USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1124 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 129 ASN : amide:sc= -5.91! C(o=-9.9!,f=-13!) USER MOD Set 1.2: A 132 GLN : amide:sc= -3.96! C(o=-9.9!,f=-10!) USER MOD Set 2.1: A 27 THR OG1 : rot 180:sc= 0.00346 USER MOD Set 2.2: A 59 ASN : amide:sc= -1.22! C(o=-1.2!,f=-1.9!) USER MOD Set 3.1: A 36 CYS SG : rot -136:sc= 1.36 USER MOD Set 3.2: A 39 CYS SG : rot 180:sc= 0.411 USER MOD Set 4.1: A 7 SER OG : rot 0:sc= -1.82! USER MOD Set 4.2: A 18 SER OG : rot 113:sc= 0.951 USER MOD Single : A 1 MET CE :methyl -151:sc= -0.083 (180deg=-0.611) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 5 THR OG1 : rot -57:sc= 0.0757 USER MOD Single : A 8 THR OG1 : rot 85:sc= 0.563 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -100:sc= -0.644 USER MOD Single : A 14 ASN : amide:sc= -0.199 X(o=-0.2,f=-0.041) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -135:sc= -0.474 (180deg=-1.05) USER MOD Single : A 34 SER OG : rot -122:sc= 0.418 USER MOD Single : A 41 SER OG : rot -58:sc= 0.14 USER MOD Single : A 45 GLN : amide:sc= -0.208 X(o=-0.21,f=-0.21) USER MOD Single : A 46 THR OG1 : rot 81:sc= 1.26 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.0583 X(o=-0.058,f=-0.39) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -99:sc= -0.877 USER MOD Single : A 65 SER OG : rot 170:sc= -0.135 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 72 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0861) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -2.05! C(o=-2.1!,f=-6!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -5.72! C(o=-5.7!,f=-3.8!) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 44:sc= 0.257 USER MOD Single : A 95 ASN : amide:sc= -0.0247 K(o=-0.025,f=-0.64) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.031 X(o=-0.031,f=-0.25) USER MOD Single : A 102 SER OG : rot 90:sc= 0.972 USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 114:sc= 1.22 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -1.55 K(o=-1.5,f=-2.5) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= -0.897 USER MOD Single : A 141 ASN : amide:sc= -0.0307 K(o=-0.031,f=-0.67) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.559 -7.270 12.260 1.00 0.00 N ATOM 2 CA MET A 1 10.888 -6.762 11.076 1.00 0.00 C ATOM 3 C MET A 1 9.888 -7.784 10.530 1.00 0.00 C ATOM 4 O MET A 1 10.121 -8.389 9.485 1.00 0.00 O ATOM 5 CB MET A 1 11.924 -6.438 9.999 1.00 0.00 C ATOM 6 CG MET A 1 11.261 -5.822 8.766 1.00 0.00 C ATOM 7 SD MET A 1 11.513 -6.876 7.347 1.00 0.00 S ATOM 8 CE MET A 1 13.287 -6.768 7.192 1.00 0.00 C ATOM 0 H1 MET A 1 12.231 -6.558 12.610 1.00 0.00 H new ATOM 0 H2 MET A 1 10.855 -7.474 12.998 1.00 0.00 H new ATOM 0 H3 MET A 1 12.072 -8.143 12.021 1.00 0.00 H new ATOM 0 HA MET A 1 10.343 -5.859 11.352 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.666 -5.748 10.400 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.454 -7.347 9.715 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.194 -5.688 8.945 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.678 -4.834 8.574 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.570 -6.901 6.148 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.624 -5.791 7.538 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.753 -7.547 7.796 1.00 0.00 H new ATOM 18 N VAL A 2 8.797 -7.947 11.264 1.00 0.00 N ATOM 19 CA VAL A 2 7.762 -8.887 10.867 1.00 0.00 C ATOM 20 C VAL A 2 6.434 -8.142 10.718 1.00 0.00 C ATOM 21 O VAL A 2 6.269 -7.046 11.252 1.00 0.00 O ATOM 22 CB VAL A 2 7.691 -10.041 11.869 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.089 -10.573 12.191 1.00 0.00 C ATOM 24 CG2 VAL A 2 6.959 -9.616 13.144 1.00 0.00 C ATOM 0 H VAL A 2 8.607 -7.444 12.131 1.00 0.00 H new ATOM 0 HA VAL A 2 7.998 -9.329 9.899 1.00 0.00 H new ATOM 0 HB VAL A 2 7.122 -10.849 11.410 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.011 -11.393 12.905 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.561 -10.932 11.277 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.692 -9.773 12.621 1.00 0.00 H new ATOM 0 HG21 VAL A 2 6.923 -10.455 13.839 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.488 -8.783 13.607 1.00 0.00 H new ATOM 0 HG23 VAL A 2 5.944 -9.307 12.895 1.00 0.00 H new ATOM 34 N PRO A 3 5.495 -8.784 9.970 1.00 0.00 N ATOM 35 CA PRO A 3 4.187 -8.195 9.745 1.00 0.00 C ATOM 36 C PRO A 3 3.313 -8.301 10.997 1.00 0.00 C ATOM 37 O PRO A 3 2.312 -7.598 11.122 1.00 0.00 O ATOM 38 CB PRO A 3 3.616 -8.948 8.556 1.00 0.00 C ATOM 39 CG PRO A 3 4.419 -10.235 8.453 1.00 0.00 C ATOM 40 CD PRO A 3 5.656 -10.082 9.325 1.00 0.00 C ATOM 0 HA PRO A 3 4.238 -7.126 9.536 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.556 -9.159 8.700 1.00 0.00 H new ATOM 0 HB3 PRO A 3 3.703 -8.359 7.643 1.00 0.00 H new ATOM 0 HG2 PRO A 3 3.822 -11.085 8.783 1.00 0.00 H new ATOM 0 HG3 PRO A 3 4.702 -10.427 7.418 1.00 0.00 H new ATOM 0 HD2 PRO A 3 5.724 -10.884 10.060 1.00 0.00 H new ATOM 0 HD3 PRO A 3 6.568 -10.118 8.729 1.00 0.00 H new ATOM 48 N HIS A 4 3.725 -9.186 11.892 1.00 0.00 N ATOM 49 CA HIS A 4 2.993 -9.395 13.130 1.00 0.00 C ATOM 50 C HIS A 4 2.942 -8.087 13.922 1.00 0.00 C ATOM 51 O HIS A 4 1.921 -7.764 14.529 1.00 0.00 O ATOM 52 CB HIS A 4 3.596 -10.550 13.931 1.00 0.00 C ATOM 53 CG HIS A 4 2.663 -11.136 14.963 1.00 0.00 C ATOM 54 ND1 HIS A 4 1.934 -12.292 14.744 1.00 0.00 N ATOM 55 CD2 HIS A 4 2.350 -10.716 16.222 1.00 0.00 C ATOM 56 CE1 HIS A 4 1.216 -12.545 15.828 1.00 0.00 C ATOM 57 NE2 HIS A 4 1.474 -11.568 16.742 1.00 0.00 N ATOM 0 H HIS A 4 4.557 -9.767 11.785 1.00 0.00 H new ATOM 0 HA HIS A 4 1.966 -9.684 12.905 1.00 0.00 H new ATOM 0 HB2 HIS A 4 3.899 -11.338 13.241 1.00 0.00 H new ATOM 0 HB3 HIS A 4 4.499 -10.199 14.430 1.00 0.00 H new ATOM 0 HD2 HIS A 4 2.747 -9.840 16.713 1.00 0.00 H new ATOM 0 HE1 HIS A 4 0.544 -13.379 15.964 1.00 0.00 H new ATOM 0 HE2 HIS A 4 1.062 -11.502 17.673 1.00 0.00 H new ATOM 66 N THR A 5 4.055 -7.370 13.892 1.00 0.00 N ATOM 67 CA THR A 5 4.150 -6.105 14.601 1.00 0.00 C ATOM 68 C THR A 5 3.546 -4.978 13.761 1.00 0.00 C ATOM 69 O THR A 5 2.855 -4.107 14.289 1.00 0.00 O ATOM 70 CB THR A 5 5.619 -5.874 14.961 1.00 0.00 C ATOM 71 OG1 THR A 5 6.248 -5.620 13.708 1.00 0.00 O ATOM 72 CG2 THR A 5 6.303 -7.144 15.471 1.00 0.00 C ATOM 0 H THR A 5 4.899 -7.641 13.388 1.00 0.00 H new ATOM 0 HA THR A 5 3.573 -6.125 15.526 1.00 0.00 H new ATOM 0 HB THR A 5 5.689 -5.094 15.720 1.00 0.00 H new ATOM 0 HG1 THR A 5 6.097 -6.379 13.106 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.343 -6.925 15.712 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.790 -7.500 16.365 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.263 -7.913 14.700 1.00 0.00 H new ATOM 80 N LEU A 6 3.827 -5.030 12.468 1.00 0.00 N ATOM 81 CA LEU A 6 3.321 -4.024 11.550 1.00 0.00 C ATOM 82 C LEU A 6 1.832 -3.795 11.822 1.00 0.00 C ATOM 83 O LEU A 6 1.333 -2.683 11.666 1.00 0.00 O ATOM 84 CB LEU A 6 3.629 -4.415 10.103 1.00 0.00 C ATOM 85 CG LEU A 6 2.790 -3.721 9.028 1.00 0.00 C ATOM 86 CD1 LEU A 6 3.331 -2.321 8.729 1.00 0.00 C ATOM 87 CD2 LEU A 6 2.697 -4.580 7.765 1.00 0.00 C ATOM 0 H LEU A 6 4.399 -5.754 12.034 1.00 0.00 H new ATOM 0 HA LEU A 6 3.826 -3.072 11.712 1.00 0.00 H new ATOM 0 HB2 LEU A 6 4.680 -4.205 9.907 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.494 -5.492 10.002 1.00 0.00 H new ATOM 0 HG LEU A 6 1.777 -3.600 9.411 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.717 -1.850 7.962 1.00 0.00 H new ATOM 0 HD12 LEU A 6 3.303 -1.719 9.637 1.00 0.00 H new ATOM 0 HD13 LEU A 6 4.359 -2.396 8.375 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.095 -4.063 7.017 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.697 -4.754 7.369 1.00 0.00 H new ATOM 0 HD23 LEU A 6 2.232 -5.535 8.008 1.00 0.00 H new ATOM 99 N SER A 7 1.166 -4.868 12.223 1.00 0.00 N ATOM 100 CA SER A 7 -0.255 -4.800 12.517 1.00 0.00 C ATOM 101 C SER A 7 -0.534 -3.646 13.482 1.00 0.00 C ATOM 102 O SER A 7 -1.658 -3.153 13.559 1.00 0.00 O ATOM 103 CB SER A 7 -0.761 -6.118 13.107 1.00 0.00 C ATOM 104 OG SER A 7 -1.950 -5.940 13.871 1.00 0.00 O ATOM 0 H SER A 7 1.584 -5.789 12.351 1.00 0.00 H new ATOM 0 HA SER A 7 -0.789 -4.623 11.583 1.00 0.00 H new ATOM 0 HB2 SER A 7 -0.951 -6.827 12.301 1.00 0.00 H new ATOM 0 HB3 SER A 7 0.014 -6.553 13.738 1.00 0.00 H new ATOM 0 HG SER A 7 -2.205 -4.994 13.863 1.00 0.00 H new ATOM 110 N THR A 8 0.510 -3.248 14.196 1.00 0.00 N ATOM 111 CA THR A 8 0.391 -2.161 15.153 1.00 0.00 C ATOM 112 C THR A 8 0.157 -0.834 14.427 1.00 0.00 C ATOM 113 O THR A 8 -0.615 0.004 14.890 1.00 0.00 O ATOM 114 CB THR A 8 1.646 -2.162 16.028 1.00 0.00 C ATOM 115 OG1 THR A 8 1.616 -3.430 16.676 1.00 0.00 O ATOM 116 CG2 THR A 8 1.561 -1.155 17.175 1.00 0.00 C ATOM 0 H THR A 8 1.441 -3.659 14.131 1.00 0.00 H new ATOM 0 HA THR A 8 -0.475 -2.298 15.801 1.00 0.00 H new ATOM 0 HB THR A 8 2.517 -1.938 15.413 1.00 0.00 H new ATOM 0 HG1 THR A 8 2.024 -4.105 16.094 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.477 -1.197 17.764 1.00 0.00 H new ATOM 0 HG22 THR A 8 1.436 -0.151 16.769 1.00 0.00 H new ATOM 0 HG23 THR A 8 0.709 -1.398 17.810 1.00 0.00 H new ATOM 124 N LEU A 9 0.839 -0.684 13.302 1.00 0.00 N ATOM 125 CA LEU A 9 0.717 0.527 12.507 1.00 0.00 C ATOM 126 C LEU A 9 -0.753 0.950 12.456 1.00 0.00 C ATOM 127 O LEU A 9 -1.648 0.109 12.521 1.00 0.00 O ATOM 128 CB LEU A 9 1.348 0.328 11.128 1.00 0.00 C ATOM 129 CG LEU A 9 2.839 0.654 11.020 1.00 0.00 C ATOM 130 CD1 LEU A 9 3.078 2.164 11.088 1.00 0.00 C ATOM 131 CD2 LEU A 9 3.642 -0.102 12.081 1.00 0.00 C ATOM 0 H LEU A 9 1.479 -1.381 12.921 1.00 0.00 H new ATOM 0 HA LEU A 9 1.270 1.345 12.969 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.201 -0.710 10.829 1.00 0.00 H new ATOM 0 HB3 LEU A 9 0.808 0.946 10.411 1.00 0.00 H new ATOM 0 HG LEU A 9 3.193 0.317 10.046 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.146 2.367 11.009 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.554 2.653 10.267 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.705 2.549 12.037 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.699 0.147 11.983 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.292 0.183 13.073 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.508 -1.175 11.943 1.00 0.00 H new ATOM 143 N LYS A 10 -0.956 2.254 12.339 1.00 0.00 N ATOM 144 CA LYS A 10 -2.302 2.798 12.277 1.00 0.00 C ATOM 145 C LYS A 10 -2.517 3.466 10.918 1.00 0.00 C ATOM 146 O LYS A 10 -1.613 4.115 10.391 1.00 0.00 O ATOM 147 CB LYS A 10 -2.558 3.729 13.466 1.00 0.00 C ATOM 148 CG LYS A 10 -2.503 2.959 14.787 1.00 0.00 C ATOM 149 CD LYS A 10 -3.874 2.380 15.142 1.00 0.00 C ATOM 150 CE LYS A 10 -4.430 3.026 16.411 1.00 0.00 C ATOM 151 NZ LYS A 10 -5.469 2.166 17.020 1.00 0.00 N ATOM 0 H LYS A 10 -0.212 2.949 12.286 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.039 1.999 12.360 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -1.815 4.526 13.475 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.533 4.203 13.358 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -1.772 2.154 14.712 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -2.167 3.622 15.584 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -4.566 2.541 14.315 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.792 1.302 15.284 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -3.623 3.192 17.125 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -4.852 4.003 16.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -5.835 2.621 17.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -6.247 2.029 16.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -5.056 1.243 17.265 1.00 0.00 H new ATOM 164 N THR A 11 -3.717 3.285 10.388 1.00 0.00 N ATOM 165 CA THR A 11 -4.060 3.861 9.100 1.00 0.00 C ATOM 166 C THR A 11 -4.476 5.325 9.263 1.00 0.00 C ATOM 167 O THR A 11 -4.437 5.865 10.369 1.00 0.00 O ATOM 168 CB THR A 11 -5.147 2.989 8.467 1.00 0.00 C ATOM 169 OG1 THR A 11 -6.072 2.762 9.527 1.00 0.00 O ATOM 170 CG2 THR A 11 -4.640 1.590 8.108 1.00 0.00 C ATOM 0 H THR A 11 -4.464 2.747 10.827 1.00 0.00 H new ATOM 0 HA THR A 11 -3.200 3.872 8.431 1.00 0.00 H new ATOM 0 HB THR A 11 -5.528 3.478 7.571 1.00 0.00 H new ATOM 0 HG1 THR A 11 -5.917 1.874 9.912 1.00 0.00 H new ATOM 0 HG21 THR A 11 -5.450 1.013 7.663 1.00 0.00 H new ATOM 0 HG22 THR A 11 -3.819 1.672 7.396 1.00 0.00 H new ATOM 0 HG23 THR A 11 -4.290 1.088 9.010 1.00 0.00 H new ATOM 178 N ALA A 12 -4.861 5.925 8.147 1.00 0.00 N ATOM 179 CA ALA A 12 -5.283 7.316 8.154 1.00 0.00 C ATOM 180 C ALA A 12 -6.670 7.422 8.793 1.00 0.00 C ATOM 181 O ALA A 12 -7.193 8.520 8.971 1.00 0.00 O ATOM 182 CB ALA A 12 -5.258 7.864 6.725 1.00 0.00 C ATOM 0 H ALA A 12 -4.890 5.475 7.232 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.599 7.921 8.749 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.574 8.907 6.730 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.246 7.794 6.326 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -5.936 7.282 6.100 1.00 0.00 H new ATOM 188 N ASP A 13 -7.224 6.264 9.121 1.00 0.00 N ATOM 189 CA ASP A 13 -8.539 6.213 9.739 1.00 0.00 C ATOM 190 C ASP A 13 -8.394 5.799 11.204 1.00 0.00 C ATOM 191 O ASP A 13 -9.316 5.229 11.786 1.00 0.00 O ATOM 192 CB ASP A 13 -9.433 5.184 9.044 1.00 0.00 C ATOM 193 CG ASP A 13 -10.694 5.758 8.394 1.00 0.00 C ATOM 194 OD1 ASP A 13 -11.544 6.357 9.069 1.00 0.00 O ATOM 195 OD2 ASP A 13 -10.787 5.567 7.122 1.00 0.00 O ATOM 0 H ASP A 13 -6.787 5.355 8.971 1.00 0.00 H new ATOM 0 HA ASP A 13 -8.991 7.201 9.653 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.848 4.674 8.279 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.729 4.430 9.774 1.00 0.00 H new ATOM 201 N ASN A 14 -7.230 6.103 11.759 1.00 0.00 N ATOM 202 CA ASN A 14 -6.953 5.770 13.147 1.00 0.00 C ATOM 203 C ASN A 14 -7.360 4.319 13.410 1.00 0.00 C ATOM 204 O ASN A 14 -7.851 3.994 14.490 1.00 0.00 O ATOM 205 CB ASN A 14 -7.750 6.665 14.098 1.00 0.00 C ATOM 206 CG ASN A 14 -6.821 7.584 14.894 1.00 0.00 C ATOM 207 OD1 ASN A 14 -6.976 8.794 14.920 1.00 0.00 O ATOM 208 ND2 ASN A 14 -5.850 6.943 15.538 1.00 0.00 N ATOM 0 H ASN A 14 -6.468 6.576 11.273 1.00 0.00 H new ATOM 0 HA ASN A 14 -5.887 5.917 13.323 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.460 7.265 13.529 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.331 6.047 14.783 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.177 7.467 16.097 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.779 5.928 15.473 1.00 0.00 H new ATOM 215 N ARG A 15 -7.143 3.484 12.403 1.00 0.00 N ATOM 216 CA ARG A 15 -7.482 2.077 12.512 1.00 0.00 C ATOM 217 C ARG A 15 -6.210 1.227 12.550 1.00 0.00 C ATOM 218 O ARG A 15 -5.156 1.659 12.090 1.00 0.00 O ATOM 219 CB ARG A 15 -8.352 1.626 11.337 1.00 0.00 C ATOM 220 CG ARG A 15 -9.837 1.836 11.642 1.00 0.00 C ATOM 221 CD ARG A 15 -10.657 0.606 11.252 1.00 0.00 C ATOM 222 NE ARG A 15 -12.029 0.718 11.794 1.00 0.00 N ATOM 223 CZ ARG A 15 -13.006 -0.187 11.574 1.00 0.00 C ATOM 224 NH1 ARG A 15 -12.769 -1.282 10.821 1.00 0.00 N ATOM 225 NH2 ARG A 15 -14.196 0.012 12.109 1.00 0.00 N ATOM 0 H ARG A 15 -6.736 3.757 11.508 1.00 0.00 H new ATOM 0 HA ARG A 15 -8.043 1.942 13.437 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.078 2.185 10.442 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -8.166 0.573 11.125 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -9.968 2.043 12.704 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.203 2.708 11.100 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -10.693 0.512 10.167 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.179 -0.296 11.634 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.251 1.530 12.370 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.846 -1.431 10.413 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -13.513 -1.961 10.660 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.367 0.840 12.679 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.945 -0.662 11.952 1.00 0.00 H new ATOM 238 N PRO A 16 -6.357 -0.001 13.119 1.00 0.00 N ATOM 239 CA PRO A 16 -5.232 -0.916 13.223 1.00 0.00 C ATOM 240 C PRO A 16 -4.910 -1.545 11.866 1.00 0.00 C ATOM 241 O PRO A 16 -5.792 -2.082 11.201 1.00 0.00 O ATOM 242 CB PRO A 16 -5.653 -1.938 14.267 1.00 0.00 C ATOM 243 CG PRO A 16 -7.166 -1.832 14.368 1.00 0.00 C ATOM 244 CD PRO A 16 -7.590 -0.548 13.674 1.00 0.00 C ATOM 0 HA PRO A 16 -4.310 -0.418 13.521 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -5.351 -2.943 13.974 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -5.182 -1.731 15.228 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.641 -2.694 13.900 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -7.479 -1.823 15.412 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.323 -0.744 12.892 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -8.051 0.147 14.375 1.00 0.00 H new ATOM 252 N ALA A 17 -3.639 -1.457 11.497 1.00 0.00 N ATOM 