USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 980 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 7 THR OG1 : rot 127:sc= 2.15 USER MOD Set 1.2: A 9 THR OG1 : rot 180:sc= 0.887 USER MOD Single : A 1 MET CE :methyl -172:sc= -0.176 (180deg=-0.275) USER MOD Single : A 1 MET N :NH3+ 173:sc= 0.901 (180deg=0.863) USER MOD Single : A 2 GLN : amide:sc= -0.0604 X(o=-0.06,f=0.007) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00851 USER MOD Single : A 25 ASN : amide:sc= -2.12! C(o=-2.1!,f=-2.3!) USER MOD Single : A 27 LYS NZ :NH3+ -124:sc= 0.775 (180deg=0.176) USER MOD Single : A 29 LYS NZ :NH3+ 153:sc= 2.41 (180deg=1.62) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 33 LYS NZ :NH3+ -164:sc= 0.933 (180deg=0.764) USER MOD Single : A 40 GLN : amide:sc= -0.454 K(o=-0.45,f=-6.4!) USER MOD Single : A 41 GLN : amide:sc= 1.22 K(o=1.2,f=-5.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= -0.14 USER MOD Single : A 59 TYR OH : rot 60:sc= -0.0907 USER MOD Single : A 60 ASN : amide:sc= -0.0529 X(o=-0.053,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.539 K(o=0.54,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 55:sc= 1.13 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.073 X(o=-0.073,f=-0.57) USER MOD Single : B -1 MET CE :methyl -178:sc= 0 (180deg=-0.00638) USER MOD Single : B -2 HIS : no HD1:sc= -0.102 K(o=-0.1,f=-1.8!) USER MOD Single : B -3 GLY N :NH3+ -131:sc= 0.0425 (180deg=0) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0 USER MOD Single : B 686 GLN : amide:sc= 0.0319 X(o=0.032,f=0) USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.229 X(o=-0.23,f=-0.2) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -89:sc= 0.509 USER MOD Single : B 708 SER OG : rot 180:sc= 0 USER MOD Single : B 711 HIS : no HD1:sc= -0.0194 X(o=-0.019,f=-0.019) USER MOD Single : B 714 HIS : no HD1:sc= -0.0661 K(o=-0.066,f=-1.3) USER MOD Single : B 715 LYS NZ :NH3+ 158:sc= 3.69 (180deg=2.71) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.537 1.577 0.374 1.00 0.00 N ATOM 2 CA MET A 1 2.352 1.517 -0.888 1.00 0.00 C ATOM 3 C MET A 1 2.060 2.722 -1.787 1.00 0.00 C ATOM 4 O MET A 1 1.114 3.444 -1.518 1.00 0.00 O ATOM 5 CB MET A 1 2.169 0.188 -1.677 1.00 0.00 C ATOM 6 CG MET A 1 0.804 -0.042 -2.354 1.00 0.00 C ATOM 7 SD MET A 1 0.642 -1.684 -3.100 1.00 0.00 S ATOM 8 CE MET A 1 -0.578 -1.397 -4.416 1.00 0.00 C ATOM 0 H1 MET A 1 1.662 0.695 0.910 1.00 0.00 H new ATOM 0 H2 MET A 1 1.852 2.382 0.953 1.00 0.00 H new ATOM 0 H3 MET A 1 0.532 1.696 0.133 1.00 0.00 H new ATOM 0 HA MET A 1 3.396 1.550 -0.576 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.940 0.142 -2.446 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.351 -0.640 -0.992 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.013 0.094 -1.617 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.656 0.715 -3.124 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.871 -2.351 -4.855 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.456 -0.906 -3.997 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.140 -0.762 -5.186 1.00 0.00 H new ATOM 20 N GLN A 2 2.761 2.904 -2.912 1.00 0.00 N ATOM 21 CA GLN A 2 2.437 3.946 -3.894 1.00 0.00 C ATOM 22 C GLN A 2 2.383 3.371 -5.288 1.00 0.00 C ATOM 23 O GLN A 2 3.046 2.366 -5.544 1.00 0.00 O ATOM 24 CB GLN A 2 3.414 5.138 -3.786 1.00 0.00 C ATOM 25 CG GLN A 2 4.711 5.100 -4.617 1.00 0.00 C ATOM 26 CD GLN A 2 5.741 4.183 -3.982 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.625 4.590 -3.235 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.579 2.904 -4.250 1.00 0.00 N ATOM 0 H GLN A 2 3.568 2.334 -3.167 1.00 0.00 H new ATOM 0 HA GLN A 2 1.444 4.334 -3.669 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.869 6.040 -4.063 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.694 5.244 -2.738 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.489 4.758 -5.628 1.00 0.00 H new ATOM 0 HG3 GLN A 2 5.120 6.106 -4.704 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.832 2.605 -4.877 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.201 2.212 -3.831 1.00 0.00 H new ATOM 37 N ILE A 3 1.688 4.051 -6.192 1.00 0.00 N ATOM 38 CA ILE A 3 1.616 3.681 -7.604 1.00 0.00 C ATOM 39 C ILE A 3 1.725 4.947 -8.435 1.00 0.00 C ATOM 40 O ILE A 3 1.428 6.034 -7.946 1.00 0.00 O ATOM 41 CB ILE A 3 0.320 2.901 -7.890 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.913 3.654 -7.341 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.443 1.480 -7.304 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.179 3.370 -8.137 1.00 0.00 C ATOM 0 H ILE A 3 1.150 4.887 -5.964 1.00 0.00 H new ATOM 0 HA ILE A 3 2.439 3.018 -7.870 1.00 0.00 H new ATOM 0 HB ILE A 3 0.175 2.816 -8.967 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.072 3.371 -6.300 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.714 4.726 -7.353 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.473 0.923 -7.504 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.287 0.968 -7.766 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.602 1.543 -6.227 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.012 3.925 -7.706 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.034 3.678 -9.173 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.398 2.303 -8.103 1.00 0.00 H new ATOM 56 N PHE A 4 2.159 4.790 -9.672 1.00 0.00 N ATOM 57 CA PHE A 4 2.529 5.864 -10.575 1.00 0.00 C ATOM 58 C PHE A 4 1.498 5.930 -11.685 1.00 0.00 C ATOM 59 O PHE A 4 1.530 5.163 -12.636 1.00 0.00 O ATOM 60 CB PHE A 4 3.941 5.605 -11.128 1.00 0.00 C ATOM 61 CG PHE A 4 4.949 5.025 -10.160 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.223 5.710 -8.971 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.634 3.832 -10.445 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.148 5.203 -8.050 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.616 3.367 -9.558 1.00 0.00 C ATOM 66 CZ PHE A 4 6.873 4.046 -8.359 1.00 0.00 C ATOM 0 H PHE A 4 2.268 3.868 -10.094 1.00 0.00 H new ATOM 0 HA PHE A 4 2.548 6.822 -10.055 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.856 4.928 -11.978 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.336 6.547 -11.509 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.715 6.640 -8.761 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.406 3.276 -11.342 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.301 5.703 -7.105 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.179 2.478 -9.801 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.626 3.679 -7.677 1.00 0.00 H new ATOM 76 N VAL A 5 0.530 6.815 -11.575 1.00 0.00 N ATOM 77 CA VAL A 5 -0.484 6.955 -12.615 1.00 0.00 C ATOM 78 C VAL A 5 0.087 7.930 -13.628 1.00 0.00 C ATOM 79 O VAL A 5 0.203 9.120 -13.363 1.00 0.00 O ATOM 80 CB VAL A 5 -1.832 7.379 -12.014 1.00 0.00 C ATOM 81 CG1 VAL A 5 -2.915 7.447 -13.108 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.250 6.392 -10.918 1.00 0.00 C ATOM 0 H VAL A 5 0.418 7.448 -10.783 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.706 6.012 -13.115 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.721 8.371 -11.576 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.863 7.749 -12.663 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.622 8.174 -13.866 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.027 6.466 -13.570 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.207 6.700 -10.497 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.346 5.394 -11.345 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.495 6.380 -10.132 1.00 0.00 H new ATOM 92 N LYS A 6 0.508 7.433 -14.784 1.00 0.00 N ATOM 93 CA LYS A 6 0.963 8.280 -15.870 1.00 0.00 C ATOM 94 C LYS A 6 -0.272 8.896 -16.492 1.00 0.00 C ATOM 95 O LYS A 6 -1.211 8.175 -16.839 1.00 0.00 O ATOM 96 CB LYS A 6 1.758 7.416 -16.861 1.00 0.00 C ATOM 97 CG LYS A 6 2.670 8.302 -17.721 1.00 0.00 C ATOM 98 CD LYS A 6 3.326 7.527 -18.877 1.00 0.00 C ATOM 99 CE LYS A 6 4.397 8.303 -19.673 1.00 0.00 C ATOM 100 NZ LYS A 6 5.619 8.622 -18.867 1.00 0.00 N ATOM 0 H LYS A 6 0.542 6.435 -14.991 1.00 0.00 H new ATOM 0 HA LYS A 6 1.625 9.080 -15.538 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.356 6.684 -16.318 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.073 6.858 -17.499 1.00 0.00 H new ATOM 0 HG2 LYS A 6 2.089 9.130 -18.127 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.447 8.736 -17.092 1.00 0.00 H new ATOM 0 HD2 LYS A 6 3.782 6.623 -18.473 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.545 7.208 -19.567 1.00 0.00 H new ATOM 0 HE2 LYS A 6 4.688 7.717 -20.544 1.00 0.00 H new ATOM 0 HE3 LYS A 6 3.962 9.231 -20.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.298 9.143 -19.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.353 9.206 -18.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.056 7.739 -18.534 1.00 0.00 H new ATOM 114 N THR A 7 -0.304 10.214 -16.646 1.00 0.00 N ATOM 115 CA THR A 7 -1.349 10.811 -17.442 1.00 0.00 C ATOM 116 C THR A 7 -1.080 10.449 -18.878 1.00 0.00 C ATOM 117 O THR A 7 0.019 10.056 -19.261 1.00 0.00 O ATOM 118 CB THR A 7 -1.466 12.323 -17.262 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.257 12.928 -17.638 1.00 0.00 O ATOM 120 CG2 THR A 7 -1.777 12.671 -15.826 1.00 0.00 C ATOM 0 H THR A 7 0.365 10.868 -16.240 1.00 0.00 H new ATOM 0 HA THR A 7 -2.311 10.420 -17.111 1.00 0.00 H new ATOM 0 HB THR A 7 -2.279 12.688 -17.890 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.435 13.634 -18.294 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.856 13.753 -15.723 1.00 0.00 H new ATOM 0 HG22 THR A 7 -2.721 12.209 -15.536 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.979 12.302 -15.181 1.00 0.00 H new ATOM 128 N LEU A 8 -2.090 10.654 -19.693 1.00 0.00 N ATOM 129 CA LEU A 8 -1.944 10.587 -21.131 1.00 0.00 C ATOM 130 C LEU A 8 -1.074 11.759 -21.629 1.00 0.00 C ATOM 131 O LEU A 8 -0.660 11.683 -22.776 1.00 0.00 O ATOM 132 CB LEU A 8 -3.353 10.555 -21.742 1.00 0.00 C ATOM 133 CG LEU A 8 -3.950 9.282 -22.342 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.431 9.503 -22.680 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.317 8.903 -23.667 1.00 0.00 C ATOM 0 H LEU A 8 -3.036 10.872 -19.379 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.422 9.683 -21.445 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.040 10.887 -20.964 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.372 11.311 -22.527 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.783 8.507 -21.594 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.847 8.590 -23.107 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.977 9.761 -21.772 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.522 10.315 -23.401 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.781 7.992 -24.044 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.465 9.710 -24.385 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.249 8.735 -23.525 1.00 0.00 H new ATOM 147 N THR A 9 -0.765 12.833 -20.869 1.00 0.00 N ATOM 148 CA THR A 9 0.271 13.783 -21.318 1.00 0.00 C ATOM 149 C THR A 9 1.604 13.086 -21.120 1.00 0.00 C ATOM 150 O THR A 9 2.479 13.089 -21.982 1.00 0.00 O ATOM 151 CB THR A 9 0.330 15.093 -20.507 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.513 15.040 -19.380 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.025 16.301 -21.352 1.00 0.00 C ATOM 0 H THR A 9 -1.201 13.057 -19.975 1.00 0.00 H new ATOM 0 HA THR A 9 0.041 14.055 -22.348 1.00 0.00 H new ATOM 0 HB THR A 9 1.362 15.200 -20.172 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.452 15.884 -18.886 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.029 17.202 -20.740 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.677 16.383 -22.182 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.037 16.188 -21.742 1.00 0.00 H new ATOM 161 N GLY A 10 1.706 12.440 -19.963 1.00 0.00 N ATOM 162 CA GLY A 10 2.847 11.689 -19.526 1.00 0.00 C ATOM 163 C GLY A 10 3.359 12.165 -18.181 1.00 0.00 C ATOM 164 O GLY A 10 4.487 11.845 -17.815 1.00 0.00 O ATOM 0 H GLY A 10 0.949 12.434 -19.280 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.583 10.634 -19.460 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.642 11.773 -20.267 1.00 0.00 H new ATOM 168 N LYS A 11 2.546 12.935 -17.454 1.00 0.00 N ATOM 169 CA LYS A 11 2.903 13.386 -16.122 1.00 0.00 C ATOM 170 C LYS A 11 2.603 12.224 -15.222 1.00 0.00 C ATOM 171 O LYS A 11 1.461 11.782 -15.187 1.00 0.00 O ATOM 172 CB LYS A 11 2.066 14.616 -15.740 1.00 0.00 C ATOM 173 CG LYS A 11 2.425 15.093 -14.318 1.00 0.00 C ATOM 174 CD LYS A 11 1.386 14.757 -13.232 1.00 0.00 C ATOM 175 CE LYS A 11 0.024 15.449 -13.397 1.00 0.00 C ATOM 176 NZ LYS A 11 0.071 16.928 -13.214 1.00 0.00 N ATOM 0 H LYS A 11 1.633 13.257 -17.775 1.00 0.00 H new ATOM 0 HA LYS A 11 3.948 13.686 -16.049 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.242 15.420 -16.455 1.00 0.00 H new ATOM 0 HB3 LYS A 11 1.005 14.371 -15.791 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.380 14.651 -14.034 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.568 16.173 -14.340 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.229 13.678 -13.222 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.798 15.028 -12.260 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.367 15.228 -14.390 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.677 15.026 -12.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.882 17.324 -13.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.414 17.149 -12.