1 GLN A 5 -8.601 -31.721 -17.907 1.00 0.00 O ATOM 53 NE2 GLN A 5 -7.883 -31.732 -15.846 1.00 0.00 N ATOM 0 H GLN A 5 -5.171 -27.825 -16.537 1.00 0.00 H new ATOM 0 HA GLN A 5 -8.071 -27.092 -16.767 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.726 -29.355 -15.216 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -8.450 -29.117 -15.416 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -8.006 -29.221 -17.983 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -6.411 -29.820 -17.575 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -7.394 -31.254 -15.090 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -8.267 -32.665 -15.696 1.00 0.00 H new ATOM 62 N LYS A 6 -8.272 -26.237 -14.365 1.00 0.00 N ATOM 63 CA LYS A 6 -8.257 -25.491 -13.076 1.00 0.00 C ATOM 64 C LYS A 6 -9.028 -26.284 -12.019 1.00 0.00 C ATOM 65 O LYS A 6 -10.025 -26.916 -12.308 1.00 0.00 O ATOM 66 CB LYS A 6 -8.917 -24.124 -13.270 1.00 0.00 C ATOM 67 CG LYS A 6 -8.077 -23.285 -14.236 1.00 0.00 C ATOM 68 CD LYS A 6 -8.672 -21.880 -14.342 1.00 0.00 C ATOM 69 CE LYS A 6 -7.927 -21.091 -15.420 1.00 0.00 C ATOM 70 NZ LYS A 6 -8.814 -20.018 -15.951 1.00 0.00 N ATOM 0 H LYS A 6 -9.186 -26.316 -14.810 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.227 -25.354 -12.748 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.926 -24.248 -13.662 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.008 -23.613 -12.312 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.047 -23.229 -13.885 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.054 -23.757 -15.218 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.732 -21.940 -14.588 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.595 -21.368 -13.383 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -7.019 -20.655 -15.004 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -7.620 -21.757 -16.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -8.308 -19.481 -16.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.668 -20.446 -16.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.085 -19.378 -15.178 1.00 0.00 H new ATOM 84 N ILE A 7 -8.575 -26.256 -10.795 1.00 0.00 N ATOM 85 CA ILE A 7 -9.283 -27.009 -9.722 1.00 0.00 C ATOM 86 C ILE A 7 -9.803 -26.028 -8.669 1.00 0.00 C ATOM 87 O ILE A 7 -9.123 -25.100 -8.279 1.00 0.00 O ATOM 88 CB ILE A 7 -8.311 -27.992 -9.065 1.00 0.00 C ATOM 89 CG1 ILE A 7 -7.743 -28.935 -10.128 1.00 0.00 C ATOM 90 CG2 ILE A 7 -9.052 -28.809 -8.004 1.00 0.00 C ATOM 91 CD1 ILE A 7 -6.647 -29.805 -9.506 1.00 0.00 C ATOM 0 H ILE A 7 -7.746 -25.745 -10.492 1.00 0.00 H new ATOM 0 HA ILE A 7 -10.120 -27.557 -10.154 1.00 0.00 H new ATOM 0 HB ILE A 7 -7.497 -27.439 -8.596 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.536 -29.564 -10.532 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -7.337 -28.360 -10.960 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -8.361 -29.509 -7.536 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.458 -28.139 -7.247 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -9.866 -29.362 -8.473 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -6.242 -30.477 -10.263 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -5.850 -29.168 -9.123 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -7.068 -30.391 -8.689 1.00 0.00 H new ATOM 103 N ARG A 8 -11.007 -26.226 -8.206 1.00 0.00 N ATOM 104 CA ARG A 8 -11.572 -25.305 -7.179 1.00 0.00 C ATOM 105 C ARG A 8 -11.867 -26.088 -5.898 1.00 0.00 C ATOM 106 O ARG A 8 -12.406 -27.177 -5.936 1.00 0.00 O ATOM 107 CB ARG A 8 -12.867 -24.685 -7.707 1.00 0.00 C ATOM 108 CG ARG A 8 -12.562 -23.845 -8.949 1.00 0.00 C ATOM 109 CD ARG A 8 -13.841 -23.149 -9.422 1.00 0.00 C ATOM 110 NE ARG A 8 -13.588 -22.483 -10.731 1.00 0.00 N ATOM 111 CZ ARG A 8 -13.320 -23.199 -11.788 1.00 0.00 C ATOM 112 NH1 ARG A 8 -13.522 -24.489 -11.771 1.00 0.00 N ATOM 113 NH2 ARG A 8 -12.850 -22.627 -12.862 1.00 0.00 N ATOM 0 H ARG A 8 -11.624 -26.985 -8.494 1.00 0.00 H new ATOM 0 HA ARG A 8 -10.852 -24.515 -6.964 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -13.584 -25.468 -7.952 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -13.325 -24.063 -6.938 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -11.795 -23.104 -8.721 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -12.166 -24.480 -9.742 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -14.648 -23.875 -9.521 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -14.162 -22.414 -8.684 1.00 0.00 H new ATOM 0 HE ARG A 8 -13.624 -21.466 -10.801 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -13.889 -24.937 -10.931 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -13.313 -25.049 -12.597 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -12.692 -21.619 -12.876 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -12.641 -23.187 -13.688 1.00 0.00 H new ATOM 127 N ILE A 9 -11.519 -25.544 -4.765 1.00 0.00 N ATOM 128 CA ILE A 9 -11.780 -26.258 -3.483 1.00 0.00 C ATOM 129 C ILE A 9 -12.685 -25.399 -2.597 1.00 0.00 C ATOM 130 O ILE A 9 -12.436 -24.229 -2.388 1.00 0.00 O ATOM 131 CB ILE A 9 -10.455 -26.515 -2.762 1.00 0.00 C ATOM 132 CG1 ILE A 9 -9.529 -27.325 -3.672 1.00 0.00 C ATOM 133 CG2 ILE A 9 -10.720 -27.298 -1.476 1.00 0.00 C ATOM 134 CD1 ILE A 9 -8.163 -27.477 -3.001 1.00 0.00 C ATOM 0 H ILE A 9 -11.065 -24.635 -4.671 1.00 0.00 H new ATOM 0 HA ILE A 9 -12.270 -27.209 -3.690 1.00 0.00 H new ATOM 0 HB ILE A 9 -9.982 -25.564 -2.517 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.961 -28.306 -3.868 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.420 -26.826 -4.635 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.777 -27.482 -0.961 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.381 -26.721 -0.828 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -11.192 -28.250 -1.720 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.502 -28.054 -3.648 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.731 -26.491 -2.827 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.281 -27.994 -2.049 1.00 0.00 H new ATOM 146 N LYS A 10 -13.736 -25.971 -2.075 1.00 0.00 N ATOM 147 CA LYS A 10 -14.656 -25.186 -1.205 1.00 0.00 C ATOM 148 C LYS A 10 -14.348 -25.482 0.264 1.00 0.00 C ATOM 149 O LYS A 10 -14.231 -26.622 0.667 1.00 0.00 O ATOM 150 CB LYS A 10 -16.102 -25.576 -1.510 1.00 0.00 C ATOM 151 CG LYS A 10 -16.523 -24.969 -2.850 1.00 0.00 C ATOM 152 CD LYS A 10 -17.965 -25.373 -3.162 1.00 0.00 C ATOM 153 CE LYS A 10 -18.295 -25.010 -4.611 1.00 0.00 C ATOM 154 NZ LYS A 10 -19.688 -24.485 -4.687 1.00 0.00 N ATOM 0 H LYS A 10 -13.997 -26.947 -2.214 1.00 0.00 H new ATOM 0 HA LYS A 10 -14.517 -24.122 -1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -16.198 -26.661 -1.544 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.760 -25.223 -0.716 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -16.438 -23.883 -2.812 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -15.858 -25.313 -3.642 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -18.096 -26.444 -3.005 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.651 -24.866 -2.484 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -17.593 -24.262 -4.979 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -18.190 -25.887 -5.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -19.913 -24.238 -5.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -20.352 -25.212 -4.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -19.773 -23.638 -4.090 1.00 0.00 H new ATOM 168 N LEU A 11 -14.217 -24.462 1.068 1.00 0.00 N ATOM 169 CA LEU A 11 -13.918 -24.684 2.511 1.00 0.00 C ATOM 170 C LEU A 11 -15.139 -24.295 3.347 1.00 0.00 C ATOM 171 O LEU A 11 -15.748 -23.266 3.132 1.00 0.00 O ATOM 172 CB LEU A 11 -12.723 -23.823 2.923 1.00 0.00 C ATOM 173 CG LEU A 11 -11.523 -24.155 2.033 1.00 0.00 C ATOM 174 CD1 LEU A 11 -11.723 -23.525 0.652 1.00 0.00 C ATOM 175 CD2 LEU A 11 -10.248 -23.597 2.668 1.00 0.00 C ATOM 0 H LEU A 11 -14.304 -23.485 0.788 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.682 -25.735 2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.975 -22.766 2.833 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.475 -24.004 3.969 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.435 -25.237 1.930 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -10.869 -23.761 0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -12.632 -23.922 0.199 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.811 -22.443 0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -9.393 -23.833 2.035 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.336 -22.515 2.771 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -10.106 -24.044 3.652 1.00 0.00 H new ATOM 187 N LYS A 12 -15.502 -25.110 4.300 1.00 0.00 N ATOM 188 CA LYS A 12 -16.683 -24.784 5.147 1.00 0.00 C ATOM 189 C LYS A 12 -16.285 -24.843 6.623 1.00 0.00 C ATOM 190 O LYS A 12 -15.516 -25.688 7.036 1.00 0.00 O ATOM 191 CB LYS A 12 -17.797 -25.798 4.879 1.00 0.00 C ATOM 192 CG LYS A 12 -18.119 -25.818 3.383 1.00 0.00 C ATOM 193 CD LYS A 12 -19.372 -26.662 3.142 1.00 0.00 C ATOM 194 CE LYS A 12 -19.703 -26.668 1.649 1.00 0.00 C ATOM 195 NZ LYS A 12 -21.115 -26.232 1.451 1.00 0.00 N ATOM 0 H LYS A 12 -15.032 -25.986 4.528 1.00 0.00 H new ATOM 0 HA LYS A 12 -17.037 -23.782 4.906 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.488 -26.790 5.209 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.688 -25.536 5.450 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -18.277 -24.802 3.020 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.278 -26.229 2.825 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -19.210 -27.681 3.494 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -20.210 -26.258 3.710 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -19.027 -26.002 1.113 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -19.559 -27.667 1.