253 CA ALA A 17 -3.188 -2.010 10.231 1.00 0.00 C ATOM 254 C ALA A 17 -3.699 -3.447 10.098 1.00 0.00 C ATOM 255 O ALA A 17 -3.951 -3.920 8.991 1.00 0.00 O ATOM 256 CB ALA A 17 -1.664 -1.923 10.150 1.00 0.00 C ATOM 0 H ALA A 17 -2.909 -1.011 12.052 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.591 -1.437 9.396 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.326 -2.338 9.200 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -1.355 -0.880 10.221 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -1.223 -2.489 10.971 1.00 0.00 H new ATOM 262 N SER A 18 -3.832 -4.103 11.243 1.00 0.00 N ATOM 263 CA SER A 18 -4.305 -5.476 11.267 1.00 0.00 C ATOM 264 C SER A 18 -5.651 -5.578 10.545 1.00 0.00 C ATOM 265 O SER A 18 -6.061 -6.664 10.141 1.00 0.00 O ATOM 266 CB SER A 18 -4.434 -5.988 12.703 1.00 0.00 C ATOM 267 OG SER A 18 -3.732 -7.214 12.897 1.00 0.00 O ATOM 0 H SER A 18 -3.620 -3.708 12.159 1.00 0.00 H new ATOM 0 HA SER A 18 -3.574 -6.099 10.751 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.049 -5.236 13.392 1.00 0.00 H new ATOM 0 HB3 SER A 18 -5.487 -6.131 12.944 1.00 0.00 H new ATOM 0 HG SER A 18 -2.972 -7.064 13.498 1.00 0.00 H new ATOM 273 N VAL A 19 -6.301 -4.432 10.407 1.00 0.00 N ATOM 274 CA VAL A 19 -7.591 -4.378 9.741 1.00 0.00 C ATOM 275 C VAL A 19 -7.511 -5.147 8.419 1.00 0.00 C ATOM 276 O VAL A 19 -8.376 -5.967 8.121 1.00 0.00 O ATOM 277 CB VAL A 19 -8.026 -2.923 9.560 1.00 0.00 C ATOM 278 CG1 VAL A 19 -8.428 -2.302 10.899 1.00 0.00 C ATOM 279 CG2 VAL A 19 -6.928 -2.102 8.880 1.00 0.00 C ATOM 0 H VAL A 19 -5.958 -3.533 10.745 1.00 0.00 H new ATOM 0 HA VAL A 19 -8.356 -4.859 10.351 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.901 -2.912 8.910 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -8.733 -1.267 10.743 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.258 -2.865 11.326 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -7.580 -2.331 11.583 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -7.264 -1.071 8.764 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -6.026 -2.123 9.492 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.711 -2.526 7.899 1.00 0.00 H new ATOM 289 N TYR A 20 -6.463 -4.853 7.664 1.00 0.00 N ATOM 290 CA TYR A 20 -6.258 -5.506 6.382 1.00 0.00 C ATOM 291 C TYR A 20 -4.957 -6.312 6.379 1.00 0.00 C ATOM 292 O TYR A 20 -4.378 -6.558 5.322 1.00 0.00 O ATOM 293 CB TYR A 20 -6.149 -4.383 5.348 1.00 0.00 C ATOM 294 CG TYR A 20 -7.499 -3.898 4.814 1.00 0.00 C ATOM 295 CD1 TYR A 20 -8.294 -4.749 4.077 1.00 0.00 C ATOM 296 CD2 TYR A 20 -7.918 -2.608 5.069 1.00 0.00 C ATOM 297 CE1 TYR A 20 -9.565 -4.293 3.572 1.00 0.00 C ATOM 298 CE2 TYR A 20 -9.189 -2.152 4.566 1.00 0.00 C ATOM 299 CZ TYR A 20 -9.949 -3.016 3.843 1.00 0.00 C ATOM 300 OH TYR A 20 -11.148 -2.585 3.367 1.00 0.00 O ATOM 0 H TYR A 20 -5.747 -4.172 7.915 1.00 0.00 H new ATOM 0 HA TYR A 20 -7.076 -6.194 6.168 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -5.623 -3.540 5.796 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -5.542 -4.730 4.512 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.965 -5.758 3.878 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -7.294 -1.941 5.645 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -10.197 -4.949 2.992 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -9.530 -1.146 4.759 1.00 0.00 H new ATOM 0 HH TYR A 20 -11.292 -1.654 3.638 1.00 0.00 H new ATOM 310 N LEU A 21 -4.537 -6.702 7.574 1.00 0.00 N ATOM 311 CA LEU A 21 -3.315 -7.476 7.722 1.00 0.00 C ATOM 312 C LEU A 21 -3.664 -8.883 8.206 1.00 0.00 C ATOM 313 O LEU A 21 -4.101 -9.064 9.342 1.00 0.00 O ATOM 314 CB LEU A 21 -2.324 -6.741 8.628 1.00 0.00 C ATOM 315 CG LEU A 21 -0.942 -6.470 8.029 1.00 0.00 C ATOM 316 CD1 LEU A 21 -0.801 -5.002 7.622 1.00 0.00 C ATOM 317 CD2 LEU A 21 0.167 -6.909 8.986 1.00 0.00 C ATOM 0 H LEU A 21 -5.021 -6.497 8.448 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.813 -7.585 6.761 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.766 -5.788 8.918 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -2.195 -7.324 9.540 1.00 0.00 H new ATOM 0 HG LEU A 21 -0.839 -7.067 7.123 1.00 0.00 H new ATOM 0 HD11 LEU A 21 0.190 -4.835 7.199 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.559 -4.756 6.878 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -0.933 -4.367 8.498 1.00 0.00 H new ATOM 0 HD21 LEU A 21 1.138 -6.705 8.535 1.00 0.00 H new ATOM 0 HD22 LEU A 21 0.079 -6.358 9.922 1.00 0.00 H new ATOM 0 HD23 LEU A 21 0.076 -7.977 9.183 1.00 0.00 H new ATOM 329 N LYS A 22 -3.462 -9.847 7.319 1.00 0.00 N ATOM 330 CA LYS A 22 -3.749 -11.234 7.641 1.00 0.00 C ATOM 331 C LYS A 22 -2.438 -12.021 7.701 1.00 0.00 C ATOM 332 O LYS A 22 -1.641 -11.979 6.766 1.00 0.00 O ATOM 333 CB LYS A 22 -4.770 -11.812 6.658 1.00 0.00 C ATOM 334 CG LYS A 22 -6.190 -11.708 7.219 1.00 0.00 C ATOM 335 CD LYS A 22 -6.880 -13.073 7.216 1.00 0.00 C ATOM 336 CE LYS A 22 -7.577 -13.337 8.552 1.00 0.00 C ATOM 337 NZ LYS A 22 -8.199 -14.681 8.557 1.00 0.00 N ATOM 0 H LYS A 22 -3.103 -9.694 6.377 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.211 -11.309 8.625 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.710 -11.278 5.710 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -4.532 -12.856 6.452 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -6.156 -11.316 8.235 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -6.769 -11.002 6.624 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -7.609 -13.114 6.407 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -6.146 -13.855 7.024 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -6.856 -13.261 9.366 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -8.338 -12.577 8.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -8.667 -14.843 9.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.901 -14.741 7.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -7.465 -15.404 8.411 1.00 0.00 H new ATOM 350 N LYS A 23 -2.256 -12.722 8.811 1.00 0.00 N ATOM 351 CA LYS A 23 -1.056 -13.519 9.006 1.00 0.00 C ATOM 352 C LYS A 23 -1.239 -14.880 8.330 1.00 0.00 C ATOM 353 O LYS A 23 -0.497 -15.820 8.612 1.00 0.00 O ATOM 354 CB LYS A 23 -0.710 -13.611 10.493 1.00 0.00 C ATOM 355 CG LYS A 23 0.779 -13.348 10.726 1.00 0.00 C ATOM 356 CD LYS A 23 1.541 -14.657 10.936 1.00 0.00 C ATOM 357 CE LYS A 23 2.756 -14.445 11.841 1.00 0.00 C ATOM 358 NZ LYS A 23 3.983 -14.964 11.192 1.00 0.00 N ATOM 0 H LYS A 23 -2.920 -12.755 9.585 1.00 0.00 H new ATOM 0 HA LYS A 23 -0.198 -13.040 8.533 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -1.303 -12.888 11.053 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.972 -14.599 10.871 1.00 0.00 H new ATOM 0 HG2 LYS A 23 1.195 -12.814 9.872 1.00 0.00 H new ATOM 0 HG3 LYS A 23 0.906 -12.705 11.597 1.00 0.00 H new ATOM 0 HD2 LYS A 23 0.878 -15.401 11.379 1.00 0.00 H new ATOM 0 HD3 LYS A 23 1.865 -15.052 9.973 1.00 0.00 H new ATOM 0 HE2 LYS A 23 2.874 -13.384 12.059 1.00 0.00 H new ATOM 0 HE3 LYS A 23 2.600 -14.951 12.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 4.798 -14.812 11.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 3.874 -15.981 11.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 4.139 -14.463 10.294 1.00 0.00 H new ATOM 371 N ASP A 24 -2.229 -14.942 7.452 1.00 0.00 N ATOM 372 CA ASP A 24 -2.517 -16.172 6.735 1.00 0.00 C ATOM 373 C ASP A 24 -2.965 -15.835 5.312 1.00 0.00 C ATOM 374 O ASP A 24 -3.543 -16.674 4.624 1.00 0.00 O ATOM 375 CB ASP A 24 -3.646 -16.953 7.412 1.00 0.00 C ATOM 376 CG ASP A 24 -3.236 -18.307 7.996 1.00 0.00 C ATOM 377 OD1 ASP A 24 -2.045 -18.577 8.208 1.00 0.00 O ATOM 378 OD2 ASP A 24 -4.214 -19.115 8.238 1.00 0.00 O ATOM 0 H ASP A 24 -2.842 -14.160 7.221 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.611 -16.778 6.729 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.063 -16.340 8.212 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.443 -17.114 6.686 1.00 0.00 H new ATOM 384 N LYS A 25 -2.676 -14.605 4.912 1.00 0.00 N ATOM 385 CA LYS A 25 -3.042 -14.147 3.581 1.00 0.00 C ATOM 386 C LYS A 25 -1.965 -13.191 3.063 1.00 0.00 C ATOM 387 O LYS A 25 -1.259 -12.561 3.849 1.00 0.00 O ATOM 388 CB LYS A 25 -4.448 -13.544 3.590 1.00 0.00 C ATOM 389 CG LYS A 25 -5.505 -14.616 3.865 1.00 0.00 C ATOM 390 CD LYS A 25 -5.723 -15.498 2.634 1.00 0.00 C ATOM 391 CE LYS A 25 -6.615 -14.794 1.607 1.00 0.00 C ATOM 392 NZ LYS A 25 -7.603 -15.741 1.045 1.00 0.00 N ATOM 0 H LYS A 25 -2.194 -13.912 5.485 1.00 0.00 H new ATOM 0 HA LYS A 25 -3.085 -14.986 2.887 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -4.508 -12.766 4.351 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -4.649 -13.068 2.630 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.193 -15.232 4.708 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.445 -14.141 4.148 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -4.762 -15.741 2.181 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.181 -16.441 2.934 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.131 -13.957 2.077 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.002 -14.381 0.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.200 -15.248 0.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.105 -16.526 0.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.199 -16.115 1.810 1.00 0.00 H new ATOM 405 N PRO A 26 -1.873 -13.111 1.709 1.00 0.00 N ATOM 406 CA PRO A 26 -0.895 -12.242 1.076 1.00 0.00 C ATOM 407 C PRO A 26 -1.322 -10.775 1.170 1.00 0.00 C ATOM 408 O PRO A 26 -2.446 -10.429 0.811 1.00 0.00 O ATOM 409 CB PRO A 26 -0.794 -12.741 -0.355 1.00 0.00 C ATOM 410 CG PRO A 26 -2.048 -13.564 -0.601 1.00 0.00 C ATOM 411 CD PRO A 26 -2.695 -13.840 0.748 1.00 0.00 C ATOM 0 HA PRO A 26 0.078 -12.277 1.565 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.730 -11.908 -1.055 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.103 -13.345 -0.495 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.737 -13.026 -1.252 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.799 -14.499 -1.104 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -3.729 -13.495 0.769 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -2.710 -14.907 0.969 1.00 0.00 H new ATOM 419 N THR A 27 -0.402 -9.954 1.654 1.00 0.00 N ATOM 420 CA THR A 27 -0.668 -8.533 1.799 1.00 0.00 C ATOM 421 C THR A 27 0.188 -7.726 0.822 1.00 0.00 C ATOM 422 O THR A 27 1.399 -7.928 0.739 1.00 0.00 O ATOM 423 CB THR A 27 -0.438 -8.155 3.263 1.00 0.00 C ATOM 424 OG1 THR A 27 -1.207 -9.108 3.993 1.00 0.00 O ATOM 425 CG2 THR A 27 -1.068 -6.811 3.628 1.00 0.00 C ATOM 0 H THR A 27 0.529 -10.246 1.951 1.00 0.00 H new ATOM 0 HA THR A 27 -1.702 -8.298 1.546 1.00 0.00 H new ATOM 0 HB THR A 27 0.633 -8.120 3.464 1.00 0.00 H new ATOM 0 HG1 THR A 27 -1.114 -8.937 4.953 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.875 -6.592 4.678 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.635 -6.026 3.008 1.00 0.00 H new ATOM 0 HG23 THR A 27 -2.144 -6.856 3.459 1.00 0.00 H new ATOM 433 N LEU A 28 -0.474 -6.830 0.104 1.00 0.00 N ATOM 434 CA LEU A 28 0.214 -5.993 -0.864 1.00 0.00 C ATOM 435 C LEU A 28 0.213 -4.544 -0.371 1.00 0.00 C ATOM 436 O LEU A 28 -0.832 -4.011 -0.005 1.00 0.00 O ATOM 437 CB LEU A 28 -0.400 -6.169 -2.256 1.00 0.00 C ATOM 438 CG LEU A 28 0.239 -5.352 -3.380 1.00 0.00 C ATOM 439 CD1 LEU A 28 1.669 -5.823 -3.655 1.00 0.00 C ATOM 440 CD2 LEU A 28 -0.627 -5.380 -4.641 1.00 0.00 C ATOM 0 H LEU A 28 -1.478 -6.666 0.173 1.00 0.00 H new ATOM 0 HA LEU A 28 1.256 -6.298 -0.959 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.345 -7.224 -2.525 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.457 -5.909 -2.200 1.00 0.00 H new ATOM 0 HG LEU A 28 0.299 -4.313 -3.055 1.00 0.00 H new ATOM 0 HD11 LEU A 28 2.101 -5.226 -4.458 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.270 -5.707 -2.753 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.656 -6.872 -3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.149 -4.791 -5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.742 -6.409 -4.980 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.608 -4.959 -4.418 1.00 0.00 H new ATOM 452 N ILE A 29 1.396 -3.951 -0.377 1.00 0.00 N ATOM 453 CA ILE A 29 1.546 -2.575 0.065 1.00 0.00 C ATOM 454 C ILE A 29 1.835 -1.683 -1.145 1.00 0.00 C ATOM 455 O ILE A 29 2.443 -2.128 -2.118 1.00 0.00 O ATOM 456 CB ILE A 29 2.604 -2.478 1.166 1.00 0.00 C ATOM 457 CG1 ILE A 29 2.358 -3.522 2.257 1.00 0.00 C ATOM 458 CG2 ILE A 29 2.675 -1.059 1.737 1.00 0.00 C ATOM 459 CD1 ILE A 29 3.676 -4.130 2.742 1.00 0.00 C ATOM 0 H ILE A 29 2.261 -4.398 -0.681 1.00 0.00 H new ATOM 0 HA ILE A 29 0.619 -2.216 0.512 1.00 0.00 H new ATOM 0 HB ILE A 29 3.576 -2.696 0.724 1.00 0.00 H new ATOM 0 HG12 ILE A 29 1.836 -3.061 3.095 1.00 0.00 H new ATOM 0 HG13 ILE A 29 1.710 -4.309 1.872 1.00 0.00 H new ATOM 0 HG21 ILE A 29 3.435 -1.018 2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.934 -0.359 0.942 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.707 -0.788 2.158 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.472 -4.869 3.517 1.00 0.00 H new ATOM 0 HD12 ILE A 29 4.184 -4.611 1.906 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.312 -3.343 3.149 1.00 0.00 H new ATOM 471 N LYS A 30 1.385 -0.441 -1.044 1.00 0.00 N ATOM 472 CA LYS A 30 1.587 0.517 -2.118 1.00 0.00 C ATOM 473 C LYS A 30 1.951 1.877 -1.520 1.00 0.00 C ATOM 474 O LYS A 30 1.155 2.476 -0.799 1.00 0.00 O ATOM 475 CB LYS A 30 0.365 0.557 -3.037 1.00 0.00 C ATOM 476 CG LYS A 30 0.182 1.948 -3.645 1.00 0.00 C ATOM 477 CD LYS A 30 -0.714 1.892 -4.885 1.00 0.00 C ATOM 478 CE LYS A 30 -0.980 3.295 -5.434 1.00 0.00 C ATOM 479 NZ LYS A 30 -1.135 3.256 -6.905 1.00 0.00 N ATOM 0 H LYS A 30 0.881 -0.076 -0.236 1.00 0.00 H new ATOM 0 HA LYS A 30 2.422 0.212 -2.749 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.480 -0.179 -3.833 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.527 0.282 -2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.257 2.617 -2.905 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.154 2.362 -3.913 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -0.240 1.281 -5.653 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.659 1.411 -4.633 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.881 3.705 -4.978 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -0.157 3.958 -5.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -0.591 4.033 -7.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.783 2.347 -7.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.140 3.361 -7.151 1.00 0.00 H new ATOM 492 N PHE A 31 3.156 2.326 -1.842 1.00 0.00 N ATOM 493 CA PHE A 31 3.635 3.605 -1.346 1.00 0.00 C ATOM 494 C PHE A 31 3.259 4.739 -2.300 1.00 0.00 C ATOM 495 O PHE A 31 3.650 4.731 -3.466 1.00 0.00 O ATOM 496 CB PHE A 31 5.160 3.509 -1.263 1.00 0.00 C ATOM 497 CG PHE A 31 5.666 2.295 -0.480 1.00 0.00 C ATOM 498 CD1 PHE A 31 5.789 1.090 -1.100 1.00 0.00 C ATOM 499 CD2 PHE A 31 5.992 2.421 0.833 1.00 0.00 C ATOM 500 CE1 PHE A 31 6.258 -0.037 -0.372 1.00 0.00 C ATOM 501 CE2 PHE A 31 6.461 1.294 1.560 1.00 0.00 C ATOM 502 CZ PHE A 31 6.585 0.089 0.942 1.00 0.00 C ATOM 0 H PHE A 31 3.814 1.827 -2.440 1.00 0.00 H new ATOM 0 HA PHE A 31 3.187 3.819 -0.376 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.567 3.472 -2.274 1.00 0.00 H new ATOM 0 HB3 PHE A 31 5.546 4.416 -0.797 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.531 0.990 -2.144 1.00 0.00 H new ATOM 0 HD2 PHE A 31 5.895 3.378 1.324 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.355 -0.994 -0.863 1.00 0.00 H new ATOM 0 HE2 PHE A 31 6.719 1.394 2.604 1.00 0.00 H new ATOM 0 HZ PHE A 31 6.943 -0.767 1.494 1.00 0.00 H new ATOM 512 N TRP A 32 2.503 5.689 -1.770 1.00 0.00 N ATOM 513 CA TRP A 32 2.069 6.829 -2.559 1.00 0.00 C ATOM 514 C TRP A 32 2.452 8.103 -1.803 1.00 0.00 C ATOM 515 O TRP A 32 2.829 8.044 -0.634 1.00 0.00 O ATOM 516 CB TRP A 32 0.574 6.744 -2.869 1.00 0.00 C ATOM 517 CG TRP A 32 -0.319 6.713 -1.626 1.00 0.00 C ATOM 518 CD1 TRP A 32 -0.367 5.777 -0.668 1.00 0.00 C ATOM 519 CD2 TRP A 32 -1.295 7.705 -1.244 1.00 0.00 C ATOM 520 NE1 TRP A 32 -1.299 6.091 0.300 1.00 0.00 N ATOM 521 CE2 TRP A 32 -1.881 7.300 -0.061 1.00 0.00 C ATOM 522 CE3 TRP A 32 -1.671 8.902 -1.876 1.00 0.00 C ATOM 523 CZ2 TRP A 32 -2.876 8.036 0.592 1.00 0.00 C ATOM 524 CZ3 TRP A 32 -2.668 9.626 -1.211 1.00 0.00 C ATOM 525 CH2 TRP A 32 -3.268 9.234 -0.020 1.00 0.00 C ATOM 0 H TRP A 32 2.180 5.692 -0.803 1.00 0.00 H new ATOM 0 HA TRP A 32 2.567 6.838 -3.529 1.00 0.00 H new ATOM 0 HB2 TRP A 32 0.292 7.598 -3.485 1.00 0.00 H new ATOM 0 HB3 TRP A 32 0.387 5.848 -3.461 1.00 0.00 H new ATOM 0 HD1 TRP A 32 0.247 4.888 -0.655 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.520 5.538 1.128 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -1.226 9.237 -2.801 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -3.318 7.699 1.