USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 793 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 -1 HIS N :NH3+ 160:sc= 0.0235 (180deg=-0.291) USER MOD Set 1.2: A 51 SER OG : rot 138:sc= 0.0526 USER MOD Set 2.1: A 9 GLN : amide:sc= 0.341 K(o=1.4,f=-4.3!) USER MOD Set 2.2: A 45 ASN : amide:sc= 1.08 K(o=1.4,f=-6.7!) USER MOD Set 2.3: A 47 GLN : amide:sc= 0 X(o=1.4,f=1.4) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 LYS NZ :NH3+ 166:sc= 1.19 (180deg=0.178!) USER MOD Single : A 5 THR OG1 : rot -90:sc= 0.745 USER MOD Single : A 7 LYS NZ :NH3+ 170:sc= 2.19 (180deg=1.71) USER MOD Single : A -1 HIS : no HD1:sc= 0.0689 K(o=0.069,f=-0.47) USER MOD Single : A 13 GLN : amide:sc= 0.701 K(o=0.7,f=-3.6!) USER MOD Single : A 22 SER OG : rot 34:sc= 0.965 USER MOD Single : A 23 THR OG1 : rot -56:sc= 1.29 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 124:sc= 0.527 (180deg=-0.679) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.0131 X(o=-0.013,f=0) USER MOD Single : A 57 GLN : amide:sc= 1.17 K(o=1.2,f=-0.0045) USER MOD Single : A 59 LYS NZ :NH3+ -156:sc= 1.94 (180deg=0.297!) USER MOD Single : A 70 GLN : amide:sc= 0.229 X(o=0.23,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 149:sc= 1.07 (180deg=-0.993!) USER MOD Single : A 74 TYR OH : rot -150:sc= 0.105 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 1.02 K(o=1,f=-0.22) USER MOD Single : A 82 ASN : amide:sc= 2.29 K(o=2.3,f=-3.8!) USER MOD Single : A 84 THR OG1 : rot 109:sc= 1.28 USER MOD Single : A 87 LYS NZ :NH3+ -140:sc= 1.14 (180deg=-0.806!) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -1 4.685 8.937 3.998 1.00 0.00 N ATOM 2 CA HIS A -1 5.168 9.727 2.830 1.00 0.00 C ATOM 3 C HIS A -1 4.711 11.233 2.871 1.00 0.00 C ATOM 4 O HIS A -1 4.282 11.786 1.853 1.00 0.00 O ATOM 5 CB HIS A -1 4.741 9.012 1.514 1.00 0.00 C ATOM 6 CG HIS A -1 5.266 7.599 1.230 1.00 0.00 C ATOM 7 ND1 HIS A -1 6.373 7.346 0.430 1.00 0.00 N ATOM 8 CD2 HIS A -1 4.546 6.412 1.458 1.00 0.00 C ATOM 9 CE1 HIS A -1 6.190 5.996 0.233 1.00 0.00 C ATOM 10 NE2 HIS A -1 5.138 5.345 0.815 1.00 0.00 N ATOM 0 H1 HIS A -1 4.712 7.923 3.767 1.00 0.00 H new ATOM 0 H2 HIS A -1 5.297 9.122 4.819 1.00 0.00 H new ATOM 0 H3 HIS A -1 3.709 9.214 4.225 1.00 0.00 H new ATOM 0 HA HIS A -1 6.256 9.767 2.873 1.00 0.00 H new ATOM 0 HB2 HIS A -1 3.652 8.967 1.503 1.00 0.00 H new ATOM 0 HB3 HIS A -1 5.042 9.648 0.682 1.00 0.00 H new ATOM 0 HD2 HIS A -1 3.650 6.345 2.057 1.00 0.00 H new ATOM 0 HE1 HIS A -1 6.883 5.446 -0.387 1.00 0.00 H new ATOM 0 HE2 HIS A -1 4.870 4.361 0.783 1.00 0.00 H new ATOM 18 N MET A 0 4.865 11.916 4.027 1.00 0.00 N ATOM 19 CA MET A 0 4.441 13.337 4.265 1.00 0.00 C ATOM 20 C MET A 0 2.939 13.454 4.703 1.00 0.00 C ATOM 21 O MET A 0 2.028 13.055 3.970 1.00 0.00 O ATOM 22 CB MET A 0 4.781 14.395 3.169 1.00 0.00 C ATOM 23 CG MET A 0 6.254 14.479 2.722 1.00 0.00 C ATOM 24 SD MET A 0 6.414 15.745 1.447 1.00 0.00 S ATOM 25 CE MET A 0 8.065 15.377 0.827 1.00 0.00 C ATOM 0 H MET A 0 5.297 11.494 4.849 1.00 0.00 H new ATOM 0 HA MET A 0 5.093 13.613 5.094 1.00 0.00 H new ATOM 0 HB2 MET A 0 4.170 14.184 2.291 1.00 0.00 H new ATOM 