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.714 17.345 -13.917 1.00 0.00 H new ATOM 190 N THR A 12 3.578 11.721 -14.497 1.00 0.00 N ATOM 191 CA THR A 12 3.332 10.601 -13.623 1.00 0.00 C ATOM 192 C THR A 12 2.966 11.163 -12.259 1.00 0.00 C ATOM 193 O THR A 12 3.800 11.743 -11.562 1.00 0.00 O ATOM 194 CB THR A 12 4.525 9.646 -13.656 1.00 0.00 C ATOM 195 OG1 THR A 12 5.152 9.642 -14.931 1.00 0.00 O ATOM 196 CG2 THR A 12 3.997 8.238 -13.411 1.00 0.00 C ATOM 0 H THR A 12 4.538 12.067 -14.496 1.00 0.00 H new ATOM 0 HA THR A 12 2.492 9.984 -13.942 1.00 0.00 H new ATOM 0 HB THR A 12 5.247 9.964 -12.904 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.912 9.023 -14.920 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.826 7.530 -13.428 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.506 8.198 -12.439 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.281 7.977 -14.190 1.00 0.00 H new ATOM 204 N ILE A 13 1.684 11.025 -11.916 1.00 0.00 N ATOM 205 CA ILE A 13 1.174 11.373 -10.610 1.00 0.00 C ATOM 206 C ILE A 13 1.336 10.124 -9.778 1.00 0.00 C ATOM 207 O ILE A 13 0.717 9.100 -10.049 1.00 0.00 O ATOM 208 CB ILE A 13 -0.266 11.938 -10.677 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.054 11.786 -9.349 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.161 11.551 -11.865 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.256 10.821 -9.322 1.00 0.00 C ATOM 0 H ILE A 13 0.972 10.664 -12.551 1.00 0.00 H new ATOM 0 HA ILE A 13 1.722 12.194 -10.148 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.031 12.986 -10.862 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.352 11.465 -8.580 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.413 12.774 -9.060 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.134 12.030 -11.759 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.694 11.879 -12.794 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.290 10.469 -11.886 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.702 10.824 -8.328 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -2.997 11.143 -10.053 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.919 9.813 -9.566 1.00 0.00 H new ATOM 223 N THR A 14 2.197 10.206 -8.780 1.00 0.00 N ATOM 224 CA THR A 14 2.383 9.118 -7.846 1.00 0.00 C ATOM 225 C THR A 14 1.356 9.330 -6.742 1.00 0.00 C ATOM 226 O THR A 14 1.107 10.470 -6.337 1.00 0.00 O ATOM 227 CB THR A 14 3.835 9.115 -7.359 1.00 0.00 C ATOM 228 OG1 THR A 14 4.702 9.083 -8.481 1.00 0.00 O ATOM 229 CG2 THR A 14 4.137 7.887 -6.486 1.00 0.00 C ATOM 0 H THR A 14 2.781 11.022 -8.597 1.00 0.00 H new ATOM 0 HA THR A 14 2.223 8.133 -8.285 1.00 0.00 H new ATOM 0 HB THR A 14 3.989 10.016 -6.765 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.633 9.082 -8.175 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.176 7.920 -6.159 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.482 7.890 -5.614 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.967 6.979 -7.064 1.00 0.00 H new ATOM 237 N LEU A 15 0.751 8.245 -6.261 1.00 0.00 N ATOM 238 CA LEU A 15 -0.219 8.307 -5.188 1.00 0.00 C ATOM 239 C LEU A 15 -0.029 7.129 -4.281 1.00 0.00 C ATOM 240 O LEU A 15 0.410 6.086 -4.748 1.00 0.00 O ATOM 241 CB LEU A 15 -1.654 8.377 -5.726 1.00 0.00 C ATOM 242 CG LEU A 15 -2.222 7.122 -6.401 1.00 0.00 C ATOM 243 CD1 LEU A 15 -3.691 6.949 -6.027 1.00 0.00 C ATOM 244 CD2 LEU A 15 -2.134 7.239 -7.901 1.00 0.00 C ATOM 0 H LEU A 15 0.925 7.302 -6.609 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.057 9.223 -4.619 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.311 8.639 -4.897 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.704 9.196 -6.443 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.638 6.266 -6.062 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.087 6.056 -6.510 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -3.782 6.847 -4.946 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.256 7.821 -6.358 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.542 6.339 -8.361 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.705 8.106 -8.232 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.091 7.357 -8.196 1.00 0.00 H new ATOM 256 N GLU A 16 -0.403 7.268 -3.019 1.00 0.00 N ATOM 257 CA GLU A 16 -0.259 6.203 -2.050 1.00 0.00 C ATOM 258 C GLU A 16 -1.618 5.547 -1.848 1.00 0.00 C ATOM 259 O GLU A 16 -2.672 6.181 -1.768 1.00 0.00 O ATOM 260 CB GLU A 16 0.459 6.666 -0.777 1.00 0.00 C ATOM 261 CG GLU A 16 1.986 6.626 -0.990 1.00 0.00 C ATOM 262 CD GLU A 16 2.736 7.162 0.242 1.00 0.00 C ATOM 263 OE1 GLU A 16 2.988 8.388 0.320 1.00 0.00 O ATOM 264 OE2 GLU A 16 3.085 6.352 1.137 1.00 0.00 O ATOM 0 H GLU A 16 -0.814 8.122 -2.642 1.00 0.00 H new ATOM 0 HA GLU A 16 0.410 5.428 -2.425 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.146 7.678 -0.520 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.183 6.025 0.060 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.300 5.602 -1.193 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.249 7.220 -1.865 1.00 0.00 H new ATOM 271 N VAL A 17 -1.563 4.227 -1.888 1.00 0.00 N ATOM 272 CA VAL A 17 -2.668 3.291 -1.943 1.00 0.00 C ATOM 273 C VAL A 17 -2.279 2.047 -1.149 1.00 0.00 C ATOM 274 O VAL A 17 -1.163 1.908 -0.642 1.00 0.00 O ATOM 275 CB VAL A 17 -2.947 2.928 -3.426 1.00 0.00 C ATOM 276 CG1 VAL A 17 -3.350 4.136 -4.287 1.00 0.00 C ATOM 277 CG2 VAL A 17 -1.727 2.243 -4.059 1.00 0.00 C ATOM 0 H VAL A 17 -0.665 3.743 -1.882 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.571 3.726 -1.515 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.796 2.244 -3.406 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.530 3.809 -5.311 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.259 4.583 -3.884 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.548 4.874 -4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.946 1.998 -5.098 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.870 2.915 -4.017 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.498 1.329 -3.511 1.00 0.00 H new ATOM 287 N GLU A 18 -3.174 1.081 -1.172 1.00 0.00 N ATOM 288 CA GLU A 18 -2.976 -0.282 -0.687 1.00 0.00 C ATOM 289 C GLU A 18 -3.260 -1.209 -1.871 1.00 0.00 C ATOM 290 O GLU A 18 -3.956 -0.795 -2.796 1.00 0.00 O ATOM 291 CB GLU A 18 -3.937 -0.601 0.474 1.00 0.00 C ATOM 292 CG GLU A 18 -3.927 0.415 1.623 1.00 0.00 C ATOM 293 CD GLU A 18 -2.530 0.691 2.221 1.00 0.00 C ATOM 294 OE1 GLU A 18 -1.675 -0.227 2.285 1.00 0.00 O ATOM 295 OE2 GLU A 18 -2.290 1.836 2.668 1.00 0.00 O ATOM 0 H GLU A 18 -4.111 1.227 -1.548 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.962 -0.411 -0.309 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.950 -0.669 0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.685 -1.583 0.875 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.347 1.355 1.264 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.583 0.055 2.416 1.00 0.00 H new ATOM 302 N PRO A 19 -2.799 -2.468 -1.894 1.00 0.00 N ATOM 303 CA PRO A 19 -3.228 -3.409 -2.930 1.00 0.00 C ATOM 304 C PRO A 19 -4.757 -3.590 -2.983 1.00 0.00 C ATOM 305 O PRO A 19 -5.327 -3.861 -4.040 1.00 0.00 O ATOM 306 CB PRO A 19 -2.505 -4.719 -2.612 1.00 0.00 C ATOM 307 CG PRO A 19 -1.373 -4.349 -1.660 1.00 0.00 C ATOM 308 CD PRO A 19 -1.889 -3.099 -0.949 1.00 0.00 C ATOM 0 HA PRO A 19 -2.973 -3.036 -3.922 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.183 -5.438 -2.152 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.117 -5.182 -3.519 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.165 -5.153 -0.954 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.447 -4.149 -2.198 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.401 -3.357 -0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.070 -2.430 -0.685 1.00 0.00 H new ATOM 316 N SER A 20 -5.446 -3.353 -1.866 1.00 0.00 N ATOM 317 CA SER A 20 -6.884 -3.525 -1.713 1.00 0.00 C ATOM 318 C SER A 20 -7.607 -2.205 -1.954 1.00 0.00 C ATOM 319 O SER A 20 -8.807 -2.105 -1.696 1.00 0.00 O ATOM 320 CB SER A 20 -7.184 -4.107 -0.324 1.00 0.00 C ATOM 321 OG SER A 20 -6.373 -5.253 -0.072 1.00 0.00 O ATOM 0 H SER A 20 -4.996 -3.023 -1.012 1.00 0.00 H new ATOM 0 HA SER A 20 -7.253 -4.229 -2.459 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.001 -3.351 0.440 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.237 -4.379 -0.258 1.00 0.00 H new ATOM 0 HG SER A 20 -6.577 -5.609 0.818 1.00 0.00 H new ATOM 327 N ASP A 21 -6.898 -1.189 -2.456 1.00 0.00 N ATOM 328 CA ASP A 21 -7.528 0.039 -2.874 1.00 0.00 C ATOM 329 C ASP A 21 -8.442 -0.296 -4.038 1.00 0.00 C ATOM 330 O ASP A 21 -7.964 -0.823 -5.052 1.00 0.00 O ATOM 331 CB ASP A 21 -6.500 1.089 -3.317 1.00 0.00 C ATOM 332 CG ASP A 21 -6.160 2.131 -2.252 1.00 0.00 C ATOM 333 OD1 ASP A 21 -5.947 1.781 -1.077 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.092 3.326 -2.620 1.00 0.00 O ATOM 0 H ASP A 21 -5.885 -1.206 -2.578 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.080 0.464 -2.036 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.584 0.579 -3.614 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.880 1.602 -4.201 1.00 0.00 H new ATOM 339 N THR A 22 -9.739 -0.006 -3.917 1.00 0.00 N ATOM 340 CA THR A 22 -10.631 -0.116 -5.054 1.00 0.00 C ATOM 341 C THR A 22 -10.334 0.978 -6.049 1.00 0.00 C ATOM 342 O THR A 22 -9.928 2.084 -5.680 1.00 0.00 O ATOM 343 CB THR A 22 -12.117 -0.060 -4.692 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.321 0.874 -3.645 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.630 -1.430 -4.299 1.00 0.00 C ATOM 0 H THR A 22 -10.183 0.302 -3.052 1.00 0.00 H new ATOM 0 HA THR A 22 -10.444 -1.102 -5.479 1.00 0.00 H new ATOM 0 HB THR A 22 -12.679 0.265 -5.568 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.274 0.908 -3.418 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.688 -1.364 -4.046 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.499 -2.121 -5.132 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.073 -1.793 -3.435 1.00 0.00 H new ATOM 353 N ILE A 23 -10.622 0.684 -7.309 1.00 0.00 N ATOM 354 CA ILE A 23 -10.539 1.651 -8.383 1.00 0.00 C ATOM 355 C ILE A 23 -11.441 2.853 -8.116 1.00 0.00 C ATOM 356 O ILE A 23 -11.007 3.949 -8.428 1.00 0.00 O ATOM 357 CB ILE A 23 -10.820 0.956 -9.719 1.00 0.00 C ATOM 358 CG1 ILE A 23 -9.895 -0.251 -9.976 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.739 1.927 -10.909 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.485 -0.245 -9.381 1.00 0.00 C ATOM 0 H ILE A 23 -10.922 -0.242 -7.612 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.529 2.057 -8.437 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.842 0.586 -9.636 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.405 -1.141 -9.606 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -9.796 -0.366 -11.055 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.946 1.388 -11.833 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.474 2.722 -10.781 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.740 2.361 -10.957 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.970 -1.165 -9.657 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.931 0.611 -9.767 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.549 -0.176 -8.295 1.00 0.00 H new ATOM 372 N GLU A 24 -12.618 2.714 -7.496 1.00 0.00 N ATOM 373 CA GLU A 24 -13.434 3.880 -7.119 1.00 0.00 C ATOM 374 C GLU A 24 -12.606 4.847 -6.271 1.00 0.00 C ATOM 375 O GLU A 24 -12.476 6.033 -6.578 1.00 0.00 O ATOM 376 CB GLU A 24 -14.675 3.405 -6.334 1.00 0.00 C ATOM 377 CG GLU A 24 -15.564 4.538 -5.787 1.00 0.00 C ATOM 378 CD GLU A 24 -15.999 5.598 -6.828 1.00 0.00 C ATOM 379 OE1 GLU A 24 -16.187 5.265 -8.020 1.00 0.00 O ATOM 380 OE2 GLU A 24 -16.171 6.777 -6.435 1.00 0.00 O ATOM 0 H GLU A 24 -13.027 1.814 -7.245 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.759 4.402 -8.019 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -15.278 2.770 -6.984 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.345 2.786 -5.500 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -16.458 4.096 -5.347 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.029 5.041 -4.982 1.00 0.00 H new ATOM 387 N ASN A 25 -11.981 4.311 -5.222 1.00 0.00 N ATOM 388 CA ASN A 25 -11.202 5.101 -4.282 1.00 0.00 C ATOM 389 C ASN A 25 -9.914 5.629 -4.923 1.00 0.00 C ATOM 390 O ASN A 25 -9.512 6.753 -4.641 1.00 0.00 O ATOM 391 CB ASN A 25 -10.993 4.272 -2.997 1.00 0.00 C ATOM 392 CG ASN A 25 -9.539 4.162 -2.595 1.00 0.00 C ATOM 393 OD1 ASN A 25 -9.041 4.896 -1.754 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.826 3.251 -3.227 1.00 0.00 N ATOM 0 H ASN A 25 -12.004 3.315 -5.004 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.742 6.004 -3.997 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.556 4.727 -2.182 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -11.400 3.272 -3.146 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.833 3.145 -3.019 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -9.267 2.652 -3.924 1.00 0.00 H new ATOM 401 N VAL A 26 -9.285 4.880 -5.832 1.00 0.00 N ATOM 402 CA VAL A 26 -8.119 5.341 -6.584 1.00 0.00 C ATOM 403 C VAL A 26 -8.549 6.503 -7.465 1.00 0.00 C ATOM 404 O VAL A 26 -7.960 7.571 -7.382 1.00 0.00 O ATOM 405 CB VAL A 26 -7.565 4.168 -7.404 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.559 4.588 -8.476 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.919 3.130 -6.489 1.00 0.00 C ATOM 0 H VAL A 26 -9.574 3.930 -6.067 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.325 5.689 -5.923 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.424 3.739 -7.920 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.211 3.706 -9.014 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.037 5.275 -9.175 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.710 5.083 -8.004 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.532 2.306 -7.089 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.101 3.591 -5.936 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.662 2.750 -5.788 1.00 0.00 H new ATOM 417 N LYS A 27 -9.592 6.351 -8.279 1.00 0.00 N ATOM 418 CA LYS A 27 -10.102 7.444 -9.092 1.00 0.00 C ATOM 419 C LYS A 27 -10.422 8.677 -8.259 1.00 0.00 C ATOM 420 O LYS A 27 -10.167 9.782 -8.729 1.00 0.00 O ATOM 421 CB LYS A 27 -11.372 6.995 -9.816 1.00 0.00 C ATOM 422 CG LYS A 27 -11.210 5.972 -10.949 1.00 0.00 C ATOM 423 CD LYS A 27 -12.623 5.635 -11.471 1.00 0.00 C ATOM 424 CE LYS A 27 -12.595 4.893 -12.816 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.925 4.964 -13.512 1.00 0.00 N ATOM 0 H LYS A 27 -10.101 5.474 -8.390 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.323 7.709 -9.807 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -12.052 6.574 -9.075 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.857 7.880 -10.227 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.592 6.380 -11.749 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.710 5.074 -10.587 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.142 5.023 -10.733 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.195 6.556 -11.580 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.825 5.325 -13.455 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.324 3.850 -12.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.262 4.001 -13.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.612 5.449 -12.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.823 5.491 -14.403 1.00 0.00 H new ATOM 439 N ALA A 28 -10.925 8.522 -7.034 1.00 0.00 N ATOM 440 CA ALA A 28 -11.148 9.660 -6.144 1.00 0.00 C ATOM 441 C ALA A 28 -9.826 10.358 -5.804 1.00 0.00 C ATOM 442 O ALA A 28 -9.760 11.584 -5.827 1.00 0.00 O ATOM 443 CB ALA A 28 -11.893 9.206 -4.881 1.00 0.00 C ATOM 0 H ALA A 28 -11.185 7.620 -6.636 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.773 10.390 -6.658 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -12.053 10.062 -4.226 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.856 8.778 -5.161 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.300 8.455 -4.359 1.00 0.00 H new ATOM 449 N LYS A 29 -8.740 9.608 -5.575 1.00 0.00 N ATOM 450 CA LYS A 29 -7.416 10.209 -5.377 1.00 0.00 C ATOM 451 C LYS A 29 -6.955 10.876 -6.672 1.00 0.00 C ATOM 452 O LYS A 29 -6.362 11.941 -6.642 1.00 0.00 O ATOM 453 CB LYS A 29 -6.404 9.149 -4.922 1.00 0.00 C ATOM 454 CG LYS A 29 -6.761 8.553 -3.551 1.00 0.00 C ATOM 455 CD LYS A 29 -5.849 7.374 -3.184 1.00 0.00 C ATOM 456 CE LYS A 29 -6.343 6.749 -1.869 1.00 0.00 C ATOM 457 NZ LYS A 29 -5.444 5.702 -1.326 1.00 0.00 N ATOM 0 H LYS A 29 -8.752 8.589 -5.523 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.483 10.966 -4.595 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.360 8.350 -5.663 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.411 9.595 -4.874 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.680 9.326 -2.787 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.799 8.220 -3.559 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.857 6.630 -3.981 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.819 7.714 -3.076 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.458 7.537 -1.125 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -7.331 6.317 -2.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.554 5.652 -0.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.689 4.782 -1.