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -2.994 10.555 -1.655 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -4.032 9.849 0.431 1.00 0.00 H new ATOM 536 N ALA A 33 2.341 9.223 -2.501 1.00 0.00 N ATOM 537 CA ALA A 33 2.672 10.509 -1.910 1.00 0.00 C ATOM 538 C ALA A 33 1.548 11.505 -2.206 1.00 0.00 C ATOM 539 O ALA A 33 1.056 11.573 -3.331 1.00 0.00 O ATOM 540 CB ALA A 33 4.026 10.982 -2.440 1.00 0.00 C ATOM 0 H ALA A 33 2.027 9.267 -3.470 1.00 0.00 H new ATOM 0 HA ALA A 33 2.760 10.423 -0.827 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.274 11.946 -1.996 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.794 10.254 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA A 33 3.977 11.083 -3.524 1.00 0.00 H new ATOM 546 N SER A 34 1.176 12.253 -1.178 1.00 0.00 N ATOM 547 CA SER A 34 0.121 13.241 -1.314 1.00 0.00 C ATOM 548 C SER A 34 0.545 14.328 -2.304 1.00 0.00 C ATOM 549 O SER A 34 -0.279 14.845 -3.056 1.00 0.00 O ATOM 550 CB SER A 34 -0.228 13.864 0.039 1.00 0.00 C ATOM 551 OG SER A 34 -1.540 13.509 0.469 1.00 0.00 O ATOM 0 H SER A 34 1.587 12.194 -0.246 1.00 0.00 H new ATOM 0 HA SER A 34 -0.769 12.739 -1.694 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.498 13.540 0.785 1.00 0.00 H new ATOM 0 HB3 SER A 34 -0.151 14.949 -0.031 1.00 0.00 H new ATOM 0 HG SER A 34 -2.068 14.322 0.614 1.00 0.00 H new ATOM 557 N TRP A 35 1.833 14.642 -2.272 1.00 0.00 N ATOM 558 CA TRP A 35 2.377 15.656 -3.157 1.00 0.00 C ATOM 559 C TRP A 35 2.394 15.086 -4.577 1.00 0.00 C ATOM 560 O TRP A 35 2.465 15.836 -5.550 1.00 0.00 O ATOM 561 CB TRP A 35 3.758 16.116 -2.682 1.00 0.00 C ATOM 562 CG TRP A 35 4.795 14.994 -2.603 1.00 0.00 C ATOM 563 CD1 TRP A 35 5.308 14.420 -1.508 1.00 0.00 C ATOM 564 CD2 TRP A 35 5.426 14.328 -3.718 1.00 0.00 C ATOM 565 NE1 TRP A 35 6.221 13.437 -1.831 1.00 0.00 N ATOM 566 CE2 TRP A 35 6.295 13.379 -3.218 1.00 0.00 C ATOM 567 CE3 TRP A 35 5.268 14.520 -5.101 1.00 0.00 C ATOM 568 CZ2 TRP A 35 7.074 12.548 -4.033 1.00 0.00 C ATOM 569 CZ3 TRP A 35 6.053 13.682 -5.902 1.00 0.00 C ATOM 570 CH2 TRP A 35 6.933 12.723 -5.415 1.00 0.00 C ATOM 0 H TRP A 35 2.514 14.211 -1.647 1.00 0.00 H new ATOM 0 HA TRP A 35 1.753 16.550 -3.148 1.00 0.00 H new ATOM 0 HB2 TRP A 35 4.125 16.889 -3.358 1.00 0.00 H new ATOM 0 HB3 TRP A 35 3.658 16.574 -1.698 1.00 0.00 H new ATOM 0 HD1 TRP A 35 5.041 14.692 -0.498 1.00 0.00 H new ATOM 0 HE1 TRP A 35 6.745 12.860 -1.173 1.00 0.00 H new ATOM 0 HE3 TRP A 35 4.594 15.256 -5.514 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 7.747 11.812 -3.618 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.969 13.788 -6.973 1.00 0.00 H new ATOM 0 HH2 TRP A 35 7.506 12.115 -6.100 1.00 0.00 H new ATOM 581 N CYS A 36 2.326 13.765 -4.651 1.00 0.00 N ATOM 582 CA CYS A 36 2.332 13.087 -5.935 1.00 0.00 C ATOM 583 C CYS A 36 0.915 13.137 -6.511 1.00 0.00 C ATOM 584 O CYS A 36 -0.014 12.576 -5.934 1.00 0.00 O ATOM 585 CB CYS A 36 2.847 11.652 -5.814 1.00 0.00 C ATOM 586 SG CYS A 36 3.063 10.922 -7.478 1.00 0.00 S ATOM 0 H CYS A 36 2.266 13.146 -3.842 1.00 0.00 H new ATOM 0 HA CYS A 36 3.018 13.594 -6.614 1.00 0.00 H new ATOM 0 HB2 CYS A 36 3.796 11.641 -5.277 1.00 0.00 H new ATOM 0 HB3 CYS A 36 2.146 11.053 -5.233 1.00 0.00 H new ATOM 0 HG CYS A 36 2.594 9.710 -7.484 1.00 0.00 H new ATOM 592 N PRO A 37 0.792 13.832 -7.674 1.00 0.00 N ATOM 593 CA PRO A 37 -0.496 13.963 -8.335 1.00 0.00 C ATOM 594 C PRO A 37 -0.888 12.659 -9.033 1.00 0.00 C ATOM 595 O PRO A 37 -2.020 12.195 -8.898 1.00 0.00 O ATOM 596 CB PRO A 37 -0.326 15.124 -9.299 1.00 0.00 C ATOM 597 CG PRO A 37 1.172 15.301 -9.481 1.00 0.00 C ATOM 598 CD PRO A 37 1.871 14.509 -8.387 1.00 0.00 C ATOM 0 HA PRO A 37 -1.310 14.158 -7.637 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.813 14.915 -10.252 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -0.781 16.031 -8.901 1.00 0.00 H new ATOM 0 HG2 PRO A 37 1.481 14.948 -10.465 1.00 0.00 H new ATOM 0 HG3 PRO A 37 1.442 16.355 -9.421 1.00 0.00 H new ATOM 0 HD2 PRO A 37 2.579 13.794 -8.806 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.435 15.164 -7.723 1.00 0.00 H new ATOM 606 N LEU A 38 0.068 12.104 -9.764 1.00 0.00 N ATOM 607 CA LEU A 38 -0.164 10.864 -10.482 1.00 0.00 C ATOM 608 C LEU A 38 -0.712 9.813 -9.514 1.00 0.00 C ATOM 609 O LEU A 38 -1.503 8.956 -9.905 1.00 0.00 O ATOM 610 CB LEU A 38 1.105 10.423 -11.213 1.00 0.00 C ATOM 611 CG LEU A 38 0.895 9.574 -12.470 1.00 0.00 C ATOM 612 CD1 LEU A 38 2.195 9.442 -13.265 1.00 0.00 C ATOM 613 CD2 LEU A 38 0.298 8.211 -12.118 1.00 0.00 C ATOM 0 H LEU A 38 1.005 12.491 -9.874 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.917 11.008 -11.257 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.669 11.314 -11.490 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.724 9.858 -10.516 1.00 0.00 H new ATOM 0 HG LEU A 38 0.176 10.084 -13.111 1.00 0.00 H new ATOM 0 HD11 LEU A 38 2.019 8.834 -14.153 1.00 0.00 H new ATOM 0 HD12 LEU A 38 2.540 10.431 -13.565 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.954 8.966 -12.645 1.00 0.00 H new ATOM 0 HD21 LEU A 38 0.159 7.628 -13.029 1.00 0.00 H new ATOM 0 HD22 LEU A 38 0.973 7.680 -11.447 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.665 8.351 -11.627 1.00 0.00 H new ATOM 625 N CYS A 39 -0.270 9.914 -8.268 1.00 0.00 N ATOM 626 CA CYS A 39 -0.707 8.984 -7.241 1.00 0.00 C ATOM 627 C CYS A 39 -2.115 9.382 -6.799 1.00 0.00 C ATOM 628 O CYS A 39 -2.991 8.529 -6.659 1.00 0.00 O ATOM 629 CB CYS A 39 0.270 8.940 -6.065 1.00 0.00 C ATOM 630 SG CYS A 39 1.737 7.937 -6.506 1.00 0.00 S ATOM 0 H CYS A 39 0.386 10.626 -7.947 1.00 0.00 H new ATOM 0 HA CYS A 39 -0.728 7.973 -7.648 1.00 0.00 H new ATOM 0 HB2 CYS A 39 0.577 9.951 -5.799 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.221 8.515 -5.189 1.00 0.00 H new ATOM 0 HG CYS A 39 2.561 7.908 -5.501 1.00 0.00 H new ATOM 636 N LEU A 40 -2.291 10.679 -6.590 1.00 0.00 N ATOM 637 CA LEU A 40 -3.578 11.201 -6.166 1.00 0.00 C ATOM 638 C LEU A 40 -4.669 10.682 -7.104 1.00 0.00 C ATOM 639 O LEU A 40 -5.725 10.243 -6.652 1.00 0.00 O ATOM 640 CB LEU A 40 -3.529 12.727 -6.064 1.00 0.00 C ATOM 641 CG LEU A 40 -2.813 13.295 -4.838 1.00 0.00 C ATOM 642 CD1 LEU A 40 -2.364 14.737 -5.084 1.00 0.00 C ATOM 643 CD2 LEU A 40 -3.685 13.172 -3.587 1.00 0.00 C ATOM 0 H LEU A 40 -1.563 11.384 -6.707 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.823 10.845 -5.165 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.040 13.115 -6.958 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.551 13.105 -6.070 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.914 12.703 -4.663 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.858 15.117 -4.197 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.680 14.765 -5.932 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.234 15.357 -5.299 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.152 13.583 -2.730 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.614 13.723 -3.735 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.912 12.122 -3.403 1.00 0.00 H new ATOM 655 N SER A 41 -4.376 10.750 -8.395 1.00 0.00 N ATOM 656 CA SER A 41 -5.319 10.292 -9.401 1.00 0.00 C ATOM 657 C SER A 41 -5.427 8.765 -9.360 1.00 0.00 C ATOM 658 O SER A 41 -6.444 8.202 -9.765 1.00 0.00 O ATOM 659 CB SER A 41 -4.903 10.755 -10.798 1.00 0.00 C ATOM 660 OG SER A 41 -4.131 9.771 -11.481 1.00 0.00 O ATOM 0 H SER A 41 -3.499 11.115 -8.767 1.00 0.00 H new ATOM 0 HA SER A 41 -6.294 10.726 -9.178 1.00 0.00 H new ATOM 0 HB2 SER A 41 -5.793 10.987 -11.383 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.326 11.676 -10.717 1.00 0.00 H new ATOM 0 HG SER A 41 -3.333 9.557 -10.954 1.00 0.00 H new ATOM 666 N GLU A 42 -4.368 8.141 -8.869 1.00 0.00 N ATOM 667 CA GLU A 42 -4.331 6.692 -8.769 1.00 0.00 C ATOM 668 C GLU A 42 -5.134 6.224 -7.553 1.00 0.00 C ATOM 669 O GLU A 42 -5.608 5.088 -7.519 1.00 0.00 O ATOM 670 CB GLU A 42 -2.891 6.183 -8.705 1.00 0.00 C ATOM 671 CG GLU A 42 -2.776 4.783 -9.312 1.00 0.00 C ATOM 672 CD GLU A 42 -2.901 4.834 -10.835 1.00 0.00 C ATOM 673 OE1 GLU A 42 -3.458 5.801 -11.380 1.00 0.00 O ATOM 674 OE2 GLU A 42 -2.395 3.825 -11.458 1.00 0.00 O ATOM 0 H GLU A 42 -3.527 8.613 -8.535 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.789 6.273 -9.665 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.235 6.870 -9.239 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.555 6.162 -7.668 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -1.818 4.341 -9.037 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.554 4.140 -8.901 1.00 0.00 H new ATOM 682 N LEU A 43 -5.261 7.120 -6.586 1.00 0.00 N ATOM 683 CA LEU A 43 -5.997 6.813 -5.371 1.00 0.00 C ATOM 684 C LEU A 43 -7.323 6.145 -5.740 1.00 0.00 C ATOM 685 O LEU A 43 -7.630 5.055 -5.258 1.00 0.00 O ATOM 686 CB LEU A 43 -6.158 8.066 -4.511 1.00 0.00 C ATOM 687 CG LEU A 43 -4.899 8.550 -3.788 1.00 0.00 C ATOM 688 CD1 LEU A 43 -5.148 9.891 -3.093 1.00 0.00 C ATOM 689 CD2 LEU A 43 -4.384 7.487 -2.816 1.00 0.00 C ATOM 0 H LEU A 43 -4.866 8.060 -6.619 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.442 6.104 -4.757 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.522 8.874 -5.146 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.930 7.874 -3.766 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.118 8.713 -4.531 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.238 10.213 -2.587 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.434 10.637 -3.834 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.949 9.779 -2.363 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.489 7.855 -2.315 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.152 7.270 -2.074 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.144 6.577 -3.366 1.00 0.00 H new ATOM 701 N GLY A 44 -8.075 6.825 -6.593 1.00 0.00 N ATOM 702 CA GLY A 44 -9.362 6.312 -7.032 1.00 0.00 C ATOM 703 C GLY A 44 -9.216 4.914 -7.636 1.00 0.00 C ATOM 704 O GLY A 44 -9.913 3.984 -7.232 1.00 0.00 O ATOM 0 H GLY A 44 -7.817 7.728 -6.992 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -10.051 6.278 -6.188 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.795 6.988 -7.770 1.00 0.00 H new ATOM 708 N GLN A 45 -8.305 4.810 -8.594 1.00 0.00 N ATOM 709 CA GLN A 45 -8.062 3.541 -9.259 1.00 0.00 C ATOM 710 C GLN A 45 -7.693 2.468 -8.232 1.00 0.00 C ATOM 711 O GLN A 45 -8.022 1.296 -8.410 1.00 0.00 O ATOM 712 CB GLN A 45 -6.970 3.681 -10.321 1.00 0.00 C ATOM 713 CG GLN A 45 -6.862 2.411 -11.167 1.00 0.00 C ATOM 714 CD GLN A 45 -6.535 2.747 -12.623 1.00 0.00 C ATOM 715 OE1 GLN A 45 -5.485 3.283 -12.943 1.00 0.00 O ATOM 716 NE2 GLN A 45 -7.488 2.406 -13.485 1.00 0.00 N ATOM 0 H GLN A 45 -7.727 5.583 -8.925 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.978 3.234 -9.764 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.190 4.533 -10.964 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.013 3.884 -9.840 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.088 1.762 -10.757 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.800 1.858 -11.120 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.342 1.960 -13.151 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.365 2.590 -14.481 1.00 0.00 H new ATOM 725 N THR A 46 -7.015 2.906 -7.182 1.00 0.00 N ATOM 726 CA THR A 46 -6.599 1.997 -6.127 1.00 0.00 C ATOM 727 C THR A 46 -7.811 1.515 -5.329 1.00 0.00 C ATOM 728 O THR A 46 -7.913 0.334 -5.000 1.00 0.00 O ATOM 729 CB THR A 46 -5.552 2.714 -5.271 1.00 0.00 C ATOM 730 OG1 THR A 46 -4.522 3.054 -6.194 1.00 0.00 O ATOM 731 CG2 THR A 46 -4.867 1.776 -4.276 1.00 0.00 C ATOM 0 H THR A 46 -6.743 3.879 -7.039 1.00 0.00 H new ATOM 0 HA THR A 46 -6.142 1.097 -6.538 1.00 0.00 H new ATOM 0 HB THR A 46 -6.025 3.533 -4.730 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.776 3.864 -6.683 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.134 2.335 -3.694 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.613 1.349 -3.606 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.365 0.974 -4.818 1.00 0.00 H new ATOM 739 N GLU A 47 -8.701 2.454 -5.041 1.00 0.00 N ATOM 740 CA GLU A 47 -9.902 2.139 -4.286 1.00 0.00 C ATOM 741 C GLU A 47 -10.805 1.203 -5.093 1.00 0.00 C ATOM 742 O GLU A 47 -11.496 0.359 -4.525 1.00 0.00 O ATOM 743 CB GLU A 47 -10.650 3.414 -3.889 1.00 0.00 C ATOM 744 CG GLU A 47 -11.556 3.163 -2.682 1.00 0.00 C ATOM 745 CD GLU A 47 -12.253 4.453 -2.245 1.00 0.00 C ATOM 746 OE1 GLU A 47 -12.726 5.223 -3.096 1.00 0.00 O ATOM 747 OE2 GLU A 47 -12.296 4.645 -0.970 1.00 0.00 O ATOM 0 H GLU A 47 -8.614 3.432 -5.317 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.608 1.629 -3.369 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.934 4.202 -3.654 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -11.247 3.767 -4.730 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.302 2.409 -2.933 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.966 2.766 -1.856 1.00 0.00 H new ATOM 755 N LYS A 48 -10.770 1.384 -6.406 1.00 0.00 N ATOM 756 CA LYS A 48 -11.575 0.566 -7.296 1.00 0.00 C ATOM 757 C LYS A 48 -10.910 -0.800 -7.469 1.00 0.00 C ATOM 758 O LYS A 48 -11.589 -1.823 -7.525 1.00 0.00 O ATOM 759 CB LYS A 48 -11.830 1.299 -8.614 1.00 0.00 C ATOM 760 CG LYS A 48 -12.517 0.382 -9.629 1.00 0.00 C ATOM 761 CD LYS A 48 -13.983 0.773 -9.814 1.00 0.00 C ATOM 762 CE LYS A 48 -14.552 0.169 -11.100 1.00 0.00 C ATOM 763 NZ LYS A 48 -15.932 0.655 -11.334 1.00 0.00 N ATOM 0 H LYS A 48 -10.196 2.086 -6.874 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.559 0.388 -6.863 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.451 2.176 -8.432 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.885 1.657 -9.023 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.998 0.439 -10.586 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.452 -0.653 -9.292 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -14.565 0.431 -8.958 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -14.072 1.859 -9.847 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.918 0.435 -11.946 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.550 -0.919 -11.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.304 0.236 -12.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -16.537 0.379 -10.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.925 1.691 -11.422 1.00 0.00 H new ATOM 776 N TRP A 49 -9.586 -0.772 -7.550 1.00 0.00 N ATOM 777 CA TRP A 49 -8.821 -1.996 -7.717 1.00 0.00 C ATOM 778 C TRP A 49 -8.917 -2.795 -6.416 1.00 0.00 C ATOM 779 O TRP A 49 -8.823 -4.021 -6.427 1.00 0.00 O ATOM 780 CB TRP A 49 -7.379 -1.689 -8.124 1.00 0.00 C ATOM 781 CG TRP A 49 -7.224 -1.253 -9.584 1.00 0.00 C ATOM 782 CD1 TRP A 49 -8.191 -1.008 -10.478 1.00 0.00 C ATOM 783 CD2 TRP A 49 -5.984 -1.019 -10.283 1.00 0.00 C ATOM 784 NE1 TRP A 49 -7.667 -0.636 -11.699 1.00 0.00 N ATOM 785 CE2 TRP A 49 -6.283 -0.641 -11.577 1.00 0.00 C ATOM 786 CE3 TRP A 49 -4.655 -1.121 -9.838 1.00 0.00 C ATOM 787 CZ2 TRP A 49 -5.305 -0.337 -12.532 1.00 0.00 C ATOM 788 CZ3 TRP A 49 -3.689 -0.814 -10.805 1.00 0.00 C ATOM 789 CH2 TRP A 49 -3.972 -0.433 -12.111 1.00 0.00 C ATOM 0 H TRP A 49 -9.025 0.079 -7.503 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.231 -2.599 -8.527 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -6.989 -0.903 -7.477 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -6.767 -2.575 -7.953 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -9.247 -1.091 -10.269 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -8.198 -0.401 -12.537 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -4.399 -1.413 -8.830 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -5.564 -0.044 -13.