0 HB3 MET A 0 4.481 15.376 3.538 1.00 0.00 H new ATOM 0 HG2 MET A 0 6.892 14.720 3.573 1.00 0.00 H new ATOM 0 HG3 MET A 0 6.586 13.514 2.338 1.00 0.00 H new ATOM 0 HE1 MET A 0 8.318 16.075 0.028 1.00 0.00 H new ATOM 0 HE2 MET A 0 8.788 15.475 1.637 1.00 0.00 H new ATOM 0 HE3 MET A 0 8.090 14.358 0.440 1.00 0.00 H new ATOM 35 N LYS A 1 2.696 14.054 5.890 1.00 0.00 N ATOM 36 CA LYS A 1 1.338 14.250 6.486 1.00 0.00 C ATOM 37 C LYS A 1 0.722 12.931 7.061 1.00 0.00 C ATOM 38 O LYS A 1 0.963 12.607 8.226 1.00 0.00 O ATOM 39 CB LYS A 1 0.431 15.210 5.640 1.00 0.00 C ATOM 40 CG LYS A 1 -1.004 15.510 6.155 1.00 0.00 C ATOM 41 CD LYS A 1 -1.076 16.197 7.535 1.00 0.00 C ATOM 42 CE LYS A 1 -2.525 16.397 8.024 1.00 0.00 C ATOM 43 NZ LYS A 1 -2.505 17.037 9.365 1.00 0.00 N ATOM 0 H LYS A 1 3.444 14.424 6.477 1.00 0.00 H new ATOM 0 HA LYS A 1 1.441 14.831 7.402 1.00 0.00 H new ATOM 0 HB2 LYS A 1 0.955 16.161 5.541 1.00 0.00 H new ATOM 0 HB3 LYS A 1 0.344 14.789 4.639 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -1.510 16.142 5.425 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -1.559 14.573 6.204 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -0.530 15.598 8.264 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -0.578 17.165 7.481 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -3.077 17.019 7.319 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -3.040 15.438 8.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -3.456 17.388 9.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -2.211 16.340 10.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -1.834 17.832 9.360 1.00 0.00 H new ATOM 57 N VAL A 2 -0.093 12.210 6.275 1.00 0.00 N ATOM 58 CA VAL A 2 -0.730 10.930 6.702 1.00 0.00 C ATOM 59 C VAL A 2 -0.737 10.002 5.448 1.00 0.00 C ATOM 60 O VAL A 2 -1.632 10.125 4.606 1.00 0.00 O ATOM 61 CB VAL A 2 -2.169 11.147 7.309 1.00 0.00 C ATOM 62 CG1 VAL A 2 -2.853 9.823 7.728 1.00 0.00 C ATOM 63 CG2 VAL A 2 -2.207 12.063 8.553 1.00 0.00 C ATOM 0 H VAL A 2 -0.336 12.488 5.324 1.00 0.00 H new ATOM 0 HA VAL A 2 -0.166 10.469 7.513 1.00 0.00 H new ATOM 0 HB VAL A 2 -2.701 11.624 6.486 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.840 10.037 8.138 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -2.955 9.175 6.858 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -2.247 9.323 8.484 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -3.235 12.157 8.904 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.592 11.631 9.342 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.821 13.048 8.291 1.00 0.00 H new ATOM 73 N ASP A 3 0.219 9.060 5.331 1.00 0.00 N ATOM 74 CA ASP A 3 0.090 7.916 4.377 1.00 0.00 C ATOM 75 C ASP A 3 -0.333 6.600 5.104 1.00 0.00 C ATOM 76 O ASP A 3 -0.137 6.408 6.307 1.00 0.00 O ATOM 77 CB ASP A 3 1.351 7.778 3.477 1.00 0.00 C ATOM 78 CG ASP A 3 1.079 7.155 2.099 1.00 0.00 C ATOM 79 OD1 ASP A 3 0.376 6.125 2.017 1.00 0.00 O ATOM 80 OD2 ASP A 3 1.549 7.709 1.085 1.00 0.00 O ATOM 0 H ASP A 3 1.083 9.058 5.873 1.00 0.00 H new ATOM 0 HA ASP A 3 -0.729 8.133 3.691 1.00 0.00 H new ATOM 0 HB2 ASP A 3 1.792 8.765 3.336 1.00 0.00 H new