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -21.206 -25.756 0.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -21.741 -27.062 1.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -21.385 -25.573 2.209 1.00 0.00 H new ATOM 209 N ALA A 13 -16.802 -23.949 7.421 1.00 0.00 N ATOM 210 CA ALA A 13 -16.453 -23.953 8.869 1.00 0.00 C ATOM 211 C ALA A 13 -17.333 -22.942 9.608 1.00 0.00 C ATOM 212 O ALA A 13 -17.709 -21.921 9.068 1.00 0.00 O ATOM 213 CB ALA A 13 -14.981 -23.569 9.039 1.00 0.00 C ATOM 0 H ALA A 13 -17.451 -23.217 7.133 1.00 0.00 H new ATOM 0 HA ALA A 13 -16.619 -24.948 9.281 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.724 -23.572 10.098 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.354 -24.288 8.512 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.815 -22.573 8.628 1.00 0.00 H new ATOM 219 N TYR A 14 -17.664 -23.219 10.839 1.00 0.00 N ATOM 220 CA TYR A 14 -18.520 -22.274 11.611 1.00 0.00 C ATOM 221 C TYR A 14 -17.746 -20.980 11.870 1.00 0.00 C ATOM 222 O TYR A 14 -18.285 -19.894 11.777 1.00 0.00 O ATOM 223 CB TYR A 14 -18.907 -22.913 12.946 1.00 0.00 C ATOM 224 CG TYR A 14 -19.742 -24.145 12.692 1.00 0.00 C ATOM 225 CD1 TYR A 14 -21.112 -24.022 12.434 1.00 0.00 C ATOM 226 CD2 TYR A 14 -19.145 -25.412 12.714 1.00 0.00 C ATOM 227 CE1 TYR A 14 -21.886 -25.165 12.198 1.00 0.00 C ATOM 228 CE2 TYR A 14 -19.919 -26.554 12.478 1.00 0.00 C ATOM 229 CZ TYR A 14 -21.289 -26.431 12.220 1.00 0.00 C ATOM 230 OH TYR A 14 -22.053 -27.557 11.987 1.00 0.00 O ATOM 0 H TYR A 14 -17.379 -24.058 11.344 1.00 0.00 H new ATOM 0 HA TYR A 14 -19.421 -22.050 11.040 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -18.011 -23.177 13.508 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -19.466 -22.201 13.554 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -21.573 -23.045 12.417 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -18.088 -25.508 12.913 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -22.943 -25.070 11.999 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -19.459 -27.531 12.495 1.00 0.00 H new ATOM 0 HH TYR A 14 -21.485 -28.354 12.037 1.00 0.00 H new ATOM 240 N ASP A 15 -16.486 -21.085 12.194 1.00 0.00 N ATOM 241 CA ASP A 15 -15.680 -19.861 12.458 1.00 0.00 C ATOM 242 C ASP A 15 -14.952 -19.443 11.178 1.00 0.00 C ATOM 243 O ASP A 15 -14.082 -20.139 10.693 1.00 0.00 O ATOM 244 CB ASP A 15 -14.656 -20.153 13.555 1.00 0.00 C ATOM 245 CG ASP A 15 -15.385 -20.460 14.865 1.00 0.00 C ATOM 246 OD1 ASP A 15 -16.567 -20.166 14.945 1.00 0.00 O ATOM 247 OD2 ASP A 15 -14.750 -20.984 15.765 1.00 0.00 O ATOM 0 H ASP A 15 -15.981 -21.966 12.287 1.00 0.00 H new ATOM 0 HA ASP A 15 -16.339 -19.055 12.781 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -14.031 -20.998 13.268 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -13.994 -19.297 13.687 1.00 0.00 H new ATOM 252 N HIS A 16 -15.299 -18.312 10.628 1.00 0.00 N ATOM 253 CA HIS A 16 -14.624 -17.853 9.380 1.00 0.00 C ATOM 254 C HIS A 16 -13.122 -17.719 9.635 1.00 0.00 C ATOM 255 O HIS A 16 -12.308 -18.027 8.787 1.00 0.00 O ATOM 256 CB HIS A 16 -15.196 -16.498 8.955 1.00 0.00 C ATOM 257 CG HIS A 16 -14.720 -15.430 9.901 1.00 0.00 C ATOM 258 ND1 HIS A 16 -15.247 -15.280 11.175 1.00 0.00 N ATOM 259 CD2 HIS A 16 -13.769 -14.449 9.771 1.00 0.00 C ATOM 260 CE1 HIS A 16 -14.614 -14.244 11.756 1.00 0.00 C ATOM 261 NE2 HIS A 16 -13.703 -13.701 10.943 1.00 0.00 N ATOM 0 H HIS A 16 -16.020 -17.686 10.988 1.00 0.00 H new ATOM 0 HA HIS A 16 -14.794 -18.580 8.586 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -14.883 -16.263 7.938 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -16.285 -16.536 8.952 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -13.163 -14.283 8.892 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -14.818 -13.894 12.757 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -13.091 -12.909 11.139 1.00 0.00 H new ATOM 269 N GLU A 17 -12.746 -17.263 10.799 1.00 0.00 N ATOM 270 CA GLU A 17 -11.296 -17.111 11.107 1.00 0.00 C ATOM 271 C GLU A 17 -10.580 -18.436 10.833 1.00 0.00 C ATOM 272 O GLU A 17 -9.616 -18.490 10.096 1.00 0.00 O ATOM 273 CB GLU A 17 -11.123 -16.733 12.579 1.00 0.00 C ATOM 274 CG GLU A 17 -11.781 -15.377 12.838 1.00 0.00 C ATOM 275 CD GLU A 17 -11.476 -14.926 14.268 1.00 0.00 C ATOM 276 OE1 GLU A 17 -10.957 -15.730 15.024 1.00 0.00 O ATOM 277 OE2 GLU A 17 -11.768 -13.784 14.583 1.00 0.00 O ATOM 0 H GLU A 17 -13.380 -16.989 11.549 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.870 -16.328 10.480 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.572 -17.495 13.216 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.064 -16.689 12.832 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.411 -14.639 12.126 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.859 -15.450 12.690 1.00 0.00 H new ATOM 284 N LEU A 18 -11.046 -19.505 11.420 1.00 0.00 N ATOM 285 CA LEU A 18 -10.393 -20.824 11.191 1.00 0.00 C ATOM 286 C LEU A 18 -10.358 -21.117 9.691 1.00 0.00 C ATOM 287 O LEU A 18 -9.334 -21.470 9.140 1.00 0.00 O ATOM 288 CB LEU A 18 -11.187 -21.918 11.907 1.00 0.00 C ATOM 289 CG LEU A 18 -10.844 -21.902 13.398 1.00 0.00 C ATOM 290 CD1 LEU A 18 -11.127 -20.512 13.974 1.00 0.00 C ATOM 291 CD2 LEU A 18 -11.699 -22.940 14.129 1.00 0.00 C ATOM 0 H LEU A 18 -11.850 -19.521 12.048 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.376 -20.801 11.582 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.256 -21.758 11.767 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -10.952 -22.893 11.479 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.789 -22.141 13.530 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.882 -20.502 15.036 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.519 -19.772 13.454 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -12.182 -20.271 13.842 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.455 -22.929 15.191 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.754 -22.701 13.996 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.497 -23.930 13.721 1.00 0.00 H new ATOM 303 N LEU A 19 -11.470 -20.973 9.023 1.00 0.00 N ATOM 304 CA LEU A 19 -11.499 -21.242 7.558 1.00 0.00 C ATOM 305 C LEU A 19 -10.544 -20.281 6.847 1.00 0.00 C ATOM 306 O LEU A 19 -9.959 -20.609 5.834 1.00 0.00 O ATOM 307 CB LEU A 19 -12.919 -21.033 7.029 1.00 0.00 C ATOM 308 CG LEU A 19 -12.991 -21.483 5.568 1.00 0.00 C ATOM 309 CD1 LEU A 19 -14.448 -21.761 5.191 1.00 0.00 C ATOM 310 CD2 LEU A 19 -12.432 -20.381 4.667 1.00 0.00 C ATOM 0 H LEU A 19 -12.359 -20.681 9.429 1.00 0.00 H new ATOM 0 HA LEU A 19 -11.189 -22.270 7.370 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.630 -21.600 7.631 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -13.198 -19.983 7.111 1.00 0.00 H new ATOM 0 HG LEU A 19 -12.403 -22.391 5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -14.500 -22.082 4.150 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -14.846 -22.547 5.833 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.037 -20.853 5.321 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -12.483 -20.701 3.626 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -13.020 -19.472 4.796 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -11.394 -20.183 4.935 1.00 0.00 H new ATOM 322 N ASP A 20 -10.382 -19.097 7.371 1.00 0.00 N ATOM 323 CA ASP A 20 -9.464 -18.116 6.726 1.00 0.00 C ATOM 324 C ASP A 20 -8.024 -18.621 6.830 1.00 0.00 C ATOM 325 O ASP A 20 -7.238 -18.479 5.915 1.00 0.00 O ATOM 326 CB ASP A 20 -9.585 -16.765 7.432 1.00 0.00 C ATOM 327 CG ASP A 20 -10.971 -16.176 7.173 1.00 0.00 C ATOM 328 OD1 ASP A 20 -11.740 -16.808 6.466 1.00 0.00 O ATOM 329 OD2 ASP A 20 -11.242 -15.102 7.686 1.00 0.00 O ATOM 0 H ASP A 20 -10.845 -18.767 8.217 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.733 -18.002 5.676 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.425 -16.887 8.503 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -8.815 -16.083 7.070 1.00 0.00 H new ATOM 334 N GLU A 21 -7.671 -19.212 7.940 1.00 0.00 N ATOM 335 CA GLU A 21 -6.282 -19.726 8.101 1.00 0.00 C ATOM 336 C GLU A 21 -6.079 -20.938 7.190 1.00 0.00 C ATOM 337 O GLU A 21 -5.033 -21.114 6.598 1.00 0.00 O ATOM 338 CB GLU A 21 -6.056 -20.137 9.557 1.00 0.00 C ATOM 339 CG GLU A 21 -4.576 -20.462 9.772 1.00 0.00 C ATOM 340 CD GLU A 21 -4.377 -21.029 11.179 1.00 0.00 C ATOM 341 OE1 GLU A 21 -5.354 -21.120 11.903 1.00 0.00 O ATOM 342 OE2 GLU A 21 -3.250 -21.364 11.507 1.00 0.00 O ATOM 0 H GLU A 21 -8.285 -19.361 8.741 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.571 -18.945 7.830 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.363 -19.332 10.225 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.669 -21.005 9.800 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.239 -21.183 9.027 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.973 -19.563 9.642 1.00 0.00 H new ATOM 349 N SER A 22 -7.074 -21.776 7.072 1.00 0.00 N ATOM 350 CA SER A 22 -6.937 -22.974 6.198 1.00 0.00 C ATOM 351 C SER A 22 -6.791 -22.528 4.742 1.00 0.00 C ATOM 352 O SER A 22 -5.950 -23.016 4.014 1.00 0.00 O ATOM 353 CB SER A 22 -8.181 -23.854 6.340 1.00 0.00 C ATOM 354 OG SER A 22 -7.955 -25.100 5.696 1.00 0.00 O ATOM 0 H SER A 22 -7.974 -21.682 7.543 1.00 0.00 H new ATOM 0 HA SER A 22 -6.055 -23.542 6.495 1.00 0.00 H new ATOM 0 HB2 SER A 22 -8.409 -24.013 7.394 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.044 -23.356 5.899 1.00 0.00 H new ATOM 0 HG SER A 22 -8.805 -25.454 5.362 1.00 0.00 H new ATOM 360 N ALA A 23 -7.604 -21.602 4.312 1.00 0.00 N ATOM 361 CA ALA A 23 -7.510 -21.124 2.905 1.00 0.00 C ATOM 362 C ALA A 23 -6.168 -20.422 2.694 1.00 0.00 C ATOM 363 O ALA A 23 -5.462 -20.683 1.740 1.00 0.00 O ATOM 364 CB ALA A 23 -8.649 -20.141 2.623 1.00 0.00 C ATOM 0 H ALA A 23 -8.329 -21.156 4.875 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.587 -21.974 2.227 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.581 -19.791 1.593 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -9.606 -20.640 2.774 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -8.572 -19.291 3.301 1.00 0.00 H new ATOM 370 N LYS A 24 -5.809 -19.532 3.579 1.00 0.00 N ATOM 371 CA LYS A 24 -4.512 -18.815 3.430 1.00 0.00 C ATOM 372 C LYS A 24 -3.361 -19.817 3.552 1.00 0.00 C ATOM 373 O LYS A 24 -2.415 -19.786 2.790 1.00 0.00 O ATOM 374 CB LYS A 24 -4.385 -17.756 4.526 1.00 0.00 C ATOM 375 CG LYS A 24 -3.142 -16.902 4.269 1.00 0.00 C ATOM 376 CD LYS A 24 -2.997 -15.863 5.383 1.00 0.00 C ATOM 377 CE LYS A 24 -1.865 -14.895 5.035 1.00 0.00 C ATOM 378 NZ LYS A 24 -0.559 -15.610 5.110 1.00 0.00 N ATOM 0 H LYS A 24 -6.358 -19.271 4.398 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.473 -18.332 2.454 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.275 -17.126 4.543 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.315 -18.235 5.503 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -2.255 -17.534 4.229 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.223 -16.405 3.302 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -3.932 -15.316 5.508 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.788 -16.358 6.331 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -2.013 -14.490 4.034 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -1.870 -14.051 5.