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -2.651 -0.878 -10.515 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -3.169 -0.212 -12.798 1.00 0.00 H new ATOM 800 N ALA A 50 -9.103 -2.066 -5.324 1.00 0.00 N ATOM 801 CA ALA A 50 -9.213 -2.691 -4.016 1.00 0.00 C ATOM 802 C ALA A 50 -10.588 -3.348 -3.884 1.00 0.00 C ATOM 803 O ALA A 50 -10.842 -4.078 -2.926 1.00 0.00 O ATOM 804 CB ALA A 50 -8.957 -1.647 -2.928 1.00 0.00 C ATOM 0 H ALA A 50 -9.180 -1.049 -5.319 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.462 -3.473 -3.899 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -9.040 -2.116 -1.947 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.956 -1.233 -3.049 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -9.693 -0.847 -3.011 1.00 0.00 H new ATOM 810 N GLN A 51 -11.440 -3.065 -4.858 1.00 0.00 N ATOM 811 CA GLN A 51 -12.783 -3.619 -4.862 1.00 0.00 C ATOM 812 C GLN A 51 -12.900 -4.721 -5.917 1.00 0.00 C ATOM 813 O GLN A 51 -13.840 -5.513 -5.890 1.00 0.00 O ATOM 814 CB GLN A 51 -13.827 -2.524 -5.096 1.00 0.00 C ATOM 815 CG GLN A 51 -13.896 -1.570 -3.902 1.00 0.00 C ATOM 816 CD GLN A 51 -15.275 -1.619 -3.238 1.00 0.00 C ATOM 817 OE1 GLN A 51 -15.888 -2.665 -3.102 1.00 0.00 O ATOM 818 NE2 GLN A 51 -15.725 -0.433 -2.837 1.00 0.00 N ATOM 0 H GLN A 51 -11.226 -2.459 -5.650 1.00 0.00 H new ATOM 0 HA GLN A 51 -12.977 -4.058 -3.883 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -13.578 -1.966 -5.998 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -14.804 -2.977 -5.261 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -13.129 -1.836 -3.175 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -13.683 -0.553 -4.232 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -15.159 0.403 -2.983 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.636 -0.360 -2.384 1.00 0.00 H new ATOM 827 N ASP A 52 -11.930 -4.737 -6.819 1.00 0.00 N ATOM 828 CA ASP A 52 -11.912 -5.730 -7.880 1.00 0.00 C ATOM 829 C ASP A 52 -11.755 -7.122 -7.267 1.00 0.00 C ATOM 830 O ASP A 52 -10.817 -7.370 -6.511 1.00 0.00 O ATOM 831 CB ASP A 52 -10.736 -5.498 -8.831 1.00 0.00 C ATOM 832 CG ASP A 52 -10.806 -6.276 -10.147 1.00 0.00 C ATOM 833 OD1 ASP A 52 -9.831 -6.328 -10.910 1.00 0.00 O ATOM 834 OD2 ASP A 52 -11.936 -6.852 -10.381 1.00 0.00 O ATOM 0 H ASP A 52 -11.151 -4.079 -6.837 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.847 -5.648 -8.434 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.676 -4.434 -9.058 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.813 -5.766 -8.316 1.00 0.00 H new ATOM 840 N ALA A 53 -12.690 -7.996 -7.614 1.00 0.00 N ATOM 841 CA ALA A 53 -12.667 -9.358 -7.108 1.00 0.00 C ATOM 842 C ALA A 53 -11.274 -9.953 -7.321 1.00 0.00 C ATOM 843 O ALA A 53 -10.717 -10.578 -6.418 1.00 0.00 O ATOM 844 CB ALA A 53 -13.763 -10.175 -7.795 1.00 0.00 C ATOM 0 H ALA A 53 -13.468 -7.787 -8.240 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.871 -9.374 -6.037 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.747 -11.197 -7.416 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.735 -9.727 -7.588 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.590 -10.184 -8.871 1.00 0.00 H new ATOM 850 N LYS A 54 -10.751 -9.740 -8.519 1.00 0.00 N ATOM 851 CA LYS A 54 -9.434 -10.248 -8.862 1.00 0.00 C ATOM 852 C LYS A 54 -8.442 -9.869 -7.759 1.00 0.00 C ATOM 853 O LYS A 54 -7.643 -10.697 -7.326 1.00 0.00 O ATOM 854 CB LYS A 54 -9.019 -9.766 -10.254 1.00 0.00 C ATOM 855 CG LYS A 54 -9.761 -10.538 -11.345 1.00 0.00 C ATOM 856 CD LYS A 54 -9.160 -11.933 -11.537 1.00 0.00 C ATOM 857 CE LYS A 54 -10.054 -12.797 -12.427 1.00 0.00 C ATOM 858 NZ LYS A 54 -9.439 -14.125 -12.646 1.00 0.00 N ATOM 0 H LYS A 54 -11.216 -9.222 -9.265 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.449 -11.336 -8.918 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -9.228 -8.701 -10.351 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -7.944 -9.893 -10.381 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -10.815 -10.626 -11.081 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -9.713 -9.985 -12.283 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -8.169 -11.848 -11.984 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -9.032 -12.414 -10.567 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -11.033 -12.915 -11.963 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -10.212 -12.301 -13.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -10.059 -14.699 -13.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -8.515 -14.008 -13.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -9.310 -14.603 -11.731 1.00 0.00 H new ATOM 871 N PHE A 55 -8.528 -8.616 -7.336 1.00 0.00 N ATOM 872 CA PHE A 55 -7.649 -8.117 -6.292 1.00 0.00 C ATOM 873 C PHE A 55 -8.057 -8.666 -4.923 1.00 0.00 C ATOM 874 O PHE A 55 -7.211 -8.857 -4.050 1.00 0.00 O ATOM 875 CB PHE A 55 -7.789 -6.593 -6.279 1.00 0.00 C ATOM 876 CG PHE A 55 -6.665 -5.860 -7.014 1.00 0.00 C ATOM 877 CD1 PHE A 55 -5.424 -5.787 -6.459 1.00 0.00 C ATOM 878 CD2 PHE A 55 -6.906 -5.279 -8.219 1.00 0.00 C ATOM 879 CE1 PHE A 55 -4.383 -5.105 -7.140 1.00 0.00 C ATOM 880 CE2 PHE A 55 -5.863 -4.597 -8.899 1.00 0.00 C ATOM 881 CZ PHE A 55 -4.623 -4.525 -8.346 1.00 0.00 C ATOM 0 H PHE A 55 -9.193 -7.932 -7.697 1.00 0.00 H new ATOM 0 HA PHE A 55 -6.623 -8.430 -6.489 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.743 -6.322 -6.732 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -7.818 -6.250 -5.245 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -5.232 -6.248 -5.501 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.891 -5.336 -8.659 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.399 -5.046 -6.700 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.055 -4.135 -9.856 1.00 0.00 H new ATOM 0 HZ PHE A 55 -3.829 -4.007 -8.864 1.00 0.00 H new ATOM 891 N SER A 56 -9.350 -8.906 -4.779 1.00 0.00 N ATOM 892 CA SER A 56 -9.882 -9.429 -3.532 1.00 0.00 C ATOM 893 C SER A 56 -9.018 -10.594 -3.044 1.00 0.00 C ATOM 894 O SER A 56 -8.772 -10.730 -1.846 1.00 0.00 O ATOM 895 CB SER A 56 -11.335 -9.879 -3.696 1.00 0.00 C ATOM 896 OG SER A 56 -12.009 -9.971 -2.443 1.00 0.00 O ATOM 0 H SER A 56 -10.047 -8.748 -5.506 1.00 0.00 H new ATOM 0 HA SER A 56 -9.860 -8.631 -2.790 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.862 -9.176 -4.341 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.361 -10.848 -4.194 1.00 0.00 H new ATOM 0 HG SER A 56 -12.934 -10.260 -2.590 1.00 0.00 H new ATOM 902 N SER A 57 -8.581 -11.404 -3.997 1.00 0.00 N ATOM 903 CA SER A 57 -7.749 -12.553 -3.679 1.00 0.00 C ATOM 904 C SER A 57 -6.727 -12.179 -2.606 1.00 0.00 C ATOM 905 O SER A 57 -6.670 -12.807 -1.550 1.00 0.00 O ATOM 906 CB SER A 57 -7.040 -13.082 -4.928 1.00 0.00 C ATOM 907 OG SER A 57 -6.429 -14.348 -4.698 1.00 0.00 O ATOM 0 H SER A 57 -8.787 -11.288 -4.989 1.00 0.00 H new ATOM 0 HA SER A 57 -8.392 -13.345 -3.297 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.758 -13.169 -5.743 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.282 -12.366 -5.246 1.00 0.00 H new ATOM 0 HG SER A 57 -5.989 -14.653 -5.519 1.00 0.00 H new ATOM 913 N ALA A 58 -5.943 -11.155 -2.913 1.00 0.00 N ATOM 914 CA ALA A 58 -4.923 -10.689 -1.988 1.00 0.00 C ATOM 915 C ALA A 58 -5.380 -9.372 -1.355 1.00 0.00 C ATOM 916 O ALA A 58 -6.322 -8.744 -1.833 1.00 0.00 O ATOM 917 CB ALA A 58 -3.589 -10.550 -2.724 1.00 0.00 C ATOM 0 H ALA A 58 -5.994 -10.635 -3.789 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.776 -11.410 -1.183 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -2.825 -10.201 -2.030 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.295 -11.518 -3.130 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.695 -9.832 -3.538 1.00 0.00 H new ATOM 923 N ASN A 59 -4.689 -8.995 -0.289 1.00 0.00 N ATOM 924 CA ASN A 59 -5.011 -7.766 0.415 1.00 0.00 C ATOM 925 C ASN A 59 -4.228 -6.608 -0.207 1.00 0.00 C ATOM 926 O ASN A 59 -3.002 -6.653 -0.283 1.00 0.00 O ATOM 927 CB ASN A 59 -4.625 -7.858 1.892 1.00 0.00 C ATOM 928 CG ASN A 59 -4.715 -9.302 2.393 1.00 0.00 C ATOM 929 OD1 ASN A 59 -5.402 -10.139 1.831 1.00 0.00 O ATOM 930 ND2 ASN A 59 -3.985 -9.545 3.478 1.00 0.00 N ATOM 0 H ASN A 59 -3.907 -9.519 0.104 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.086 -7.603 0.334 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.611 -7.484 2.031 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.283 -7.222 2.484 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.978 -10.478 3.889 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.432 -8.798 3.899 1.00 0.00 H new ATOM 937 N LEU A 60 -4.970 -5.597 -0.635 1.00 0.00 N ATOM 938 CA LEU A 60 -4.361 -4.429 -1.248 1.00 0.00 C ATOM 939 C LEU A 60 -4.494 -3.234 -0.301 1.00 0.00 C ATOM 940 O LEU A 60 -5.591 -2.922 0.160 1.00 0.00 O ATOM 941 CB LEU A 60 -4.953 -4.181 -2.637 1.00 0.00 C ATOM 942 CG LEU A 60 -4.498 -2.901 -3.342 1.00 0.00 C ATOM 943 CD1 LEU A 60 -4.950 -2.890 -4.804 1.00 0.00 C ATOM 944 CD2 LEU A 60 -4.974 -1.661 -2.585 1.00 0.00 C ATOM 0 H LEU A 60 -5.987 -5.563 -0.569 1.00 0.00 H new ATOM 0 HA LEU A 60 -3.295 -4.595 -1.407 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.704 -5.030 -3.273 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.039 -4.157 -2.548 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.408 -2.879 -3.343 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.614 -1.970 -5.282 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.521 -3.747 -5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.038 -2.946 -4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.638 -0.765 -3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.063 -1.663 -2.532 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.561 -1.670 -1.576 1.00 0.00 H new ATOM 956 N ILE A 61 -3.362 -2.598 -0.040 1.00 0.00 N ATOM 957 CA ILE A 61 -3.339 -1.445 0.843 1.00 0.00 C ATOM 958 C ILE A 61 -2.191 -0.519 0.435 1.00 0.00 C ATOM 959 O ILE A 61 -1.269 -0.937 -0.263 1.00 0.00 O ATOM 960 CB ILE A 61 -3.279 -1.889 2.305 1.00 0.00 C ATOM 961 CG1 ILE A 61 -1.913 -2.491 2.640 1.00 0.00 C ATOM 962 CG2 ILE A 61 -4.424 -2.851 2.633 1.00 0.00 C ATOM 963 CD1 ILE A 61 -1.211 -1.687 3.735 1.00 0.00 C ATOM 0 H ILE A 61 -2.454 -2.859 -0.425 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.262 -0.873 0.746 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.406 -1.008 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -2.037 -3.524 2.966 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.292 -2.512 1.745 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.358 -3.152 3.679 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.378 -2.354 2.457 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.352 -3.733 1.997 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.243 -2.137 3.953 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.066 -0.661 3.397 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.823 -1.689 4.637 1.00 0.00 H new ATOM 975 N THR A 62 -2.285 0.724 0.889 1.00 0.00 N ATOM 976 CA THR A 62 -1.266 1.712 0.580 1.00 0.00 C ATOM 977 C THR A 62 -0.560 2.168 1.859 1.00 0.00 C ATOM 978 O THR A 62 -1.154 2.161 2.935 1.00 0.00 O ATOM 979 CB THR A 62 -1.934 2.856 -0.187 1.00 0.00 C ATOM 980 OG1 THR A 62 -2.775 3.477 0.781 1.00 0.00 O ATOM 981 CG2 THR A 62 -2.904 2.354 -1.258 1.00 0.00 C ATOM 0 H THR A 62 -3.051 1.068 1.468 1.00 0.00 H new ATOM 0 HA THR A 62 -0.485 1.290 -0.052 1.00 0.00 H new ATOM 0 HB THR A 62 -1.169 3.477 -0.653 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.694 3.155 0.670 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.350 3.205 -1.772 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.365 1.738 -1.977 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.689 1.761 -0.789 1.00 0.00 H new ATOM 989 N VAL A 63 0.698 2.554 1.696 1.00 0.00 N ATOM 990 CA VAL A 63 1.491 3.012 2.825 1.00 0.00 C ATOM 991 C VAL A 63 2.004 4.425 2.542 1.00 0.00 C ATOM 992 O VAL A 63 2.325 4.756 1.401 1.00 0.00 O ATOM 993 CB VAL A 63 2.615 2.015 3.113 1.00 0.00 C ATOM 994 CG1 VAL A 63 3.839 2.723 3.697 1.00 0.00 C ATOM 995 CG2 VAL A 63 2.132 0.899 4.042 1.00 0.00 C ATOM 0 H VAL A 63 1.187 2.559 0.801 1.00 0.00 H new ATOM 0 HA VAL A 63 0.880 3.062 3.726 1.00 0.00 H new ATOM 0 HB VAL A 63 2.911 1.560 2.168 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.623 1.992 3.893 1.00 0.00 H new ATOM 0 HG12 VAL A 63 4.204 3.465 2.987 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.563 3.217 4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.950 0.204 4.231 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.797 1.330 4.985 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.305 0.367 3.572 1.00 0.00 H new ATOM 1005 N ALA A 64 2.062 5.221 3.599 1.00 0.00 N ATOM 1006 CA ALA A 64 2.529 6.592 3.478 1.00 0.00 C ATOM 1007 C ALA A 64 3.511 6.893 4.613 1.00 0.00 C ATOM 1008 O ALA A 64 3.293 6.484 5.753 1.00 0.00 O ATOM 1009 CB ALA A 64 1.331 7.542 3.478 1.00 0.00 C ATOM 0 H ALA A 64 1.794 4.943 4.543 1.00 0.00 H new ATOM 0 HA ALA A 64 3.058 6.735 2.536 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.682 8.570 3.387 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.679 7.305 2.637 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.777 7.429 4.410 1.00 0.00 H new ATOM 1015 N SER A 65 4.573 7.606 4.262 1.00 0.00 N ATOM 1016 CA SER A 65 5.588 7.966 5.236 1.00 0.00 C ATOM 1017 C SER A 65 5.587 9.481 5.457 1.00 0.00 C ATOM 1018 O SER A 65 6.013 10.239 4.587 1.00 0.00 O ATOM 1019 CB SER A 65 6.972 7.497 4.788 1.00 0.00 C ATOM 1020 OG SER A 65 6.964 6.135 4.370 1.00 0.00 O ATOM 0 H SER A 65 4.751 7.943 3.316 1.00 0.00 H new ATOM 0 HA SER A 65 5.352 7.467 6.176 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.320 8.126 3.969 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.680 7.621 5.608 1.00 0.00 H new ATOM 0 HG SER A 65 7.819 5.919 3.943 1.00 0.00 H new ATOM 1026 N PRO A 66 5.090 9.886 6.656 1.00 0.00 N ATOM 1027 CA PRO A 66 5.029 11.296 7.003 1.00 0.00 C ATOM 1028 C PRO A 66 6.415 11.835 7.355 1.00 0.00 C ATOM 1029 O PRO A 66 7.167 11.194 8.091 1.00 0.00 O ATOM 1030 CB PRO A 66 4.049 11.373 8.163 1.00 0.00 C ATOM 1031 CG PRO A 66 3.954 9.963 8.724 1.00 0.00 C ATOM 1032 CD PRO A 66 4.577 9.016 7.711 1.00 0.00 C ATOM 0 HA PRO A 66 4.694 11.919 6.174 1.00 0.00 H new ATOM 0 HB2 PRO A 66 4.397 12.073 8.923 1.00 0.00 H new ATOM 0 HB3 PRO A 66 3.074 11.726 7.828 1.00 0.00 H new ATOM 0 HG2 PRO A 66 4.474 9.896 9.679 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.914 9.695 8.908 1.00 0.00 H new ATOM 0 HD2 PRO A 66 5.375 8.425 8.160 1.00 0.00 H new ATOM 0 HD3 PRO A 66 3.841 8.313 7.321 1.00 0.00 H new ATOM 1040 N GLY A 67 6.715 13.006 6.815 1.00 0.00 N ATOM 1041 CA GLY A 67 7.999 13.639 7.064 1.00 0.00 C ATOM 1042 C GLY A 67 9.123 12.909 6.324 1.00 0.00 C ATOM 1043 O GLY A 67 10.293 13.262 6.461 1.00 0.00 O ATOM 0 H GLY A 67 6.091 13.534 6.205 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.964 14.680 6.743 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.205 13.642 8.134 1.00 0.00 H new ATOM 1047 N PHE A 68 8.728 11.904 5.557 1.00 0.00 N ATOM 1048 CA PHE A 68 9.686 11.122 4.797 1.00 0.00 C ATOM 1049 C PHE A 68 9.379 11.183 3.299 1.00 0.00 C ATOM 1050 O PHE A 68 8.235 10.994 2.887 1.00 0.00 O ATOM 1051 CB PHE A 68 9.558 9.672 5.271 1.00 0.00 C ATOM 1052 CG PHE A 68 10.612 8.730 4.686 1.00 0.00 C ATOM 1053 CD1 PHE A 68 11.887 8.757 5.158 1.00 0.00 C ATOM 1054 CD2 PHE A 68 10.273 7.865 3.692 1.00 0.00 C ATOM 1055 CE1 PHE A 68 12.864 7.882 4.614 1.00 0.00 C ATOM 1056 CE2 PHE A 68 11.250 6.990 3.149 1.00 0.00 C ATOM 1057 CZ PHE A 68 12.526 7.018 3.621 1.00 0.00 C ATOM 0 H PHE A 68 7.757 11.614 5.446 1.00 0.00 H new ATOM 0 HA PHE A 68 10.691 11.514 4.952 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.628 9.649 6.358 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.568 9.301 5.008 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.156 9.444 5.947 1.00 0.00 H new ATOM 0 HD2 PHE A 68 9.261 7.844 3.316 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.876 7.903 4.990 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.981 6.302 2.361 1.00 0.00 H new ATOM 0 HZ PHE A 68 13.270 6.354 3.207 1.00 0.00 H new ATOM 1067 N LEU A 69 10.419 11.448 2.523 1.00 0.00 N ATOM 1068 CA LEU A 69 10.276 11.537 1.080 1.00 0.00 C ATOM 1069 C LEU A 69 9.610 12.866 0.719 1.00 0.00 C ATOM 1070 O LEU A 69 9.058 13.013 -0.370 1.00 0.00 O ATOM 1071 CB LEU A 69 9.536 10.311 0.540 1.00 0.00 C ATOM 1072 CG LEU A 69 10.288 9.481 -0.503 1.00 0.00 C ATOM 1073 CD1 LEU A 69 10.711 10.346 -1.693 1.00 0.00 C ATOM 1074 CD2 LEU A 69 11.475 8.753 0.129 1.00 0.00 C ATOM 0 H LEU A 69 11.366 11.604 2.867 1.00 0.00 H new ATOM 0 HA LEU A 69 11.254 11.529 0.598 1.00 0.00 H new ATOM 0 HB2 LEU A 69 9.286 9.663 1.380 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.595 10.643 0.102 1.00 0.00 H new ATOM 0 HG LEU A 69 9.610 8.718 -0.886 1.00 0.00 H new ATOM 0 HD11 LEU A 69 11.243 9.731 -2.419 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.827 10.777 -2.162 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.365 11.146 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.992 8.171 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.163 9.482 0.558 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.117 8.087 0.914 1.00 0.00 H new ATOM 1086 N HIS A 70 9.682 13.801 1.656 1.00 0.00 N ATOM 1087 CA HIS A 70 9.094 15.113 1.451 1.00 0.00 C ATOM 1088 C HIS A 70 7.568 15.003 1.486 1.00 0.00 C ATOM 1089 O HIS A 70 6.869 15.807 0.871 1.00 0.00 O ATOM 1090 CB HIS A 70 9.612 15.745 0.158 1.00 0.00 C ATOM 1091 CG HIS A 70 10.587 16.877 0.375 1.00 0.00 C ATOM 1092 ND1 HIS A 70 11.660 16.786 1.244 1.00 0.00 N ATOM 1093 CD2 HIS A 70 10.641 18.125 -0.173 1.00 0.00 C ATOM 1094 CE1 HIS A 70 12.322 17.933 1.214 1.00 0.00 C ATOM 1095 NE2 HIS A 70 11.689 18.762 0.334 1.00 0.00 N ATOM 0 H HIS A 70 10.139 13.675 2.559 1.00 0.00 H new ATOM 0 HA HIS A 70 9.395 15.780 2.259 1.00 0.00 H new ATOM 0 HB2 HIS A 70 10.094 14.974 -0.443 1.00 0.00 H new ATOM 0 HB3 HIS A 70 8.764 16.115 -0.418 1.00 0.00 H new ATOM 0 HD2 HIS A 70 9.948 18.527 -0.897 1.00 0.00 H new ATOM 0 HE1 HIS A 70 13.207 18.170 1.786 1.00 0.00 H new ATOM 0 HE2 HIS A 70 11.974 19.714 0.104 1.00 0.00 H new ATOM 1104 N GLU A 71 7.097 14.000 2.213 1.00 0.00 N ATOM 1105 CA GLU A 71 5.666 13.774 2.337 1.00 0.00 C ATOM 1106 C GLU A 71 5.112 14.533 3.544 1.00 0.00 C ATOM 1107 O GLU A 71 5.780 14.645 4.570 1.00 0.00 O ATOM 1108 CB GLU A 71 5.354 12.280 2.437 1.00 0.00 C ATOM 1109 CG GLU A 71 4.324 11.863 1.385 1.00 0.00 C ATOM 1110 CD GLU A 71 3.147 12.839 1.354 1.00 0.00 C ATOM 1111 OE1 GLU A 71 3.175 13.821 0.597 1.00 0.00 O ATOM 1112 OE2 GLU A 71 2.176 12.548 2.152 1.00 0.00 O ATOM 0 H GLU A 71 7.680 13.335 2.722 1.00 0.00 H new ATOM 0 HA GLU A 71 5.178 14.154 1.439 1.00 0.00 H new ATOM 0 HB2 GLU A 71 6.270 11.704 2.303 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.975 12.050 3.433 1.00 0.00 H new ATOM 0 HG2 GLU A 71 4.796 11.826 0.403 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.962 10.858 1.603 1.00 0.00 H new ATOM 1120 N LYS A 72 3.895 15.031 3.381 1.00 0.00 N ATOM 1121 CA LYS A 72 3.244 15.775 4.446 1.00 0.00 C ATOM 1122 C LYS A 72 3.523 15.092 5.786 1.00 0.00 C ATOM 1123 O LYS A 72 3.677 13.873 5.845 1.00 0.00 O ATOM 1124 CB LYS A 72 1.753 15.948 4.142 1.00 0.00 C ATOM 1125 CG LYS A 72 1.442 17.386 3.727 1.00 0.00 C ATOM 1126 CD LYS A 72 0.540 17.417 2.491 1.00 0.00 C ATOM 1127 CE LYS A 72 -0.388 18.632 2.519 1.00 0.00 C ATOM 1128 NZ LYS A 72 0.400 19.885 2.551 1.00 0.00 N ATOM 0 H LYS A 72 3.343 14.934 2.529 1.00 0.00 H new ATOM 0 HA LYS A 72 3.653 16.783 4.512 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.459 15.264 3.346 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.166 15.684 5.022 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.955 17.909 4.550 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.371 17.917 3.517 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.153 17.444 1.590 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.053 16.503 2.446 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.034 18.624 1.641 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.037 18.581 3.