ATOM 0 HB3 ASP A 3 2.090 7.170 3.998 1.00 0.00 H new ATOM 85 N ILE A 4 -0.976 5.720 4.332 1.00 0.00 N ATOM 86 CA ILE A 4 -1.624 4.482 4.834 1.00 0.00 C ATOM 87 C ILE A 4 -1.078 3.271 4.014 1.00 0.00 C ATOM 88 O ILE A 4 -1.649 2.869 2.998 1.00 0.00 O ATOM 89 CB ILE A 4 -3.190 4.647 4.887 1.00 0.00 C ATOM 90 CG1 ILE A 4 -3.891 5.008 3.541 1.00 0.00 C ATOM 91 CG2 ILE A 4 -3.592 5.648 6.000 1.00 0.00 C ATOM 92 CD1 ILE A 4 -5.430 5.016 3.553 1.00 0.00 C ATOM 0 H ILE A 4 -1.069 5.840 3.323 1.00 0.00 H new ATOM 0 HA ILE A 4 -1.364 4.278 5.873 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.559 3.648 5.118 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.546 5.994 3.230 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.559 4.300 2.782 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.677 5.750 6.023 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -3.242 5.280 6.964 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.140 6.619 5.797 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.800 5.281 2.563 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.797 4.026 3.825 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -5.784 5.747 4.280 1.00 0.00 H new ATOM 104 N THR A 5 0.035 2.680 4.481 1.00 0.00 N ATOM 105 CA THR A 5 0.692 1.517 3.816 1.00 0.00 C ATOM 106 C THR A 5 0.116 0.210 4.464 1.00 0.00 C ATOM 107 O THR A 5 0.549 -0.217 5.541 1.00 0.00 O ATOM 108 CB THR A 5 2.247 1.635 3.927 1.00 0.00 C ATOM 109 OG1 THR A 5 2.719 2.929 3.556 1.00 0.00 O ATOM 110 CG2 THR A 5 3.022 0.629 3.061 1.00 0.00 C ATOM 0 H THR A 5 0.512 2.987 5.329 1.00 0.00 H new ATOM 0 HA THR A 5 0.477 1.492 2.748 1.00 0.00 H new ATOM 0 HB THR A 5 2.435 1.426 4.980 1.00 0.00 H new ATOM 0 HG1 THR A 5 2.910 2.945 2.595 1.00 0.00 H new ATOM 0 HG21 THR A 5 4.093 0.780 3.198 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.758 -0.386 3.358 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.766 0.778 2.012 1.00 0.00 H new ATOM 118 N ILE A 6 -0.928 -0.377 3.855 1.00 0.00 N ATOM 119 CA ILE A 6 -1.807 -1.383 4.539 1.00 0.00 C ATOM 120 C ILE A 6 -1.701 -2.733 3.768 1.00 0.00 C ATOM 121 O ILE A 6 -2.206 -2.802 2.649 1.00 0.00 O ATOM 122 CB ILE A 6 -3.305 -0.892 4.636 1.00 0.00 C ATOM 123 CG1 ILE A 6 -3.539 0.570 5.117 1.00 0.00 C ATOM 124 CG2 ILE A 6 -4.198 -1.854 5.467 1.00 0.00 C ATOM 125 CD1 ILE A 6 -2.961 0.919 6.498 1.00 0.00 C ATOM 0 H ILE A 6 -1.197 -0.182 2.890 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.467 -1.516 5.566 1.00 0.00 H new ATOM 0 HB ILE A 6 -3.604 -0.904 3.588 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -3.107 1.248 4.381 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -4.612 0.760 5.134 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -5.217 -1.467 5.500 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -4.199 -2.841 5.004 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -3.805 -1.930 6.481 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -3.182 1.960 6.732 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -3.409 0.274 7.254 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -1.881 0.770 6.489 1.00 0.00 H new ATOM 137 N