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.218 -14.920 5.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.500 -16.132 6.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -0.482 -16.277 4.316 1.00 0.00 H new ATOM 392 N LYS A 25 -3.434 -20.705 4.506 1.00 0.00 N ATOM 393 CA LYS A 25 -2.346 -21.707 4.675 1.00 0.00 C ATOM 394 C LYS A 25 -2.216 -22.539 3.397 1.00 0.00 C ATOM 395 O LYS A 25 -1.138 -22.710 2.863 1.00 0.00 O ATOM 396 CB LYS A 25 -2.677 -22.627 5.851 1.00 0.00 C ATOM 397 CG LYS A 25 -1.479 -23.533 6.143 1.00 0.00 C ATOM 398 CD LYS A 25 -1.816 -24.469 7.306 1.00 0.00 C ATOM 399 CE LYS A 25 -0.569 -25.261 7.701 1.00 0.00 C ATOM 400 NZ LYS A 25 -0.671 -26.648 7.166 1.00 0.00 N ATOM 0 H LYS A 25 -4.200 -20.779 5.175 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.405 -21.192 4.871 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.922 -22.034 6.732 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.555 -23.230 5.619 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.225 -24.114 5.257 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -0.605 -22.930 6.390 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.179 -23.893 8.157 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -2.617 -25.150 7.018 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.324 -24.773 7.309 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.469 -25.285 8.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.280 -27.064 7.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.255 -27.224 7.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -1.109 -26.625 6.223 1.00 0.00 H new ATOM 414 N ILE A 26 -3.307 -23.056 2.902 1.00 0.00 N ATOM 415 CA ILE A 26 -3.245 -23.876 1.660 1.00 0.00 C ATOM 416 C ILE A 26 -2.710 -23.020 0.510 1.00 0.00 C ATOM 417 O ILE A 26 -1.916 -23.468 -0.292 1.00 0.00 O ATOM 418 CB ILE A 26 -4.647 -24.379 1.311 1.00 0.00 C ATOM 419 CG1 ILE A 26 -5.140 -25.321 2.411 1.00 0.00 C ATOM 420 CG2 ILE A 26 -4.601 -25.131 -0.021 1.00 0.00 C ATOM 421 CD1 ILE A 26 -6.615 -25.654 2.175 1.00 0.00 C ATOM 0 H ILE A 26 -4.238 -22.946 3.304 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.582 -24.727 1.819 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.327 -23.531 1.227 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.546 -26.235 2.415 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.013 -24.854 3.388 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.599 -25.490 -0.271 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.250 -24.461 -0.805 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.921 -25.979 0.063 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -6.966 -26.325 2.959 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -7.203 -24.736 2.193 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.728 -26.138 1.205 1.00 0.00 H new ATOM 433 N VAL A 27 -3.139 -21.791 0.424 1.00 0.00 N ATOM 434 CA VAL A 27 -2.653 -20.908 -0.674 1.00 0.00 C ATOM 435 C VAL A 27 -1.127 -20.814 -0.615 1.00 0.00 C ATOM 436 O VAL A 27 -0.451 -20.909 -1.620 1.00 0.00 O ATOM 437 CB VAL A 27 -3.257 -19.512 -0.511 1.00 0.00 C ATOM 438 CG1 VAL A 27 -2.622 -18.561 -1.526 1.00 0.00 C ATOM 439 CG2 VAL A 27 -4.767 -19.579 -0.749 1.00 0.00 C ATOM 0 H VAL A 27 -3.804 -21.360 1.066 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.954 -21.324 -1.635 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.064 -19.148 0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.052 -17.566 -1.411 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.546 -18.514 -1.357 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.815 -18.925 -2.535 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -5.198 -18.585 -0.633 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.960 -19.943 -1.758 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.220 -20.257 -0.026 1.00 0.00 H new ATOM 449 N GLU A 28 -0.579 -20.627 0.554 1.00 0.00 N ATOM 450 CA GLU A 28 0.902 -20.527 0.675 1.00 0.00 C ATOM 451 C GLU A 28 1.540 -21.839 0.216 1.00 0.00 C ATOM 452 O GLU A 28 2.520 -21.846 -0.503 1.00 0.00 O ATOM 453 CB GLU A 28 1.278 -20.257 2.133 1.00 0.00 C ATOM 454 CG GLU A 28 0.752 -18.882 2.549 1.00 0.00 C ATOM 455 CD GLU A 28 1.370 -17.807 1.653 1.00 0.00 C ATOM 456 OE1 GLU A 28 2.371 -18.096 1.019 1.00 0.00 O ATOM 457 OE2 GLU A 28 0.833 -16.712 1.617 1.00 0.00 O ATOM 0 H GLU A 28 -1.093 -20.539 1.431 1.00 0.00 H new ATOM 0 HA GLU A 28 1.264 -19.710 0.051 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.857 -21.029 2.777 1.00 0.00 H new ATOM 0 HB3 GLU A 28 2.361 -20.296 2.254 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.335 -18.857 2.469 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.999 -18.687 3.593 1.00 0.00 H new ATOM 464 N VAL A 29 0.993 -22.951 0.626 1.00 0.00 N ATOM 465 CA VAL A 29 1.570 -24.261 0.213 1.00 0.00 C ATOM 466 C VAL A 29 1.297 -24.492 -1.275 1.00 0.00 C ATOM 467 O VAL A 29 2.148 -24.955 -2.007 1.00 0.00 O ATOM 468 CB VAL A 29 0.924 -25.383 1.029 1.00 0.00 C ATOM 469 CG1 VAL A 29 1.604 -26.712 0.695 1.00 0.00 C ATOM 470 CG2 VAL A 29 1.087 -25.086 2.521 1.00 0.00 C ATOM 0 H VAL A 29 0.172 -23.009 1.229 1.00 0.00 H new ATOM 0 HA VAL A 29 2.646 -24.256 0.389 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.136 -25.447 0.785 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.145 -27.512 1.276 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.488 -26.923 -0.368 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.664 -26.650 0.939 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.627 -25.885 3.103 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.147 -25.023 2.766 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.603 -24.139 2.758 1.00 0.00 H new ATOM 480 N ALA A 30 0.116 -24.170 -1.728 1.00 0.00 N ATOM 481 CA ALA A 30 -0.210 -24.371 -3.168 1.00 0.00 C ATOM 482 C ALA A 30 0.667 -23.453 -4.022 1.00 0.00 C ATOM 483 O ALA A 30 1.267 -23.876 -4.990 1.00 0.00 O ATOM 484 CB ALA A 30 -1.683 -24.037 -3.409 1.00 0.00 C ATOM 0 H ALA A 30 -0.637 -23.777 -1.163 1.00 0.00 H new ATOM 0 HA ALA A 30 -0.024 -25.410 -3.441 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.922 -24.184 -4.462 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -2.308 -24.690 -2.801 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -1.870 -22.998 -3.136 1.00 0.00 H new ATOM 490 N LYS A 31 0.747 -22.199 -3.671 1.00 0.00 N ATOM 491 CA LYS A 31 1.587 -21.255 -4.463 1.00 0.00 C ATOM 492 C LYS A 31 3.019 -21.785 -4.534 1.00 0.00 C ATOM 493 O LYS A 31 3.676 -21.691 -5.551 1.00 0.00 O ATOM 494 CB LYS A 31 1.584 -19.881 -3.789 1.00 0.00 C ATOM 495 CG LYS A 31 2.175 -18.844 -4.745 1.00 0.00 C ATOM 496 CD LYS A 31 2.271 -17.492 -4.035 1.00 0.00 C ATOM 497 CE LYS A 31 2.812 -16.442 -5.008 1.00 0.00 C ATOM 498 NZ LYS A 31 4.216 -16.782 -5.375 1.00 0.00 N ATOM 0 H LYS A 31 0.268 -21.787 -2.871 1.00 0.00 H new ATOM 0 HA LYS A 31 1.182 -21.166 -5.471 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.567 -19.601 -3.515 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.165 -19.915 -2.867 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.163 -19.162 -5.079 1.00 0.00 H new ATOM 0 HG3 LYS A 31 1.551 -18.756 -5.634 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.290 -17.192 -3.668 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.926 -17.571 -3.167 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.190 -16.404 -5.902 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.773 -15.453 -4.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 4.683 -15.943 -5.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.731 -17.094 -4.