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.227 20.694 2.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.840 19.995 3.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.141 19.848 1.823 1.00 0.00 H new ATOM 1141 N LYS A 73 3.582 15.907 6.828 1.00 0.00 N ATOM 1142 CA LYS A 73 3.841 15.398 8.163 1.00 0.00 C ATOM 1143 C LYS A 73 2.582 14.707 8.694 1.00 0.00 C ATOM 1144 O LYS A 73 1.491 14.907 8.166 1.00 0.00 O ATOM 1145 CB LYS A 73 4.360 16.514 9.072 1.00 0.00 C ATOM 1146 CG LYS A 73 3.270 17.555 9.339 1.00 0.00 C ATOM 1147 CD LYS A 73 3.869 18.839 9.913 1.00 0.00 C ATOM 1148 CE LYS A 73 4.019 18.743 11.433 1.00 0.00 C ATOM 1149 NZ LYS A 73 4.880 19.835 11.939 1.00 0.00 N ATOM 0 H LYS A 73 3.455 16.918 6.774 1.00 0.00 H new ATOM 0 HA LYS A 73 4.631 14.647 8.137 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.702 16.090 10.016 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.221 16.995 8.608 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.741 17.779 8.413 1.00 0.00 H new ATOM 0 HG3 LYS A 73 2.536 17.149 10.035 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.842 19.025 9.459 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.232 19.686 9.660 1.00 0.00 H new ATOM 0 HE2 LYS A 73 3.038 18.797 11.905 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.450 17.778 11.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 4.971 19.755 12.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.821 19.766 11.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 4.454 20.753 11.699 1.00 0.00 H new ATOM 1162 N ASP A 74 2.779 13.906 9.733 1.00 0.00 N ATOM 1163 CA ASP A 74 1.674 13.186 10.340 1.00 0.00 C ATOM 1164 C ASP A 74 0.623 14.187 10.824 1.00 0.00 C ATOM 1165 O ASP A 74 0.962 15.240 11.363 1.00 0.00 O ATOM 1166 CB ASP A 74 2.144 12.375 11.549 1.00 0.00 C ATOM 1167 CG ASP A 74 1.054 12.042 12.569 1.00 0.00 C ATOM 1168 OD1 ASP A 74 0.053 11.384 12.244 1.00 0.00 O ATOM 1169 OD2 ASP A 74 1.263 12.494 13.758 1.00 0.00 O ATOM 0 H ASP A 74 3.687 13.741 10.168 1.00 0.00 H new ATOM 0 HA ASP A 74 1.259 12.512 9.591 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.584 11.443 11.193 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.935 12.929 12.054 1.00 0.00 H new ATOM 1175 N GLY A 75 -0.634 13.824 10.614 1.00 0.00 N ATOM 1176 CA GLY A 75 -1.739 14.676 11.022 1.00 0.00 C ATOM 1177 C GLY A 75 -2.137 15.634 9.897 1.00 0.00 C ATOM 1178 O GLY A 75 -3.321 15.824 9.629 1.00 0.00 O ATOM 0 H GLY A 75 -0.912 12.951 10.166 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.594 14.060 11.300 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.456 15.246 11.907 1.00 0.00 H new ATOM 1182 N ASP A 76 -1.122 16.211 9.269 1.00 0.00 N ATOM 1183 CA ASP A 76 -1.351 17.144 8.179 1.00 0.00 C ATOM 1184 C ASP A 76 -1.785 16.371 6.933 1.00 0.00 C ATOM 1185 O ASP A 76 -2.565 16.873 6.127 1.00 0.00 O ATOM 1186 CB ASP A 76 -0.073 17.914 7.836 1.00 0.00 C ATOM 1187 CG ASP A 76 -0.159 19.429 8.028 1.00 0.00 C ATOM 1188 OD1 ASP A 76 -0.516 20.172 7.101 1.00 0.00 O ATOM 1189 OD2 ASP A 76 0.162 19.849 9.205 1.00 0.00 O ATOM 0 H ASP A 76 -0.140 16.050 9.494 1.00 0.00 H new ATOM 0 HA ASP A 76 -2.123 17.846 8.493 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.740 17.531 8.452 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.189 17.709 6.798 1.00 0.00 H new ATOM 1195 N PHE A 77 -1.262 15.159 6.815 1.00 0.00 N ATOM 1196 CA PHE A 77 -1.587 14.310 5.682 1.00 0.00 C ATOM 1197 C PHE A 77 -2.970 13.676 5.849 1.00 0.00 C ATOM 1198 O PHE A 77 -3.844 13.853 5.003 1.00 0.00 O ATOM 1199 CB PHE A 77 -0.533 13.203 5.636 1.00 0.00 C ATOM 1200 CG PHE A 77 -0.990 11.939 4.903 1.00 0.00 C ATOM 1201 CD1 PHE A 77 -0.799 11.826 3.562 1.00 0.00 C ATOM 1202 CD2 PHE A 77 -1.587 10.931 5.593 1.00 0.00 C ATOM 1203 CE1 PHE A 77 -1.222 10.653 2.882 1.00 0.00 C ATOM 1204 CE2 PHE A 77 -2.011 9.759 4.912 1.00 0.00 C ATOM 1205 CZ PHE A 77 -1.819 9.645 3.571 1.00 0.00 C ATOM 0 H PHE A 77 -0.615 14.745 7.486 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.597 14.901 4.766 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.363 13.589 5.150 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.254 12.938 6.656 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -0.326 12.627 3.014 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.739 11.021 6.658 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.069 10.562 1.817 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -2.486 8.958 5.459 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.141 8.754 3.053 1.00 0.00 H new ATOM 1215 N GLN A 78 -3.124 12.951 6.947 1.00 0.00 N ATOM 1216 CA GLN A 78 -4.385 12.290 7.237 1.00 0.00 C ATOM 1217 C GLN A 78 -5.543 13.285 7.130 1.00 0.00 C ATOM 1218 O GLN A 78 -6.668 12.901 6.815 1.00 0.00 O ATOM 1219 CB GLN A 78 -4.354 11.631 8.618 1.00 0.00 C ATOM 1220 CG GLN A 78 -4.017 12.654 9.706 1.00 0.00 C ATOM 1221 CD GLN A 78 -3.689 11.958 11.029 1.00 0.00 C ATOM 1222 OE1 GLN A 78 -2.539 11.743 11.377 1.00 0.00 O ATOM 1223 NE2 GLN A 78 -4.758 11.620 11.743 1.00 0.00 N ATOM 0 H GLN A 78 -2.396 12.807 7.647 1.00 0.00 H new ATOM 0 HA GLN A 78 -4.538 11.503 6.499 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -5.321 11.175 8.829 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -3.615 10.829 8.626 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -3.168 13.261 9.390 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -4.859 13.332 9.846 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.693 11.830 11.392 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.644 11.151 12.641 1.00 0.00 H new ATOM 1232 N LYS A 79 -5.226 14.544 7.397 1.00 0.00 N ATOM 1233 CA LYS A 79 -6.226 15.595 7.334 1.00 0.00 C ATOM 1234 C LYS A 79 -6.652 15.803 5.881 1.00 0.00 C ATOM 1235 O LYS A 79 -7.843 15.813 5.573 1.00 0.00 O ATOM 1236 CB LYS A 79 -5.709 16.866 8.011 1.00 0.00 C ATOM 1237 CG LYS A 79 -6.262 16.997 9.431 1.00 0.00 C ATOM 1238 CD LYS A 79 -6.332 18.464 9.861 1.00 0.00 C ATOM 1239 CE LYS A 79 -7.645 18.762 10.585 1.00 0.00 C ATOM 1240 NZ LYS A 79 -7.380 19.252 11.957 1.00 0.00 N ATOM 0 H LYS A 79 -4.291 14.859 7.657 1.00 0.00 H new ATOM 0 HA LYS A 79 -7.118 15.305 7.889 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.620 16.848 8.042 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -5.997 17.738 7.423 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -7.256 16.552 9.480 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.630 16.441 10.124 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.491 18.695 10.515 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.241 19.108 8.986 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -8.213 19.508 10.029 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -8.257 17.861 10.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -8.282 19.450 12.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -6.857 18.527 12.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.814 20.123 11.911 1.00 0.00 H new ATOM 1253 N TRP A 80 -5.654 15.962 5.022 1.00 0.00 N ATOM 1254 CA TRP A 80 -5.912 16.169 3.607 1.00 0.00 C ATOM 1255 C TRP A 80 -6.547 14.892 3.050 1.00 0.00 C ATOM 1256 O TRP A 80 -7.620 14.939 2.452 1.00 0.00 O ATOM 1257 CB TRP A 80 -4.631 16.569 2.871 1.00 0.00 C ATOM 1258 CG TRP A 80 -4.748 16.514 1.346 1.00 0.00 C ATOM 1259 CD1 TRP A 80 -5.859 16.388 0.607 1.00 0.00 C ATOM 1260 CD2 TRP A 80 -3.663 16.590 0.397 1.00 0.00 C ATOM 1261 NE1 TRP A 80 -5.570 16.377 -0.743 1.00 0.00 N ATOM 1262 CE2 TRP A 80 -4.192 16.505 -0.875 1.00 0.00 C ATOM 1263 CE3 TRP A 80 -2.280 16.728 0.607 1.00 0.00 C ATOM 1264 CZ2 TRP A 80 -3.410 16.546 -2.036 1.00 0.00 C ATOM 1265 CZ3 TRP A 80 -1.511 16.767 -0.564 1.00 0.00 C ATOM 1266 CH2 TRP A 80 -2.029 16.682 -1.850 1.00 0.00 C ATOM 0 H TRP A 80 -4.667 15.952 5.279 1.00 0.00 H new ATOM 0 HA TRP A 80 -6.606 16.996 3.458 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -4.354 17.581 3.168 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -3.822 15.911 3.187 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -6.855 16.305 1.016 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -6.244 16.291 -1.504 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -1.844 16.798 1.593 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -3.848 16.477 -3.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -0.441 16.870 -0.459 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -1.369 16.721 -2.704 1.00 0.00 H new ATOM 1277 N TYR A 81 -5.856 13.783 3.267 1.00 0.00 N ATOM 1278 CA TYR A 81 -6.339 12.497 2.794 1.00 0.00 C ATOM 1279 C TYR A 81 -7.798 12.278 3.196 1.00 0.00 C ATOM 1280 O TYR A 81 -8.533 11.561 2.518 1.00 0.00 O ATOM 1281 CB TYR A 81 -5.469 11.442 3.481 1.00 0.00 C ATOM 1282 CG TYR A 81 -6.204 10.137 3.797 1.00 0.00 C ATOM 1283 CD1 TYR A 81 -6.868 9.991 4.997 1.00 0.00 C ATOM 1284 CD2 TYR A 81 -6.204 9.107 2.878 1.00 0.00 C ATOM 1285 CE1 TYR A 81 -7.561 8.764 5.292 1.00 0.00 C ATOM 1286 CE2 TYR A 81 -6.897 7.879 3.174 1.00 0.00 C ATOM 1287 CZ TYR A 81 -7.541 7.768 4.367 1.00 0.00 C ATOM 1288 OH TYR A 81 -8.194 6.609 4.646 1.00 0.00 O ATOM 0 H TYR A 81 -4.966 13.748 3.764 1.00 0.00 H new ATOM 0 HA TYR A 81 -6.283 12.442 1.707 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -4.614 11.220 2.843 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -5.075 11.859 4.408 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -6.868 10.797 5.716 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -5.685 9.222 1.938 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -8.085 8.638 6.228 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -6.905 7.065 2.464 1.00 0.00 H new ATOM 0 HH TYR A 81 -8.095 5.989 3.894 1.00 0.00 H new ATOM 1298 N ALA A 82 -8.176 12.908 4.300 1.00 0.00 N ATOM 1299 CA ALA A 82 -9.534 12.790 4.801 1.00 0.00 C ATOM 1300 C ALA A 82 -10.512 13.281 3.732 1.00 0.00 C ATOM 1301 O ALA A 82 -11.673 12.874 3.713 1.00 0.00 O ATOM 1302 CB ALA A 82 -9.664 13.570 6.112 1.00 0.00 C ATOM 0 H ALA A 82 -7.565 13.501 4.861 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.775 11.749 5.015 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.683 13.482 6.488 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.969 13.164 6.847 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.432 14.620 5.935 1.00 0.00 H new ATOM 1308 N GLY A 83 -10.007 14.148 2.867 1.00 0.00 N ATOM 1309 CA GLY A 83 -10.821 14.698 1.797 1.00 0.00 C ATOM 1310 C GLY A 83 -10.448 14.076 0.449 1.00 0.00 C ATOM 1311 O GLY A 83 -10.770 14.626 -0.603 1.00 0.00 O ATOM 0 H GLY A 83 -9.044 14.483 2.885 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -11.875 14.516 2.007 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.687 15.779 1.752 1.00 0.00 H new ATOM 1315 N LEU A 84 -9.774 12.938 0.524 1.00 0.00 N ATOM 1316 CA LEU A 84 -9.355 12.234 -0.675 1.00 0.00 C ATOM 1317 C LEU A 84 -9.991 10.843 -0.695 1.00 0.00 C ATOM 1318 O LEU A 84 -9.891 10.099 0.279 1.00 0.00 O ATOM 1319 CB LEU A 84 -7.829 12.215 -0.779 1.00 0.00 C ATOM 1320 CG LEU A 84 -7.156 13.566 -1.037 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -5.633 13.438 -0.989 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -7.640 14.175 -2.354 1.00 0.00 C ATOM 0 H LEU A 84 -9.507 12.486 1.398 1.00 0.00 H new ATOM 0 HA LEU A 84 -9.706 12.756 -1.565 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -7.427 11.802 0.146 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -7.548 11.533 -1.581 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.445 14.251 -0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.180 14.412 -1.175 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.329 13.079 -0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.303 12.732 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.147 15.134 -2.514 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.399 13.501 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.719 14.324 -2.311 1.00 0.00 H new ATOM 1334 N ASN A 85 -10.628 10.534 -1.815 1.00 0.00 N ATOM 1335 CA ASN A 85 -11.279 9.245 -1.974 1.00 0.00 C ATOM 1336 C ASN A 85 -12.335 9.074 -0.880 1.00 0.00 C ATOM 1337 O ASN A 85 -12.590 9.997 -0.109 1.00 0.00 O ATOM 1338 CB ASN A 85 -10.273 8.099 -1.842 1.00 0.00 C ATOM 1339 CG ASN A 85 -9.816 7.610 -3.219 1.00 0.00 C ATOM 1340 OD1 ASN A 85 -9.901 8.311 -4.214 1.00 0.00 O ATOM 1341 ND2 ASN A 85 -9.330 6.373 -3.219 1.00 0.00 N ATOM 0 H ASN A 85 -10.707 11.154 -2.621 1.00 0.00 H new ATOM 0 HA ASN A 85 -11.731 9.216 -2.965 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -9.410 8.432 -1.265 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -10.725 7.275 -1.291 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -8.999 5.955 -4.089 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -9.288 5.842 -2.349 1.00 0.00 H new ATOM 1348 N TYR A 86 -12.920 7.885 -0.848 1.00 0.00 N ATOM 1349 CA TYR A 86 -13.943 7.581 0.138 1.00 0.00 C ATOM 1350 C TYR A 86 -13.373 6.728 1.273 1.00 0.00 C ATOM 1351 O TYR A 86 -12.231 6.277 1.203 1.00 0.00 O ATOM 1352 CB TYR A 86 -15.014 6.776 -0.600 1.00 0.00 C ATOM 1353 CG TYR A 86 -16.343 7.515 -0.766 1.00 0.00 C ATOM 1354 CD1 TYR A 86 -16.360 8.800 -1.265 1.00 0.00 C ATOM 1355 CD2 TYR A 86 -17.525 6.894 -0.417 1.00 0.00 C ATOM 1356 CE1 TYR A 86 -17.612 9.498 -1.421 1.00 0.00 C ATOM 1357 CE2 TYR A 86 -18.777 7.590 -0.573 1.00 0.00 C ATOM 1358 CZ TYR A 86 -18.758 8.857 -1.068 1.00 0.00 C ATOM 1359 OH TYR A 86 -19.939 9.514 -1.217 1.00 0.00 O ATOM 0 H TYR A 86 -12.705 7.121 -1.489 1.00 0.00 H new ATOM 0 HA TYR A 86 -14.337 8.497 0.577 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -14.635 6.505 -1.585 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -15.192 5.846 -0.060 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -15.435 9.284 -1.539 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -17.512 5.887 -0.027 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -17.639 10.506 -1.809 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -19.709 7.117 -0.303 1.00 0.00 H new ATOM 0 HH TYR A 86 -20.674 8.935 -0.926 1.00 0.00 H new ATOM 1369 N PRO A 87 -14.217 6.529 2.321 1.00 0.00 N ATOM 1370 CA PRO A 87 -13.808 5.738 3.470 1.00 0.00 C ATOM 1371 C PRO A 87 -13.812 4.245 3.138 1.00 0.00 C ATOM 1372 O PRO A 87 -14.331 3.436 3.905 1.00 0.00 O ATOM 1373 CB PRO A 87 -14.794 6.104 4.569 1.00 0.00 C ATOM 1374 CG PRO A 87 -15.989 6.727 3.867 1.00 0.00 C ATOM 1375 CD PRO A 87 -15.576 7.048 2.439 1.00 0.00 C ATOM 0 HA PRO A 87 -12.785 5.948 3.783 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -15.091 5.222 5.137 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -14.348 6.803 5.276 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -16.836 6.041 3.874 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -16.307 7.632 4.385 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -16.244 6.577 1.718 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -15.608 8.121 2.249 1.00 0.00 H new ATOM 1383 N LYS A 88 -13.229 3.924 1.992 1.00 0.00 N ATOM 1384 CA LYS A 88 -13.157 2.542 1.549 1.00 0.00 C ATOM 1385 C LYS A 88 -11.793 2.289 0.904 1.00 0.00 C ATOM 1386 O LYS A 88 -11.587 1.256 0.267 1.00 0.00 O ATOM 1387 CB LYS A 88 -14.341 2.211 0.637 1.00 0.00 C ATOM 1388 CG LYS A 88 -15.635 2.084 1.444 1.00 0.00 C ATOM 1389 CD LYS A 88 -16.416 0.836 1.032 1.00 0.00 C ATOM 1390 CE LYS A 88 -17.264 0.312 2.194 1.00 0.00 C ATOM 1391 NZ LYS A 88 -18.415 -0.467 1.686 1.00 0.00 N ATOM 0 H LYS A 88 -12.802 4.598 1.357 1.00 0.00 H new ATOM 0 HA LYS A 88 -13.239 1.863 2.398 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -14.453 2.990 -0.117 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -14.146 1.279 0.106 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -15.402 2.037 2.508 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -16.251 2.970 1.292 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -17.059 1.069 0.183 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -15.723 0.061 0.704 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -16.653 -0.313 2.845 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -17.620 1.147 2.