LYS A 7 -1.113 -3.799 4.347 1.00 0.00 N ATOM 138 CA LYS A 7 -1.069 -5.150 3.698 1.00 0.00 C ATOM 139 C LYS A 7 -2.063 -6.145 4.396 1.00 0.00 C ATOM 140 O LYS A 7 -1.888 -6.468 5.576 1.00 0.00 O ATOM 141 CB LYS A 7 0.380 -5.728 3.741 1.00 0.00 C ATOM 142 CG LYS A 7 1.414 -5.130 2.757 1.00 0.00 C ATOM 143 CD LYS A 7 2.850 -5.646 3.018 1.00 0.00 C ATOM 144 CE LYS A 7 3.900 -5.177 1.985 1.00 0.00 C ATOM 145 NZ LYS A 7 3.848 -5.981 0.731 1.00 0.00 N ATOM 0 H LYS A 7 -0.660 -3.764 5.260 1.00 0.00 H new ATOM 0 HA LYS A 7 -1.375 -5.032 2.658 1.00 0.00 H new ATOM 0 HB2 LYS A 7 0.764 -5.599 4.753 1.00 0.00 H new ATOM 0 HB3 LYS A 7 0.321 -6.801 3.557 1.00 0.00 H new ATOM 0 HG2 LYS A 7 1.123 -5.376 1.736 1.00 0.00 H new ATOM 0 HG3 LYS A 7 1.402 -4.043 2.839 1.00 0.00 H new ATOM 0 HD2 LYS A 7 3.164 -5.320 4.010 1.00 0.00 H new ATOM 0 HD3 LYS A 7 2.834 -6.736 3.031 1.00 0.00 H new ATOM 0 HE2 LYS A 7 3.732 -4.126 1.749 1.00 0.00 H new ATOM 0 HE3 LYS A 7 4.896 -5.250 2.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 4.444 -5.533 0.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 4.197 -6.942 0.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 2.867 -6.030 0.391 1.00 0.00 H new ATOM 159 N ILE A 8 -3.063 -6.679 3.660 1.00 0.00 N ATOM 160 CA ILE A 8 -3.950 -7.791 4.151 1.00 0.00 C ATOM 161 C ILE A 8 -3.323 -9.142 3.661 1.00 0.00 C ATOM 162 O ILE A 8 -3.499 -9.515 2.495 1.00 0.00 O ATOM 163 CB ILE A 8 -5.441 -7.570 3.677 1.00 0.00 C ATOM 164 CG1 ILE A 8 -6.108 -6.309 4.306 1.00 0.00 C ATOM 165 CG2 ILE A 8 -6.373 -8.789 3.937 1.00 0.00 C ATOM 166 CD1 ILE A 8 -7.336 -5.759 3.551 1.00 0.00 C ATOM 0 H ILE A 8 -3.288 -6.365 2.716 1.00 0.00 H new ATOM 0 HA ILE A 8 -4.003 -7.811 5.240 1.00 0.00 H new ATOM 0 HB ILE A 8 -5.338 -7.429 2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -6.408 -6.549 5.326 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.360 -5.519 4.372 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.379 -8.560 3.584 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -5.991 -9.659 3.403 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -6.403 -9.003 5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.722 -4.883 4.073 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.045 -5.479 2.538 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -8.110 -6.526 3.508 1.00 0.00 H new ATOM 178 N GLN A 9 -2.595 -9.868 4.534 1.00 0.00 N ATOM 179 CA GLN A 9 -1.839 -11.094 4.145 1.00 0.00 C ATOM 180 C GLN A 9 -2.632 -12.392 4.489 1.00 0.00 C ATOM 181 O GLN A 9 -3.020 -12.633 5.639 1.00 0.00 O ATOM 182 CB GLN A 9 -0.441 -11.018 4.820 1.00 0.00 C ATOM 183 CG GLN A 9 0.663 -11.974 4.278 1.00 0.00 C ATOM 184 CD GLN A 9 0.790 -13.394 4.852 1.00 0.00 C ATOM 185 OE1 GLN A 9 -0.044 -13.935 5.569 1.00 0.00 O ATOM 186 NE2 GLN A 9 1.878 -14.060 4.551 1.00 0.00 N ATOM 0 H GLN A 9 -2.510 -9.630 5.522 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.702 -11.139 3.065 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -0.077 -9.995 4.729 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -0.568 -11.217 5.884 1.00 0.00 H new ATOM 0 HG2 GLN A 9 0.512 -12.070 3.203 1.00 