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.215 -17.546 -6.080 1.00 0.00 H new ATOM 512 N SER A 32 3.510 -22.342 -3.460 1.00 0.00 N ATOM 513 CA SER A 32 4.900 -22.877 -3.466 1.00 0.00 C ATOM 514 C SER A 32 5.046 -23.906 -4.589 1.00 0.00 C ATOM 515 O SER A 32 6.106 -24.068 -5.160 1.00 0.00 O ATOM 516 CB SER A 32 5.196 -23.544 -2.121 1.00 0.00 C ATOM 517 OG SER A 32 4.945 -22.622 -1.070 1.00 0.00 O ATOM 0 H SER A 32 3.008 -22.449 -2.579 1.00 0.00 H new ATOM 0 HA SER A 32 5.603 -22.060 -3.629 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.574 -24.430 -1.998 1.00 0.00 H new ATOM 0 HB3 SER A 32 6.234 -23.876 -2.088 1.00 0.00 H new ATOM 0 HG SER A 32 4.003 -22.677 -0.805 1.00 0.00 H new ATOM 523 N THR A 33 3.990 -24.602 -4.910 1.00 0.00 N ATOM 524 CA THR A 33 4.070 -25.618 -5.996 1.00 0.00 C ATOM 525 C THR A 33 4.092 -24.913 -7.353 1.00 0.00 C ATOM 526 O THR A 33 3.701 -23.769 -7.476 1.00 0.00 O ATOM 527 CB THR A 33 2.853 -26.542 -5.920 1.00 0.00 C ATOM 528 OG1 THR A 33 1.701 -25.842 -6.369 1.00 0.00 O ATOM 529 CG2 THR A 33 2.643 -26.999 -4.477 1.00 0.00 C ATOM 0 H THR A 33 3.076 -24.511 -4.467 1.00 0.00 H new ATOM 0 HA THR A 33 4.980 -26.206 -5.878 1.00 0.00 H new ATOM 0 HB THR A 33 3.020 -27.414 -6.552 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.799 -24.888 -6.168 1.00 0.00 H new ATOM 0 HG21 THR A 33 1.775 -27.657 -4.426 1.00 0.00 H new ATOM 0 HG22 THR A 33 3.527 -27.537 -4.133 1.00 0.00 H new ATOM 0 HG23 THR A 33 2.477 -26.130 -3.841 1.00 0.00 H new ATOM 537 N ASN A 34 4.544 -25.587 -8.375 1.00 0.00 N ATOM 538 CA ASN A 34 4.590 -24.954 -9.724 1.00 0.00 C ATOM 539 C ASN A 34 3.191 -24.461 -10.103 1.00 0.00 C ATOM 540 O ASN A 34 3.034 -23.441 -10.744 1.00 0.00 O ATOM 541 CB ASN A 34 5.066 -25.981 -10.753 1.00 0.00 C ATOM 542 CG ASN A 34 5.401 -25.269 -12.066 1.00 0.00 C ATOM 543 OD1 ASN A 34 5.298 -24.062 -12.160 1.00 0.00 O ATOM 544 ND2 ASN A 34 5.800 -25.971 -13.091 1.00 0.00 N ATOM 0 H ASN A 34 4.883 -26.548 -8.334 1.00 0.00 H new ATOM 0 HA ASN A 34 5.280 -24.111 -9.707 1.00 0.00 H new ATOM 0 HB2 ASN A 34 5.944 -26.508 -10.378 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.292 -26.730 -10.920 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.025 -25.506 -13.971 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.887 -26.984 -13.013 1.00 0.00 H new ATOM 551 N SER A 35 2.174 -25.179 -9.711 1.00 0.00 N ATOM 552 CA SER A 35 0.787 -24.752 -10.049 1.00 0.00 C ATOM 553 C SER A 35 0.494 -23.402 -9.390 1.00 0.00 C ATOM 554 O SER A 35 1.115 -23.028 -8.416 1.00 0.00 O ATOM 555 CB SER A 35 -0.207 -25.796 -9.536 1.00 0.00 C ATOM 556 OG SER A 35 -0.330 -25.680 -8.126 1.00 0.00 O ATOM 0 H SER A 35 2.244 -26.042 -9.172 1.00 0.00 H new ATOM 0 HA SER A 35 0.689 -24.657 -11.130 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.178 -25.652 -10.009 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.132 -26.797 -9.801 1.00 0.00 H new ATOM 0 HG SER A 35 0.553 -25.776 -7.712 1.00 0.00 H new ATOM 562 N LYS A 36 -0.449 -22.669 -9.915 1.00 0.00 N ATOM 563 CA LYS A 36 -0.781 -21.345 -9.318 1.00 0.00 C ATOM 564 C LYS A 36 -2.175 -21.404 -8.690 1.00 0.00 C ATOM 565 O LYS A 36 -3.046 -22.114 -9.154 1.00 0.00 O ATOM 566 CB LYS A 36 -0.758 -20.273 -10.408 1.00 0.00 C ATOM 567 CG LYS A 36 0.655 -20.160 -10.984 1.00 0.00 C ATOM 568 CD LYS A 36 0.703 -19.017 -11.999 1.00 0.00 C ATOM 569 CE LYS A 36 2.072 -18.998 -12.682 1.00 0.00 C ATOM 570 NZ LYS A 36 2.102 -20.023 -13.763 1.00 0.00 N ATOM 0 H LYS A 36 -1.003 -22.929 -10.731 1.00 0.00 H new ATOM 0 HA LYS A 36 -0.047 -21.098 -8.551 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.465 -20.527 -11.198 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.072 -19.314 -9.996 1.00 0.00 H new ATOM 0 HG2 LYS A 36 1.372 -19.980 -10.183 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.940 -21.097 -11.462 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.084 -19.143 -12.742 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.521 -18.065 -11.500 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.269 -18.010 -13.098 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.857 -19.200 -11.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 3.058 -20.426 -13.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.423 -20.779 -13.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.846 -19.580 -14.668 1.00 0.00 H new ATOM 584 N VAL A 37 -2.395 -20.663 -7.638 1.00 0.00 N ATOM 585 CA VAL A 37 -3.734 -20.679 -6.983 1.00 0.00 C ATOM 586 C VAL A 37 -4.302 -19.259 -6.949 1.00 0.00 C ATOM 587 O VAL A 37 -3.594 -18.303 -6.701 1.00 0.00 O ATOM 588 CB VAL A 37 -3.597 -21.209 -5.556 1.00 0.00 C ATOM 589 CG1 VAL A 37 -4.987 -21.387 -4.943 1.00 0.00 C ATOM 590 CG2 VAL A 37 -2.874 -22.557 -5.580 1.00 0.00 C ATOM 0 H VAL A 37 -1.706 -20.048 -7.204 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.407 -21.325 -7.547 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.024 -20.500 -4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -4.890 -21.765 -3.925 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -5.503 -20.427 -4.926 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -5.560 -22.096 -5.540 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -2.776 -22.935 -4.563 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -3.447 -23.266 -6.177 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -1.884 -22.431 -6.017 1.00 0.00 H new ATOM 600 N SER A 38 -5.575 -19.112 -7.195 1.00 0.00 N ATOM 601 CA SER A 38 -6.187 -17.754 -7.176 1.00 0.00 C ATOM 602 C SER A 38 -7.173 -17.655 -6.011 1.00 0.00 C ATOM 603 O SER A 38 -7.895 -18.586 -5.715 1.00 0.00 O ATOM 604 CB SER A 38 -6.926 -17.510 -8.493 1.00 0.00 C ATOM 605 OG SER A 38 -7.285 -16.139 -8.586 1.00 0.00 O ATOM 0 H SER A 38 -6.218 -19.875 -7.408 1.00 0.00 H new ATOM 0 HA SER A 38 -5.405 -17.004 -7.054 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.293 -17.789 -9.335 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.818 -18.135 -8.544 1.00 0.00 H new ATOM 0 HG SER A 38 -7.757 -15.981 -9.430 1.00 0.00 H new ATOM 611 N GLY A 39 -7.210 -16.532 -5.347 1.00 0.00 N ATOM 612 CA GLY A 39 -8.149 -16.374 -4.201 1.00 0.00 C ATOM 613 C GLY A 39 -7.358 -16.030 -2.937 1.00 0.00 C ATOM 614 O GLY A 39 -6.320 -15.402 -2.996 1.00 0.00 O ATOM 0 H GLY A 39 -6.630 -15.717 -5.549 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.872 -15.587 -4.416 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.714 -17.294 -4.050 1.00 0.00 H new ATOM 618 N PRO A 40 -7.867 -16.454 -1.771 1.00 0.00 N ATOM 619 CA PRO A 40 -9.120 -17.214 -1.680 1.00 0.00 C ATOM 620 C PRO A 40 -10.337 -16.338 -1.993 1.00 0.00 C ATOM 621 O PRO A 40 -10.361 -15.162 -1.690 1.00 0.00 O ATOM 622 CB PRO A 40 -9.161 -17.662 -0.220 1.00 0.00 C ATOM 623 CG PRO A 40 -8.333 -16.657 0.507 1.00 0.00 C ATOM 624 CD PRO A 40 -7.256 -16.225 -0.449 1.00 0.00 C ATOM 0 HA PRO A 40 -9.153 -18.038 -2.393 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -10.183 -17.683 0.159 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.757 -18.668 -0.103 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.939 -15.807 0.819 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.901 -17.089 1.410 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.987 -15.179 -0.306 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.345 -16.809 -0.320 1.00 0.00 H new ATOM 632 N ILE A 41 -11.348 -16.904 -2.594 1.00 0.00 N ATOM 633 CA ILE A 41 -12.560 -16.105 -2.925 1.00 0.00 C ATOM 634 C ILE A 41 -13.620 -16.317 -1.842 1.00 0.00 C ATOM 635 O ILE A 41 -14.070 -17.421 -1.609 1.00 0.00 O ATOM 636 CB ILE A 41 -13.115 -16.555 -4.277 1.00 0.00 C ATOM 637 CG1 ILE A 41 -11.968 -16.689 -5.281 1.00 0.00 C ATOM 638 CG2 ILE A 41 -14.119 -15.520 -4.786 1.00 0.00 C ATOM 639 CD1 ILE A 41 -12.372 -17.662 -6.391 1.00 0.00 C ATOM 0 H ILE A 41 -11.386 -17.885 -2.870 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.297 -15.048 -2.975 1.00 0.00 H new ATOM 0 HB ILE A 41 -13.612 -17.518 -4.163 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.728 -15.715 -5.707 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -11.070 -17.047 -4.778 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.515 -15.840 -5.750 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.937 -15.424 -4.072 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -13.622 -14.557 -4.900 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.555 -17.758 -7.106 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -12.591 -18.638 -5.958 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -13.258 -17.285 -6.901 1.00 0.00 H new ATOM 651 N PRO A 42 -14.025 -15.230 -1.167 1.00 0.00 N ATOM 652 CA PRO A 42 -15.034 -15.288 -0.103 1.00 0.00 C ATOM 653 C PRO A 42 -16.433 -15.564 -0.661 1.00 0.00 C ATOM 654 O PRO A 42 -16.784 -15.117 -1.734 1.00 0.00 O ATOM 655 CB PRO A 42 -14.986 -13.890 0.513 1.00 0.00 C ATOM 656 CG PRO A 42 -14.468 -13.014 -0.577 1.00 0.00 C ATOM 657 CD PRO A 42 -13.529 -13.861 -1.391 1.00 0.00 C ATOM 0 HA PRO A 42 -14.832 -16.089 0.608 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -15.974 -13.569 0.844 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.334 -13.864 1.386 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -15.284 -12.637 -1.193 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -13.952 -12.147 -0.166 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -13.557 -13.591 -2.447 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.497 -13.748 -1.060 1.00 0.00 H new ATOM 665 N LEU A 43 -17.235 -16.300 0.059 1.00 0.00 N ATOM 666 CA LEU A 43 -18.610 -16.605 -0.429 1.00 0.00 C ATOM 667 C LEU A 43 -19.632 -16.155 0.615 1.00 0.00 C ATOM 668 O LEU A 43 -19.281 -15.743 1.704 1.00 0.00 O ATOM 669 CB LEU A 43 -18.746 -18.111 -0.661 1.00 0.00 C ATOM 670 CG LEU A 43 -18.761 -18.398 -2.164 1.00 0.00 C ATOM 671 CD1 LEU A 43 -17.331 -18.346 -2.707 1.00 0.00 C ATOM 672 CD2 LEU A 43 -19.351 -19.787 -2.412 1.00 0.00 C ATOM 0 H LEU A 43 -16.997 -16.704 0.965 1.00 0.00 H new ATOM 0 HA LEU A 43 -18.790 -16.076 -1.365 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -17.918 -18.639 -0.188 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -19.663 -18.479 -0.201 1.00 0.00 H new ATOM 0 HG LEU A 43 -19.370 -17.649 -2.671 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -17.341 -18.550 -3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -16.910 -17.356 -2.530 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -16.722 -19.095 -2.200 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -19.362 -19.992 -3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -18.743 -20.536 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -20.369 -19.824 -2.025 1.00 0.00 H new ATOM 684 N PRO A 44 -20.926 -16.237 0.272 1.00 0.00 N ATOM 685 CA PRO A 44 -22.013 -15.840 1.176 1.00 0.00 C ATOM 686 C PRO A 44 -22.157 -16.811 2.352 1.00 0.00 C ATOM 687 O PRO A 44 -22.111 -18.014 2.185 1.00 0.00 O ATOM 688 CB PRO A 44 -23.257 -15.905 0.291 1.00 0.00 C ATOM 689 CG PRO A 44 -22.905 -16.882 -0.781 1.00 0.00 C ATOM 690 CD PRO A 44 -21.431 -16.723 -1.024 1.00 0.00 C ATOM 0 HA PRO A 44 -21.839 -14.859 1.618 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -24.129 -16.234 0.856 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -23.498 -14.928 -0.127 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -23.141 -17.900 -0.473 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -23.473 -16.684 -1.690 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -20.966 -17.667 -1.309 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -21.230 -16.013 -1.826 1.00 0.00 H new ATOM 698 N THR A 45 -22.327 -16.298 3.539 1.00 0.00 N ATOM 699 CA THR A 45 -22.473 -17.191 4.723 1.00 0.00 C ATOM 700 C THR A 45 -23.898 -17.745 4.775 1.00 0.00 C ATOM 701 O THR A 45 -24.857 -17.042 4.526 1.00 0.00 O ATOM 702 CB THR A 45 -22.189 -16.395 6.000 1.00 0.00 C ATOM 703 OG1 THR A 45 -20.919 -15.768 5.894 1.00 0.00 O ATOM 704 CG2 THR A 45 -22.194 -17.341 7.203 1.00 0.00 C ATOM 0 H THR A 45 -22.371 -15.299 3.741 1.00 0.00 H new ATOM 0 HA THR A 45 -21.766 -18.017 4.643 1.00 0.00 H new ATOM 0 HB THR A 45 -22.959 -15.635 6.134 1.00 0.00 H new ATOM 0 HG1 THR A 45 -20.240 -16.329 6.324 1.00 0.00 H new ATOM 0 HG21 THR A 45 -21.992 -16.775 8.112 1.00 0.00 H new ATOM 0 HG22 THR A 45 -23.169 -17.821 7.284 1.00 0.00 H new ATOM 0 HG23 THR A 45 -21.425 -18.102 7.071 1.00 0.00 H new ATOM 712 N GLU A 46 -24.045 -19.002 5.096 1.00 0.00 N ATOM 713 CA GLU A 46 -25.408 -19.599 5.165 1.00 0.00 C ATOM 714 C GLU A 46 -25.565 -20.357 6.484 1.00 0.00 C ATOM 715 O GLU A 46 -24.634 -20.961 6.979 1.00 0.00 O ATOM 716 CB GLU A 46 -25.601 -20.565 3.994 1.00 0.00 C ATOM 717 CG GLU A 46 -25.493 -19.796 2.676 1.00 0.00 C ATOM 718 CD GLU A 46 -25.786 -20.741 1.508 1.00 0.00 C ATOM 719 OE1 GLU A 46 -25.904 -21.931 1.749 1.00 0.00 O ATOM 720 OE2 GLU A 46 -25.888 -20.258 0.392 1.00 0.00 O ATOM 0 H GLU A 46 -23.280 -19.641 5.313 1.00 0.00 H new ATOM 0 HA GLU A 46 -26.156 -18.808 5.110 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -24.849 -21.353 4.031 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -26.574 -21.050 4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -26.197 -18.964 2.670 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -24.495 -19.370 2.572 1.00 0.00 H new ATOM 727 N SER A 47 -26.736 -20.330 7.059 1.00 0.00 N ATOM 728 CA SER A 47 -26.949 -21.049 8.347 1.00 0.00 C ATOM 729 C SER A 47 -25.810 -20.711 9.311 1.00 0.00 C ATOM 730 O SER A 47 -25.323 -21.559 10.033 1.00 0.00 O ATOM 731 CB SER A 47 -26.974 -22.557 8.091 1.00 0.00 C ATOM 732 OG SER A 47 -27.283 -23.236 9.300 1.00 0.00 O ATOM 0 H SER A 47 -27.554 -19.842 6.693 1.00 0.00 H new ATOM 0 HA SER A 47 -27.899 -20.741 8.785 1.00 0.00 H new ATOM 0 HB2 SER A 47 -27.715 -22.795 7.328 1.00 0.00 H new ATOM 0 HB3 SER A 47 -26.007 -22.889 7.712 1.00 0.00 H new ATOM 0 HG SER A 47 -26.665 -22.949 10.004 1.00 0.00 H new ATOM 738 N ARG A 48 -25.380 -19.479 9.326 1.00 0.00 N ATOM 739 CA ARG A 48 -24.272 -19.089 10.242 1.00 0.00 C ATOM 740 C ARG A 48 -23.009 -19.873 9.878 1.00 0.00 C ATOM 741 O ARG A 48 -22.225 -20.236 10.733 1.00 0.00 O ATOM 742 CB ARG A 48 -24.668 -19.402 11.686 1.00 0.00 C ATOM 743 CG ARG A 48 -25.898 -18.575 12.068 1.00 0.00 C ATOM 744 CD ARG A 48 -26.233 -18.810 13.542 1.00 0.00 C ATOM 745 NE ARG A 48 -27.541 -18.173 13.862 1.00 0.00 N ATOM 746 CZ ARG A 48 -28.650 -18.710 13.432 1.00 0.00 C ATOM 747 NH1 ARG A 48 -29.051 -19.854 13.915 1.00 0.00 N ATOM 748 NH2 ARG A 48 -29.358 -18.104 12.518 1.00 0.00 N ATOM 0 H ARG A 48 -25.748 -18.727 8.744 1.00 0.00 H new ATOM 0 HA ARG A 48 -24.078 -18.021 10.142 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -24.884 -20.465 11.793 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -23.841 -19.175 12.359 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -25.707 -17.516 11.892 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -26.746 -18.854 11.442 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -26.277 -19.879 13.750 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -25.449 -18.394 14.175 1.00 0.00 H new ATOM 0 HE ARG A 48 -27.570 -17.318 14.417 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -28.498 -20.328 14.629 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -29.918 -20.274 13.579 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -29.045 -17.210 12.139 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -30.225 -18.524 12.182 1.00 0.00 H new ATOM 762 N VAL A 49 -22.806 -20.138 8.617 1.00 0.00 N ATOM 763 CA VAL A 49 -21.594 -20.899 8.201 1.00 0.00 C ATOM 764 C VAL A 49 -20.834 -20.106 7.136 1.00 0.00 C ATOM 765 O VAL A 49 -21.410 -19.609 6.189 1.00 0.00 O ATOM 766 CB VAL A 49 -22.015 -22.253 7.624 1.00 0.00 C ATOM 767 CG1 VAL A 49 -20.768 -23.070 7.280 1.00 0.00 C ATOM 768 CG2 VAL A 49 -22.851 -23.009 8.658 1.00 0.00 C ATOM 0 H VAL A 49 -23.427 -19.861 7.857 1.00 0.00 H new ATOM 0 HA VAL A 49 -20.950 -21.056 9.066 1.00 0.00 H new ATOM 0 HB VAL A 49 -22.607 -22.096 6.722 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -21.067 -24.034 6.869 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -20.172 -22.531 6.544 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -20.176 -23.228 8.182 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -23.151 -23.973 8.248 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -22.259 -23.166 9.560 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -23.739 -22.427 8.904 1.00 0.00 H new ATOM 778 N HIS A 50 -19.542 -19.987 7.283 1.00 0.00 N ATOM 779 CA HIS A 50 -18.745 -19.228 6.278 1.00 0.00 C ATOM 780 C HIS A 50 -18.112 -20.208 5.288 1.00 0.00 C ATOM 781 O HIS A 50 -17.742 -21.310 5.641 1.00 0.00 O ATOM 782 CB HIS A 50 -17.646 -18.440 6.990 1.00 0.00 C ATOM 783 CG HIS A 50 -18.269 -17.502 7.987 1.00 0.00 C ATOM 784 ND1 HIS A 50 -18.908 -16.333 7.602 1.00 0.00 N ATOM 785 CD2 HIS A 50 -18.358 -17.545 9.356 1.00 0.00 C ATOM 786 CE1 HIS A 50 -19.350 -15.726 8.719 1.00 0.00 C ATOM 787 NE2 HIS A 50 -19.041 -16.423 9.816 1.00 0.00 N ATOM 0 H HIS A 50 -19.005 -20.382 8.055 1.00 0.00 H new ATOM 0 HA HIS A 50 -19.396 -18.538 5.741 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -16.962 -19.123 7.495 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -17.058 -17.878 6.264 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -17.959 -18.330 9.981 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -19.889 -14.790 8.727 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -19.259 -16.184 10.783 1.00 0.00 H new ATOM 795 N LYS A 51 -17.986 -19.817 4.049 1.00 0.00 N ATOM 796 CA LYS A 51 -17.378 -20.731 3.041 1.00 0.00 C ATOM 797 C LYS A 51 -16.502 -19.925 2.080 1.00 0.00 C ATOM 798 O LYS A 51 -16.816 -18.806 1.726 1.00 0.00 O ATOM 799 CB LYS A 51 -18.488 -21.429 2.253 1.00 0.00 C ATOM 800 CG LYS A 51 -19.424 -22.155 3.221 1.00 0.00 C ATOM 801 CD LYS A 51 -20.347 -23.089 2.437 1.00 0.00 C ATOM 802 CE LYS A 51 -21.260 -22.261 1.529 1.00 0.00 C ATOM 803 NZ LYS A 51 -22.536 -21.968 2.241 1.00 0.00 N ATOM 0 H LYS A 51 -18.277 -18.907 3.692 1.00 0.00 H new ATOM 0 HA LYS A 51 -16.767 -21.476 3.550 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -19.048 -20.699 1.669 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -18.056 -22.139 1.547 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -18.843 -22.725 3.946 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -20.014 -21.432 3.784 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -19.757 -23.784 1.840 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -20.945 -23.687 3.124 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -20.766 -21.331 1.249 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -21.463 -22.805 0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.156 -21.405 1.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -23.009 -22.861 2.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -22.334 -21.433 3.110 1.00 0.00 H new ATOM 817 N ARG A 52 -15.405 -20.489 1.652 1.00 0.00 N ATOM 818 CA ARG A 52 -14.508 -19.760 0.712 1.00 0.00 C ATOM 819 C ARG A 52 -14.163 -20.674 -0.466 1.00 0.00 C ATOM 820 O ARG A 52 -14.164 -21.883 -0.346 1.00 0.00 O ATOM 821 CB ARG A 52 -13.225 -19.356 1.440 1.00 0.00 C ATOM 822 CG ARG A 52 -13.548 -18.291 2.489 1.00 0.00 C ATOM 823 CD ARG A 52 -12.246 -17.722 3.057 1.00 0.00 C ATOM 824 NE ARG A 52 -12.561 -16.752 4.143 1.00 0.00 N ATOM 825 CZ ARG A 52 -12.587 -15.473 3.889 1.00 0.00 C ATOM 826 NH1 ARG A 52 -12.696 -15.055 2.657 1.00 0.00 N ATOM 827 NH2 ARG A 52 -12.504 -14.610 4.865 1.00 0.00 N ATOM 0 H ARG A 52 -15.092 -21.424 1.913 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.011 -18.865 0.345 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -12.775 -20.227 1.917 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -12.496 -18.971 0.727 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.141 -17.493 2.042 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -14.148 -18.724 3.290 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.623 -18.528 3.444 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.677 -17.230 2.268 1.00 0.00 H new ATOM 0 HE ARG A 52 -12.756 -17.088 5.086 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.761 -15.729 1.894 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.716 -14.055 2.458 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.419 -14.936 5.828 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -12.524 -13.610 4.665 1.00 0.00 H new ATOM 841 N LEU A 53 -13.870 -20.108 -1.605 1.00 0.00 N ATOM 842 CA LEU A 53 -13.529 -20.948 -2.786 1.00 0.00 C ATOM 843 C LEU A 53 -12.161 -20.536 -3.333 1.00 0.00 C ATOM 844 O LEU A 53 -11.924 -19.383 -3.634 