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -18.979 -0.815 2.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -19.006 0.140 1.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -18.069 -1.275 1.130 1.00 0.00 H new ATOM 1404 N LEU A 89 -10.898 3.246 1.090 1.00 0.00 N ATOM 1405 CA LEU A 89 -9.560 3.139 0.534 1.00 0.00 C ATOM 1406 C LEU A 89 -8.563 2.877 1.664 1.00 0.00 C ATOM 1407 O LEU A 89 -8.512 3.626 2.638 1.00 0.00 O ATOM 1408 CB LEU A 89 -9.228 4.374 -0.306 1.00 0.00 C ATOM 1409 CG LEU A 89 -7.740 4.686 -0.481 1.00 0.00 C ATOM 1410 CD1 LEU A 89 -7.146 3.888 -1.644 1.00 0.00 C ATOM 1411 CD2 LEU A 89 -7.510 6.190 -0.641 1.00 0.00 C ATOM 0 H LEU A 89 -11.073 4.101 1.619 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.498 2.292 -0.149 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.671 4.247 -1.294 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.709 5.239 0.150 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.217 4.375 0.423 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -6.088 4.128 -1.747 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.259 2.822 -1.449 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.668 4.145 -2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.444 6.384 -0.764 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.048 6.549 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.874 6.710 0.245 1.00 0.00 H new ATOM 1423 N PRO A 90 -7.772 1.783 1.490 1.00 0.00 N ATOM 1424 CA PRO A 90 -6.778 1.414 2.483 1.00 0.00 C ATOM 1425 C PRO A 90 -5.566 2.344 2.419 1.00 0.00 C ATOM 1426 O PRO A 90 -4.988 2.544 1.351 1.00 0.00 O ATOM 1427 CB PRO A 90 -6.433 -0.034 2.176 1.00 0.00 C ATOM 1428 CG PRO A 90 -6.894 -0.277 0.748 1.00 0.00 C ATOM 1429 CD PRO A 90 -7.803 0.874 0.349 1.00 0.00 C ATOM 0 HA PRO A 90 -7.147 1.514 3.504 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.362 -0.210 2.276 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -6.934 -0.710 2.869 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.038 -0.338 0.076 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.425 -1.226 0.675 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.447 1.364 -0.557 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -8.816 0.527 0.147 1.00 0.00 H new ATOM 1437 N VAL A 91 -5.214 2.887 3.576 1.00 0.00 N ATOM 1438 CA VAL A 91 -4.081 3.792 3.664 1.00 0.00 C ATOM 1439 C VAL A 91 -3.395 3.613 5.020 1.00 0.00 C ATOM 1440 O VAL A 91 -4.028 3.769 6.065 1.00 0.00 O ATOM 1441 CB VAL A 91 -4.536 5.229 3.408 1.00 0.00 C ATOM 1442 CG1 VAL A 91 -3.414 6.223 3.715 1.00 0.00 C ATOM 1443 CG2 VAL A 91 -5.041 5.398 1.974 1.00 0.00 C ATOM 0 H VAL A 91 -5.694 2.717 4.460 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.345 3.558 2.894 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.366 5.442 4.082 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.764 7.237 3.524 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.122 6.130 4.761 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.555 6.010 3.078 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.358 6.429 1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.240 5.156 1.275 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.885 4.729 1.804 1.00 0.00 H new ATOM 1453 N VAL A 92 -2.112 3.290 4.961 1.00 0.00 N ATOM 1454 CA VAL A 92 -1.335 3.090 6.173 1.00 0.00 C ATOM 1455 C VAL A 92 -0.274 4.187 6.280 1.00 0.00 C ATOM 1456 O VAL A 92 0.361 4.540 5.289 1.00 0.00 O ATOM 1457 CB VAL A 92 -0.741 1.679 6.185 1.00 0.00 C ATOM 1458 CG1 VAL A 92 0.063 1.435 7.465 1.00 0.00 C ATOM 1459 CG2 VAL A 92 -1.832 0.623 6.013 1.00 0.00 C ATOM 0 H VAL A 92 -1.591 3.162 4.094 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.972 3.168 7.054 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.059 1.595 5.339 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.475 0.426 7.449 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.877 2.158 7.527 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.589 1.548 8.331 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.382 -0.370 6.025 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.551 0.706 6.828 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.342 0.779 5.063 1.00 0.00 H new ATOM 1469 N THR A 93 -0.115 4.695 7.494 1.00 0.00 N ATOM 1470 CA THR A 93 0.857 5.745 7.744 1.00 0.00 C ATOM 1471 C THR A 93 1.898 5.275 8.763 1.00 0.00 C ATOM 1472 O THR A 93 1.567 5.008 9.916 1.00 0.00 O ATOM 1473 CB THR A 93 0.098 6.998 8.185 1.00 0.00 C ATOM 1474 OG1 THR A 93 -0.943 6.498 9.018 1.00 0.00 O ATOM 1475 CG2 THR A 93 -0.642 7.672 7.027 1.00 0.00 C ATOM 0 H THR A 93 -0.643 4.399 8.315 1.00 0.00 H new ATOM 0 HA THR A 93 1.417 5.989 6.841 1.00 0.00 H new ATOM 0 HB THR A 93 0.796 7.707 8.631 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.580 5.817 9.623 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.164 8.556 7.394 1.00 0.00 H new ATOM 0 HG22 THR A 93 0.074 7.966 6.260 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.364 6.975 6.602 1.00 0.00 H new ATOM 1483 N ASP A 94 3.136 5.188 8.299 1.00 0.00 N ATOM 1484 CA ASP A 94 4.228 4.756 9.155 1.00 0.00 C ATOM 1485 C ASP A 94 5.215 5.911 9.338 1.00 0.00 C ATOM 1486 O ASP A 94 5.896 6.307 8.393 1.00 0.00 O ATOM 1487 CB ASP A 94 4.985 3.581 8.532 1.00 0.00 C ATOM 1488 CG ASP A 94 6.154 3.051 9.363 1.00 0.00 C ATOM 1489 OD1 ASP A 94 6.625 3.715 10.299 1.00 0.00 O ATOM 1490 OD2 ASP A 94 6.590 1.889 9.012 1.00 0.00 O ATOM 0 H ASP A 94 3.407 5.409 7.341 1.00 0.00 H new ATOM 0 HA ASP A 94 3.805 4.446 10.111 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.282 2.766 8.360 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.362 3.888 7.556 1.00 0.00 H new ATOM 1496 N ASN A 95 5.262 6.418 10.562 1.00 0.00 N ATOM 1497 CA ASN A 95 6.155 7.519 10.881 1.00 0.00 C ATOM 1498 C ASN A 95 7.596 7.109 10.567 1.00 0.00 C ATOM 1499 O ASN A 95 8.114 6.155 11.145 1.00 0.00 O ATOM 1500 CB ASN A 95 6.079 7.877 12.366 1.00 0.00 C ATOM 1501 CG ASN A 95 6.792 9.200 12.649 1.00 0.00 C ATOM 1502 OD1 ASN A 95 8.010 9.293 12.637 1.00 0.00 O ATOM 1503 ND2 ASN A 95 5.973 10.216 12.903 1.00 0.00 N ATOM 0 H ASN A 95 4.697 6.087 11.344 1.00 0.00 H new ATOM 0 HA ASN A 95 5.853 8.381 10.286 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.036 7.949 12.673 1.00 0.00 H new ATOM 0 HB3 ASN A 95 6.531 7.082 12.959 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.354 11.141 13.103 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.963 10.071 12.897 1.00 0.00 H new ATOM 1510 N GLY A 96 8.202 7.852 9.653 1.00 0.00 N ATOM 1511 CA GLY A 96 9.572 7.578 9.255 1.00 0.00 C ATOM 1512 C GLY A 96 9.623 6.506 8.163 1.00 0.00 C ATOM 1513 O GLY A 96 10.661 6.306 7.534 1.00 0.00 O ATOM 0 H GLY A 96 7.769 8.643 9.177 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.039 8.494 8.893 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.147 7.248 10.120 1.00 0.00 H new ATOM 1517 N GLY A 97 8.490 5.848 7.973 1.00 0.00 N ATOM 1518 CA GLY A 97 8.392 4.802 6.969 1.00 0.00 C ATOM 1519 C GLY A 97 9.404 3.685 7.237 1.00 0.00 C ATOM 1520 O GLY A 97 10.313 3.462 6.440 1.00 0.00 O ATOM 0 H GLY A 97 7.632 6.018 8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 97 7.383 4.390 6.966 1.00 0.00 H new ATOM 0 HA3 GLY A 97 8.566 5.225 5.980 1.00 0.00 H new ATOM 1524 N THR A 98 9.213 3.016 8.365 1.00 0.00 N ATOM 1525 CA THR A 98 10.097 1.930 8.750 1.00 0.00 C ATOM 1526 C THR A 98 10.035 0.801 7.719 1.00 0.00 C ATOM 1527 O THR A 98 11.007 0.071 7.534 1.00 0.00 O ATOM 1528 CB THR A 98 9.713 1.486 10.163 1.00 0.00 C ATOM 1529 OG1 THR A 98 10.292 2.476 11.007 1.00 0.00 O ATOM 1530 CG2 THR A 98 10.410 0.188 10.578 1.00 0.00 C ATOM 0 H THR A 98 8.458 3.206 9.025 1.00 0.00 H new ATOM 0 HA THR A 98 11.138 2.254 8.768 1.00 0.00 H new ATOM 0 HB THR A 98 8.633 1.353 10.221 1.00 0.00 H new ATOM 0 HG1 THR A 98 10.090 2.267 11.943 1.00 0.00 H new ATOM 0 HG21 THR A 98 10.103 -0.083 11.588 1.00 0.00 H new ATOM 0 HG22 THR A 98 10.134 -0.610 9.889 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.490 0.331 10.553 1.00 0.00 H new ATOM 1538 N ILE A 99 8.883 0.694 7.074 1.00 0.00 N ATOM 1539 CA ILE A 99 8.680 -0.334 6.068 1.00 0.00 C ATOM 1540 C ILE A 99 9.315 0.117 4.752 1.00 0.00 C ATOM 1541 O ILE A 99 9.873 -0.697 4.017 1.00 0.00 O ATOM 1542 CB ILE A 99 7.195 -0.681 5.947 1.00 0.00 C ATOM 1543 CG1 ILE A 99 6.642 -1.195 7.278 1.00 0.00 C ATOM 1544 CG2 ILE A 99 6.953 -1.671 4.807 1.00 0.00 C ATOM 1545 CD1 ILE A 99 5.496 -0.311 7.773 1.00 0.00 C ATOM 0 H ILE A 99 8.080 1.303 7.229 1.00 0.00 H new ATOM 0 HA ILE A 99 9.176 -1.259 6.363 1.00 0.00 H new ATOM 0 HB ILE A 99 6.651 0.231 5.702 1.00 0.00 H new ATOM 0 HG12 ILE A 99 6.290 -2.220 7.158 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.438 -1.216 8.023 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.889 -1.900 4.744 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.286 -1.232 3.867 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.511 -2.588 4.997 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.121 -0.698 8.720 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.857 0.708 7.915 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.692 -0.312 7.037 1.00 0.00 H new ATOM 1557 N ALA A 100 9.209 1.412 4.492 1.00 0.00 N ATOM 1558 CA ALA A 100 9.766 1.981 3.278 1.00 0.00 C ATOM 1559 C ALA A 100 11.290 2.039 3.398 1.00 0.00 C ATOM 1560 O ALA A 100 12.003 1.837 2.415 1.00 0.00 O ATOM 1561 CB ALA A 100 9.149 3.359 3.028 1.00 0.00 C ATOM 0 H ALA A 100 8.745 2.084 5.103 1.00 0.00 H new ATOM 0 HA ALA A 100 9.526 1.356 2.418 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.568 3.785 2.116 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.069 3.260 2.919 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.370 4.015 3.870 1.00 0.00 H new ATOM 1567 N GLN A 101 11.745 2.313 4.611 1.00 0.00 N ATOM 1568 CA GLN A 101 13.172 2.400 4.873 1.00 0.00 C ATOM 1569 C GLN A 101 13.766 1.000 5.047 1.00 0.00 C ATOM 1570 O GLN A 101 14.907 0.754 4.660 1.00 0.00 O ATOM 1571 CB GLN A 101 13.452 3.270 6.100 1.00 0.00 C ATOM 1572 CG GLN A 101 14.747 2.841 6.793 1.00 0.00 C ATOM 1573 CD GLN A 101 15.378 4.013 7.551 1.00 0.00 C ATOM 1574 OE1 GLN A 101 15.582 5.091 7.018 1.00 0.00 O ATOM 1575 NE2 GLN A 101 15.675 3.738 8.818 1.00 0.00 N ATOM 0 H GLN A 101 11.151 2.478 5.424 1.00 0.00 H new ATOM 0 HA GLN A 101 13.651 2.873 4.016 1.00 0.00 H new ATOM 0 HB2 GLN A 101 13.525 4.315 5.800 1.00 0.00 H new ATOM 0 HB3 GLN A 101 12.619 3.197 6.800 1.00 0.00 H new ATOM 0 HG2 GLN A 101 14.540 2.025 7.485 1.00 0.00 H new ATOM 0 HG3 GLN A 101 15.451 2.461 6.053 1.00 0.00 H new ATOM 0 HE21 GLN A 101 15.476 2.813 9.199 1.00 0.00 H new ATOM 0 HE22 GLN A 101 16.101 4.452 9.408 1.00 0.00 H new ATOM 1584 N SER A 102 12.965 0.121 5.631 1.00 0.00 N ATOM 1585 CA SER A 102 13.396 -1.247 5.860 1.00 0.00 C ATOM 1586 C SER A 102 13.631 -1.953 4.524 1.00 0.00 C ATOM 1587 O SER A 102 14.445 -2.871 4.437 1.00 0.00 O ATOM 1588 CB SER A 102 12.369 -2.016 6.693 1.00 0.00 C ATOM 1589 OG SER A 102 12.491 -1.736 8.085 1.00 0.00 O ATOM 0 H SER A 102 12.020 0.330 5.952 1.00 0.00 H new ATOM 0 HA SER A 102 14.331 -1.221 6.419 1.00 0.00 H new ATOM 0 HB2 SER A 102 11.364 -1.758 6.358 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.495 -3.086 6.526 1.00 0.00 H new ATOM 0 HG SER A 102 11.930 -0.966 8.314 1.00 0.00 H new ATOM 1595 N LEU A 103 12.903 -1.498 3.514 1.00 0.00 N ATOM 1596 CA LEU A 103 13.022 -2.075 2.186 1.00 0.00 C ATOM 1597 C LEU A 103 13.849 -1.141 1.302 1.00 0.00 C ATOM 1598 O LEU A 103 14.302 -1.535 0.228 1.00 0.00 O ATOM 1599 CB LEU A 103 11.639 -2.399 1.616 1.00 0.00 C ATOM 1600 CG LEU A 103 10.842 -3.474 2.358 1.00 0.00 C ATOM 1601 CD1 LEU A 103 9.338 -3.214 2.248 1.00 0.00 C ATOM 1602 CD2 LEU A 103 11.220 -4.873 1.865 1.00 0.00 C ATOM 0 H LEU A 103 12.229 -0.736 3.589 1.00 0.00 H new ATOM 0 HA LEU A 103 13.553 -3.026 2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 103 11.050 -1.482 1.603 1.00 0.00 H new ATOM 0 HB3 LEU A 103 11.760 -2.715 0.580 1.00 0.00 H new ATOM 0 HG LEU A 103 11.101 -3.424 3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 103 8.794 -3.992 2.784 1.00 0.00 H new ATOM 0 HD12 LEU A 103 9.104 -2.242 2.683 1.00 0.00 H new ATOM 0 HD13 LEU A 103 9.043 -3.222 1.199 1.00 0.00 H new ATOM 0 HD21 LEU A 103 10.640 -5.619 2.408 1.00 0.00 H new ATOM 0 HD22 LEU A 103 11.007 -4.953 0.799 1.00 0.00 H new ATOM 0 HD23 LEU A 103 12.283 -5.044 2.037 1.00 0.00 H new ATOM 1614 N ASN A 104 14.023 0.080 1.785 1.00 0.00 N ATOM 1615 CA ASN A 104 14.787 1.075 1.050 1.00 0.00 C ATOM 1616 C ASN A 104 14.002 1.500 -0.191 1.00 0.00 C ATOM 1617 O ASN A 104 14.486 1.364 -1.314 1.00 0.00 O ATOM 1618 CB ASN A 104 16.130 0.505 0.589 1.00 0.00 C ATOM 1619 CG ASN A 104 17.143 1.625 0.340 1.00 0.00 C ATOM 1620 OD1 ASN A 104 17.673 2.233 1.256 1.00 0.00 O ATOM 1621 ND2 ASN A 104 17.381 1.861 -0.946 1.00 0.00 N ATOM 0 H ASN A 104 13.648 0.404 2.677 1.00 0.00 H new ATOM 0 HA ASN A 104 14.963 1.923 1.712 1.00 0.00 H new ATOM 0 HB2 ASN A 104 16.517 -0.180 1.344 1.00 0.00 H new ATOM 0 HB3 ASN A 104 15.990 -0.073 -0.324 1.00 0.00 H new ATOM 0 HD21 ASN A 104 18.042 2.589 -1.217 1.00 0.00 H new ATOM 0 HD22 ASN A 104 16.902 1.314 -1.662 1.00 0.00 H new ATOM 1628 N ILE A 105 12.803 2.010 0.052 1.00 0.00 N ATOM 1629 CA ILE A 105 11.946 2.457 -1.034 1.00 0.00 C ATOM 1630 C ILE A 105 11.921 3.987 -1.061 1.00 0.00 C ATOM 1631 O ILE A 105 11.393 4.619 -0.149 1.00 0.00 O ATOM 1632 CB ILE A 105 10.560 1.822 -0.918 1.00 0.00 C ATOM 1633 CG1 ILE A 105 10.662 0.349 -0.518 1.00 0.00 C ATOM 1634 CG2 ILE A 105 9.760 2.010 -2.209 1.00 0.00 C ATOM 1635 CD1 ILE A 105 9.281 -0.237 -0.217 1.00 0.00 C ATOM 0 H ILE A 105 12.405 2.124 0.984 1.00 0.00 H new ATOM 0 HA ILE A 105 12.343 2.127 -1.994 1.00 0.00 H new ATOM 0 HB ILE A 105 10.017 2.334 -0.124 1.00 0.00 H new ATOM 0 HG12 ILE A 105 11.134 -0.217 -1.321 1.00 0.00 H new ATOM 0 HG13 ILE A 105 11.301 0.251 0.359 1.00 0.00 H new ATOM 0 HG21 ILE A 105 8.778 1.549 -2.099 1.00 0.00 H new ATOM 0 HG22 ILE A 105 9.640 3.074 -2.411 1.00 0.00 H new ATOM 0 HG23 ILE A 105 10.291 1.541 -3.037 1.00 0.00 H new ATOM 0 HD11 ILE A 105 9.384 -1.285 0.065 1.00 0.00 H new ATOM 0 HD12 ILE A 105 8.822 0.316 0.603 1.00 0.00 H new ATOM 0 HD13 ILE A 105 8.652 -0.160 -1.104 1.00 0.00 H new ATOM 1647 N SER A 106 12.500 4.537 -2.118 1.00 0.00 N ATOM 1648 CA SER A 106 12.551 5.982 -2.276 1.00 0.00 C ATOM 1649 C SER A 106 12.055 6.373 -3.670 1.00 0.00 C ATOM 1650 O SER A 106 12.574 7.308 -4.278 1.00 0.00 O ATOM 1651 CB SER A 106 13.969 6.511 -2.049 1.00 0.00 C ATOM 1652 OG SER A 106 14.950 5.696 -2.682 1.00 0.00 O ATOM 0 H SER A 106 12.938 4.009 -2.873 1.00 0.00 H new ATOM 0 HA SER A 106 11.900 6.432 -1.526 1.00 0.00 H new ATOM 0 HB2 SER A 106 14.042 7.529 -2.432 1.00 0.00 H new ATOM 0 HB3 SER A 106 14.172 6.557 -0.979 1.00 0.00 H new ATOM 0 HG SER A 106 15.841 6.068 -2.515 1.00 0.00 H new ATOM 1658 N VAL A 107 11.054 5.638 -4.134 1.00 0.00 N ATOM 1659 CA VAL A 107 10.484 5.897 -5.445 1.00 0.00 C ATOM 1660 C VAL A 107 8.995 5.541 -5.426 1.00 0.00 C ATOM 1661 O VAL A 107 8.615 4.475 -4.948 1.00 0.00 O ATOM 1662 CB VAL A 107 11.267 5.137 -6.517 1.00 0.00 C ATOM 1663 CG1 VAL A 107 11.542 3.698 -6.077 1.00 0.00 C ATOM 1664 CG2 VAL A 107 10.531 5.170 -7.859 1.00 0.00 C ATOM 0 H VAL A 107 10.624 4.865 -3.626 1.00 0.00 H new ATOM 0 HA VAL A 107 10.564 6.955 -5.694 1.00 0.00 H new ATOM 0 HB VAL A 107 12.227 5.636 -6.649 1.00 0.00 H new ATOM 0 HG11 VAL A 107 12.100 3.179 -6.857 1.00 0.00 H new ATOM 0 HG12 VAL A 107 12.126 3.704 -5.156 1.00 0.00 H new ATOM 0 HG13 VAL A 107 10.597 3.184 -5.904 1.00 0.00 H new ATOM 0 HG21 VAL A 107 11.108 4.623 -8.604 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.551 4.707 -7.748 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.409 6.204 -8.182 1.00 0.00 H new