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.458 5.937 -1.558 1.00 0.00 H new ATOM 471 N ILE A 30 -7.264 10.306 -7.836 1.00 0.00 N ATOM 472 CA ILE A 30 -6.839 10.895 -9.109 1.00 0.00 C ATOM 473 C ILE A 30 -7.561 12.214 -9.283 1.00 0.00 C ATOM 474 O ILE A 30 -6.946 13.173 -9.685 1.00 0.00 O ATOM 475 CB ILE A 30 -7.113 9.965 -10.305 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.507 8.547 -10.228 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.652 10.643 -11.612 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.372 8.363 -9.219 1.00 0.00 C ATOM 0 H ILE A 30 -7.802 9.444 -7.926 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.760 11.049 -9.083 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.192 9.810 -10.280 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.304 7.845 -9.983 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.137 8.276 -11.217 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.848 9.980 -12.455 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.198 11.576 -11.750 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.584 10.852 -11.556 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -5.022 7.331 -9.249 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.549 9.033 -9.471 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.735 8.594 -8.217 1.00 0.00 H new ATOM 490 N GLN A 31 -8.836 12.298 -8.960 1.00 0.00 N ATOM 491 CA GLN A 31 -9.617 13.521 -8.990 1.00 0.00 C ATOM 492 C GLN A 31 -9.013 14.553 -8.048 1.00 0.00 C ATOM 493 O GLN A 31 -8.982 15.725 -8.402 1.00 0.00 O ATOM 494 CB GLN A 31 -11.071 13.228 -8.621 1.00 0.00 C ATOM 495 CG GLN A 31 -12.003 14.433 -8.850 1.00 0.00 C ATOM 496 CD GLN A 31 -12.609 14.930 -7.545 1.00 0.00 C ATOM 497 OE1 GLN A 31 -11.940 15.537 -6.709 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.888 14.664 -7.346 1.00 0.00 N ATOM 0 H GLN A 31 -9.377 11.488 -8.658 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.598 13.930 -10.000 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.427 12.383 -9.210 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.122 12.930 -7.574 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.444 15.241 -9.323 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.800 14.151 -9.538 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.420 14.159 -8.055 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.343 14.963 -6.484 1.00 0.00 H new ATOM 507 N ASP A 32 -8.462 14.127 -6.913 1.00 0.00 N ATOM 508 CA ASP A 32 -7.763 15.055 -6.042 1.00 0.00 C ATOM 509 C ASP A 32 -6.528 15.617 -6.760 1.00 0.00 C ATOM 510 O ASP A 32 -6.222 16.800 -6.590 1.00 0.00 O ATOM 511 CB ASP A 32 -7.366 14.400 -4.715 1.00 0.00 C ATOM 512 CG ASP A 32 -6.377 15.285 -3.930 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.841 16.171 -3.173 1.00 0.00 O ATOM 514 OD2 ASP A 32 -5.141 15.095 -4.068 1.00 0.00 O ATOM 0 H ASP A 32 -8.487 13.162 -6.583 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.443 15.873 -5.807 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.257 14.223 -4.113 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.914 13.427 -4.908 1.00 0.00 H new ATOM 519 N LYS A 33 -5.840 14.813 -7.596 1.00 0.00 N ATOM 520 CA LYS A 33 -4.546 15.213 -8.136 1.00 0.00 C ATOM 521 C LYS A 33 -4.666 15.885 -9.510 1.00 0.00 C ATOM 522 O LYS A 33 -3.893 16.786 -9.834 1.00 0.00 O ATOM 523 CB LYS A 33 -3.640 13.978 -8.178 1.00 0.00 C ATOM 524 CG LYS A 33 -3.577 13.174 -6.848 1.00 0.00 C ATOM 525 CD LYS A 33 -2.213 13.142 -6.141 1.00 0.00 C ATOM 526 CE LYS A 33 -1.669 14.531 -5.777 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.355 15.129 -4.595 1.00 0.00 N ATOM 0 H LYS A 33 -6.163 13.895 -7.903 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.105 15.969 -7.486 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.987 13.316 -8.971 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.631 14.293 -8.445 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.311 13.593 -6.159 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.881 12.148 -7.053 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.300 12.547 -5.232 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.493 12.638 -6.785 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.601 14.456 -5.572 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.783 15.197 -6.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.153 16.148 -4.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.381 14.983 -4.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.010 14.673 -3.726 1.00 0.00 H new ATOM 541 N GLU A 34 -5.682 15.493 -10.279 1.00 0.00 N ATOM 542 CA GLU A 34 -5.878 15.809 -11.689 1.00 0.00 C ATOM 543 C GLU A 34 -7.140 16.625 -11.948 1.00 0.00 C ATOM 544 O GLU A 34 -7.200 17.369 -12.924 1.00 0.00 O ATOM 545 CB GLU A 34 -5.981 14.476 -12.454 1.00 0.00 C ATOM 546 CG GLU A 34 -4.697 13.643 -12.380 1.00 0.00 C ATOM 547 CD GLU A 34 -3.436 14.481 -12.656 1.00 0.00 C ATOM 548 OE1 GLU A 34 -3.303 15.034 -13.773 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.592 14.604 -11.741 1.00 0.00 O ATOM 0 H GLU A 34 -6.434 14.911 -9.909 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.036 16.415 -12.022 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.809 13.894 -12.049 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.216 14.680 -13.499 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.619 13.189 -11.392 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.754 12.828 -13.102 1.00 0.00 H new ATOM 556 N GLY A 35 -8.149 16.493 -11.091 1.00 0.00 N ATOM 557 CA GLY A 35 -9.341 17.325 -11.131 1.00 0.00 C ATOM 558 C GLY A 35 -10.351 16.784 -12.127 1.00 0.00 C ATOM 559 O GLY A 35 -11.058 17.568 -12.754 1.00 0.00 O ATOM 0 H GLY A 35 -8.159 15.799 -10.344 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.791 17.369 -10.139 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.068 18.345 -11.403 1.00 0.00 H new ATOM 563 N ILE A 36 -10.400 15.454 -12.296 1.00 0.00 N ATOM 564 CA ILE A 36 -11.303 14.802 -13.228 1.00 0.00 C ATOM 565 C ILE A 36 -12.190 13.930 -12.361 1.00 0.00 C ATOM 566 O ILE A 36 -11.635 13.145 -11.594 1.00 0.00 O ATOM 567 CB ILE A 36 -10.507 13.941 -14.215 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.533 14.795 -15.048 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.466 13.183 -15.150 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.444 13.882 -15.573 1.00 0.00 C ATOM 0 H ILE A 36 -9.805 14.805 -11.781 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.879 15.515 -13.818 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.922 13.226 -13.637 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -10.058 15.276 -15.873 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.103 15.589 -14.437 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.890 12.575 -15.847 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.117 12.539 -14.559 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -12.071 13.898 -15.707 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.738 14.462 -16.168 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.920 13.422 -14.735 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.889 13.104 -16.194 1.00 0.00 H new ATOM 582 N PRO A 37 -13.522 13.993 -12.479 1.00 0.00 N ATOM 583 CA PRO A 37 -14.407 13.142 -11.712 1.00 0.00 C ATOM 584 C PRO A 37 -14.107 11.667 -11.980 1.00 0.00 C ATOM 585 O PRO A 37 -13.818 11.313 -13.121 1.00 0.00 O ATOM 586 CB PRO A 37 -15.832 13.548 -12.073 1.00 0.00 C ATOM 587 CG PRO A 37 -15.707 14.771 -12.987 1.00 0.00 C ATOM 588 CD PRO A 37 -14.250 14.794 -13.440 1.00 0.00 C ATOM 0 HA PRO A 37 -14.262 13.268 -10.639 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.352 12.735 -12.579 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.407 13.787 -11.179 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.382 14.694 -13.840 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.967 15.686 -12.456 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.147 14.386 -14.446 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.866 15.814 -13.469 1.00 0.00 H new ATOM 596 N PRO A 38 -14.207 10.780 -10.971 1.00 0.00 N ATOM 597 CA PRO A 38 -14.074 9.336 -11.173 1.00 0.00 C ATOM 598 C PRO A 38 -14.956 8.833 -12.295 1.00 0.00 C ATOM 599 O PRO A 38 -14.532 8.012 -13.101 1.00 0.00 O ATOM 600 CB PRO A 38 -14.536 8.690 -9.865 1.00 0.00 C ATOM 601 CG PRO A 38 -14.348 9.767 -8.808 1.00 0.00 C ATOM 602 CD PRO A 38 -14.518 11.076 -9.573 1.00 0.00 C ATOM 0 HA PRO A 38 -13.045 9.092 -11.438 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -15.578 8.375 -9.927 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.947 7.802 -9.633 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -15.084 9.674 -8.009 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -13.364 9.702 -8.344 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.535 11.455 -9.473 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.852 11.844 -9.181 1.00 0.00 H new ATOM 610 N ASP A 39 -16.167 9.380 -12.357 1.00 0.00 N ATOM 611 CA ASP A 39 -17.176 8.929 -13.309 1.00 0.00 C ATOM 612 C ASP A 39 -16.761 9.165 -14.767 1.00 0.00 C ATOM 613 O ASP A 39 -17.245 8.469 -15.655 1.00 0.00 O ATOM 614 CB ASP A 39 -18.521 9.598 -12.993 1.00 0.00 C ATOM 615 CG ASP A 39 -19.651 9.134 -13.934 1.00 0.00 C ATOM 616 OD1 ASP A 39 -20.048 7.946 -13.871 1.00 0.00 O ATOM 617 OD2 ASP A 39 -20.173 9.964 -14.714 1.00 0.00 O ATOM 0 H ASP A 39 -16.474 10.143 -11.753 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.279 7.850 -13.199 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.799 9.378 -11.962 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.411 10.680 -13.069 1.00 0.00 H new ATOM 622 N GLN A 40 -15.809 10.072 -15.017 1.00 0.00 N ATOM 623 CA GLN A 40 -15.282 10.348 -16.359 1.00 0.00 C ATOM 624 C GLN A 40 -13.885 9.747 -16.561 1.00 0.00 C ATOM 625 O GLN A 40 -13.419 9.683 -17.697 1.00 0.00 O ATOM 626 CB GLN A 40 -15.325 11.873 -16.593 1.00 0.00 C ATOM 627 CG GLN A 40 -14.961 12.330 -18.021 1.00 0.00 C ATOM 628 CD GLN A 40 -15.906 11.846 -19.106 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.639 10.852 -19.773 1.00 0.00 O ATOM 630 NE2 GLN A 40 -17.012 12.537 -19.324 1.00 0.00 N ATOM 0 H GLN A 40 -15.379 10.640 -14.287 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.905 9.862 -17.110 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -16.327 12.232 -16.358 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.642 12.351 -15.891 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.934 13.419 -18.042 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.955 11.981 -18.253 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -17.218 13.361 -18.760 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.659 12.246 -20.057 1.00 0.00 H new ATOM 639 N GLN A 41 -13.201 9.267 -15.514 1.00 0.00 N ATOM 640 CA GLN A 41 -11.933 8.565 -15.700 1.00 0.00 C ATOM 641 C GLN A 41 -12.215 7.195 -16.273 1.00 0.00 C ATOM 642 O GLN A 41 -13.153 6.514 -15.872 1.00 0.00 O ATOM 643 CB GLN A 41 -11.204 8.421 -14.352 1.00 0.00 C ATOM 644 CG GLN A 41 -10.588 9.732 -13.842 1.00 0.00 C ATOM 645 CD GLN A 41 -10.190 9.602 -12.380 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.546 8.633 -12.009 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.601 10.509 -11.506 1.00 0.00 N ATOM 0 H GLN A 41 -13.503 9.352 -14.543 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.299 9.132 -16.381 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.906 8.046 -13.607 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.416 7.674 -14.453 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.714 9.987 -14.441 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.303 10.546 -13.959 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.138 11.316 -11.823 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.380 10.400 -10.516 1.00 0.00 H new ATOM 656 N ARG A 42 -11.309 6.751 -17.129 1.00 0.00 N ATOM 657 CA ARG A 42 -11.240 5.396 -17.658 1.00 0.00 C ATOM 658 C ARG A 42 -9.818 5.000 -17.345 1.00 0.00 C ATOM 659 O ARG A 42 -8.888 5.468 -17.984 1.00 0.00 O ATOM 660 CB ARG A 42 -11.603 5.460 -19.143 1.00 0.00 C ATOM 661 CG ARG A 42 -11.384 4.162 -19.933 1.00 0.00 C ATOM 662 CD ARG A 42 -11.947 4.267 -21.363 1.00 0.00 C ATOM 663 NE ARG A 42 -13.368 3.862 -21.468 1.00 0.00 N ATOM 664 CZ ARG A 42 -14.138 3.946 -22.569 1.00 0.00 C ATOM 665 NH1 ARG A 42 -13.706 4.541 -23.675 1.00 0.00 N ATOM 666 NH2 ARG A 42 -15.365 3.439 -22.568 1.00 0.00 N ATOM 0 H ARG A 42 -10.568 7.351 -17.491 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.925 4.657 -17.242 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.651 5.746 -19.231 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.016 6.252 -19.609 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.318 3.937 -19.976 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.864 3.333 -19.412 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.843 5.295 -21.712 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.349 3.643 -22.027 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.804 3.484 -20.627 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.771 4.948 -23.703 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.309 4.591 -24.496 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -15.728 2.983 -21.731 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -15.945 3.505 -23.405 1.00 0.00 H new ATOM 680 N LEU A 43 -9.630 4.292 -16.247 1.00 0.00 N ATOM 681 CA LEU A 43 -8.299 4.008 -15.734 1.00 0.00 C ATOM 682 C LEU A 43 -7.845 2.801 -16.519 1.00 0.00 C ATOM 683 O LEU A 43 -8.638 1.886 -16.714 1.00 0.00 O ATOM 684 CB LEU A 43 -8.398 3.731 -14.216 1.00 0.00 C ATOM 685 CG LEU A 43 -7.267 4.340 -13.372 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.259 5.877 -13.438 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.516 3.927 -11.918 1.00 0.00 C ATOM 0 H LEU A 43 -10.388 3.899 -15.688 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.589 4.827 -15.848 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.351 4.116 -13.853 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.409 2.653 -14.058 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.311 3.983 -13.754 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.443 6.263 -12.827 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.121 6.196 -14.471 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.207 6.262 -13.063 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.732 4.340 -11.283 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.485 4.307 -11.593 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.508 2.840 -11.842 1.00 0.00 H new ATOM 699 N ILE A 44 -6.605 2.790 -16.976 1.00 0.00 N ATOM 700 CA ILE A 44 -6.053 1.725 -17.802 1.00 0.00 C ATOM 701 C ILE A 44 -4.834 1.186 -17.083 1.00 0.00 C ATOM 702 O ILE A 44 -4.157 1.912 -16.357 1.00 0.00 O ATOM 703 CB ILE A 44 -5.800 2.259 -19.239 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.196 2.505 -19.857 1.00 0.00 C ATOM 705 CG2 ILE A 44 -4.946 1.357 -20.152 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.279 2.720 -21.375 1.00 0.00 C ATOM 0 H ILE A 44 -5.938 3.536 -16.780 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.738 0.888 -17.938 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.198 3.164 -19.160 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.829 1.654 -19.604 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.628 3.380 -19.371 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.835 1.829 -21.128 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.963 1.213 -19.704 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.436 0.390 -20.270 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.318 2.880 -21.664 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.687 3.592 -21.652 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.891 1.840 -21.889 1.00 0.00 H new ATOM 718 N PHE A 45 -4.573 -0.104 -17.273 1.00 0.00 N ATOM 719 CA PHE A 45 -3.373 -0.744 -16.776 1.00 0.00 C ATOM 720 C PHE A 45 -2.936 -1.751 -17.817 1.00 0.00 C ATOM 721 O PHE A 45 -3.678 -2.685 -18.093 1.00 0.00 O ATOM 722 CB PHE A 45 -3.665 -1.435 -15.438 1.00 0.00 C ATOM 723 CG PHE A 45 -2.502 -2.259 -14.945 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.283 -1.613 -14.692 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.616 -3.651 -14.779 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.174 -2.351 -14.249 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.520 -4.385 -14.297 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.306 -3.735 -14.018 1.00 0.00 C ATOM 0 H PHE A 45 -5.196 -0.733 -17.780 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.582 -0.014 -16.604 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.914 -0.681 -14.691 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.539 -2.076 -15.548 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.197 -0.546 -14.838 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.541 -4.153 -15.021 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.775 -1.861 -14.086 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.610 -5.450 -14.141 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.528 -4.297 -13.625 1.00 0.00 H new ATOM 738 N ALA A 46 -1.759 -1.545 -18.410 1.00 0.00 N ATOM 739 CA ALA A 46 -1.129 -2.486 -19.341 1.00 0.00 C ATOM 740 C ALA A 46 -2.042 -2.921 -20.510 1.00 0.00 C ATOM 741 O ALA A 46 -1.934 -4.029 -21.036 1.00 0.00 O ATOM 742 CB ALA A 46 -0.606 -3.679 -18.532 1.00 0.00 C ATOM 0 H ALA A 46 -1.205 -0.703 -18.254 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.302 -1.977 -19.836 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.132 -4.394 -19.204 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.123 -3.331 -17.800 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.437 -4.161 -18.016 1.00 0.00 H new ATOM 748 N GLY A 47 -2.960 -2.032 -20.899 1.00 0.00 N ATOM 749 CA GLY A 47 -3.915 -2.229 -21.993 1.00 0.00 C ATOM 750 C GLY A 47 -5.285 -2.725 -21.541 1.00 0.00 C ATOM 751 O GLY A 47 -6.197 -2.821 -22.364 1.00 0.00 O ATOM 0 H GLY A 47 -3.062 -1.124 -20.445 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.039 -1.287 -22.527 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.497 -2.944 -22.702 1.00 0.00 H new ATOM 755 N LYS A 48 -5.468 -3.016 -20.250 1.00 0.00 N ATOM 756 CA LYS A 48 -6.783 -3.291 -19.672 1.00 0.00 C ATOM 757 C LYS A 48 -7.363 -1.978 -19.196 1.00 0.00 C ATOM 758 O LYS A 48 -6.617 -1.043 -18.946 1.00 0.00 O ATOM 759 CB LYS A 48 -6.651 -4.267 -18.487 1.00 0.00 C ATOM 760 CG LYS A 48 -6.139 -5.640 -18.933 1.00 0.00 C ATOM 761 CD LYS A 48 -6.097 -6.615 -17.750 1.00 0.00 C ATOM 762 CE LYS A 48 -5.520 -7.988 -18.138 1.00 0.00 C ATOM 763 NZ LYS A 48 -6.419 -8.775 -19.031 1.00 0.00 N ATOM 0 H LYS A 48 -4.705 -3.067 -19.575 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.434 -3.749 -20.417 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.970 -3.849 -17.746 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.620 -4.381 -18.001 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.785 -6.038 -19.715 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -5.143 -5.540 -19.363 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.495 -6.185 -16.950 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.105 -6.746 -17.356 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.561 -7.844 -18.635 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.326 -8.562 -17.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.973 -9.688 -19.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.326 -8.941 -18.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.585 -8.245 -19.911 1.00 0.00 H new ATOM 777 N GLN A 49 -8.660 -1.927 -18.972 1.00 0.00 N ATOM 778 CA GLN A 49 -9.376 -0.840 -18.317 1.00 0.00 C ATOM 779 C GLN A 49 -9.935 -1.435 -17.040 1.00 0.00 C ATOM 780 O GLN A 49 -10.305 -2.613 -17.006 1.00 0.00 O ATOM 781 CB GLN A 49 -10.542 -0.355 -19.201 1.00 0.00 C ATOM 782 CG GLN A 49 -10.096 0.409 -20.456 1.00 0.00 C ATOM 783 CD GLN A 49 -11.167 0.451 -21.554 1.00 0.00 C ATOM 784 OE1 GLN A 49 -12.298 0.873 -21.324 1.00 0.00 O ATOM 785 NE2 GLN A 49 -10.819 0.047 -22.766 1.00 0.00 N ATOM 0 H GLN A 49 -9.282 -2.684 -19.256 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.721 0.011 -18.131 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.137 -1.216 -19.504 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.192 0.289 -18.608 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.831 1.429 -20.177 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.195 -0.056 -20.855 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.875 -0.300 -22.936 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.495 0.083 -23.529 1.00 0.00 H new ATOM 794 N LEU A 50 -9.967 -0.617 -15.992 1.00 0.00 N ATOM 795 CA LEU A 50 -10.315 -1.092 -14.666 1.00 0.00 C ATOM 796 C LEU A 50 -11.656 -0.478 -14.283 1.00 0.00 C ATOM 797 O LEU A 50 -11.882 0.702 -14.557 1.00 0.00 O ATOM 798 CB LEU A 50 -9.227 -0.736 -13.644 1.00 0.00 C ATOM 799 CG LEU A 50 -7.769 -1.120 -13.940 1.00 0.00 C ATOM 800 CD1 LEU A 50 -7.097 -0.225 -14.978 1.00 0.00 C ATOM 801 CD2 LEU A 50 -6.945 -0.953 -12.659 1.00 0.00 C ATOM 0 H LEU A 50 -9.755 0.380 -16.041 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.393 -2.179 -14.670 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.258 0.343 -13.493 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.503 -1.198 -12.696 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.800 -2.142 -14.317 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.071 -0.557 -15.135 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.645 -0.284 -15.918 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.095 0.806 -14.623 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.907 -1.223 -12.856 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.994 0.084 -12.328 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.347 -1.602 -11.881 1.00 0.00 H new ATOM 813 N GLU A 51 -12.526 -1.252 -13.633 1.00 0.00 N ATOM 814 CA GLU A 51 -13.847 -0.786 -13.226 1.00 0.00 C ATOM 815 C GLU A 51 -13.836 -0.507 -11.722 1.00 0.00 C ATOM 816 O GLU A 51 -13.043 -1.075 -10.972 1.00 0.00 O ATOM 817 CB GLU A 51 -14.964 -1.743 -13.697 1.00 0.00 C ATOM 818 CG GLU A 51 -14.918 -3.101 -12.993 1.00 0.00 C ATOM 819 CD GLU A 51 -15.965 -4.133 -13.449 1.00 0.00 C ATOM 820 OE1 GLU A 51 -16.987 -3.775 -14.086 1.00 0.00 O ATOM 821 OE2 GLU A 51 -15.766 -5.335 -13.139 1.00 0.00 O ATOM 0 H GLU A 51 -12.332 -2.220 -13.375 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.083 0.155 -13.723 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.934 -1.279 -13.517 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.877 -1.894 -14.773 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.927 -3.530 -13.139 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -15.040 -2.937 -11.922 1.00 0.00 H new ATOM 828 N ASP A 52 -14.728 0.379 -11.281 1.00 0.00 N ATOM 829 CA ASP A 52 -14.753 0.972 -9.943 1.00 0.00 C ATOM 830 C ASP A 52 -14.811 -0.047 -8.810 1.00 0.00 C ATOM 831 O ASP A 52 -14.212 0.181 -7.759 1.00 0.00 O ATOM 832 CB ASP A 52 -15.909 1.970 -9.821 1.00 0.00 C ATOM 833 CG ASP A 52 -17.254 1.312 -9.457 1.00 0.00 C ATOM 834 OD1 ASP A 52 -17.892 0.731 -10.368 1.00 0.00 O ATOM 835 OD2 ASP A 52 -17.678 1.375 -8.281 1.00 0.00 O ATOM 0 H ASP A 52 -15.487 0.719 -11.872 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.801 1.490 -9.831 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.659 2.712 -9.062 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.019 2.504 -10.765 1.00 0.00 H new ATOM 840 N GLY A 53 -15.467 -1.187 -9.047 1.00 0.00 N ATOM 841 CA GLY A 53 -15.728 -2.192 -8.029 1.00 0.00 C ATOM 842 C GLY A 53 -14.555 -3.139 -7.786 1.00 0.00 C ATOM 843 O GLY A 53 -14.699 -4.095 -7.022 1.00 0.00 O ATOM 0 H GLY A 53 -15.834 -1.435 -9.966 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.980 -1.692 -7.094 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.600 -2.776 -8.323 1.00 0.00 H new ATOM 847 N ARG A 54 -13.408 -2.919 -8.437 1.00 0.00 N ATOM 848 CA ARG A 54 -12.275 -3.844 -8.446 1.00 0.00 C ATOM 849 C ARG A 54 -11.117 -3.184 -7.739 1.00 0.00 C ATOM 850 O ARG A 54 -11.210 -2.008 -7.419 1.00 0.00 O ATOM 851 CB ARG A 54 -11.945 -4.158 -9.906 1.00 0.00 C ATOM 852 CG ARG A 54 -13.098 -4.791 -10.710 1.00 0.00 C ATOM 853 CD ARG A 54 -13.387 -6.273 -10.484 1.00 0.00 C ATOM 854 NE ARG A 54 -12.486 -7.109 -11.281 1.00 0.00 N ATOM 855 CZ ARG A 54 -12.566 -7.427 -12.577 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.585 -7.053 -13.350 1.00 0.00 N ATOM 857 NH2 ARG A 54 -11.569 -8.144 -13.081 1.00 0.00 N ATOM 0 H ARG A 54 -13.240 -2.074 -8.983 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.500 -4.776 -7.928 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.640 -3.236 -10.401 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.089 -4.833 -9.933 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -14.008 -4.234 -10.488 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.887 -4.648 -11.770 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.272 -6.513 -9.427 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.422 -6.490 -10.750 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.690 -7.502 -10.779 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.347 -6.500 -12.957 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -13.603 -7.319 -14.334 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -10.791 -8.425 -12.485 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -11.581 -8.413 -14.065 1.00 0.00 H new ATOM 871 N THR A 55 -10.019 -3.881 -7.509 1.00 0.00 N ATOM 872 CA THR A 55 -8.917 -3.384 -6.704 1.00 0.00 C ATOM 873 C THR A 55 -7.622 -3.548 -7.462 1.00 0.00 C ATOM 874 O THR A 55 -7.555 -4.281 -8.445 1.00 0.00 O ATOM 875 CB THR A 55 -8.858 -4.157 -5.381 1.00 0.00 C ATOM 876 OG1 THR A 55 -8.913 -5.546 -5.656 1.00 0.00 O ATOM 877 CG2 THR A 55 -9.995 -3.789 -4.436 1.00 0.00 C ATOM 0 H THR A 55 -9.865 -4.819 -7.880 1.00 0.00 H new ATOM 0 HA THR A 55 -9.069 -2.326 -6.490 1.00 0.00 H new ATOM 0 HB THR A 55 -7.924 -3.891 -4.886 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.874 -6.048 -4.815 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.904 -4.366 -3.516 1.00 0.00 H new ATOM 0 HG22 THR A 55 -9.945 -2.725 -4.204 1.00 0.00 H new ATOM 0 HG23 THR A 55 -10.950 -4.013 -4.911 1.00 0.00 H new ATOM 885 N LEU A 56 -6.577 -2.885 -6.985 1.00 0.00 N ATOM 886 CA LEU A 56 -5.252 -2.995 -7.592 1.00 0.00 C ATOM 887 C LEU A 56 -4.805 -4.457 -7.632 1.00 0.00 C ATOM 888 O LEU A 56 -4.421 -4.958 -8.690 1.00 0.00 O ATOM 889 CB LEU A 56 -4.269 -2.081 -6.838 1.00 0.00 C ATOM 890 CG LEU A 56 -4.722 -0.614 -6.785 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.617 0.253 -6.207 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.095 -0.080 -8.174 1.00 0.00 C ATOM 0 H LEU A 56 -6.619 -2.263 -6.178 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.281 -2.657 -8.628 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.145 -2.453 -5.821 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.292 -2.135 -7.318 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.607 -0.573 -6.150 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.949 1.291 -6.174 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.380 -0.085 -5.198 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.728 0.176 -6.834 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.410 0.960 -8.091 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.230 -0.146 -8.834 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.911 -0.674 -8.585 1.00 0.00 H new ATOM 904 N SER A 57 -4.979 -5.170 -6.525 1.00 0.00 N ATOM 905 CA SER A 57 -4.728 -6.598 -6.418 1.00 0.00 C ATOM 906 C SER A 57 -5.547 -7.423 -7.408 1.00 0.00 C ATOM 907 O SER A 57 -5.037 -8.437 -7.882 1.00 0.00 O ATOM 908 CB SER A 57 -5.068 -7.076 -5.004 1.00 0.00 C ATOM 909 OG SER A 57 -3.996 -6.829 -4.122 1.00 0.00 O ATOM 0 H SER A 57 -5.308 -4.756 -5.653 1.00 0.00 H new ATOM 0 HA SER A 57 -3.672 -6.745 -6.647 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.963 -6.566 -4.648 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.294 -8.142 -5.020 1.00 0.00 H new ATOM 0 HG SER A 57 -4.233 -7.140 -3.223 1.00 0.00 H new ATOM 915 N ASP A 58 -6.776 -7.015 -7.760 1.00 0.00 N ATOM 916 CA ASP A 58 -7.576 -7.770 -8.718 1.00 0.00 C ATOM 917 C ASP A 58 -6.878 -7.809 -10.083 1.00 0.00 C ATOM 918 O ASP A 58 -6.927 -8.812 -10.798 1.00 0.00 O ATOM 919 CB ASP A 58 -8.955 -7.141 -8.844 1.00 0.00 C ATOM 920 CG ASP A 58 -9.883 -8.114 -9.581 1.00 0.00 C ATOM 921 OD1 ASP A 58 -9.944 -8.083 -10.831 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.607 -8.883 -8.907 1.00 0.00 O ATOM 0 H ASP A 58 -7.227 -6.176 -7.397 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.686 -8.794 -8.361 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.356 -6.913 -7.857 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.890 -6.198 -9.387 1.00 0.00 H new ATOM 927 N TYR A 59 -6.139 -6.736 -10.379 1.00 0.00 N ATOM 928 CA TYR A 59 -5.379 -6.545 -11.604 1.00 0.00 C ATOM 929 C TYR A 59 -3.892 -6.886 -11.411 1.00 0.00 C ATOM 930 O TYR A 59 -3.105 -6.724 -12.339 1.00 0.00 O ATOM 931 CB TYR A 59 -5.626 -5.114 -12.094 1.00 0.00 C ATOM 932 CG TYR A 59 -7.064 -4.864 -12.509 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.544 -5.399 -13.722 1.00 0.00 C ATOM 934 CD2 TYR A 59 -7.937 -4.130 -11.679 1.00 0.00 C ATOM 935 CE1 TYR A 59 -8.888 -5.215 -14.099 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.275 -3.949 -12.054 1.00 0.00 C ATOM 937 CZ TYR A 59 -9.764 -4.496 -13.259 1.00 0.00 C ATOM 938 OH TYR A 59 -11.072 -4.301 -13.604 1.00 0.00 O ATOM 0 H TYR A 59 -6.055 -5.946 -9.739 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.716 -7.237 -12.376 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.356 -4.414 -11.303 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.970 -4.908 -12.939 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.877 -5.953 -14.366 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.574 -3.707 -10.754 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.248 -5.624 -15.031 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.938 -3.385 -11.414 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.516 -5.169 -13.706 1.00 0.00 H new ATOM 948 N ASN A 60 -3.508 -7.418 -10.243 1.00 0.00 N ATOM 949 CA ASN A 60 -2.159 -7.860 -9.844 1.00 0.00 C ATOM 950 C ASN A 60 -1.191 -6.683 -9.653 1.00 0.00 C ATOM 951 O ASN A 60 0.021 -6.879 -9.497 1.00 0.00 O ATOM 952 CB ASN A 60 -1.543 -8.914 -10.790 1.00 0.00 C ATOM 953 CG ASN A 60 -2.489 -10.045 -11.160 1.00 0.00 C ATOM 954 OD1 ASN A 60 -2.577 -11.063 -10.476 1.00 0.00 O ATOM 955 ND2 ASN A 60 -3.216 -9.880 -12.258 1.00 0.00 N ATOM 0 H ASN A 60 -4.183 -7.563 -9.492 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.304 -8.347 -8.880 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.212 -8.418 -11.703 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.656 -9.336 -10.317 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.867 -10.608 -12.553 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.123 -9.026 -12.807 1.00 0.00 H new ATOM 962 N ILE A 61 -1.714 -5.462 -9.671 1.00 0.00 N ATOM 963 CA ILE A 61 -0.972 -4.236 -9.430 1.00 0.00 C ATOM 964 C ILE A 61 -0.546 -4.261 -7.962 1.00 0.00 C ATOM 965 O ILE A 61 -1.363 -4.507 -7.067 1.00 0.00 O ATOM 966 CB ILE A 61 -1.887 -3.041 -9.737 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.343 -3.017 -11.203 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.235 -1.689 -9.385 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.639 -2.228 -11.344 1.00 0.00 C ATOM 0 H ILE A 61 -2.702 -5.296 -9.861 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.090 -4.149 -10.064 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.760 -3.180 -9.100 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.568 -2.569 -11.824 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.489 -4.036 -11.562 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.925 -0.879 -9.622 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.999 -1.665 -8.321 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.319 -1.566 -9.963 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -3.949 -2.221 -12.389 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.416 -2.694 -10.739 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.480 -1.204 -11.005 1.00 0.00 H new ATOM 981 N GLN A 62 0.726 -3.967 -7.722 1.00 0.00 N ATOM 982 CA GLN A 62 1.352 -3.926 -6.411 1.00 0.00 C ATOM 983 C GLN A 62 1.945 -2.528 -6.224 1.00 0.00 C ATOM 984 O GLN A 62 1.572 -1.579 -6.910 1.00 0.00 O ATOM 985 CB GLN A 62 2.404 -5.056 -6.353 1.00 0.00 C ATOM 986 CG GLN A 62 1.735 -6.436 -6.425 1.00 0.00 C ATOM 987 CD GLN A 62 2.692 -7.489 -6.972 1.00 0.00 C ATOM 988 OE1 GLN A 62 3.561 -8.009 -6.273 1.00 0.00 O ATOM 989 NE2 GLN A 62 2.557 -7.806 -8.251 1.00 0.00 N ATOM 0 H GLN A 62 1.378 -3.740 -8.473 1.00 0.00 H new ATOM 0 HA GLN A 62 0.650 -4.096 -5.594 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.107 -4.946 -7.178 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.980 -4.975 -5.431 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.397 -6.730 -5.432 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.851 -6.381 -7.060 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.830 -7.363 -8.812 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.180 -8.493 -8.675 1.00 0.00 H new ATOM 998 N LYS A 63 2.847 -2.378 -5.257 1.00 0.00 N ATOM 999 CA LYS A 63 3.643 -1.179 -5.065 1.00 0.00 C ATOM 1000 C LYS A 63 4.450 -0.872 -6.315 1.00 0.00 C ATOM 1001 O LYS A 63 4.702 -1.740 -7.147 1.00 0.00 O ATOM 1002 CB LYS A 63 4.574 -1.378 -3.850 1.00 0.00 C ATOM 1003 CG LYS A 63 5.682 -2.409 -4.108 1.00 0.00 C ATOM 1004 CD LYS A 63 6.589 -2.638 -2.891 1.00 0.00 C ATOM 1005 CE LYS A 63 5.913 -3.482 -1.793 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.845 -3.781 -0.673 1.00 0.00 N ATOM 0 H LYS A 63 3.046 -3.107 -4.572 1.00 0.00 H new ATOM 0 HA LYS A 63 2.983 -0.332 -4.876 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.028 -0.423 -3.586 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.981 -1.696 -2.993 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.228 -3.356 -4.398 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.290 -2.077 -4.949 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.504 -3.135 -3.214 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.880 -1.674 -2.474 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.043 -2.949 -1.409 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.551 -4.416 -2.