1.00 0.00 O ATOM 845 CB LEU A 53 -14.593 -20.757 -3.870 1.00 0.00 C ATOM 846 CG LEU A 53 -14.439 -21.841 -4.942 1.00 0.00 C ATOM 847 CD1 LEU A 53 -13.154 -21.595 -5.737 1.00 0.00 C ATOM 848 CD2 LEU A 53 -14.370 -23.215 -4.274 1.00 0.00 C ATOM 0 H LEU A 53 -13.852 -19.101 -1.768 1.00 0.00 H new ATOM 0 HA LEU A 53 -13.496 -21.996 -2.488 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -15.588 -20.807 -3.429 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -14.494 -19.770 -4.321 1.00 0.00 H new ATOM 0 HG LEU A 53 -15.295 -21.808 -5.616 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -13.045 -22.366 -6.499 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -13.204 -20.617 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -12.298 -21.627 -5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -14.260 -23.986 -5.037 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -13.515 -23.249 -3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -15.285 -23.391 -3.709 1.00 0.00 H new ATOM 860 N ILE A 54 -11.260 -21.471 -3.467 1.00 0.00 N ATOM 861 CA ILE A 54 -9.909 -21.134 -3.997 1.00 0.00 C ATOM 862 C ILE A 54 -9.733 -21.777 -5.375 1.00 0.00 C ATOM 863 O ILE A 54 -9.817 -22.979 -5.525 1.00 0.00 O ATOM 864 CB ILE A 54 -8.839 -21.668 -3.044 1.00 0.00 C ATOM 865 CG1 ILE A 54 -9.071 -21.098 -1.643 1.00 0.00 C ATOM 866 CG2 ILE A 54 -7.455 -21.248 -3.542 1.00 0.00 C ATOM 867 CD1 ILE A 54 -8.053 -21.696 -0.672 1.00 0.00 C ATOM 0 H ILE A 54 -11.402 -22.453 -3.232 1.00 0.00 H new ATOM 0 HA ILE A 54 -9.809 -20.052 -4.083 1.00 0.00 H new ATOM 0 HB ILE A 54 -8.897 -22.756 -3.008 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.977 -20.012 -1.661 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -10.084 -21.325 -1.310 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.693 -21.629 -2.862 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.288 -21.655 -4.539 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.397 -20.160 -3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.219 -21.289 0.326 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.168 -22.780 -0.646 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -7.045 -21.446 -1.002 1.00 0.00 H new ATOM 879 N ASP A 55 -9.490 -20.985 -6.383 1.00 0.00 N ATOM 880 CA ASP A 55 -9.313 -21.551 -7.750 1.00 0.00 C ATOM 881 C ASP A 55 -7.850 -21.951 -7.955 1.00 0.00 C ATOM 882 O ASP A 55 -6.944 -21.297 -7.475 1.00 0.00 O ATOM 883 CB ASP A 55 -9.704 -20.502 -8.792 1.00 0.00 C ATOM 884 CG ASP A 55 -11.198 -20.198 -8.674 1.00 0.00 C ATOM 885 OD1 ASP A 55 -11.892 -20.973 -8.036 1.00 0.00 O ATOM 886 OD2 ASP A 55 -11.624 -19.195 -9.222 1.00 0.00 O ATOM 0 H ASP A 55 -9.406 -19.970 -6.319 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.948 -22.430 -7.862 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.124 -19.591 -8.642 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -9.474 -20.865 -9.794 1.00 0.00 H new ATOM 891 N ILE A 56 -7.612 -23.020 -8.665 1.00 0.00 N ATOM 892 CA ILE A 56 -6.208 -23.460 -8.904 1.00 0.00 C ATOM 893 C ILE A 56 -5.937 -23.494 -10.410 1.00 0.00 C ATOM 894 O ILE A 56 -6.713 -24.028 -11.177 1.00 0.00 O ATOM 895 CB ILE A 56 -6.005 -24.859 -8.318 1.00 0.00 C ATOM 896 CG1 ILE A 56 -6.318 -24.836 -6.820 1.00 0.00 C ATOM 897 CG2 ILE A 56 -4.554 -25.294 -8.529 1.00 0.00 C ATOM 898 CD1 ILE A 56 -6.175 -26.248 -6.248 1.00 0.00 C ATOM 0 H ILE A 56 -8.329 -23.608 -9.090 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.521 -22.763 -8.425 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.672 -25.562 -8.817 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.641 -24.154 -6.306 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -7.330 -24.466 -6.655 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -4.409 -26.290 -8.112 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.331 -25.311 -9.596 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.887 -24.591 -8.030 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.398 -26.233 -5.181 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -6.870 -26.918 -6.754 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.155 -26.601 -6.401 1.00 0.00 H new ATOM 910 N ILE A 57 -4.844 -22.925 -10.839 1.00 0.00 N ATOM 911 CA ILE A 57 -4.529 -22.924 -12.296 1.00 0.00 C ATOM 912 C ILE A 57 -3.321 -23.826 -12.560 1.00 0.00 C ATOM 913 O ILE A 57 -2.361 -23.828 -11.816 1.00 0.00 O ATOM 914 CB ILE A 57 -4.210 -21.498 -12.748 1.00 0.00 C ATOM 915 CG1 ILE A 57 -5.376 -20.575 -12.391 1.00 0.00 C ATOM 916 CG2 ILE A 57 -3.989 -21.481 -14.262 1.00 0.00 C ATOM 917 CD1 ILE A 57 -5.006 -19.130 -12.731 1.00 0.00 C ATOM 0 H ILE A 57 -4.156 -22.461 -10.245 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.388 -23.298 -12.853 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.307 -21.151 -12.245 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.270 -20.872 -12.940 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.610 -20.662 -11.330 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.762 -20.465 -14.585 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -3.157 -22.137 -14.516 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -4.891 -21.828 -14.765 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.837 -18.472 -12.477 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -4.124 -18.837 -12.162 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -4.793 -19.050 -13.797 1.00 0.00 H new ATOM 929 N ASP A 58 -3.361 -24.589 -13.617 1.00 0.00 N ATOM 930 CA ASP A 58 -2.216 -25.490 -13.932 1.00 0.00 C ATOM 931 C ASP A 58 -1.800 -26.250 -12.672 1.00 0.00 C ATOM 932 O ASP A 58 -0.698 -26.102 -12.183 1.00 0.00 O ATOM 933 CB ASP A 58 -1.037 -24.655 -14.436 1.00 0.00 C ATOM 934 CG ASP A 58 -0.722 -25.040 -15.884 1.00 0.00 C ATOM 935 OD1 ASP A 58 -1.101 -26.128 -16.282 1.00 0.00 O ATOM 936 OD2 ASP A 58 -0.109 -24.238 -16.569 1.00 0.00 O ATOM 0 H ASP A 58 -4.138 -24.628 -14.277 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.515 -26.202 -14.701 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.277 -23.593 -14.374 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -0.163 -24.822 -13.806 1.00 0.00 H new ATOM 941 N PRO A 59 -2.707 -27.083 -12.140 1.00 0.00 N ATOM 942 CA PRO A 59 -2.442 -27.876 -10.934 1.00 0.00 C ATOM 943 C PRO A 59 -1.425 -28.989 -11.200 1.00 0.00 C ATOM 944 O PRO A 59 -1.409 -29.590 -12.256 1.00 0.00 O ATOM 945 CB PRO A 59 -3.804 -28.483 -10.598 1.00 0.00 C ATOM 946 CG PRO A 59 -4.532 -28.515 -11.900 1.00 0.00 C ATOM 947 CD PRO A 59 -4.061 -27.316 -12.673 1.00 0.00 C ATOM 0 HA PRO A 59 -2.020 -27.272 -10.131 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -3.700 -29.483 -10.177 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -4.336 -27.881 -9.861 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.319 -29.436 -12.442 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -5.610 -28.479 -11.744 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -4.044 -27.510 -13.746 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -4.710 -26.455 -12.515 1.00 0.00 H new ATOM 955 N SER A 60 -0.574 -29.270 -10.250 1.00 0.00 N ATOM 956 CA SER A 60 0.440 -30.342 -10.451 1.00 0.00 C ATOM 957 C SER A 60 0.265 -31.419 -9.377 1.00 0.00 C ATOM 958 O SER A 60 -0.452 -31.235 -8.413 1.00 0.00 O ATOM 959 CB SER A 60 1.845 -29.742 -10.350 1.00 0.00 C ATOM 960 OG SER A 60 2.377 -29.993 -9.058 1.00 0.00 O ATOM 0 H SER A 60 -0.538 -28.803 -9.344 1.00 0.00 H new ATOM 0 HA SER A 60 0.306 -30.788 -11.437 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.493 -30.176 -11.112 1.00 0.00 H new ATOM 0 HB3 SER A 60 1.808 -28.669 -10.537 1.00 0.00 H new ATOM 0 HG SER A 60 3.277 -29.610 -8.995 1.00 0.00 H new ATOM 966 N PRO A 61 0.937 -32.565 -9.554 1.00 0.00 N ATOM 967 CA PRO A 61 0.861 -33.683 -8.604 1.00 0.00 C ATOM 968 C PRO A 61 1.525 -33.341 -7.268 1.00 0.00 C ATOM 969 O PRO A 61 1.204 -33.905 -6.241 1.00 0.00 O ATOM 970 CB PRO A 61 1.634 -34.800 -9.306 1.00 0.00 C ATOM 971 CG PRO A 61 2.561 -34.089 -10.231 1.00 0.00 C ATOM 972 CD PRO A 61 1.827 -32.861 -10.689 1.00 0.00 C ATOM 0 HA PRO A 61 -0.169 -33.947 -8.362 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.181 -35.414 -8.591 1.00 0.00 H new ATOM 0 HB3 PRO A 61 0.964 -35.465 -9.850 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.489 -33.823 -9.725 1.00 0.00 H new ATOM 0 HG3 PRO A 61 2.829 -34.722 -11.077 1.00 0.00 H new ATOM 0 HD2 PRO A 61 2.509 -32.036 -10.893 1.00 0.00 H new ATOM 0 HD3 PRO A 61 1.266 -33.044 -11.605 1.00 0.00 H new ATOM 980 N LYS A 62 2.446 -32.416 -7.273 1.00 0.00 N ATOM 981 CA LYS A 62 3.124 -32.037 -6.001 1.00 0.00 C ATOM 982 C LYS A 62 2.123 -31.329 -5.087 1.00 0.00 C ATOM 983 O LYS A 62 2.293 -31.279 -3.884 1.00 0.00 O ATOM 984 CB LYS A 62 4.293 -31.097 -6.306 1.00 0.00 C ATOM 985 CG LYS A 62 5.345 -31.844 -7.127 1.00 0.00 C ATOM 986 CD LYS A 62 6.562 -30.942 -7.342 1.00 0.00 C ATOM 987 CE LYS A 62 7.571 -31.653 -8.244 1.00 0.00 C ATOM 988 NZ LYS A 62 8.937 -31.116 -7.982 1.00 0.00 N ATOM 0 H LYS A 62 2.758 -31.908 -8.101 1.00 0.00 H new ATOM 0 HA LYS A 62 3.500 -32.932 -5.506 1.00 0.00 H new ATOM 0 HB2 LYS A 62 3.939 -30.225 -6.856 1.00 0.00 H new ATOM 0 HB3 LYS A 62 4.732 -30.732 -5.378 1.00 0.00 H new ATOM 0 HG2 LYS A 62 5.643 -32.757 -6.611 1.00 0.00 H new ATOM 0 HG3 LYS A 62 4.926 -32.143 -8.088 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.254 -30.000 -7.795 1.00 0.00 H new ATOM 0 HD3 LYS A 62 7.022 -30.700 -6.384 1.00 0.00 H new ATOM 0 HE2 LYS A 62 7.549 -32.727 -8.057 1.00 0.00 H new ATOM 0 HE3 LYS A 62 7.306 -31.506 -9.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 9.624 -31.599 -8.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 8.953 -30.095 -8.