0.00 H new ATOM 0 HG3 GLN A 9 1.623 -11.478 4.422 1.00 0.00 H new ATOM 0 HE21 GLN A 9 2.589 -13.634 3.956 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.014 -15.004 4.912 1.00 0.00 H new ATOM 195 N ARG A 10 -2.861 -13.235 3.468 1.00 0.00 N ATOM 196 CA ARG A 10 -3.561 -14.541 3.638 1.00 0.00 C ATOM 197 C ARG A 10 -2.660 -15.726 3.146 1.00 0.00 C ATOM 198 O ARG A 10 -2.999 -16.426 2.188 1.00 0.00 O ATOM 199 CB ARG A 10 -4.942 -14.452 2.926 1.00 0.00 C ATOM 200 CG ARG A 10 -5.913 -13.353 3.445 1.00 0.00 C ATOM 201 CD ARG A 10 -7.351 -13.438 2.900 1.00 0.00 C ATOM 202 NE ARG A 10 -7.407 -13.192 1.430 1.00 0.00 N ATOM 203 CZ ARG A 10 -7.924 -12.123 0.832 1.00 0.00 C ATOM 204 NH1 ARG A 10 -8.346 -11.060 1.467 1.00 0.00 N ATOM 205 NH2 ARG A 10 -7.997 -12.138 -0.465 1.00 0.00 N ATOM 0 H ARG A 10 -2.574 -13.043 2.508 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.747 -14.752 4.691 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -4.769 -14.282 1.863 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -5.438 -15.418 3.018 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.950 -13.408 4.533 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.502 -12.377 3.189 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -7.764 -14.423 3.119 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -7.977 -12.709 3.414 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.011 -13.912 0.826 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -8.289 -11.017 2.484 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -8.732 -10.274 0.945 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.664 -12.950 -0.985 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.387 -11.338 -0.963 1.00 0.00 H new ATOM 219 N ASP A 11 -1.513 -15.944 3.826 1.00 0.00 N ATOM 220 CA ASP A 11 -0.499 -16.991 3.486 1.00 0.00 C ATOM 221 C ASP A 11 0.086 -16.893 2.034 1.00 0.00 C ATOM 222 O ASP A 11 -0.428 -17.512 1.096 1.00 0.00 O ATOM 223 CB ASP A 11 -0.997 -18.409 3.900 1.00 0.00 C ATOM 224 CG ASP A 11 0.066 -19.269 4.577 1.00 0.00 C ATOM 225 OD1 ASP A 11 0.473 -18.912 5.707 1.00 0.00 O ATOM 226 OD2 ASP A 11 0.468 -20.306 4.019 1.00 0.00 O ATOM 0 H ASP A 11 -1.252 -15.392 4.643 1.00 0.00 H new ATOM 0 HA ASP A 11 0.380 -16.783 4.096 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -1.846 -18.301 4.575 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.359 -18.929 3.013 1.00 0.00 H new ATOM 231 N GLY A 12 1.103 -16.034 1.818 1.00 0.00 N ATOM 232 CA GLY A 12 1.553 -15.675 0.439 1.00 0.00 C ATOM 233 C GLY A 12 0.737 -14.577 -0.285 1.00 0.00 C ATOM 234 O GLY A 12 1.305 -13.612 -0.797 1.00 0.00 O ATOM 0 H GLY A 12 1.628 -15.577 2.563 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.592 -15.350 0.492 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.532 -16.577 -0.173 1.00 0.00 H new ATOM 238 N GLN A 13 -0.591 -14.745 -0.346 1.00 0.00 N ATOM 239 CA GLN A 13 -1.513 -13.790 -1.008 1.00 0.00 C ATOM 240 C GLN A 13 -1.693 -12.471 -0.178 1.00 0.00 C ATOM 241 O GLN A 13 -2.547 -12.412 0.714 1.00 0.00 O ATOM 242 CB GLN A 13 -2.827 -14.599 -1.227 1.00 0.00 C ATOM 243 CG GLN A 13 -3.899 -13.876 -2.080 