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.353 -4.350 0.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.663 -4.311 -1.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.171 -2.891 -0.246 1.00 0.00 H new ATOM 1020 N GLU A 64 4.892 0.381 -6.349 1.00 0.00 N ATOM 1021 CA GLU A 64 5.769 0.980 -7.344 1.00 0.00 C ATOM 1022 C GLU A 64 5.358 0.532 -8.753 1.00 0.00 C ATOM 1023 O GLU A 64 6.176 0.116 -9.574 1.00 0.00 O ATOM 1024 CB GLU A 64 7.254 0.844 -6.920 1.00 0.00 C ATOM 1025 CG GLU A 64 7.959 -0.489 -7.156 1.00 0.00 C ATOM 1026 CD GLU A 64 9.260 -0.585 -6.339 1.00 0.00 C ATOM 1027 OE1 GLU A 64 10.333 -0.165 -6.843 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.228 -1.088 -5.189 1.00 0.00 O ATOM 0 H GLU A 64 4.626 1.052 -5.628 1.00 0.00 H new ATOM 0 HA GLU A 64 5.649 2.062 -7.397 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.820 1.615 -7.442 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.317 1.068 -5.855 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.294 -1.308 -6.883 1.00 0.00 H new ATOM 0 HG3 GLU A 64 8.184 -0.601 -8.217 1.00 0.00 H new ATOM 1035 N SER A 65 4.042 0.584 -8.995 1.00 0.00 N ATOM 1036 CA SER A 65 3.460 0.038 -10.226 1.00 0.00 C ATOM 1037 C SER A 65 2.772 1.163 -10.973 1.00 0.00 C ATOM 1038 O SER A 65 2.248 2.084 -10.348 1.00 0.00 O ATOM 1039 CB SER A 65 2.500 -1.117 -9.925 1.00 0.00 C ATOM 1040 OG SER A 65 3.185 -2.258 -9.424 1.00 0.00 O ATOM 0 H SER A 65 3.363 0.997 -8.356 1.00 0.00 H new ATOM 0 HA SER A 65 4.249 -0.378 -10.852 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.757 -0.791 -9.197 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.961 -1.387 -10.833 1.00 0.00 H new ATOM 0 HG SER A 65 3.711 -2.004 -8.637 1.00 0.00 H new ATOM 1046 N THR A 66 2.773 1.096 -12.297 1.00 0.00 N ATOM 1047 CA THR A 66 2.346 2.194 -13.149 1.00 0.00 C ATOM 1048 C THR A 66 0.948 1.924 -13.694 1.00 0.00 C ATOM 1049 O THR A 66 0.608 0.796 -14.036 1.00 0.00 O ATOM 1050 CB THR A 66 3.375 2.419 -14.282 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.677 2.473 -13.723 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.137 3.710 -15.089 1.00 0.00 C ATOM 0 H THR A 66 3.073 0.269 -12.814 1.00 0.00 H new ATOM 0 HA THR A 66 2.297 3.111 -12.562 1.00 0.00 H new ATOM 0 HB THR A 66 3.262 1.583 -14.972 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.334 2.614 -14.437 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.897 3.799 -15.865 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.150 3.674 -15.550 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.195 4.571 -14.423 1.00 0.00 H new ATOM 1060 N LEU A 67 0.150 2.985 -13.782 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.225 3.031 -14.264 1.00 0.00 C ATOM 1062 C LEU A 67 -1.358 4.089 -15.358 1.00 0.00 C ATOM 1063 O LEU A 67 -0.441 4.886 -15.542 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.107 3.421 -13.065 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.290 2.499 -12.830 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.814 1.122 -12.383 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.179 3.091 -11.739 1.00 0.00 C ATOM 0 H LEU A 67 0.476 3.908 -13.495 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.523 2.068 -14.679 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.491 3.437 -12.166 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.477 4.435 -13.216 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.846 2.399 -13.762 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.676 0.475 -12.219 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.176 0.689 -13.154 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.249 1.216 -11.455 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.030 2.433 -11.566 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.606 3.192 -10.818 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.537 4.072 -12.053 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.525 4.189 -16.000 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.757 5.171 -17.071 1.00 0.00 C ATOM 1081 C HIS A 68 -4.076 5.900 -16.856 1.00 0.00 C ATOM 1082 O HIS A 68 -5.099 5.256 -16.628 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.788 4.461 -18.441 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.470 4.382 -19.166 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -0.978 3.242 -19.804 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.640 5.436 -19.435 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.159 3.626 -20.410 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.391 4.929 -20.191 1.00 0.00 N ATOM 0 H HIS A 68 -3.332 3.599 -15.797 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.943 5.895 -17.050 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.163 3.448 -18.296 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.503 4.977 -19.081 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.395 2.311 -19.809 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.769 6.460 -19.117 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.796 2.976 -20.992 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.066 7.235 -16.960 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.293 8.039 -17.017 1.00 0.00 C ATOM 1098 C LEU A 69 -5.689 8.087 -18.472 1.00 0.00 C ATOM 1099 O LEU A 69 -4.964 8.640 -19.293 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.097 9.478 -16.453 1.00 0.00 C ATOM 1101 CG LEU A 69 -5.803 10.715 -17.114 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.296 10.509 -17.400 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.696 11.882 -16.132 1.00 0.00 C ATOM 0 H LEU A 69 -3.209 7.787 -17.007 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.066 7.588 -16.394 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.408 9.455 -15.408 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.026 9.680 -16.463 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.308 10.888 -18.070 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.707 11.410 -17.856 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.423 9.667 -18.081 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.820 10.303 -16.467 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.177 12.762 -16.559 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.189 11.617 -15.197 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.646 12.100 -15.940 1.00 0.00 H new ATOM 1115 N VAL A 70 -6.876 7.578 -18.757 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.559 7.704 -20.027 1.00 0.00 C ATOM 1117 C VAL A 70 -8.949 8.242 -19.669 1.00 0.00 C ATOM 1118 O VAL A 70 -9.369 8.197 -18.514 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.442 6.345 -20.738 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.314 6.278 -21.978 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -5.970 6.076 -21.102 1.00 0.00 C ATOM 0 H VAL A 70 -7.412 7.041 -18.075 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.154 8.403 -20.759 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.796 5.575 -20.053 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.201 5.302 -22.450 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.357 6.428 -21.698 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -8.011 7.056 -22.678 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.890 5.113 -21.606 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.609 6.863 -21.765 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.367 6.062 -20.194 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.650 8.839 -20.627 1.00 0.00 N ATOM 1132 CA LEU A 71 -10.963 9.423 -20.406 1.00 0.00 C ATOM 1133 C LEU A 71 -11.993 8.389 -20.833 1.00 0.00 C ATOM 1134 O LEU A 71 -11.758 7.649 -21.781 1.00 0.00 O ATOM 1135 CB LEU A 71 -11.078 10.693 -21.259 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.319 11.529 -20.897 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.920 12.687 -19.996 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -13.019 12.064 -22.140 1.00 0.00 C ATOM 0 H LEU A 71 -9.317 8.931 -21.587 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.122 9.691 -19.362 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.182 11.300 -21.126 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.123 10.418 -22.313 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.017 10.876 -20.372 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.804 13.274 -19.745 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.470 12.299 -19.082 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.200 13.320 -20.514 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.890 12.649 -21.844 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.331 12.696 -22.701 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.338 11.230 -22.765 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.138 8.340 -20.165 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.260 7.455 -20.521 1.00 0.00 C ATOM 1152 C ARG A 72 -15.024 7.975 -21.742 1.00 0.00 C ATOM 1153 O ARG A 72 -15.753 7.213 -22.361 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.149 7.337 -19.261 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.257 6.265 -19.289 1.00 0.00 C ATOM 1156 CD ARG A 72 -17.057 6.376 -17.985 1.00 0.00 C ATOM 1157 NE ARG A 72 -18.208 5.453 -17.933 1.00 0.00 N ATOM 1158 CZ ARG A 72 -19.185 5.510 -17.013 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -19.165 6.463 -16.091 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -20.175 4.630 -17.026 1.00 0.00 N ATOM 0 H ARG A 72 -13.325 8.919 -19.347 1.00 0.00 H new ATOM 0 HA ARG A 72 -13.904 6.468 -20.817 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -14.503 7.135 -18.407 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.618 8.305 -19.084 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -16.909 6.413 -20.150 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.822 5.270 -19.386 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.397 6.172 -17.142 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.414 7.400 -17.870 1.00 0.00 H new ATOM 0 HE ARG A 72 -18.265 4.723 -18.643 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.410 7.149 -16.083 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.905 6.510 -15.390 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -20.200 3.901 -17.739 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.912 4.681 -16.323 1.00 0.00 H new ATOM 1174 N LEU A 73 -14.903 9.273 -22.053 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.721 10.000 -23.043 1.00 0.00 C ATOM 1176 C LEU A 73 -17.210 9.815 -22.674 1.00 0.00 C ATOM 1177 O LEU A 73 -18.076 9.941 -23.527 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.439 9.571 -24.513 1.00 0.00 C ATOM 1179 CG LEU A 73 -14.017 9.546 -25.124 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -13.337 10.862 -25.468 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -13.016 8.663 -24.384 1.00 0.00 C ATOM 0 H LEU A 73 -14.207 9.871 -21.607 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.450 11.055 -23.002 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.842 8.564 -24.625 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.037 10.226 -25.147 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.287 9.102 -26.082 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.350 10.663 -25.885 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.938 11.402 -26.200 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.235 11.466 -24.566 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -12.049 8.710 -24.885 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.910 9.015 -23.358 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.373 7.633 -24.380 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.514 9.451 -21.415 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.829 9.007 -20.927 1.00 0.00 C ATOM 1195 C ARG A 74 -19.525 8.031 -21.900 1.00 0.00 C ATOM 1196 O ARG A 74 -20.744 8.060 -22.059 1.00 0.00 O ATOM 1197 CB ARG A 74 -19.651 10.245 -20.511 1.00 0.00 C ATOM 1198 CG ARG A 74 -20.843 9.991 -19.565 1.00 0.00 C ATOM 1199 CD ARG A 74 -20.481 9.109 -18.353 1.00 0.00 C ATOM 1200 NE ARG A 74 -21.343 9.332 -17.178 1.00 0.00 N ATOM 1201 CZ ARG A 74 -22.625 8.998 -16.999 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -23.333 8.422 -17.969 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -23.190 9.254 -15.828 1.00 0.00 N ATOM 0 H ARG A 74 -16.813 9.460 -20.674 1.00 0.00 H new ATOM 0 HA ARG A 74 -18.713 8.397 -20.031 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.979 10.956 -20.030 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -20.028 10.724 -21.415 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -21.226 10.947 -19.209 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -21.648 9.515 -20.125 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -20.545 8.061 -18.646 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -19.445 9.299 -18.073 1.00 0.00 H new ATOM 0 HE ARG A 74 -20.899 9.807 -16.392 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -22.898 8.227 -18.871 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -24.310 8.176 -17.810 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -22.648 9.697 -15.086 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -24.167 9.008 -15.668 1.00 0.00 H new ATOM 1217 N GLY A 75 -18.743 7.152 -22.539 1.00 0.00 N ATOM 1218 CA GLY A 75 -19.233 6.118 -23.446 1.00 0.00 C ATOM 1219 C GLY A 75 -19.138 6.523 -24.922 1.00 0.00 C ATOM 1220 O GLY A 75 -19.359 5.685 -25.800 1.00 0.00 O ATOM 0 H GLY A 75 -17.728 7.144 -22.434 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -18.662 5.203 -23.288 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -20.271 