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 9.189 -31.278 -6.986 1.00 0.00 H new ATOM 1002 N THR A 63 1.077 -30.786 -5.647 1.00 0.00 N ATOM 1003 CA THR A 63 0.063 -30.086 -4.809 1.00 0.00 C ATOM 1004 C THR A 63 -0.752 -31.120 -4.032 1.00 0.00 C ATOM 1005 O THR A 63 -1.061 -30.938 -2.871 1.00 0.00 O ATOM 1006 CB THR A 63 -0.869 -29.270 -5.709 1.00 0.00 C ATOM 1007 OG1 THR A 63 -0.099 -28.376 -6.500 1.00 0.00 O ATOM 1008 CG2 THR A 63 -1.849 -28.476 -4.845 1.00 0.00 C ATOM 0 H THR A 63 0.881 -30.797 -6.648 1.00 0.00 H new ATOM 0 HA THR A 63 0.566 -29.418 -4.110 1.00 0.00 H new ATOM 0 HB THR A 63 -1.426 -29.943 -6.361 1.00 0.00 H new ATOM 0 HG1 THR A 63 -0.695 -27.854 -7.077 1.00 0.00 H new ATOM 0 HG21 THR A 63 -2.512 -27.895 -5.487 1.00 0.00 H new ATOM 0 HG22 THR A 63 -2.440 -29.163 -4.240 1.00 0.00 H new ATOM 0 HG23 THR A 63 -1.295 -27.802 -4.192 1.00 0.00 H new ATOM 1016 N ILE A 64 -1.103 -32.208 -4.665 1.00 0.00 N ATOM 1017 CA ILE A 64 -1.895 -33.255 -3.962 1.00 0.00 C ATOM 1018 C ILE A 64 -1.041 -33.882 -2.859 1.00 0.00 C ATOM 1019 O ILE A 64 -1.508 -34.138 -1.767 1.00 0.00 O ATOM 1020 CB ILE A 64 -2.311 -34.336 -4.961 1.00 0.00 C ATOM 1021 CG1 ILE A 64 -3.142 -33.705 -6.081 1.00 0.00 C ATOM 1022 CG2 ILE A 64 -3.145 -35.399 -4.244 1.00 0.00 C ATOM 1023 CD1 ILE A 64 -3.414 -34.750 -7.165 1.00 0.00 C ATOM 0 H ILE A 64 -0.875 -32.415 -5.637 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.785 -32.805 -3.522 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.421 -34.799 -5.387 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -4.083 -33.327 -5.681 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.611 -32.853 -6.507 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.442 -36.170 -4.955 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.553 -35.849 -3.447 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -4.035 -34.937 -3.818 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.006 -34.301 -7.963 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.468 -35.107 -7.572 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.962 -35.587 -6.734 1.00 0.00 H new ATOM 1035 N ASP A 65 0.211 -34.129 -3.135 1.00 0.00 N ATOM 1036 CA ASP A 65 1.096 -34.737 -2.103 1.00 0.00 C ATOM 1037 C ASP A 65 1.174 -33.810 -0.889 1.00 0.00 C ATOM 1038 O ASP A 65 1.162 -34.250 0.243 1.00 0.00 O ATOM 1039 CB ASP A 65 2.497 -34.935 -2.684 1.00 0.00 C ATOM 1040 CG ASP A 65 3.361 -35.706 -1.684 1.00 0.00 C ATOM 1041 OD1 ASP A 65 3.305 -36.924 -1.699 1.00 0.00 O ATOM 1042 OD2 ASP A 65 4.064 -35.064 -0.921 1.00 0.00 O ATOM 0 H ASP A 65 0.658 -33.936 -4.031 1.00 0.00 H new ATOM 0 HA ASP A 65 0.690 -35.702 -1.799 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.438 -35.481 -3.626 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.951 -33.969 -2.903 1.00 0.00 H new ATOM 1047 N ALA A 66 1.252 -32.527 -1.115 1.00 0.00 N ATOM 1048 CA ALA A 66 1.330 -31.572 0.027 1.00 0.00 C ATOM 1049 C ALA A 66 0.022 -31.619 0.819 1.00 0.00 C ATOM 1050 O ALA A 66 0.019 -31.571 2.033 1.00 0.00 O ATOM 1051 CB ALA A 66 1.553 -30.156 -0.506 1.00 0.00 C ATOM 0 H ALA A 66 1.265 -32.099 -2.041 1.00 0.00 H new ATOM 0 HA ALA A 66 2.160 -31.849 0.677 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.610 -29.458 0.329 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.484 -30.122 -1.071 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.724 -29.877 -1.156 1.00 0.00 H new ATOM 1057 N LEU A 67 -1.089 -31.713 0.142 1.00 0.00 N ATOM 1058 CA LEU A 67 -2.396 -31.765 0.857 1.00 0.00 C ATOM 1059 C LEU A 67 -2.453 -33.027 1.719 1.00 0.00 C ATOM 1060 O LEU A 67 -2.966 -33.017 2.820 1.00 0.00 O ATOM 1061 CB LEU A 67 -3.535 -31.792 -0.163 1.00 0.00 C ATOM 1062 CG LEU A 67 -4.876 -31.727 0.569 1.00 0.00 C ATOM 1063 CD1 LEU A 67 -4.865 -30.552 1.549 1.00 0.00 C ATOM 1064 CD2 LEU A 67 -6.003 -31.532 -0.447 1.00 0.00 C ATOM 0 H LEU A 67 -1.149 -31.756 -0.875 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.499 -30.885 1.492 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.442 -30.951 -0.850 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.479 -32.701 -0.762 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.037 -32.656 1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.821 -30.505 2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.062 -30.690 2.273 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.705 -29.623 1.002 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.959 -31.486 0.075 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.843 -30.603 -0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -6.011 -32.368 -1.146 1.00 0.00 H new ATOM 1076 N MET A 68 -1.930 -34.117 1.226 1.00 0.00 N ATOM 1077 CA MET A 68 -1.954 -35.380 2.017 1.00 0.00 C ATOM 1078 C MET A 68 -1.007 -35.252 3.212 1.00 0.00 C ATOM 1079 O MET A 68 -1.256 -35.790 4.273 1.00 0.00 O ATOM 1080 CB MET A 68 -1.502 -36.544 1.132 1.00 0.00 C ATOM 1081 CG MET A 68 -2.601 -36.869 0.118 1.00 0.00 C ATOM 1082 SD MET A 68 -2.136 -38.345 -0.823 1.00 0.00 S ATOM 1083 CE MET A 68 -0.595 -37.697 -1.515 1.00 0.00 C ATOM 0 H MET A 68 -1.487 -34.187 0.310 1.00 0.00 H new ATOM 0 HA MET A 68 -2.967 -35.566 2.374 1.00 0.00 H new ATOM 0 HB2 MET A 68 -0.579 -36.284 0.614 1.00 0.00 H new ATOM 0 HB3 MET A 68 -1.287 -37.419 1.745 1.00 0.00 H new ATOM 0 HG2 MET A 68 -3.548 -37.036 0.632 1.00 0.00 H new ATOM 0 HG3 MET A 68 -2.749 -36.026 -0.557 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.306 -38.293 -2.381 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.740 -36.661 -1.820 1.00 0.00 H new ATOM 0 HE3 MET A 68 0.191 -37.747 -0.762 1.00 0.00 H new ATOM 1093 N ARG A 69 0.076 -34.543 3.049 1.00 0.00 N ATOM 1094 CA ARG A 69 1.037 -34.383 4.177 1.00 0.00 C ATOM 1095 C ARG A 69 0.443 -33.434 5.221 1.00 0.00 C ATOM 1096 O ARG A 69 0.755 -33.511 6.392 1.00 0.00 O ATOM 1097 CB ARG A 69 2.351 -33.803 3.650 1.00 0.00 C ATOM 1098 CG ARG A 69 3.005 -34.807 2.698 1.00 0.00 C ATOM 1099 CD ARG A 69 4.349 -34.254 2.218 1.00 0.00 C ATOM 1100 NE ARG A 69 5.302 -34.203 3.362 1.00 0.00 N ATOM 1101 CZ ARG A 69 6.582 -34.353 3.153 1.00 0.00 C ATOM 1102 NH1 ARG A 69 7.089 -34.073 1.983 1.00 0.00 N ATOM 1103 NH2 ARG A 69 7.355 -34.780 4.114 1.00 0.00 N ATOM 0 H ARG A 69 0.337 -34.068 2.185 1.00 0.00 H new ATOM 0 HA ARG A 69 1.226 -35.354 4.634 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.164 -32.863 3.132 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.022 -33.582 4.480 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.152 -35.761 3.204 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.352 -34.995 1.846 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.751 -34.883 1.424 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.215 -33.257 1.798 1.00 0.00 H new ATOM 0 HE ARG A 69 4.954 -34.051 4.309 1.00 0.00 H new ATOM 0 HH11 ARG A 69 6.485 -33.737 1.233 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.089 -34.190 1.819 1.00 0.00 H new ATOM 0 HH21 ARG A 69 6.959 -34.997 5.029 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.355 -34.897 3.950 1.00 0.00 H new ATOM 1117 N ILE A 70 -0.411 -32.539 4.805 1.00 0.00 N ATOM 1118 CA ILE A 70 -1.023 -31.587 5.774 1.00 0.00 C ATOM 1119 C ILE A 70 -2.489 -31.966 6.005 1.00 0.00 C ATOM 1120 O ILE A 70 -3.224 -32.233 5.074 1.00 0.00 O ATOM 1121 CB ILE A 70 -0.946 -30.167 5.212 1.00 0.00 C ATOM 1122 CG1 ILE A 70 0.511 -29.818 4.905 1.00 0.00 C ATOM 1123 CG2 ILE A 70 -1.502 -29.180 6.240 1.00 0.00 C ATOM 1124 CD1 ILE A 70 0.573 -28.460 4.203 1.00 0.00 C ATOM 0 H ILE A 70 -0.711 -32.426 3.837 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.482 -31.633 6.719 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.534 -30.107 4.296 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.091 -29.790 5.827 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.955 -30.587 4.273 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.447 -28.168 5.839 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.541 -29.428 6.458 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.915 -29.240 7.156 1.00 0.00 H new ATOM 0 HD11 ILE A 70 1.611 -28.211 3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 70 0.007 -28.505 3.273 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.145 -27.695 4.851 1.00 0.00 H new ATOM 1136 N ASN A 71 -2.918 -31.992 7.237 1.00 0.00 N ATOM 1137 CA ASN A 71 -4.334 -32.354 7.524 1.00 0.00 C ATOM 1138 C ASN A 71 -5.096 -31.108 7.978 1.00 0.00 C ATOM 1139 O ASN A 71 -4.694 -30.422 8.897 1.00 0.00 O ATOM 1140 CB ASN A 71 -4.376 -33.409 8.631 1.00 0.00 C ATOM 1141 CG ASN A 71 -5.795 -33.968 8.750 1.00 0.00 C ATOM 1142 OD1 ASN A 71 -6.356 -34.444 7.783 1.00 0.00 O ATOM 1143 ND2 ASN A 71 -6.403 -33.931 9.904 1.00 0.00 N ATOM 0 H ASN A 71 -2.349 -31.778 8.056 1.00 0.00 H new ATOM 0 HA ASN A 71 -4.797 -32.755 6.622 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -3.675 -34.213 8.408 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -4.066 -32.969 9.579 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -7.349 -34.302 9.994 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -5.932 -33.531 10.716 1.00 0.00 H new ATOM 1150 N LEU A 72 -6.196 -30.810 7.342 1.00 0.00 N ATOM 1151 CA LEU A 72 -6.984 -29.609 7.738 1.00 0.00 C ATOM 1152 C LEU A 72 -7.340 -29.699 9.223 1.00 0.00 C ATOM 1153 O LEU A 72 -7.581 -30.768 9.749 1.00 0.00 O ATOM 1154 CB LEU A 72 -8.268 -29.544 6.908 1.00 0.00 C ATOM 1155 CG LEU A 72 -8.892 -30.939 6.826 1.00 0.00 C ATOM 1156 CD1 LEU A 72 -10.369 -30.859 7.217 1.00 0.00 C ATOM 1157 CD2 LEU A 72 -8.771 -31.468 5.396 1.00 0.00 C ATOM 0 H LEU A 72 -6.583 -31.346 6.565 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.391 -28.711 7.561 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.971 -28.845 7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -8.049 -29.172 5.907 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.371 -31.612 7.507 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -10.815 -31.852 7.159 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -10.456 -30.481 8.236 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -10.890 -30.187 6.535 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -9.215 -32.462 5.337 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -9.292 -30.796 4.714 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.719 -31.524 5.116 1.00 0.00 H new ATOM 1169 N PRO A 73 -7.373 -28.548 9.909 1.00 0.00 N ATOM 1170 CA PRO A 73 -7.699 -28.486 11.339 1.00 0.00 C ATOM 1171 C PRO A 73 -9.177 -28.795 11.599 1.00 0.00 C ATOM 1172 O PRO A 73 -10.028 -28.544 10.769 1.00 0.00 O ATOM 1173 CB PRO A 73 -7.396 -27.036 11.714 1.00 0.00 C ATOM 1174 CG PRO A 73 -7.533 -26.281 10.436 1.00 0.00 C ATOM 1175 CD PRO A 73 -7.094 -27.216 9.344 1.00 0.00 C ATOM 0 HA PRO A 73 -7.135 -29.217 11.918 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -8.091 -26.668 12.468 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.393 -26.935 12.129 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.563 -25.960 10.282 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.918 -25.381 10.448 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.648 -27.046 8.421 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -6.037 -27.092 9.108 1.00 0.00 H new ATOM 1183 N ALA A 74 -9.487 -29.337 12.744 1.00 0.00 N ATOM 1184 CA ALA A 74 -10.907 -29.661 13.055 1.00 0.00 C ATOM 1185 C ALA A 74 -11.763 -28.402 12.903 1.00 0.00 C ATOM 1186 O ALA A 74 -11.309 -27.300 13.138 1.00 0.00 O ATOM 1187 CB ALA A 74 -11.010 -30.178 14.492 1.00 0.00 C ATOM 0 H ALA A 74 -8.818 -29.570 13.478 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.263 -30.428 12.367 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.049 -30.415 14.720 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.401 -31.075 14.600 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.653 -29.412 15.181 1.00 0.00 H new ATOM 1193 N GLY A 75 -12.998 -28.555 12.512 1.00 0.00 N ATOM 1194 CA GLY A 75 -13.881 -27.366 12.345 1.00 0.00 C ATOM 1195 C GLY A 75 -13.824 -26.886 10.893 1.00 0.00 C ATOM 1196 O GLY A 75 -14.392 -25.870 10.543 1.00 0.00 O ATOM 0 H GLY A 75 -13.434 -29.452 12.301 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -14.906 -27.621 12.615 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -13.564 -26.567 13.016 1.00 0.00 H new ATOM 1200 N VAL A 76 -13.142 -27.606 10.043 1.00 0.00 N ATOM 1201 CA VAL A 76 -13.051 -27.188 8.616 1.00 0.00 C ATOM 1202 C VAL A 76 -13.475 -28.350 7.717 1.00 0.00 C ATOM 1203 O VAL A 76 -13.280 -29.505 8.045 1.00 0.00 O ATOM 1204 CB VAL A 76 -11.610 -26.791 8.293 1.00 0.00 C ATOM 1205 CG1 VAL A 76 -11.539 -26.241 6.867 1.00 0.00 C ATOM 1206 CG2 VAL A 76 -11.142 -25.716 9.277 1.00 0.00 C ATOM 0 H VAL A 76 -12.644 -28.465 10.276 1.00 0.00 H new ATOM 0 HA VAL A 76 -13.709 -26.337 8.443 1.00 0.00 H new ATOM 0 HB VAL A 76 -10.966 -27.666 8.378 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -10.512 -25.958 6.637 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -11.871 -27.006 6.165 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -12.184 -25.366 6.782 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.115 -25.434 9.046 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -11.786 -24.841 9.193 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.191 -26.107 10.293 1.00 0.00 H new ATOM 1216 N ASP A 77 -14.053 -28.057 6.585 1.00 0.00 N ATOM 1217 CA ASP A 77 -14.489 -29.147 5.667 1.00 0.00 C ATOM 1218 C ASP A 77 -14.113 -28.785 4.229 1.00 0.00 C ATOM 1219 O ASP A 77 -13.942 -27.629 3.894 1.00 0.00 O ATOM 1220 CB ASP A 77 -16.005 -29.324 5.769 1.00 0.00 C ATOM 1221 CG ASP A 77 -16.441 -30.504 4.900 1.00 0.00 C ATOM 1222 OD1 ASP A 77 -15.579 -31.268 4.498 1.00 0.00 O ATOM 1223 OD2 ASP A 77 -17.629 -30.625 4.651 1.00 0.00 O ATOM 0 H ASP A 77 -14.242 -27.110 6.256 1.00 0.00 H new ATOM 0 HA ASP A 77 -13.995 -30.077 5.948 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -16.293 -29.497 6.806 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -16.511 -28.414 5.445 1.00 0.00 H new ATOM 1228 N VAL A 78 -13.984 -29.763 3.375 1.00 0.00 N ATOM 1229 CA VAL A 78 -13.620 -29.473 1.959 1.00 0.00 C ATOM 1230 C VAL A 78 -14.512 -30.293 1.026 1.00 0.00 C ATOM 1231 O VAL A 78 -14.930 -31.386 1.353 1.00 0.00 O ATOM 1232 CB VAL A 78 -12.155 -29.846 1.722 1.00 0.00 C ATOM 1233 CG1 VAL A 78 -11.266 -29.055 2.685 1.00 0.00 C ATOM 1234 CG2 VAL A 78 -11.963 -31.344 1.965 1.00 0.00 C ATOM 0 H VAL A 78 -14.115 -30.750 3.596 1.00 0.00 H new ATOM 0 HA VAL A 78 -13.762 -28.411 1.757 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.881 -29.607 0.694 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.222 -29.320 2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.402 -27.987 2.512 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.540 -29.294 3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -10.919 -31.609 1.796 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.237 -31.584 2.992 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -12.596 -31.908 1.280 1.00 0.00 H new ATOM 1244 N GLU A 79 -14.808 -29.774 -0.135 1.00 0.00 N ATOM 1245 CA GLU A 79 -15.674 -30.524 -1.087 1.00 0.00 C ATOM 1246 C GLU A 79 -14.848 -30.945 -2.305 1.00 0.00 C ATOM 1247 O GLU A 79 -14.136 -30.151 -2.888 1.00 0.00 O ATOM 1248 CB GLU A 79 -16.830 -29.629 -1.540 1.00 0.00 C ATOM 1249 CG GLU A 79 -17.812 -30.449 -2.379 1.00 0.00 C ATOM 1250 CD GLU A 79 -18.926 -29.536 -2.896 1.00 0.00 C ATOM 1251 OE1 GLU A 79 -18.874 -28.351 -2.611 1.00 0.00 O ATOM 1252 OE2 GLU A 79 -19.812 -30.039 -3.567 1.00 0.00 O ATOM 0 H GLU A 79 -14.487 -28.863 -0.464 1.00 0.00 H new ATOM 0 HA GLU A 79 -16.073 -31.410 -0.594 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -17.339 -29.208 -0.673 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -16.448 -28.791 -2.123 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -17.291 -30.915 -3.216 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -18.236 -31.254 -1.779 1.00 0.00 H new ATOM 1259 N ILE A 80 -14.939 -32.187 -2.693 1.00 0.00 N ATOM 1260 CA ILE A 80 -14.159 -32.657 -3.873 1.00 0.00 C ATOM 1261 C ILE A 80 -15.094 -33.371 -4.851 1.00 0.00 C ATOM 1262 O ILE A 80 -15.935 -34.155 -4.460 1.00 0.00 O ATOM 1263 CB ILE A 80 -13.069 -33.626 -3.410 1.00 0.00 C ATOM 1264 CG1 ILE A 80 -12.165 -33.981 -4.593 1.00 0.00 C ATOM 1265 CG2 ILE A 80 -13.718 -34.899 -2.863 1.00 0.00 C ATOM 1266 CD1 ILE A 80 -11.351 -32.752 -4.999 1.00 0.00 C ATOM 0 H ILE A 80 -15.519 -32.896 -2.245 1.00 0.00 H new ATOM 0 HA ILE A 80 -13.699 -31.802 -4.369 1.00 0.00 H new ATOM 0 HB ILE A 80 -12.474 -33.156 -2.627 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -11.498 -34.799 -4.322 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -12.767 -34.326 -5.434 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -12.942 -35.590 -2.533 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -14.361 -34.646 -2.020 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -14.313 -35.369 -3.646 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -10.707 -33.004 -5.841 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -12.027 -31.947 -5.287 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.738 -32.428 -4.158 1.00 0.00 H new ATOM 1278 N LYS A 81 -14.953 -33.106 -6.121 1.00 0.00 N ATOM 1279 CA LYS A 81 -15.834 -33.769 -7.123 1.00 0.00 C ATOM 1280 C LYS A 81 -17.272 -33.275 -6.945 1.00 0.00 C ATOM 1281 O LYS A 81 -18.210 -34.047 -6.967 1.00 0.00 O ATOM 1282 CB LYS A 81 -15.786 -35.285 -6.919 1.00 0.00 C ATOM 1283 CG LYS A 81 -16.470 -35.980 -8.098 1.00 0.00 C ATOM 1284 CD LYS A 81 -16.540 -37.485 -7.833 1.00 0.00 C ATOM 1285 CE LYS A 81 -17.193 -38.184 -9.028 1.00 0.00 C ATOM 1286 NZ LYS A 81 -18.001 -39.340 -8.547 1.00 0.00 N ATOM 0 H LYS A 81 -14.266 -32.459 -6.508 1.00 0.00 H new ATOM 0 HA LYS A 81 -15.489 -33.526 -8.128 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -14.752 -35.619 -6.836 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -16.283 -35.553 -5.987 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -17.473 -35.578 -8.239 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -15.918 -35.787 -9.018 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -15.539 -37.883 -7.668 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -17.114 -37.679 -6.927 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -17.828 -37.483 -9.570 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -16.428 -38.526 -9.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -18.445 -39.815 -9.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -17.383 -40.012 -8.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -18.740 -39.001 -7.898 1.00 0.00 H new ATOM 1300 N LEU A 82 -17.452 -31.995 -6.767 1.00 0.00 N ATOM 1301 CA LEU A 82 -18.828 -31.454 -6.588 1.00 0.00 C ATOM 1302 C LEU A 82 -19.443 -32.035 -5.313 1.00 0.00 C ATOM 1303 O LEU A 82 -20.643 -32.259 -5.306 1.00 0.00 O ATOM 1304 CB LEU A 82 -19.690 -31.841 -7.791 1.00 0.00 C ATOM 1305 CG LEU A 82 -19.036 -31.322 -9.074 1.00 0.00 C ATOM 1306 CD1 LEU A 82 -19.976 -31.564 -10.258 1.00 0.00 C ATOM 1307 CD2 LEU A 82 -18.762 -29.823 -8.938 1.00 0.00 C ATOM 1308 OXT LEU A 82 -18.704 -32.246 -4.365 1.00 0.00 O ATOM 0 H LEU A 82 -16.705 -31.301 -6.738 1.00 0.00 H new ATOM 0 HA LEU A 82 -18.783 -30.368 -6.508 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -19.801 -32.924 -7.839 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -20.691 -31.422 -7.685 1.00 0.00 H new ATOM 0 HG LEU A 82 -18.096 -31.848 -9.242 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -19.512 -31.195 -11.173 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -20.171 -32.632 -10.355 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -20.916 -31.038 -10.090 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -18.296 -29.454 -9.852 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -19.701 -29.295 -8.770 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -18.093 -29.650 -8.095 1.00 0.00 H new TER 1320 LEU A 82