ATOM 1674 N TYR A 108 8.194 6.456 -5.954 1.00 0.00 N ATOM 1675 CA TYR A 108 6.757 6.252 -6.004 1.00 0.00 C ATOM 1676 C TYR A 108 6.211 6.527 -7.406 1.00 0.00 C ATOM 1677 O TYR A 108 6.785 7.318 -8.154 1.00 0.00 O ATOM 1678 CB TYR A 108 6.153 7.262 -5.028 1.00 0.00 C ATOM 1679 CG TYR A 108 6.596 7.068 -3.576 1.00 0.00 C ATOM 1680 CD1 TYR A 108 6.895 5.804 -3.110 1.00 0.00 C ATOM 1681 CD2 TYR A 108 6.695 8.157 -2.733 1.00 0.00 C ATOM 1682 CE1 TYR A 108 7.312 5.621 -1.744 1.00 0.00 C ATOM 1683 CE2 TYR A 108 7.112 7.973 -1.368 1.00 0.00 C ATOM 1684 CZ TYR A 108 7.401 6.714 -0.940 1.00 0.00 C ATOM 1685 OH TYR A 108 7.795 6.541 0.350 1.00 0.00 O ATOM 0 H TYR A 108 8.514 7.340 -6.350 1.00 0.00 H new ATOM 0 HA TYR A 108 6.508 5.222 -5.748 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.424 8.268 -5.348 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.066 7.194 -5.077 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.816 4.952 -3.770 1.00 0.00 H new ATOM 0 HD2 TYR A 108 6.460 9.146 -3.098 1.00 0.00 H new ATOM 0 HE1 TYR A 108 7.549 4.637 -1.366 1.00 0.00 H new ATOM 0 HE2 TYR A 108 7.194 8.816 -0.698 1.00 0.00 H new ATOM 0 HH TYR A 108 7.814 7.409 0.805 1.00 0.00 H new ATOM 1695 N PRO A 109 5.083 5.842 -7.729 1.00 0.00 N ATOM 1696 CA PRO A 109 4.468 4.924 -6.785 1.00 0.00 C ATOM 1697 C PRO A 109 5.269 3.624 -6.684 1.00 0.00 C ATOM 1698 O PRO A 109 6.071 3.315 -7.563 1.00 0.00 O ATOM 1699 CB PRO A 109 3.055 4.712 -7.306 1.00 0.00 C ATOM 1700 CG PRO A 109 3.079 5.144 -8.762 1.00 0.00 C ATOM 1701 CD PRO A 109 4.363 5.921 -8.998 1.00 0.00 C ATOM 0 HA PRO A 109 4.449 5.316 -5.768 1.00 0.00 H new ATOM 0 HB2 PRO A 109 2.757 3.668 -7.213 1.00 0.00 H new ATOM 0 HB3 PRO A 109 2.336 5.300 -6.736 1.00 0.00 H new ATOM 0 HG2 PRO A 109 3.033 4.275 -9.418 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.211 5.763 -8.991 1.00 0.00 H new ATOM 0 HD2 PRO A 109 4.945 5.487 -9.811 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.155 6.955 -9.272 1.00 0.00 H new ATOM 1709 N SER A 110 5.024 2.900 -5.602 1.00 0.00 N ATOM 1710 CA SER A 110 5.713 1.641 -5.372 1.00 0.00 C ATOM 1711 C SER A 110 4.723 0.587 -4.874 1.00 0.00 C ATOM 1712 O SER A 110 3.655 0.925 -4.363 1.00 0.00 O ATOM 1713 CB SER A 110 6.855 1.812 -4.370 1.00 0.00 C ATOM 1714 OG SER A 110 8.118 1.939 -5.016 1.00 0.00 O ATOM 0 H SER A 110 4.358 3.161 -4.875 1.00 0.00 H new ATOM 0 HA SER A 110 6.143 1.309 -6.317 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.671 2.695 -3.758 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.877 0.956 -3.696 1.00 0.00 H new ATOM 0 HG SER A 110 8.479 2.836 -4.855 1.00 0.00 H new ATOM 1720 N TRP A 111 5.111 -0.670 -5.038 1.00 0.00 N ATOM 1721 CA TRP A 111 4.272 -1.775 -4.611 1.00 0.00 C ATOM 1722 C TRP A 111 5.148 -2.763 -3.840 1.00 0.00 C ATOM 1723 O TRP A 111 6.290 -3.014 -4.220 1.00 0.00 O ATOM 1724 CB TRP A 111 3.558 -2.414 -5.805 1.00 0.00 C ATOM 1725 CG TRP A 111 2.594 -1.473 -6.530 1.00 0.00 C ATOM 1726 CD1 TRP A 111 2.895 -0.466 -7.361 1.00 0.00 C ATOM 1727 CD2 TRP A 111 1.154 -1.493 -6.456 1.00 0.00 C ATOM 1728 NE1 TRP A 111 1.758 0.164 -7.826 1.00 0.00 N ATOM 1729 CE2 TRP A 111 0.665 -0.481 -7.259 1.00 0.00 C ATOM 1730 CE3 TRP A 111 0.291 -2.337 -5.736 1.00 0.00 C ATOM 1731 CZ2 TRP A 111 -0.701 -0.218 -7.417 1.00 0.00 C ATOM 1732 CZ3 TRP A 111 -1.072 -2.062 -5.904 1.00 0.00 C ATOM 1733 CH2 TRP A 111 -1.580 -1.048 -6.707 1.00 0.00 C ATOM 0 H TRP A 111 5.997 -0.947 -5.461 1.00 0.00 H new ATOM 0 HA TRP A 111 3.479 -1.425 -3.951 1.00 0.00 H new ATOM 0 HB2 TRP A 111 4.305 -2.769 -6.515 1.00 0.00 H new ATOM 0 HB3 TRP A 111 3.006 -3.288 -5.460 1.00 0.00 H new ATOM 0 HD1 TRP A 111 3.901 -0.183 -7.633 1.00 0.00 H new ATOM 0 HE1 TRP A 111 1.726 0.957 -8.467 1.00 0.00 H new ATOM 0 HE3 TRP A 111 0.651 -3.135 -5.103 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -1.058 0.580 -8.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -1.778 -2.682 -5.372 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -2.647 -0.900 -6.784 1.00 0.00 H new ATOM 1744 N ALA A 112 4.578 -3.299 -2.769 1.00 0.00 N ATOM 1745 CA ALA A 112 5.295 -4.255 -1.941 1.00 0.00 C ATOM 1746 C ALA A 112 4.413 -5.485 -1.711 1.00 0.00 C ATOM 1747 O ALA A 112 3.258 -5.359 -1.311 1.00 0.00 O ATOM 1748 CB ALA A 112 5.710 -3.584 -0.630 1.00 0.00 C ATOM 0 H ALA A 112 3.630 -3.090 -2.456 1.00 0.00 H new ATOM 0 HA ALA A 112 6.205 -4.589 -2.440 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.248 -4.300 -0.009 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.357 -2.733 -0.845 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.822 -3.239 -0.100 1.00 0.00 H new ATOM 1754 N LEU A 113 4.993 -6.646 -1.978 1.00 0.00 N ATOM 1755 CA LEU A 113 4.275 -7.897 -1.807 1.00 0.00 C ATOM 1756 C LEU A 113 4.839 -8.642 -0.596 1.00 0.00 C ATOM 1757 O LEU A 113 6.054 -8.765 -0.447 1.00 0.00 O ATOM 1758 CB LEU A 113 4.307 -8.715 -3.100 1.00 0.00 C ATOM 1759 CG LEU A 113 3.448 -9.982 -3.114 1.00 0.00 C ATOM 1760 CD1 LEU A 113 1.961 -9.637 -3.015 1.00 0.00 C ATOM 1761 CD2 LEU A 113 3.758 -10.840 -4.342 1.00 0.00 C ATOM 0 H LEU A 113 5.952 -6.746 -2.311 1.00 0.00 H new ATOM 0 HA LEU A 113 3.221 -7.706 -1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 113 3.986 -8.073 -3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.340 -8.998 -3.302 1.00 0.00 H new ATOM 0 HG LEU A 113 3.699 -10.576 -2.235 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.373 -10.555 -3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.774 -9.098 -2.086 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.675 -9.012 -3.861 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.135 -11.734 -4.328 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.552 -10.268 -5.247 1.00 0.00 H new ATOM 0 HD23 LEU A 113 4.809 -11.130 -4.327 1.00 0.00 H new ATOM 1773 N ILE A 114 3.931 -9.119 0.242 1.00 0.00 N ATOM 1774 CA ILE A 114 4.322 -9.849 1.436 1.00 0.00 C ATOM 1775 C ILE A 114 3.708 -11.249 1.398 1.00 0.00 C ATOM 1776 O ILE A 114 2.487 -11.396 1.400 1.00 0.00 O ATOM 1777 CB ILE A 114 3.960 -9.054 2.693 1.00 0.00 C ATOM 1778 CG1 ILE A 114 4.632 -7.679 2.683 1.00 0.00 C ATOM 1779 CG2 ILE A 114 4.293 -9.845 3.958 1.00 0.00 C ATOM 1780 CD1 ILE A 114 6.145 -7.809 2.503 1.00 0.00 C ATOM 0 H ILE A 114 2.924 -9.014 0.118 1.00 0.00 H new ATOM 0 HA ILE A 114 5.404 -9.976 1.466 1.00 0.00 H new ATOM 0 HB ILE A 114 2.883 -8.887 2.693 1.00 0.00 H new ATOM 0 HG12 ILE A 114 4.217 -7.074 1.877 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.417 -7.158 3.616 1.00 0.00 H new ATOM 0 HG21 ILE A 114 4.026 -9.257 4.836 1.00 0.00 H new ATOM 0 HG22 ILE A 114 3.731 -10.779 3.962 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.360 -10.064 3.980 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.598 -6.817 2.499 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.560 -8.394 3.323 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.357 -8.308 1.558 1.00 0.00 H new ATOM 1792 N GLY A 115 4.583 -12.244 1.362 1.00 0.00 N ATOM 1793 CA GLY A 115 4.142 -13.628 1.323 1.00 0.00 C ATOM 1794 C GLY A 115 2.978 -13.860 2.289 1.00 0.00 C ATOM 1795 O GLY A 115 2.704 -13.024 3.150 1.00 0.00 O ATOM 0 H GLY A 115 5.595 -12.119 1.359 1.00 0.00 H new ATOM 0 HA2 GLY A 115 3.835 -13.887 0.310 1.00 0.00 H new ATOM 0 HA3 GLY A 115 4.972 -14.285 1.583 1.00 0.00 H new ATOM 1799 N LYS A 116 2.325 -14.999 2.115 1.00 0.00 N ATOM 1800 CA LYS A 116 1.196 -15.352 2.960 1.00 0.00 C ATOM 1801 C LYS A 116 1.697 -15.641 4.377 1.00 0.00 C ATOM 1802 O LYS A 116 0.909 -15.684 5.321 1.00 0.00 O ATOM 1803 CB LYS A 116 0.403 -16.504 2.341 1.00 0.00 C ATOM 1804 CG LYS A 116 1.252 -17.776 2.266 1.00 0.00 C ATOM 1805 CD LYS A 116 0.368 -19.026 2.280 1.00 0.00 C ATOM 1806 CE LYS A 116 0.937 -20.088 3.221 1.00 0.00 C ATOM 1807 NZ LYS A 116 -0.156 -20.812 3.907 1.00 0.00 N ATOM 0 H LYS A 116 2.556 -15.690 1.401 1.00 0.00 H new ATOM 0 HA LYS A 116 0.498 -14.518 3.032 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.492 -16.694 2.934 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.070 -16.225 1.341 1.00 0.00 H new ATOM 0 HG2 LYS A 116 1.855 -17.762 1.358 1.00 0.00 H new ATOM 0 HG3 LYS A 116 1.944 -17.806 3.108 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -0.641 -18.759 2.595 1.00 0.00 H new ATOM 0 HD3 LYS A 116 0.290 -19.432 1.272 1.00 0.00 H new ATOM 0 HE2 LYS A 116 1.549 -20.792 2.657 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.588 -19.618 3.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.248 -21.530 4.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -0.724 -20.139 4.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.762 -21.277 3.201 1.00 0.00 H new ATOM 1820 N ASP A 117 3.004 -15.832 4.482 1.00 0.00 N ATOM 1821 CA ASP A 117 3.619 -16.115 5.766 1.00 0.00 C ATOM 1822 C ASP A 117 4.001 -14.798 6.447 1.00 0.00 C ATOM 1823 O ASP A 117 4.195 -14.755 7.660 1.00 0.00 O ATOM 1824 CB ASP A 117 4.893 -16.946 5.597 1.00 0.00 C ATOM 1825 CG ASP A 117 4.729 -18.443 5.870 1.00 0.00 C ATOM 1826 OD1 ASP A 117 4.966 -19.282 4.987 1.00 0.00 O ATOM 1827 OD2 ASP A 117 4.334 -18.740 7.061 1.00 0.00 O ATOM 0 H ASP A 117 3.654 -15.796 3.697 1.00 0.00 H new ATOM 0 HA ASP A 117 2.901 -16.674 6.366 1.00 0.00 H new ATOM 0 HB2 ASP A 117 5.262 -16.816 4.580 1.00 0.00 H new ATOM 0 HB3 ASP A 117 5.658 -16.551 6.266 1.00 0.00 H new ATOM 1833 N GLY A 118 4.099 -13.757 5.633 1.00 0.00 N ATOM 1834 CA GLY A 118 4.454 -12.442 6.140 1.00 0.00 C ATOM 1835 C GLY A 118 5.916 -12.114 5.835 1.00 0.00 C ATOM 1836 O GLY A 118 6.530 -11.301 6.525 1.00 0.00 O ATOM 0 H GLY A 118 3.939 -13.797 4.626 1.00 0.00 H new ATOM 0 HA2 GLY A 118 3.807 -11.688 5.691 1.00 0.00 H new ATOM 0 HA3 GLY A 118 4.286 -12.406 7.216 1.00 0.00 H new ATOM 1840 N ASP A 119 6.432 -12.763 4.802 1.00 0.00 N ATOM 1841 CA ASP A 119 7.811 -12.551 4.398 1.00 0.00 C ATOM 1842 C ASP A 119 7.837 -11.863 3.031 1.00 0.00 C ATOM 1843 O ASP A 119 7.090 -12.238 2.129 1.00 0.00 O ATOM 1844 CB ASP A 119 8.560 -13.878 4.273 1.00 0.00 C ATOM 1845 CG ASP A 119 8.175 -14.726 3.059 1.00 0.00 C ATOM 1846 OD1 ASP A 119 7.027 -15.180 2.935 1.00 0.00 O ATOM 1847 OD2 ASP A 119 9.122 -14.920 2.206 1.00 0.00 O ATOM 0 H ASP A 119 5.919 -13.436 4.232 1.00 0.00 H new ATOM 0 HA ASP A 119 8.293 -11.936 5.158 1.00 0.00 H new ATOM 0 HB2 ASP A 119 9.629 -13.672 4.229 1.00 0.00 H new ATOM 0 HB3 ASP A 119 8.385 -14.463 5.176 1.00 0.00 H new ATOM 1853 N VAL A 120 8.705 -10.867 2.921 1.00 0.00 N ATOM 1854 CA VAL A 120 8.837 -10.125 1.678 1.00 0.00 C ATOM 1855 C VAL A 120 8.776 -11.097 0.498 1.00 0.00 C ATOM 1856 O VAL A 120 9.666 -11.929 0.328 1.00 0.00 O ATOM 1857 CB VAL A 120 10.122 -9.294 1.702 1.00 0.00 C ATOM 1858 CG1 VAL A 120 10.399 -8.674 0.330 1.00 0.00 C ATOM 1859 CG2 VAL A 120 10.057 -8.216 2.785 1.00 0.00 C ATOM 0 H VAL A 120 9.323 -10.557 3.671 1.00 0.00 H new ATOM 0 HA VAL A 120 8.011 -9.423 1.562 1.00 0.00 H new ATOM 0 HB VAL A 120 10.949 -9.962 1.942 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.317 -8.089 0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.508 -9.465 -0.412 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.569 -8.026 0.049 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.982 -7.640 2.781 1.00 0.00 H new ATOM 0 HG22 VAL A 120 9.215 -7.552 2.588 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.927 -8.687 3.760 1.00 0.00 H new ATOM 1869 N GLN A 121 7.718 -10.959 -0.286 1.00 0.00 N ATOM 1870 CA GLN A 121 7.528 -11.815 -1.446 1.00 0.00 C ATOM 1871 C GLN A 121 8.213 -11.207 -2.671 1.00 0.00 C ATOM 1872 O GLN A 121 9.089 -11.829 -3.269 1.00 0.00 O ATOM 1873 CB GLN A 121 6.041 -12.057 -1.711 1.00 0.00 C ATOM 1874 CG GLN A 121 5.835 -13.298 -2.580 1.00 0.00 C ATOM 1875 CD GLN A 121 5.177 -14.424 -1.780 1.00 0.00 C ATOM 1876 OE1 GLN A 121 5.697 -14.899 -0.784 1.00 0.00 O ATOM 1877 NE2 GLN A 121 4.007 -14.824 -2.270 1.00 0.00 N ATOM 0 H GLN A 121 6.982 -10.267 -0.142 1.00 0.00 H new ATOM 0 HA GLN A 121 7.988 -12.782 -1.240 1.00 0.00 H new ATOM 0 HB2 GLN A 121 5.514 -12.180 -0.765 1.00 0.00 H new ATOM 0 HB3 GLN A 121 5.610 -11.187 -2.205 1.00 0.00 H new ATOM 0 HG2 GLN A 121 5.213 -13.046 -3.439 1.00 0.00 H new ATOM 0 HG3 GLN A 121 6.795 -13.637 -2.970 1.00 0.00 H new ATOM 0 HE21 GLN A 121 3.628 -14.384 -3.108 1.00 0.00 H new ATOM 0 HE22 GLN A 121 3.489 -15.571 -1.807 1.00 0.00 H new ATOM 1886 N ARG A 122 7.787 -9.998 -3.009 1.00 0.00 N ATOM 1887 CA ARG A 122 8.348 -9.299 -4.152 1.00 0.00 C ATOM 1888 C ARG A 122 8.127 -7.792 -4.014 1.00 0.00 C ATOM 1889 O ARG A 122 7.039 -7.352 -3.644 1.00 0.00 O ATOM 1890 CB ARG A 122 7.714 -9.783 -5.459 1.00 0.00 C ATOM 1891 CG ARG A 122 8.684 -9.621 -6.631 1.00 0.00 C ATOM 1892 CD ARG A 122 9.024 -10.978 -7.252 1.00 0.00 C ATOM 1893 NE ARG A 122 10.459 -11.024 -7.614 1.00 0.00 N ATOM 1894 CZ ARG A 122 11.129 -12.159 -7.905 1.00 0.00 C ATOM 1895 NH1 ARG A 122 10.500 -13.353 -7.880 1.00 0.00 N ATOM 1896 NH2 ARG A 122 12.410 -12.083 -8.214 1.00 0.00 N ATOM 0 H ARG A 122 7.060 -9.485 -2.511 1.00 0.00 H new ATOM 0 HA ARG A 122 9.417 -9.512 -4.179 1.00 0.00 H new ATOM 0 HB2 ARG A 122 7.426 -10.830 -5.362 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.802 -9.219 -5.656 1.00 0.00 H new ATOM 0 HG2 ARG A 122 8.242 -8.972 -7.387 1.00 0.00 H new ATOM 0 HG3 ARG A 122 9.597 -9.135 -6.288 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.792 -11.778 -6.548 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.411 -11.146 -8.138 1.00 0.00 H new ATOM 0 HE ARG A 122 10.973 -10.144 -7.645 1.00 0.00 H new ATOM 0 HH11 ARG A 122 9.510 -13.403 -7.640 1.00 0.00 H new ATOM 0 HH12 ARG A 122 11.015 -14.205 -8.101 1.00 0.00 H new ATOM 0 HH21 ARG A 122 12.878 -11.177 -8.230 1.00 0.00 H new ATOM 0 HH22 ARG A 122 12.932 -12.931 -8.437 1.00 0.00 H new ATOM 1909 N ILE A 123 9.176 -7.042 -4.319 1.00 0.00 N ATOM 1910 CA ILE A 123 9.110 -5.593 -4.233 1.00 0.00 C ATOM 1911 C ILE A 123 9.122 -5.002 -5.645 1.00 0.00 C ATOM 1912 O ILE A 123 10.036 -5.264 -6.423 1.00 0.00 O ATOM 1913 CB ILE A 123 10.225 -5.058 -3.332 1.00 0.00 C ATOM 1914 CG1 ILE A 123 9.957 -3.605 -2.933 1.00 0.00 C ATOM 1915 CG2 ILE A 123 11.594 -5.227 -3.996 1.00 0.00 C ATOM 1916 CD1 ILE A 123 10.723 -3.238 -1.661 1.00 0.00 C ATOM 0 H ILE A 123 10.076 -7.411 -4.626 1.00 0.00 H new ATOM 0 HA ILE A 123 8.177 -5.281 -3.764 1.00 0.00 H new ATOM 0 HB ILE A 123 10.237 -5.647 -2.415 1.00 0.00 H new ATOM 0 HG12 ILE A 123 10.253 -2.940 -3.745 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.889 -3.458 -2.774 1.00 0.00 H new ATOM 0 HG21 ILE A 123 12.369 -4.839 -3.335 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.777 -6.284 -4.189 1.00 0.00 H new ATOM 0 HG23 ILE A 123 11.612 -4.678 -4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 123 10.516 -2.201 -1.398 1.00 0.00 H new ATOM 0 HD12 ILE A 123 10.407 -3.889 -0.846 1.00 0.00 H new ATOM 0 HD13 ILE A 123 11.792 -3.363 -1.831 1.00 0.00 H new ATOM 1928 N VAL A 124 8.095 -4.214 -5.931 1.00 0.00 N ATOM 1929 CA VAL A 124 7.976 -3.584 -7.235 1.00 0.00 C ATOM 1930 C VAL A 124 8.092 -2.068 -7.075 1.00 0.00 C ATOM 1931 O VAL A 124 7.519 -1.490 -6.152 1.00 0.00 O ATOM 1932 CB VAL A 124 6.671 -4.016 -7.907 1.00 0.00 C ATOM 1933 CG1 VAL A 124 6.325 -3.090 -9.075 1.00 0.00 C ATOM 1934 CG2 VAL A 124 6.748 -5.474 -8.367 1.00 0.00 C ATOM 0 H VAL A 124 7.338 -3.998 -5.282 1.00 0.00 H new ATOM 0 HA VAL A 124 8.786 -3.905 -7.891 1.00 0.00 H new ATOM 0 HB VAL A 124 5.872 -3.939 -7.170 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.393 -3.418 -9.536 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.209 -2.070 -8.709 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.126 -3.121 -9.814 1.00 0.00 H new ATOM 0 HG21 VAL A 124 5.808 -5.756 -8.841 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.563 -5.588 -9.082 1.00 0.00 H new ATOM 0 HG23 VAL A 124 6.928 -6.118 -7.506 1.00 0.00 H new ATOM 1944 N LYS A 125 8.839 -1.464 -7.989 1.00 0.00 N ATOM 1945 CA LYS A 125 9.037 -0.025 -7.961 1.00 0.00 C ATOM 1946 C LYS A 125 8.519 0.583 -9.268 1.00 0.00 C ATOM 1947 O LYS A 125 9.052 0.303 -10.340 1.00 0.00 O ATOM 1948 CB LYS A 125 10.501 0.308 -7.667 1.00 0.00 C ATOM 1949 CG LYS A 125 10.835 0.054 -6.195 1.00 0.00 C ATOM 1950 CD LYS A 125 12.337 0.205 -5.940 1.00 0.00 C ATOM 1951 CE LYS A 125 12.999 -1.160 -5.742 1.00 0.00 C ATOM 1952 NZ LYS A 125 14.016 -1.398 -6.791 1.00 0.00 N ATOM 0 H LYS A 125 9.314 -1.945 -8.753 1.00 0.00 H new ATOM 0 HA LYS A 125 8.462 0.423 -7.150 1.00 0.00 H new ATOM 0 HB2 LYS A 125 11.150 -0.297 -8.301 1.00 0.00 H new ATOM 0 HB3 LYS A 125 10.697 1.351 -7.914 1.00 0.00 H new ATOM 0 HG2 LYS A 125 10.284 0.754 -5.567 1.00 0.00 H new ATOM 0 HG3 LYS A 125 10.513 -0.949 -5.913 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.802 0.720 -6.780 1.00 0.00 H new ATOM 0 HD3 LYS A 125 12.499 0.823 -5.057 1.00 0.00 H new ATOM 0 HE2 LYS A 125 13.465 -1.206 -4.758 1.00 0.00 H new ATOM 0 HE3 LYS A 125 12.244 -1.945 -5.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 14.456 -2.328 -6.