5.891 -23.203 1.00 0.00 H new ATOM 1224 N GLY A 76 -18.768 7.776 -25.204 1.00 0.00 N ATOM 1225 CA GLY A 76 -18.677 8.339 -26.537 1.00 0.00 C ATOM 1226 C GLY A 76 -20.070 8.447 -27.155 1.00 0.00 C ATOM 1227 O GLY A 76 -21.007 8.897 -26.451 1.00 0.00 O ATOM 1228 OXT GLY A 76 -20.226 8.083 -28.342 1.00 0.00 O ATOM 0 H GLY A 76 -18.516 8.444 -24.476 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -18.212 9.324 -26.494 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -18.040 7.713 -27.162 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -12.501 26.093 -46.496 1.00 0.00 N ATOM 1234 CA GLY B -3 -13.397 25.279 -45.644 1.00 0.00 C ATOM 1235 C GLY B -3 -13.223 25.599 -44.160 1.00 0.00 C ATOM 1236 O GLY B -3 -12.769 26.688 -43.792 1.00 0.00 O ATOM 0 H1 GLY B -3 -13.050 26.517 -47.271 1.00 0.00 H new ATOM 0 H2 GLY B -3 -12.069 26.847 -45.925 1.00 0.00 H new ATOM 0 H3 GLY B -3 -11.754 25.488 -46.892 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -14.433 25.456 -45.934 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -13.195 24.221 -45.813 1.00 0.00 H new ATOM 1242 N HIS B -2 -13.590 24.652 -43.287 1.00 0.00 N ATOM 1243 CA HIS B -2 -13.449 24.757 -41.832 1.00 0.00 C ATOM 1244 C HIS B -2 -13.227 23.357 -41.250 1.00 0.00 C ATOM 1245 O HIS B -2 -13.415 22.352 -41.948 1.00 0.00 O ATOM 1246 CB HIS B -2 -14.712 25.410 -41.238 1.00 0.00 C ATOM 1247 CG HIS B -2 -14.614 25.704 -39.758 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -13.472 26.174 -39.096 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -15.615 25.532 -38.846 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -13.823 26.293 -37.803 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -15.100 25.908 -37.625 1.00 0.00 N ATOM 0 H HIS B -2 -14.004 23.768 -43.583 1.00 0.00 H new ATOM 0 HA HIS B -2 -12.592 25.381 -41.579 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -14.912 26.340 -41.770 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -15.564 24.753 -41.412 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -16.614 25.172 -39.043 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -13.171 26.648 -37.018 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -15.601 25.897 -36.737 1.00 0.00 H new ATOM 1259 N MET B -1 -12.817 23.280 -39.984 1.00 0.00 N ATOM 1260 CA MET B -1 -12.623 22.021 -39.268 1.00 0.00 C ATOM 1261 C MET B -1 -13.955 21.275 -39.118 1.00 0.00 C ATOM 1262 O MET B -1 -15.022 21.892 -39.015 1.00 0.00 O ATOM 1263 CB MET B -1 -12.003 22.283 -37.882 1.00 0.00 C ATOM 1264 CG MET B -1 -10.626 22.961 -37.941 1.00 0.00 C ATOM 1265 SD MET B -1 -9.336 22.122 -38.914 1.00 0.00 S ATOM 1266 CE MET B -1 -9.123 20.596 -37.954 1.00 0.00 C ATOM 0 H MET B -1 -12.607 24.103 -39.419 1.00 0.00 H new ATOM 0 HA MET B -1 -11.940 21.399 -39.847 1.00 0.00 H new ATOM 0 HB2 MET B -1 -12.682 22.908 -37.302 1.00 0.00 H new ATOM 0 HB3 MET B -1 -11.910 21.336 -37.350 1.00 0.00 H new ATOM 0 HG2 MET B -1 -10.759 23.964 -38.347 1.00 0.00 H new ATOM 0 HG3 MET B -1 -10.260 23.076 -36.921 1.00 0.00 H new ATOM 0 HE1 MET B -1 -8.337 19.990 -38.404 1.00 0.00 H new ATOM 0 HE2 MET B -1 -8.846 20.846 -36.930 1.00 0.00 H new ATOM 0 HE3 MET B -1 -10.057 20.035 -37.951 1.00 0.00 H new ATOM 1276 N ASP B 674 -13.878 19.946 -39.048 1.00 0.00 N ATOM 1277 CA ASP B 674 -15.025 19.037 -38.881 1.00 0.00 C ATOM 1278 C ASP B 674 -14.675 17.875 -37.936 1.00 0.00 C ATOM 1279 O ASP B 674 -15.455 16.940 -37.734 1.00 0.00 O ATOM 1280 CB ASP B 674 -15.450 18.525 -40.261 1.00 0.00 C ATOM 1281 CG ASP B 674 -16.755 17.707 -40.226 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -17.795 18.229 -39.745 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -16.777 16.569 -40.758 1.00 0.00 O ATOM 0 H ASP B 674 -12.988 19.451 -39.107 1.00 0.00 H new ATOM 0 HA ASP B 674 -15.856 19.576 -38.425 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -15.578 19.373 -40.933 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -14.652 17.908 -40.675 1.00 0.00 H new ATOM 1288 N GLU B 675 -13.485 17.940 -37.333 1.00 0.00 N ATOM 1289 CA GLU B 675 -12.951 16.994 -36.364 1.00 0.00 C ATOM 1290 C GLU B 675 -11.947 17.811 -35.552 1.00 0.00 C ATOM 1291 O GLU B 675 -11.211 18.626 -36.121 1.00 0.00 O ATOM 1292 CB GLU B 675 -12.313 15.770 -37.051 1.00 0.00 C ATOM 1293 CG GLU B 675 -11.204 16.082 -38.071 1.00 0.00 C ATOM 1294 CD GLU B 675 -10.723 14.809 -38.787 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -11.319 14.419 -39.822 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -9.727 14.197 -38.333 1.00 0.00 O ATOM 0 H GLU B 675 -12.834 18.702 -37.523 1.00 0.00 H new ATOM 0 HA GLU B 675 -13.724 16.565 -35.727 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -11.901 15.118 -36.281 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -13.099 15.209 -37.556 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -11.575 16.796 -38.806 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -10.363 16.555 -37.563 1.00 0.00 H new ATOM 1303 N LYS B 676 -11.953 17.652 -34.230 1.00 0.00 N ATOM 1304 CA LYS B 676 -11.214 18.530 -33.325 1.00 0.00 C ATOM 1305 C LYS B 676 -10.624 17.746 -32.153 1.00 0.00 C ATOM 1306 O LYS B 676 -10.725 18.179 -31.001 1.00 0.00 O ATOM 1307 CB LYS B 676 -12.123 19.681 -32.845 1.00 0.00 C ATOM 1308 CG LYS B 676 -12.781 20.484 -33.983 1.00 0.00 C ATOM 1309 CD LYS B 676 -13.358 21.821 -33.495 1.00 0.00 C ATOM 1310 CE LYS B 676 -12.205 22.775 -33.143 1.00 0.00 C ATOM 1311 NZ LYS B 676 -12.677 24.134 -32.754 1.00 0.00 N ATOM 0 H LYS B 676 -12.470 16.911 -33.756 1.00 0.00 H new ATOM 0 HA LYS B 676 -10.375 18.965 -33.868 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -12.905 19.269 -32.207 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -11.534 20.361 -32.229 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -12.045 20.672 -34.765 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -13.577 19.889 -34.431 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -13.987 22.262 -34.268 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -13.991 21.660 -32.622 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -11.624 22.349 -32.325 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -11.535 22.859 -33.999 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -11.858 24.734 -32.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -13.208 24.556 -33.542 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -13.294 24.062 -31.920 1.00 0.00 H new ATOM 1325 N ILE B 677 -10.046 16.569 -32.424 1.00 0.00 N ATOM 1326 CA ILE B 677 -9.268 15.881 -31.398 1.00 0.00 C ATOM 1327 C ILE B 677 -8.164 16.858 -30.996 1.00 0.00 C ATOM 1328 O ILE B 677 -7.479 17.417 -31.863 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.679 14.530 -31.863 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -9.774 13.458 -32.042 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.666 13.994 -30.824 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -10.640 13.611 -33.297 1.00 0.00 C ATOM 0 H ILE B 677 -10.102 16.087 -33.321 1.00 0.00 H new ATOM 0 HA ILE B 677 -9.913 15.614 -30.561 1.00 0.00 H new ATOM 0 HB ILE B 677 -8.192 14.717 -32.820 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -9.299 12.477 -32.066 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -10.424 13.476 -31.167 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -7.261 13.042 -31.168 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -6.854 14.711 -30.704 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.168 13.850 -29.867 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -11.378 12.809 -33.330 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -11.151 14.574 -33.272 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -10.008 13.559 -34.184 1.00 0.00 H new ATOM 1344 N THR B 678 -7.983 17.052 -29.697 1.00 0.00 N ATOM 1345 CA THR B 678 -6.990 17.944 -29.154 1.00 0.00 C ATOM 1346 C THR B 678 -6.222 17.243 -28.034 1.00 0.00 C ATOM 1347 O THR B 678 -6.697 16.303 -27.387 1.00 0.00 O ATOM 1348 CB THR B 678 -7.701 19.256 -28.786 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.738 20.276 -28.580 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.632 19.175 -27.575 1.00 0.00 C ATOM 0 H THR B 678 -8.538 16.580 -28.983 1.00 0.00 H new ATOM 0 HA THR B 678 -6.212 18.213 -29.868 1.00 0.00 H new ATOM 0 HB THR B 678 -8.348 19.483 -29.633 1.00 0.00 H new ATOM 0 HG1 THR B 678 -7.192 21.113 -28.347 1.00 0.00 H new ATOM 0 HG21 THR B 678 -9.084 20.151 -27.398 1.00 0.00 H new ATOM 0 HG22 THR B 678 -9.415 18.441 -27.766 1.00 0.00 H new ATOM 0 HG23 THR B 678 -8.061 18.875 -26.696 1.00 0.00 H new ATOM 1358 N PHE B 679 -4.992 17.713 -27.848 1.00 0.00 N ATOM 1359 CA PHE B 679 -3.985 17.153 -26.961 1.00 0.00 C ATOM 1360 C PHE B 679 -3.545 18.263 -25.989 1.00 0.00 C ATOM 1361 O PHE B 679 -2.591 18.997 -26.277 1.00 0.00 O ATOM 1362 CB PHE B 679 -2.847 16.548 -27.786 1.00 0.00 C ATOM 1363 CG PHE B 679 -3.194 15.205 -28.415 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -3.196 14.024 -27.637 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -3.488 15.121 -29.790 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -3.475 12.778 -28.221 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.755 13.874 -30.381 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.733 12.703 -29.603 1.00 0.00 C ATOM 0 H PHE B 679 -4.656 18.540 -28.341 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.375 16.330 -26.362 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.570 17.248 -28.574 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -1.972 16.425 -27.147 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -2.980 14.081 -26.580 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -3.508 16.017 -30.392 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -3.492 11.884 -27.615 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -3.978 13.815 -31.436 1.00 0.00 H new ATOM 0 HZ PHE B 679 -3.914 11.744 -30.066 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.305 18.474 -24.896 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.090 19.530 -23.902 1.00 0.00 C ATOM 1380 C PRO B 680 -2.905 19.212 -22.978 1.00 0.00 C ATOM 1381 O PRO B 680 -2.304 18.142 -23.058 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.402 19.545 -23.100 1.00 0.00 C ATOM 1383 CG PRO B 680 -5.762 18.063 -23.077 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.451 17.663 -24.509 1.00 0.00 C ATOM 0 HA PRO B 680 -3.852 20.487 -24.366 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.265 19.949 -22.097 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.172 20.147 -23.584 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -5.165 17.506 -22.355 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -6.809 17.897 -22.821 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.222 16.600 -24.579 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.303 17.849 -25.163 1.00 0.00 H new ATOM 1392 N SER B 681 -2.671 20.069 -21.982 1.00 0.00 N ATOM 1393 CA SER B 681 -1.729 19.886 -20.872 1.00 0.00 C ATOM 1394 C SER B 681 -2.084 18.706 -19.933 1.00 0.00 C ATOM 1395 O SER B 681 -1.615 18.663 -18.795 1.00 0.00 O ATOM 1396 CB SER B 681 -1.643 21.210 -20.088 1.00 0.00 C ATOM 1397 OG SER B 681 -1.514 22.323 -20.969 1.00 0.00 O ATOM 0 H SER B 681 -3.161 20.961 -21.924 1.00 0.00 H new ATOM 0 HA SER B 681 -0.761 19.622 -21.298 1.00 0.00 H new ATOM 0 HB2 SER B 681 -2.535 21.331 -19.474 1.00 0.00 H new ATOM 0 HB3 SER B 681 -0.791 21.179 -19.409 1.00 0.00 H new ATOM 0 HG SER B 681 -1.463 23.150 -20.446 1.00 0.00 H new ATOM 1403 N ASP B 682 -2.894 17.747 -20.391 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.289 16.543 -19.665 1.00 0.00 C ATOM 1405 C ASP B 682 -3.227 15.281 -20.539 1.00 0.00 C ATOM 1406 O ASP B 682 -3.162 14.176 -20.000 1.00 0.00 O ATOM 1407 CB ASP B 682 -4.720 16.658 -19.145 1.00 0.00 C ATOM 1408 CG ASP B 682 -4.961 17.705 -18.049 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -5.043 18.917 -18.358 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -5.193 17.307 -16.883 1.00 0.00 O ATOM 0 H ASP B 682 -3.310 17.794 -21.321 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.579 16.454 -18.843 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.373 16.887 -19.987 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -5.024 15.684 -18.761 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.267 15.403 -21.873 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.233 14.280 -22.800 1.00 0.00 C ATOM 1417 C ILE B 683 -2.377 14.695 -24.007 1.00 0.00 C ATOM 1418 O ILE B 683 -2.643 15.735 -24.597 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.679 13.862 -23.165 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.390 13.158 -21.983 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.676 12.917 -24.378 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -6.085 14.009 -20.933 1.00 0.00 C ATOM 0 H ILE B 683 -3.325 16.308 -22.341 1.00 0.00 H new ATOM 0 HA ILE B 683 -2.774 13.395 -22.359 1.00 0.00 H new ATOM 0 HB ILE B 683 -5.223 14.775 -23.405 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -6.133 12.479 -22.402 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -4.649 12.543 -21.472 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.700 12.633 -24.621 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -4.228 13.423 -25.233 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -4.098 12.023 -24.142 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.531 13.362 -20.177 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.358 14.670 -20.461 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.865 14.606 -21.406 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.372 13.900 -24.394 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.396 14.199 -25.456 1.00 0.00 C ATOM 1436 C ASP B 684 -0.205 12.960 -26.347 1.00 0.00 C ATOM 1437 O ASP B 684 -0.334 11.843 -25.828 1.00 0.00 O ATOM 1438 CB ASP B 684 0.938 14.584 -24.814 1.00 0.00 C ATOM 1439 CG ASP B 684 2.005 14.957 -25.846 1.00 0.00 C ATOM 1440 OD1 ASP B 684 2.727 14.045 -26.306 1.00 0.00 O ATOM 1441 OD2 ASP B 684 2.122 16.161 -26.180 1.00 0.00 O ATOM 0 H ASP B 684 -1.207 12.992 -23.959 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.760 15.024 -26.068 1.00 0.00 H new ATOM 0 HB2 ASP B 684 0.782 15.425 -24.139 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.299 13.752 -24.209 1.00 0.00 H new ATOM 1446 N PRO B 685 0.088 13.088 -27.660 1.00 0.00 N ATOM 1447 CA PRO B 685 0.283 11.938 -28.533 1.00 0.00 C ATOM 1448 C PRO B 685 1.304 10.917 -28.021 1.00 0.00 C ATOM 1449 O PRO B 685 1.148 9.743 -28.333 1.00 0.00 O ATOM 1450 CB PRO B 685 0.690 12.494 -29.900 1.00 0.00 C ATOM 1451 CG PRO B 685 0.085 13.892 -29.905 1.00 0.00 C ATOM 1452 CD PRO B 685 0.204 14.313 -28.443 1.00 0.00 C ATOM 0 HA PRO B 685 -0.647 11.372 -28.580 1.00 0.00 H new ATOM 0 HB2 PRO B 685 1.773 12.524 -30.015 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.300 11.884 -30.715 1.00 0.00 H new ATOM 0 HG2 PRO B 685 0.629 14.566 -30.566 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -0.952 13.884 -30.241 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.158 14.807 -28.256 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.580 15.022 -28.176 1.00 0.00 H new ATOM 1460 N GLN B 686 2.310 11.322 -27.233 1.00 0.00 N ATOM 1461 CA GLN B 686 3.346 10.437 -26.692 1.00 0.00 C ATOM 1462 C GLN B 686 2.721 9.186 -26.063 1.00 0.00 C ATOM 1463 O GLN B 686 2.869 8.079 -26.581 1.00 0.00 O ATOM 1464 CB GLN B 686 4.170 11.246 -25.667 1.00 0.00 C ATOM 1465 CG GLN B 686 5.163 10.429 -24.819 1.00 0.00 C ATOM 1466 CD GLN B 686 5.757 11.261 -23.677 1.00 0.00 C ATOM 1467 OE1 GLN B 686 6.961 11.497 -23.626 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.944 11.713 -22.726 1.00 0.00 N ATOM 0 H GLN B 686 2.427 12.295 -26.949 1.00 0.00 H new ATOM 0 HA GLN B 686 4.002 10.085 -27.488 1.00 0.00 H new ATOM 0 HB2 GLN B 686 4.725 12.017 -26.201 1.00 0.00 H new ATOM 0 HB3 GLN B 686 3.480 11.757 -24.995 1.00 0.00 H new ATOM 0 HG2 GLN B 686 4.657 9.556 -24.407 1.00 0.00 H new ATOM 0 HG3 GLN B 686 5.967 10.060 -25.456 1.00 0.00 H new ATOM 0 HE21 GLN B 686 3.945 11.514 -22.773 1.00 0.00 H new ATOM 0 HE22 GLN B 686 5.320 12.258 -21.950 1.00 0.00 H new ATOM 1477 N VAL B 687 1.990 9.357 -24.956 1.00 0.00 N ATOM 1478 CA VAL B 687 1.406 8.246 -24.241 1.00 0.00 C ATOM 1479 C VAL B 687 0.392 7.551 -25.139 1.00 0.00 C ATOM 1480 O VAL B 687 0.280 6.340 -25.056 1.00 0.00 O ATOM 1481 CB VAL B 687 0.791 8.765 -22.938 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.508 7.612 -21.976 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.729 9.758 -22.236 1.00 0.00 C ATOM 0 H VAL B 687 1.795 10.269 -24.542 1.00 0.00 H new ATOM 0 HA VAL B 687 2.160 7.505 -23.975 1.00 0.00 H new ATOM 0 HB VAL B 687 -0.139 9.268 -23.203 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.072 8.004 -21.057 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.189 6.914 -22.440 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.439 7.095 -21.744 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.264 10.108 -21.314 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.672 9.264 -22.002 1.00 0.00 H new ATOM 0 HG23 VAL B 687 1.917 10.607 -22.893 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.304 8.271 -26.023 1.00 0.00 N ATOM 1494 CA PHE B 688 -1.297 7.670 -26.901 1.00 0.00 C ATOM 1495 C PHE B 688 -0.673 6.690 -27.904 1.00 0.00 C ATOM 1496 O PHE B 688 -1.235 5.626 -28.177 1.00 0.00 O ATOM 1497 CB PHE B 688 -2.056 8.787 -27.616 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.396 8.313 -28.119 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.378 7.955 -27.182 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.658 8.205 -29.492 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.637 7.513 -27.600 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -4.915 7.746 -29.919 1.00 0.00 C ATOM 1503 CZ PHE B 688 -5.899 7.396 -28.975 1.00 0.00 C ATOM 0 H PHE B 688 -0.193 9.277 -26.146 1.00 0.00 H new ATOM 0 HA PHE B 688 -1.987 7.081 -26.297 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -2.198 9.625 -26.934 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.462 9.154 -28.453 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -4.159 8.022 -26.127 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -2.901 8.472 -30.214 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.398 7.265 -26.875 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -5.127 7.661 -30.975 1.00 0.00 H new ATOM 0 HZ PHE B 688 -6.860 7.036 -29.310 1.00 0.00 H new ATOM 1513 N TYR B 689 0.501 7.017 -28.448 1.00 0.00 N ATOM 1514 CA TYR B 689 1.238 6.128 -29.335 1.00 0.00 C ATOM 1515 C TYR B 689 1.859 4.956 -28.583 1.00 0.00 C ATOM 1516 O TYR B 689 2.083 3.898 -29.170 1.00 0.00 O ATOM 1517 CB TYR B 689 2.364 6.894 -30.042 1.00 0.00 C ATOM 1518 CG TYR B 689 1.904 7.893 -31.081 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.972 7.517 -32.070 1.00 0.00 C ATOM 1520 CD2 TYR B 689 2.448 9.189 -31.088 1.00 0.00 C ATOM 1521 CE1 TYR B 689 0.571 8.438 -33.050 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.069 10.112 -32.081 1.00 0.00 C ATOM 1523 CZ TYR B 689 1.122 9.738 -33.067 1.00 0.00 C ATOM 1524 OH TYR B 689 0.735 10.614 -34.039 1.00 0.00 O ATOM 0 H TYR B 689 0.965 7.910 -28.282 1.00 0.00 H new ATOM 0 HA TYR B 689 0.521 5.743 -30.060 1.00 0.00 H new ATOM 0 HB2 TYR B 689 2.953 7.420 -29.290 1.00 0.00 H new ATOM 0 HB3 TYR B 689 3.028 6.174 -30.521 1.00 0.00 H new ATOM 0 HD1 TYR B 689 0.565 6.517 -32.073 1.00 0.00 H new ATOM 0 HD2 TYR B 689 3.160 9.478 -30.329 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -0.160 8.152 -33.792 1.00 0.00 H new ATOM 0 HE2 TYR B 689 2.499 11.103 -32.091 1.00 0.00 H new ATOM 0 HH TYR B 689 1.202 11.467 -33.915 1.00 0.00 H new ATOM 1534 N GLU B 690 2.146 5.150 -27.298 1.00 0.00 N ATOM 1535 CA GLU B 690 2.949 4.221 -26.521 1.00 0.00 C ATOM 1536 C GLU B 690 2.106 3.246 -25.700 1.00 0.00 C ATOM 1537 O GLU B 690 2.540 2.116 -25.452 1.00 0.00 O ATOM 1538 CB GLU B 690 3.860 5.118 -25.664 1.00 0.00 C ATOM 1539 CG GLU B 690 4.459 4.478 -24.423 1.00 0.00 C ATOM 1540 CD GLU B 690 5.404 3.286 -24.688 1.00 0.00 C ATOM 1541 OE1 GLU B 690 5.958 3.160 -25.808 1.00 0.00 O ATOM 1542 OE2 GLU B 690 5.637 2.490 -23.748 1.00 0.00 O ATOM 0 H GLU B 690 1.825 5.960 -26.768 1.00 0.00 H new ATOM 0 HA GLU B 690 3.532 3.556 -27.158 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.676 5.477 -26.292 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.287 5.992 -25.356 1.00 0.00 H new ATOM 0 HG2 GLU B 690 5.008 5.240 -23.870 1.00 0.00 H new ATOM 0 HG3 GLU B 690 3.646 4.141 -23.780 1.00 0.00 H new ATOM 1549 N LEU B 691 0.905 3.654 -25.285 1.00 0.00 N ATOM 1550 CA LEU B 691 -0.061 2.768 -24.655 1.00 0.00 C ATOM 1551 C LEU B 691 -0.491 1.674 -25.638 1.00 0.00 C ATOM 1552 O LEU B 691 -0.209 1.749 -26.840 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.217 3.581 -24.036 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.179 4.352 -24.965 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -3.035 3.464 -25.849 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -3.112 5.211 -24.103 1.00 0.00 C ATOM 0 H LEU B 691 0.579 4.616 -25.380 1.00 0.00 H new ATOM 0 HA LEU B 691 0.395 2.242 -23.816 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.818 2.895 -23.439 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -0.778 4.303 -23.347 1.00 0.00 H new ATOM 0 HG LEU B 691 -1.553 4.950 -25.628 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -3.682 4.084 -26.470 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -2.392 2.858 -26.487 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.647 2.812 -25.226 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.798 5.762 -24.747 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -3.682 4.568 -23.432 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.521 5.914 -23.517 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.180 0.657 -25.107 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.615 -0.521 -25.851 1.00 0.00 C ATOM 1570 C ALA B 692 -2.320 -0.106 -27.141 1.00 0.00 C ATOM 1571 O ALA B 692 -3.289 0.652 -27.088 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.554 -1.347 -24.971 1.00 0.00 C ATOM 0 H ALA B 692 -1.455 0.634 -24.125 1.00 0.00 H new ATOM 0 HA ALA B 692 -0.747 -1.122 -26.120 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -2.884 -2.229 -25.519 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -2.028 -1.657 -24.068 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.420 -0.745 -24.698 1.00 0.00 H new ATOM 1578 N GLU B 693 -1.892 -0.636 -28.284 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.437 -0.243 -29.584 1.00 0.00 C ATOM 1580 C GLU B 693 -3.939 -0.426 -29.614 1.00 0.00 C ATOM 1581 O GLU B 693 -4.656 0.445 -30.095 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.828 -1.090 -30.696 1.00 0.00 C ATOM 1583 CG GLU B 693 -0.443 -0.545 -31.077 1.00 0.00 C ATOM 1584 CD GLU B 693 0.223 -1.425 -32.146 1.00 0.00 C ATOM 1585 OE1 GLU B 693 0.002 -1.190 -33.359 1.00 0.00 O ATOM 1586 OE2 GLU B 693 0.984 -2.355 -31.782 1.00 0.00 O ATOM 0 H GLU B 693 -1.162 -1.346 -28.337 1.00 0.00 H new ATOM 0 HA GLU B 693 -2.192 0.808 -29.739 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.742 -2.126 -30.369 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -2.482 -1.084 -31.568 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.540 0.475 -31.450 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.190 -0.502 -30.191 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.436 -1.525 -29.054 1.00 0.00 N ATOM 1594 CA ALA B 694 -5.857 -1.804 -29.094 1.00 0.00 C ATOM 1595 C ALA B 694 -6.647 -0.716 -28.340 1.00 0.00 C ATOM 1596 O ALA B 694 -7.731 -0.324 -28.774 1.00 0.00 O ATOM 1597 CB ALA B 694 -6.106 -3.192 -28.509 1.00 0.00 C ATOM 0 H ALA B 694 -3.876 -2.228 -28.572 1.00 0.00 H new ATOM 0 HA ALA B 694 -6.207 -1.792 -30.126 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -7.173 -3.412 -28.535 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.568 -3.936 -29.096 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.754 -3.221 -27.478 1.00 0.00 H new ATOM 1603 N VAL B 695 -6.088 -0.185 -27.248 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.662 0.935 -26.508 1.00 0.00 C ATOM 1605 C VAL B 695 -6.566 2.203 -27.353 1.00 0.00 C ATOM 1606 O VAL B 695 -7.540 2.942 -27.412 1.00 0.00 O ATOM 1607 CB VAL B 695 -5.963 1.076 -25.136 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.122 2.447 -24.468 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.497 0.026 -24.161 1.00 0.00 C ATOM 0 H VAL B 695 -5.213 -0.528 -26.851 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.718 0.755 -26.307 1.00 0.00 H new ATOM 0 HB VAL B 695 -4.904 0.940 -25.354 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.598 2.449 -23.512 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.701 3.217 -25.114 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.180 2.651 -24.302 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -5.997 0.136 -23.199 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.570 0.164 -24.030 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.305 -0.971 -24.558 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.440 2.466 -28.027 1.00 0.00 N ATOM 1620 CA GLN B 696 -5.286 3.623 -28.901 1.00 0.00 C ATOM 1621 C GLN B 696 -6.366 3.592 -29.982 1.00 0.00 C ATOM 1622 O GLN B 696 -7.037 4.596 -30.180 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.861 3.626 -29.479 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.583 4.652 -30.580 1.00 0.00 C ATOM 1625 CD GLN B 696 -2.344 4.257 -31.381 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -2.409 3.995 -32.579 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -1.199 4.168 -30.725 1.00 0.00 N ATOM 0 H GLN B 696 -4.609 1.876 -27.978 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.417 4.553 -28.347 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -3.160 3.800 -28.663 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.649 2.633 -29.874 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -4.444 4.724 -31.244 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.438 5.638 -30.138 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -1.163 4.389 -29.730 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.352 3.878 -31.214 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.578 2.458 -30.657 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.601 2.338 -31.701 1.00 0.00 C ATOM 1638 C LYS B 697 -8.991 2.595 -31.126 1.00 0.00 C ATOM 1639 O LYS B 697 -9.747 3.398 -31.674 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.545 0.938 -32.339 1.00 0.00 C ATOM 1641 CG LYS B 697 -6.238 0.630 -33.087 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.901 1.562 -34.266 1.00 0.00 C ATOM 1643 CE LYS B 697 -7.023 1.608 -35.322 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.592 2.295 -36.572 1.00 0.00 N ATOM 0 H LYS B 697 -6.048 1.601 -30.496 1.00 0.00 H new ATOM 0 HA LYS B 697 -7.400 3.087 -32.467 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.687 0.191 -31.558 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -8.379 0.835 -33.033 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -5.416 0.668 -32.373 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -6.288 -0.393 -33.461 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.720 2.569 -33.889 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.977 1.227 -34.737 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.339 0.592 -35.558 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -7.889 2.123 -34.907 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -7.378 2.302 -37.253 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -6.315 3.273 -36.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -5.782 1.790 -36.984 1.00 0.00 H new ATOM 1658 N GLU B 698 -9.318 1.924 -30.022 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.628 2.048 -29.387 1.00 0.00 C ATOM 1660 C GLU B 698 -10.880 3.501 -28.964 1.00 0.00 C ATOM 1661 O GLU B 698 -11.954 4.049 -29.225 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.715 1.086 -28.190 1.00 0.00 C ATOM 1663 CG GLU B 698 -12.117 1.076 -27.565 1.00 0.00 C ATOM 1664 CD GLU B 698 -12.237 0.030 -26.439 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -12.507 -1.158 -26.733 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -12.080 0.399 -25.249 1.00 0.00 O ATOM 0 H GLU B 698 -8.685 1.282 -29.545 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.406 1.775 -30.100 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -10.455 0.078 -28.514 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -9.983 1.377 -27.436 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -12.344 2.065 -27.167 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -12.857 0.865 -28.337 1.00 0.00 H new ATOM 1673 N LEU B 699 -9.877 4.147 -28.360 1.00 0.00 N ATOM 1674 CA LEU B 699 -9.965 5.532 -27.926 1.00 0.00 C ATOM 1675 C LEU B 699 -10.090 6.441 -29.114 1.00 0.00 C ATOM 1676 O LEU B 699 -10.930 7.319 -29.091 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.705 5.967 -27.168 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.738 5.581 -25.694 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.313 5.595 -25.121 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.635 6.554 -24.902 1.00 0.00 C ATOM 0 H LEU B 699 -8.976 3.713 -28.160 1.00 0.00 H new ATOM 0 HA LEU B 699 -10.837 5.601 -27.276 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -7.831 5.516 -27.637 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.591 7.048 -27.253 1.00 0.00 H new ATOM 0 HG LEU B 699 -9.152 4.577 -25.603 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.342 5.318 -24.067 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.695 4.882 -25.666 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -6.890 6.594 -25.222 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.647 6.264 -23.851 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.243 7.567 -24.994 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.649 6.520 -25.300 1.00 0.00 H new ATOM 1692 N LEU B 700 -9.278 6.254 -30.146 1.00 0.00 N ATOM 1693 CA LEU B 700 -9.266 7.127 -31.304 1.00 0.00 C ATOM 1694 C LEU B 700 -10.636 7.148 -31.960 1.00 0.00 C ATOM 1695 O LEU B 700 -11.124 8.219 -32.297 1.00 0.00 O ATOM 1696 CB LEU B 700 -8.174 6.640 -32.260 1.00 0.00 C ATOM 1697 CG LEU B 700 -8.027 7.479 -33.538 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.727 8.946 -33.215 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.879 6.887 -34.357 1.00 0.00 C ATOM 0 H LEU B 700 -8.607 5.488 -30.200 1.00 0.00 H new ATOM 0 HA LEU B 700 -9.043 8.153 -31.012 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -7.221 6.636 -31.731 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -8.387 5.608 -32.540 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.963 7.452 -34.096 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.629 9.510 -34.143 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.541 9.362 -32.621 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.797 9.011 -32.651 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.750 7.464 -35.273 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.959 6.923 -33.773 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -7.108 5.852 -34.609 1.00 0.00 H new ATOM 1711 N ALA B 701 -11.282 5.991 -32.075 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.653 5.920 -32.558 1.00 0.00 C ATOM 1713 C ALA B 701 -13.609 6.655 -31.612 1.00 0.00 C ATOM 1714 O ALA B 701 -14.512 7.337 -32.084 1.00 0.00 O ATOM 1715 CB ALA B 701 -13.054 4.455 -32.739 