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 13.562 -1.375 -7.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 14.745 -0.658 -6.742 1.00 0.00 H new ATOM 1965 N GLY A 126 7.487 1.402 -9.132 1.00 0.00 N ATOM 1966 CA GLY A 126 6.891 2.050 -10.288 1.00 0.00 C ATOM 1967 C GLY A 126 5.369 1.902 -10.276 1.00 0.00 C ATOM 1968 O GLY A 126 4.770 1.696 -9.222 1.00 0.00 O ATOM 0 H GLY A 126 7.049 1.632 -8.240 1.00 0.00 H new ATOM 0 HA2 GLY A 126 7.157 3.107 -10.294 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.295 1.614 -11.202 1.00 0.00 H new ATOM 1972 N SER A 127 4.787 2.012 -11.461 1.00 0.00 N ATOM 1973 CA SER A 127 3.344 1.893 -11.601 1.00 0.00 C ATOM 1974 C SER A 127 3.001 0.661 -12.441 1.00 0.00 C ATOM 1975 O SER A 127 3.639 0.402 -13.459 1.00 0.00 O ATOM 1976 CB SER A 127 2.747 3.151 -12.234 1.00 0.00 C ATOM 1977 OG SER A 127 3.273 4.341 -11.654 1.00 0.00 O ATOM 0 H SER A 127 5.288 2.182 -12.333 1.00 0.00 H new ATOM 0 HA SER A 127 2.911 1.779 -10.607 1.00 0.00 H new ATOM 0 HB2 SER A 127 2.950 3.149 -13.305 1.00 0.00 H new ATOM 0 HB3 SER A 127 1.664 3.138 -12.115 1.00 0.00 H new ATOM 0 HG SER A 127 2.868 5.122 -12.086 1.00 0.00 H new ATOM 1983 N ILE A 128 1.993 -0.066 -11.982 1.00 0.00 N ATOM 1984 CA ILE A 128 1.557 -1.264 -12.677 1.00 0.00 C ATOM 1985 C ILE A 128 0.111 -1.081 -13.143 1.00 0.00 C ATOM 1986 O ILE A 128 -0.571 -0.153 -12.711 1.00 0.00 O ATOM 1987 CB ILE A 128 1.767 -2.501 -11.801 1.00 0.00 C ATOM 1988 CG1 ILE A 128 1.142 -2.304 -10.417 1.00 0.00 C ATOM 1989 CG2 ILE A 128 3.251 -2.866 -11.713 1.00 0.00 C ATOM 1990 CD1 ILE A 128 0.908 -3.648 -9.726 1.00 0.00 C ATOM 0 H ILE A 128 1.466 0.152 -11.137 1.00 0.00 H new ATOM 0 HA ILE A 128 2.163 -1.427 -13.568 1.00 0.00 H new ATOM 0 HB ILE A 128 1.256 -3.342 -12.269 1.00 0.00 H new ATOM 0 HG12 ILE A 128 1.796 -1.684 -9.803 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.196 -1.771 -10.514 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.372 -3.748 -11.085 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.634 -3.076 -12.712 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.805 -2.033 -11.280 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.463 -3.480 -8.745 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.234 -4.256 -10.330 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.859 -4.168 -9.609 1.00 0.00 H new ATOM 2002 N ASN A 129 -0.313 -1.978 -14.020 1.00 0.00 N ATOM 2003 CA ASN A 129 -1.665 -1.926 -14.551 1.00 0.00 C ATOM 2004 C ASN A 129 -2.496 -3.049 -13.926 1.00 0.00 C ATOM 2005 O ASN A 129 -1.953 -3.941 -13.278 1.00 0.00 O ATOM 2006 CB ASN A 129 -1.670 -2.122 -16.068 1.00 0.00 C ATOM 2007 CG ASN A 129 -0.618 -3.150 -16.491 1.00 0.00 C ATOM 2008 OD1 ASN A 129 0.572 -2.982 -16.279 1.00 0.00 O ATOM 2009 ND2 ASN A 129 -1.120 -4.219 -17.102 1.00 0.00 N ATOM 0 H ASN A 129 0.256 -2.746 -14.377 1.00 0.00 H new ATOM 0 HA ASN A 129 -2.083 -0.948 -14.313 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -2.657 -2.452 -16.393 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -1.473 -1.170 -16.562 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -0.499 -4.961 -17.425 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -2.126 -4.297 -17.248 1.00 0.00 H new ATOM 2016 N GLU A 130 -3.801 -2.966 -14.144 1.00 0.00 N ATOM 2017 CA GLU A 130 -4.712 -3.965 -13.611 1.00 0.00 C ATOM 2018 C GLU A 130 -4.270 -5.368 -14.032 1.00 0.00 C ATOM 2019 O GLU A 130 -4.298 -6.298 -13.230 1.00 0.00 O ATOM 2020 CB GLU A 130 -6.151 -3.687 -14.055 1.00 0.00 C ATOM 2021 CG GLU A 130 -7.096 -4.786 -13.569 1.00 0.00 C ATOM 2022 CD GLU A 130 -8.004 -5.270 -14.701 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -9.005 -4.609 -15.018 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -7.639 -6.373 -15.260 1.00 0.00 O ATOM 0 H GLU A 130 -4.248 -2.223 -14.682 1.00 0.00 H new ATOM 0 HA GLU A 130 -4.684 -3.909 -12.523 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.476 -2.723 -13.664 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.194 -3.620 -15.142 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.516 -5.623 -13.180 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.704 -4.410 -12.746 1.00 0.00 H new ATOM 2032 N ALA A 131 -3.872 -5.475 -15.292 1.00 0.00 N ATOM 2033 CA ALA A 131 -3.424 -6.748 -15.830 1.00 0.00 C ATOM 2034 C ALA A 131 -2.259 -7.271 -14.988 1.00 0.00 C ATOM 2035 O ALA A 131 -2.281 -8.413 -14.532 1.00 0.00 O ATOM 2036 CB ALA A 131 -3.049 -6.576 -17.303 1.00 0.00 C ATOM 0 H ALA A 131 -3.851 -4.701 -15.955 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.223 -7.488 -15.782 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.713 -7.531 -17.707 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.919 -6.232 -17.862 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.248 -5.843 -17.391 1.00 0.00 H new ATOM 2042 N GLN A 132 -1.269 -6.410 -14.806 1.00 0.00 N ATOM 2043 CA GLN A 132 -0.097 -6.770 -14.027 1.00 0.00 C ATOM 2044 C GLN A 132 -0.515 -7.346 -12.673 1.00 0.00 C ATOM 2045 O GLN A 132 0.013 -8.368 -12.238 1.00 0.00 O ATOM 2046 CB GLN A 132 0.834 -5.568 -13.846 1.00 0.00 C ATOM 2047 CG GLN A 132 2.045 -5.669 -14.774 1.00 0.00 C ATOM 2048 CD GLN A 132 2.959 -4.451 -14.619 1.00 0.00 C ATOM 2049 OE1 GLN A 132 2.546 -3.311 -14.754 1.00 0.00 O ATOM 2050 NE2 GLN A 132 4.221 -4.755 -14.327 1.00 0.00 N ATOM 0 H GLN A 132 -1.254 -5.463 -15.185 1.00 0.00 H new ATOM 0 HA GLN A 132 0.454 -7.536 -14.572 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.289 -4.647 -14.052 1.00 0.00 H new ATOM 0 HB3 GLN A 132 1.169 -5.515 -12.810 1.00 0.00 H new ATOM 0 HG2 GLN A 132 2.604 -6.578 -14.551 1.00 0.00 H new ATOM 0 HG3 GLN A 132 1.709 -5.747 -15.808 1.00 0.00 H new ATOM 0 HE21 GLN A 132 4.501 -5.731 -14.228 1.00 0.00 H new ATOM 0 HE22 GLN A 132 4.909 -4.012 -14.202 1.00 0.00 H new ATOM 2059 N ALA A 133 -1.463 -6.667 -12.044 1.00 0.00 N ATOM 2060 CA ALA A 133 -1.960 -7.098 -10.749 1.00 0.00 C ATOM 2061 C ALA A 133 -2.376 -8.569 -10.832 1.00 0.00 C ATOM 2062 O ALA A 133 -2.052 -9.360 -9.947 1.00 0.00 O ATOM 2063 CB ALA A 133 -3.112 -6.190 -10.314 1.00 0.00 C ATOM 0 H ALA A 133 -1.900 -5.820 -12.408 1.00 0.00 H new ATOM 0 HA ALA A 133 -1.179 -7.017 -9.993 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.484 -6.514 -9.342 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.758 -5.162 -10.242 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -3.916 -6.246 -11.048 1.00 0.00 H new ATOM 2069 N LEU A 134 -3.086 -8.890 -11.902 1.00 0.00 N ATOM 2070 CA LEU A 134 -3.549 -10.252 -12.111 1.00 0.00 C ATOM 2071 C LEU A 134 -2.349 -11.200 -12.114 1.00 0.00 C ATOM 2072 O LEU A 134 -2.342 -12.200 -11.399 1.00 0.00 O ATOM 2073 CB LEU A 134 -4.405 -10.337 -13.376 1.00 0.00 C ATOM 2074 CG LEU A 134 -5.530 -9.309 -13.497 1.00 0.00 C ATOM 2075 CD1 LEU A 134 -6.352 -9.539 -14.768 1.00 0.00 C ATOM 2076 CD2 LEU A 134 -6.406 -9.305 -12.242 1.00 0.00 C ATOM 0 H LEU A 134 -3.352 -8.231 -12.634 1.00 0.00 H new ATOM 0 HA LEU A 134 -4.198 -10.564 -11.293 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -3.750 -10.232 -14.241 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -4.844 -11.333 -13.427 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.080 -8.320 -13.580 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -7.145 -8.794 -14.828 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.705 -9.452 -15.641 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.792 -10.536 -14.741 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.199 -8.565 -12.354 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.848 -10.292 -12.103 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.796 -9.055 -11.374 1.00 0.00 H new ATOM 2088 N ALA A 135 -1.362 -10.851 -12.926 1.00 0.00 N ATOM 2089 CA ALA A 135 -0.158 -11.659 -13.032 1.00 0.00 C ATOM 2090 C ALA A 135 0.599 -11.613 -11.704 1.00 0.00 C ATOM 2091 O ALA A 135 1.347 -12.533 -11.380 1.00 0.00 O ATOM 2092 CB ALA A 135 0.690 -11.160 -14.204 1.00 0.00 C ATOM 0 H ALA A 135 -1.371 -10.020 -13.517 1.00 0.00 H new ATOM 0 HA ALA A 135 -0.410 -12.700 -13.232 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.593 -11.766 -14.284 1.00 0.00 H new ATOM 0 HB2 ALA A 135 0.117 -11.240 -15.128 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.965 -10.119 -14.037 1.00 0.00 H new ATOM 2098 N LEU A 136 0.377 -10.533 -10.969 1.00 0.00 N ATOM 2099 CA LEU A 136 1.030 -10.355 -9.683 1.00 0.00 C ATOM 2100 C LEU A 136 0.388 -11.291 -8.657 1.00 0.00 C ATOM 2101 O LEU A 136 1.080 -11.868 -7.819 1.00 0.00 O ATOM 2102 CB LEU A 136 1.009 -8.883 -9.270 1.00 0.00 C ATOM 2103 CG LEU A 136 1.597 -8.563 -7.894 1.00 0.00 C ATOM 2104 CD1 LEU A 136 3.127 -8.552 -7.941 1.00 0.00 C ATOM 2105 CD2 LEU A 136 1.032 -7.250 -7.346 1.00 0.00 C ATOM 0 H LEU A 136 -0.246 -9.772 -11.240 1.00 0.00 H new ATOM 0 HA LEU A 136 2.083 -10.628 -9.750 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.555 -8.309 -10.019 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.024 -8.535 -9.291 1.00 0.00 H new ATOM 0 HG LEU A 136 1.300 -9.353 -7.205 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.520 -8.322 -6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 136 3.488 -9.531 -8.256 1.00 0.00 H new ATOM 0 HD13 LEU A 136 3.464 -7.795 -8.650 1.00 0.00 H new ATOM 0 HD21 LEU A 136 1.467 -7.047 -6.367 1.00 0.00 H new ATOM 0 HD22 LEU A 136 1.277 -6.436 -8.028 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -0.051 -7.331 -7.252 1.00 0.00 H new ATOM 2117 N ILE A 137 -0.929 -11.411 -8.755 1.00 0.00 N ATOM 2118 CA ILE A 137 -1.671 -12.268 -7.846 1.00 0.00 C ATOM 2119 C ILE A 137 -1.572 -13.718 -8.323 1.00 0.00 C ATOM 2120 O ILE A 137 -1.736 -14.647 -7.533 1.00 0.00 O ATOM 2121 CB ILE A 137 -3.109 -11.767 -7.696 1.00 0.00 C ATOM 2122 CG1 ILE A 137 -3.140 -10.350 -7.123 1.00 0.00 C ATOM 2123 CG2 ILE A 137 -3.944 -12.741 -6.860 1.00 0.00 C ATOM 2124 CD1 ILE A 137 -4.198 -9.496 -7.825 1.00 0.00 C ATOM 0 H ILE A 137 -1.500 -10.929 -9.449 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.237 -12.231 -6.847 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.560 -11.723 -8.687 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.351 -10.391 -6.054 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.160 -9.887 -7.237 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.962 -12.362 -6.768 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.962 -13.716 -7.348 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.503 -12.840 -5.868 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -4.198 -8.493 -7.398 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -3.970 -9.437 -8.889 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -5.180 -9.949 -7.689 1.00 0.00 H new ATOM 2136 N ARG A 138 -1.303 -13.868 -9.611 1.00 0.00 N ATOM 2137 CA ARG A 138 -1.179 -15.190 -10.201 1.00 0.00 C ATOM 2138 C ARG A 138 0.142 -15.838 -9.780 1.00 0.00 C ATOM 2139 O ARG A 138 0.165 -16.995 -9.365 1.00 0.00 O ATOM 2140 CB ARG A 138 -1.240 -15.119 -11.728 1.00 0.00 C ATOM 2141 CG ARG A 138 -2.393 -15.966 -12.271 1.00 0.00 C ATOM 2142 CD ARG A 138 -2.393 -15.977 -13.800 1.00 0.00 C ATOM 2143 NE ARG A 138 -3.238 -14.877 -14.316 1.00 0.00 N ATOM 2144 CZ ARG A 138 -3.800 -14.865 -15.543 1.00 0.00 C ATOM 2145 NH1 ARG A 138 -3.611 -15.897 -16.394 1.00 0.00 N ATOM 2146 NH2 ARG A 138 -4.537 -13.831 -15.899 1.00 0.00 N ATOM 0 H ARG A 138 -1.167 -13.096 -10.263 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.014 -15.793 -9.843 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -1.366 -14.083 -12.043 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.298 -15.468 -12.150 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -2.307 -16.986 -11.897 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -3.342 -15.571 -11.907 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -1.374 -15.869 -14.172 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -2.766 -16.934 -14.165 1.00 0.00 H new ATOM 0 HE ARG A 138 -3.406 -14.077 -13.706 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.040 -16.693 -16.111 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.039 -15.880 -17.320 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -4.675 -13.056 -15.251 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -4.969 -13.806 -16.823 1.00 0.00 H new ATOM 2159 N ASP A 139 1.209 -15.062 -9.901 1.00 0.00 N ATOM 2160 CA ASP A 139 2.530 -15.546 -9.538 1.00 0.00 C ATOM 2161 C ASP A 139 3.538 -14.402 -9.658 1.00 0.00 C ATOM 2162 O ASP A 139 3.507 -13.641 -10.623 1.00 0.00 O ATOM 2163 CB ASP A 139 2.980 -16.672 -10.470 1.00 0.00 C ATOM 2164 CG ASP A 139 3.811 -17.771 -9.805 1.00 0.00 C ATOM 2165 OD1 ASP A 139 5.044 -17.677 -9.720 1.00 0.00 O ATOM 2166 OD2 ASP A 139 3.132 -18.770 -9.352 1.00 0.00 O ATOM 0 H ASP A 139 1.186 -14.102 -10.245 1.00 0.00 H new ATOM 0 HA ASP A 139 2.482 -15.922 -8.516 1.00 0.00 H new ATOM 0 HB2 ASP A 139 2.097 -17.127 -10.918 1.00 0.00 H new ATOM 0 HB3 ASP A 139 3.563 -16.239 -11.283 1.00 0.00 H new ATOM 2172 N PRO A 140 4.433 -14.313 -8.637 1.00 0.00 N ATOM 2173 CA PRO A 140 5.448 -13.276 -8.620 1.00 0.00 C ATOM 2174 C PRO A 140 6.566 -13.585 -9.619 1.00 0.00 C ATOM 2175 O PRO A 140 7.355 -12.706 -9.967 1.00 0.00 O ATOM 2176 CB PRO A 140 5.936 -13.225 -7.181 1.00 0.00 C ATOM 2177 CG PRO A 140 5.514 -14.542 -6.552 1.00 0.00 C ATOM 2178 CD PRO A 140 4.501 -15.197 -7.478 1.00 0.00 C ATOM 0 HA PRO A 140 5.061 -12.305 -8.930 1.00 0.00 H new ATOM 0 HB2 PRO A 140 7.018 -13.101 -7.140 1.00 0.00 H new ATOM 0 HB3 PRO A 140 5.498 -12.380 -6.650 1.00 0.00 H new ATOM 0 HG2 PRO A 140 6.378 -15.192 -6.410 1.00 0.00 H new ATOM 0 HG3 PRO A 140 5.078 -14.373 -5.568 1.00 0.00 H new ATOM 0 HD2 PRO A 140 4.816 -16.201 -7.763 1.00 0.00 H new ATOM 0 HD3 PRO A 140 3.528 -15.294 -6.996 1.00 0.00 H new ATOM 2186 N ASN A 141 6.599 -14.836 -10.054 1.00 0.00 N ATOM 2187 CA ASN A 141 7.606 -15.271 -11.005 1.00 0.00 C ATOM 2188 C ASN A 141 7.248 -14.748 -12.397 1.00 0.00 C ATOM 2189 O ASN A 141 8.096 -14.707 -13.287 1.00 0.00 O ATOM 2190 CB ASN A 141 7.673 -16.799 -11.076 1.00 0.00 C ATOM 2191 CG ASN A 141 8.332 -17.378 -9.824 1.00 0.00 C ATOM 2192 OD1 ASN A 141 9.300 -16.852 -9.301 1.00 0.00 O ATOM 2193 ND2 ASN A 141 7.756 -18.489 -9.374 1.00 0.00 N ATOM 0 H ASN A 141 5.944 -15.562 -9.765 1.00 0.00 H new ATOM 0 HA ASN A 141 8.570 -14.882 -10.676 1.00 0.00 H new ATOM 0 HB2 ASN A 141 6.667 -17.206 -11.183 1.00 0.00 H new ATOM 0 HB3 ASN A 141 8.235 -17.101 -11.960 1.00 0.00 H new ATOM 0 HD21 ASN A 141 8.123 -18.953 -8.543 1.00 0.00 H new ATOM 0 HD22 ASN A 141 6.947 -18.877 -9.860 1.00 0.00 H new ATOM 2200 N ALA A 142 5.989 -14.362 -12.543 1.00 0.00 N ATOM 2201 CA ALA A 142 5.506 -13.842 -13.810 1.00 0.00 C ATOM 2202 C ALA A 142 6.517 -12.835 -14.362 1.00 0.00 C ATOM 2203 O ALA A 142 6.537 -11.678 -13.943 1.00 0.00 O ATOM 2204 CB ALA A 142 4.118 -13.229 -13.618 1.00 0.00 C ATOM 0 H ALA A 142 5.288 -14.399 -11.803 1.00 0.00 H new ATOM 0 HA ALA A 142 5.408 -14.645 -14.540 1.00 0.00 H new ATOM 0 HB1 ALA A 142 3.757 -12.839 -14.570 1.00 0.00 H new ATOM 0 HB2 ALA A 142 3.430 -13.992 -13.254 1.00 0.00 H new ATOM 0 HB3 ALA A 142 4.176 -12.418 -12.892 1.00 0.00 H new ATOM 2210 N ASP A 143 7.332 -13.311 -15.293 1.00 0.00 N ATOM 2211 CA ASP A 143 8.343 -12.466 -15.906 1.00 0.00 C ATOM 2212 C ASP A 143 7.659 -11.407 -16.773 1.00 0.00 C ATOM 2213 O ASP A 143 7.214 -11.700 -17.881 1.00 0.00 O ATOM 2214 CB ASP A 143 9.273 -13.283 -16.804 1.00 0.00 C ATOM 2215 CG ASP A 143 10.654 -13.571 -16.212 1.00 0.00 C ATOM 2216 OD1 ASP A 143 11.591 -12.772 -16.358 1.00 0.00 O ATOM 2217 OD2 ASP A 143 10.751 -14.684 -15.567 1.00 0.00 O ATOM 0 H ASP A 143 7.312 -14.271 -15.637 1.00 0.00 H new ATOM 0 HA ASP A 143 8.925 -12.005 -15.109 1.00 0.00 H new ATOM 0 HB2 ASP A 143 8.789 -14.232 -17.036 1.00 0.00 H new ATOM 0 HB3 ASP A 143 9.402 -12.752 -17.747 1.00 0.00 H new ATOM 2223 N LEU A 144 7.598 -10.197 -16.235 1.00 0.00 N ATOM 2224 CA LEU A 144 6.976 -9.093 -16.946 1.00 0.00 C ATOM 2225 C LEU A 144 7.117 -7.815 -16.118 1.00 0.00 C ATOM 2226 O LEU A 144 7.000 -7.848 -14.894 1.00 0.00 O ATOM 2227 CB LEU A 144 5.529 -9.436 -17.309 1.00 0.00 C ATOM 2228 CG LEU A 144 4.638 -9.887 -16.150 1.00 0.00 C ATOM 2229 CD1 LEU A 144 3.821 -8.717 -15.598 1.00 0.00 C ATOM 2230 CD2 LEU A 144 3.748 -11.061 -16.568 1.00 0.00 C ATOM 0 H LEU A 144 7.969 -9.957 -15.316 1.00 0.00 H new ATOM 0 HA LEU A 144 7.484 -8.916 -17.894 1.00 0.00 H new ATOM 0 HB2 LEU A 144 5.074 -8.561 -17.772 1.00 0.00 H new ATOM 0 HB3 LEU A 144 5.541 -10.225 -18.061 1.00 0.00 H new ATOM 0 HG LEU A 144 5.280 -10.240 -15.343 1.00 0.00 H new ATOM 0 HD11 LEU A 144 3.197 -9.065 -14.775 1.00 0.00 H new ATOM 0 HD12 LEU A 144 4.495 -7.940 -15.238 1.00 0.00 H new ATOM 0 HD13 LEU A 144 3.188 -8.311 -16.387 1.00 0.00 H new ATOM 0 HD21 LEU A 144 3.124 -11.363 -15.726 1.00 0.00 H new ATOM 0 HD22 LEU A 144 3.113 -10.758 -17.400 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.373 -11.900 -16.876 1.00 0.00 H new TER 2242 LEU A 144