1.00 0.00 C ATOM 0 H ALA B 701 -10.873 5.087 -31.838 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.718 6.420 -33.525 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -14.081 4.401 -33.101 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -12.389 3.982 -33.462 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -12.978 3.936 -31.783 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.404 6.584 -30.296 1.00 0.00 N ATOM 1722 CA GLU B 702 -14.159 7.364 -29.317 1.00 0.00 C ATOM 1723 C GLU B 702 -13.963 8.865 -29.581 1.00 0.00 C ATOM 1724 O GLU B 702 -14.924 9.625 -29.697 1.00 0.00 O ATOM 1725 CB GLU B 702 -13.699 6.987 -27.895 1.00 0.00 C ATOM 1726 CG GLU B 702 -14.827 6.839 -26.870 1.00 0.00 C ATOM 1727 CD GLU B 702 -15.526 5.471 -26.923 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.256 5.199 -27.905 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -15.338 4.687 -25.959 1.00 0.00 O ATOM 0 H GLU B 702 -12.701 5.976 -29.876 1.00 0.00 H new ATOM 0 HA GLU B 702 -15.222 7.140 -29.408 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -13.147 6.048 -27.944 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -13.003 7.747 -27.540 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -14.421 6.993 -25.870 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.566 7.623 -27.038 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.721 9.321 -29.720 1.00 0.00 N ATOM 1737 CA TRP B 703 -12.366 10.714 -29.876 1.00 0.00 C ATOM 1738 C TRP B 703 -12.878 11.251 -31.226 1.00 0.00 C ATOM 1739 O TRP B 703 -13.265 12.414 -31.339 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.834 10.798 -29.705 1.00 0.00 C ATOM 1741 CG TRP B 703 -10.204 10.210 -28.457 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.813 9.694 -27.364 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.795 10.199 -28.101 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -9.900 9.393 -26.371 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.645 9.767 -26.756 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.635 10.619 -28.759 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.460 9.892 -26.037 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.419 10.741 -28.056 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -6.344 10.438 -26.680 1.00 0.00 C ATOM 0 H TRP B 703 -11.910 8.702 -29.726 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.837 11.351 -29.128 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -10.379 10.309 -30.566 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.554 11.850 -29.751 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -11.878 9.537 -27.279 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -10.131 8.955 -25.479 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.671 10.852 -29.813 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.403 9.575 -25.006 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.533 11.071 -28.578 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.434 10.626 -26.129 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.960 10.382 -32.242 1.00 0.00 N ATOM 1761 CA LYS B 704 -13.488 10.681 -33.574 1.00 0.00 C ATOM 1762 C LYS B 704 -15.008 10.646 -33.644 1.00 0.00 C ATOM 1763 O LYS B 704 -15.577 11.352 -34.476 1.00 0.00 O ATOM 1764 CB LYS B 704 -12.944 9.649 -34.583 1.00 0.00 C ATOM 1765 CG LYS B 704 -11.476 9.873 -34.986 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.354 11.019 -35.999 1.00 0.00 C ATOM 1767 CE LYS B 704 -9.899 11.289 -36.414 1.00 0.00 C ATOM 1768 NZ LYS B 704 -9.419 10.376 -37.489 1.00 0.00 N ATOM 0 H LYS B 704 -12.648 9.415 -32.152 1.00 0.00 H new ATOM 0 HA LYS B 704 -13.165 11.695 -33.811 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -13.043 8.652 -34.154 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -13.563 9.674 -35.480 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -10.882 10.101 -34.101 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -11.069 8.958 -35.416 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.942 10.780 -36.885 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -11.780 11.926 -35.569 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -9.810 12.320 -36.755 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -9.253 11.185 -35.542 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -8.433 10.607 -37.726 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -9.475 9.391 -37.159 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -10.014 10.492 -38.334 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.682 9.837 -32.823 1.00 0.00 N ATOM 1783 CA ARG B 705 -17.136 9.641 -32.976 1.00 0.00 C ATOM 1784 C ARG B 705 -17.866 10.768 -32.264 1.00 0.00 C ATOM 1785 O ARG B 705 -18.900 11.239 -32.736 1.00 0.00 O ATOM 1786 CB ARG B 705 -17.595 8.234 -32.529 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.655 8.048 -31.011 1.00 0.00 C ATOM 1788 CD ARG B 705 -17.574 6.599 -30.530 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.739 5.785 -30.917 1.00 0.00 N ATOM 1790 CZ ARG B 705 -19.145 4.676 -30.280 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -18.487 4.212 -29.217 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -20.213 4.016 -30.726 1.00 0.00 N ATOM 0 H ARG B 705 -15.259 9.313 -32.057 1.00 0.00 H new ATOM 0 HA ARG B 705 -17.392 9.685 -34.035 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -18.582 8.036 -32.948 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.916 7.492 -32.948 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.838 8.610 -30.559 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -18.584 8.485 -30.644 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -16.671 6.141 -30.933 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -17.479 6.590 -29.444 1.00 0.00 H new ATOM 0 HE ARG B 705 -19.277 6.087 -31.729 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -17.660 4.702 -28.875 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -18.811 3.367 -28.746 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -20.716 4.355 -31.546 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -20.528 3.172 -30.247 1.00 0.00 H new ATOM 1806 N THR B 706 -17.292 11.226 -31.150 1.00 0.00 N ATOM 1807 CA THR B 706 -17.709 12.426 -30.454 1.00 0.00 C ATOM 1808 C THR B 706 -17.433 13.632 -31.359 1.00 0.00 C ATOM 1809 O THR B 706 -18.243 14.554 -31.445 1.00 0.00 O ATOM 1810 CB THR B 706 -16.940 12.485 -29.132 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.552 12.398 -29.390 1.00 0.00 O ATOM 1812 CG2 THR B 706 -17.306 11.295 -28.253 1.00 0.00 C ATOM 0 H THR B 706 -16.506 10.755 -30.703 1.00 0.00 H new ATOM 0 HA THR B 706 -18.775 12.429 -30.226 1.00 0.00 H new ATOM 0 HB THR B 706 -17.194 13.421 -28.633 1.00 0.00 H new ATOM 0 HG1 THR B 706 -15.277 11.457 -29.389 1.00 0.00 H new ATOM 0 HG21 THR B 706 -16.751 11.350 -27.316 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.375 11.313 -28.043 1.00 0.00 H new ATOM 0 HG23 THR B 706 -17.053 10.369 -28.770 1.00 0.00 H new ATOM 1820 N GLY B 707 -16.299 13.585 -32.070 1.00 0.00 N ATOM 1821 CA GLY B 707 -15.936 14.505 -33.138 1.00 0.00 C ATOM 1822 C GLY B 707 -14.913 15.522 -32.647 1.00 0.00 C ATOM 1823 O GLY B 707 -13.926 15.801 -33.329 1.00 0.00 O ATOM 0 H GLY B 707 -15.586 12.874 -31.905 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -15.527 13.948 -33.981 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -16.826 15.021 -33.498 1.00 0.00 H new ATOM 1827 N SER B 708 -15.100 15.992 -31.414 1.00 0.00 N ATOM 1828 CA SER B 708 -14.250 16.981 -30.763 1.00 0.00 C ATOM 1829 C SER B 708 -13.734 16.433 -29.420 1.00 0.00 C ATOM 1830 O SER B 708 -13.337 17.217 -28.560 1.00 0.00 O ATOM 1831 CB SER B 708 -15.044 18.286 -30.605 1.00 0.00 C ATOM 1832 OG SER B 708 -15.621 18.696 -31.844 1.00 0.00 O ATOM 0 H SER B 708 -15.873 15.683 -30.824 1.00 0.00 H new ATOM 0 HA SER B 708 -13.370 17.193 -31.371 1.00 0.00 H new ATOM 0 HB2 SER B 708 -15.831 18.148 -29.863 1.00 0.00 H new ATOM 0 HB3 SER B 708 -14.387 19.071 -30.230 1.00 0.00 H new ATOM 0 HG SER B 708 -16.122 19.528 -31.712 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.778 15.102 -29.229 1.00 0.00 N ATOM 1839 CA ASP B 709 -13.364 14.365 -28.027 1.00 0.00 C ATOM 1840 C ASP B 709 -14.028 14.816 -26.707 1.00 0.00 C ATOM 1841 O ASP B 709 -13.645 14.368 -25.623 1.00 0.00 O ATOM 1842 CB ASP B 709 -11.834 14.275 -27.934 1.00 0.00 C ATOM 1843 CG ASP B 709 -11.074 15.526 -27.401 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.395 16.102 -26.328 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -10.073 15.894 -28.064 1.00 0.00 O ATOM 0 H ASP B 709 -14.125 14.476 -29.956 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.755 13.356 -28.160 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.585 13.430 -27.292 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -11.449 14.045 -28.927 1.00 0.00 H new ATOM 1850 N PHE B 710 -15.089 15.628 -26.805 1.00 0.00 N ATOM 1851 CA PHE B 710 -15.763 16.366 -25.755 1.00 0.00 C ATOM 1852 C PHE B 710 -14.834 17.340 -25.012 1.00 0.00 C ATOM 1853 O PHE B 710 -14.997 18.553 -25.168 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.503 15.419 -24.803 1.00 0.00 C ATOM 1855 CG PHE B 710 -17.618 14.582 -25.405 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.592 15.152 -26.252 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.709 13.217 -25.069 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.630 14.358 -26.775 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.758 12.434 -25.577 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.709 12.998 -26.438 1.00 0.00 C ATOM 0 H PHE B 710 -15.530 15.793 -27.710 1.00 0.00 H new ATOM 0 HA PHE B 710 -16.510 16.995 -26.239 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -15.772 14.743 -24.359 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -16.923 16.012 -23.991 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -18.541 16.202 -26.500 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -16.970 12.772 -24.419 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.365 14.795 -27.435 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.832 11.392 -25.303 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.502 12.386 -26.842 1.00 0.00 H new ATOM 1870 N HIS B 711 -13.882 16.844 -24.215 1.00 0.00 N ATOM 1871 CA HIS B 711 -13.074 17.641 -23.283 1.00 0.00 C ATOM 1872 C HIS B 711 -12.025 16.750 -22.612 1.00 0.00 C ATOM 1873 O HIS B 711 -12.025 16.599 -21.392 1.00 0.00 O ATOM 1874 CB HIS B 711 -13.971 18.372 -22.250 1.00 0.00 C ATOM 1875 CG HIS B 711 -15.152 17.584 -21.709 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -16.448 18.097 -21.562 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -15.153 16.273 -21.319 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -17.193 17.082 -21.094 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -16.443 15.976 -20.941 1.00 0.00 N ATOM 0 H HIS B 711 -13.645 15.852 -24.199 1.00 0.00 H new ATOM 0 HA HIS B 711 -12.548 18.416 -23.840 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -13.347 18.675 -21.409 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -14.350 19.284 -22.711 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -14.307 15.602 -21.309 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -18.248 17.145 -20.871 1.00 0.00 H new ATOM 0 HE2 HIS B 711 -16.773 15.072 -20.603 1.00 0.00 H new ATOM 1887 N ILE B 712 -11.162 16.093 -23.387 1.00 0.00 N ATOM 1888 CA ILE B 712 -10.263 15.054 -22.883 1.00 0.00 C ATOM 1889 C ILE B 712 -9.421 15.440 -21.666 1.00 0.00 C ATOM 1890 O ILE B 712 -9.288 14.633 -20.751 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.463 14.466 -24.065 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -10.332 13.352 -24.667 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -8.102 13.882 -23.700 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.676 12.582 -25.794 1.00 0.00 C ATOM 0 H ILE B 712 -11.066 16.267 -24.387 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.881 14.264 -22.456 1.00 0.00 H new ATOM 0 HB ILE B 712 -9.248 15.283 -24.754 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.603 12.653 -23.876 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -11.259 13.791 -25.036 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.620 13.495 -24.598 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.478 14.660 -23.260 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -8.234 13.073 -22.982 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -10.361 11.816 -26.158 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -9.430 13.265 -26.607 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.764 12.109 -25.429 1.00 0.00 H new ATOM 1906 N GLY B 713 -8.873 16.648 -21.579 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.116 17.050 -20.387 1.00 0.00 C ATOM 1908 C GLY B 713 -9.071 17.718 -19.406 1.00 0.00 C ATOM 1909 O GLY B 713 -8.915 18.901 -19.108 1.00 0.00 O ATOM 0 H GLY B 713 -8.934 17.361 -22.306 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -7.647 16.181 -19.926 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -7.315 17.736 -20.661 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.111 16.985 -19.007 1.00 0.00 N ATOM 1914 CA HIS B 714 -11.248 17.500 -18.251 1.00 0.00 C ATOM 1915 C HIS B 714 -10.809 18.197 -16.954 1.00 0.00 C ATOM 1916 O HIS B 714 -9.770 17.849 -16.379 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.224 16.347 -17.991 1.00 0.00 C ATOM 1918 CG HIS B 714 -13.509 16.798 -17.355 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -13.818 16.668 -16.001 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -14.519 17.465 -17.987 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -15.015 17.262 -15.846 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -15.461 17.739 -17.020 1.00 0.00 N ATOM 0 H HIS B 714 -10.186 15.988 -19.208 1.00 0.00 H new ATOM 0 HA HIS B 714 -11.753 18.269 -18.836 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -12.447 15.848 -18.934 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -11.744 15.611 -17.346 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -14.569 17.725 -19.034 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -15.544 17.344 -14.908 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -16.347 18.222 -17.170 1.00 0.00 H new ATOM 1930 N LYS B 715 -11.576 19.202 -16.524 1.00 0.00 N ATOM 1931 CA LYS B 715 -11.343 20.048 -15.358 1.00 0.00 C ATOM 1932 C LYS B 715 -12.713 20.445 -14.824 1.00 0.00 C ATOM 1933 O LYS B 715 -12.869 20.559 -13.587 1.00 0.00 O ATOM 1934 CB LYS B 715 -10.570 21.327 -15.725 1.00 0.00 C ATOM 1935 CG LYS B 715 -9.085 21.098 -16.032 1.00 0.00 C ATOM 1936 CD LYS B 715 -8.272 20.714 -14.782 1.00 0.00 C ATOM 1937 CE LYS B 715 -6.986 20.000 -15.198 1.00 0.00 C ATOM 1938 NZ LYS B 715 -7.209 18.562 -15.461 1.00 0.00 N ATOM 1939 OXT LYS B 715 -13.632 20.684 -15.646 1.00 0.00 O ATOM 0 H LYS B 715 -12.432 19.461 -17.016 1.00 0.00 H new ATOM 0 HA LYS B 715 -10.749 19.502 -14.625 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -11.042 21.787 -16.593 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -10.654 22.037 -14.903 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -8.990 20.309 -16.779 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -8.665 22.004 -16.470 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -8.032 21.607 -14.205 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -8.865 20.067 -14.136 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -6.582 20.473 -16.093 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -6.239 20.113 -14.413 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -6.453 18.200 -16.076 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -7.203 18.040 -14.562 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -8.128 18.433 -15.930 1.00 0.00 H new TER 1953 LYS B 715