1.00 0.00 C ATOM 244 CD GLN A 13 -5.290 -14.519 -2.046 1.00 0.00 C ATOM 245 OE1 GLN A 13 -6.174 -14.141 -1.278 1.00 0.00 O ATOM 246 NE2 GLN A 13 -5.536 -15.498 -2.883 1.00 0.00 N ATOM 0 H GLN A 13 -1.066 -15.550 0.063 1.00 0.00 H new ATOM 0 HA GLN A 13 -1.130 -13.423 -1.960 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -2.579 -15.546 -1.707 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -3.257 -14.838 -0.254 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.982 -12.845 -1.736 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -3.556 -13.840 -3.114 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -4.808 -15.817 -3.523 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -6.455 -15.941 -2.894 1.00 0.00 H new ATOM 255 N GLU A 14 -0.901 -11.420 -0.479 1.00 0.00 N ATOM 256 CA GLU A 14 -1.032 -10.089 0.188 1.00 0.00 C ATOM 257 C GLU A 14 -1.571 -8.971 -0.759 1.00 0.00 C ATOM 258 O GLU A 14 -1.030 -8.702 -1.836 1.00 0.00 O ATOM 259 CB GLU A 14 0.215 -9.709 1.025 1.00 0.00 C ATOM 260 CG GLU A 14 1.590 -9.541 0.334 1.00 0.00 C ATOM 261 CD GLU A 14 2.763 -9.276 1.285 1.00 0.00 C ATOM 262 OE1 GLU A 14 2.757 -9.745 2.446 1.00 0.00 O ATOM 263 OE2 GLU A 14 3.709 -8.577 0.865 1.00 0.00 O ATOM 0 H GLU A 14 -0.161 -11.459 -1.179 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.824 -10.192 0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.009 -8.771 1.533 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.331 -10.470 1.797 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.804 -10.442 -0.241 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.525 -8.717 -0.377 1.00 0.00 H new ATOM 270 N ILE A 15 -2.685 -8.350 -0.331 1.00 0.00 N ATOM 271 CA ILE A 15 -3.449 -7.347 -1.127 1.00 0.00 C ATOM 272 C ILE A 15 -3.323 -5.992 -0.361 1.00 0.00 C ATOM 273 O ILE A 15 -3.674 -5.907 0.826 1.00 0.00 O ATOM 274 CB ILE A 15 -4.952 -7.767 -1.353 1.00 0.00 C ATOM 275 CG1 ILE A 15 -5.188 -9.207 -1.910 1.00 0.00 C ATOM 276 CG2 ILE A 15 -5.661 -6.781 -2.322 1.00 0.00 C ATOM 277 CD1 ILE A 15 -5.139 -10.334 -0.862 1.00 0.00 C ATOM 0 H ILE A 15 -3.093 -8.526 0.587 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.038 -7.266 -2.133 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.368 -7.742 -0.346 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -6.160 -9.233 -2.403 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.438 -9.411 -2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -6.697 -7.091 -2.463 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -5.637 -5.776 -1.900 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -5.148 -6.783 -3.284 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -5.315 -11.293 -1.350 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.159 -10.344 -0.384 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.908 -10.164 -0.109 1.00 0.00 H new ATOM 289 N GLU A 16 -2.798 -4.946 -1.029 1.00 0.00 N ATOM 290 CA GLU A 16 -2.275 -3.742 -0.328 1.00 0.00 C ATOM 291 C GLU A 16 -2.600 -2.362 -0.976 1.00 0.00 C ATOM 292 O GLU A 16 -2.760 -2.228 -2.193 1.00 0.00 O ATOM 293 CB GLU A 16 -0.755 -3.946 -0.060 1.00 0.00 C ATOM 294 CG GLU A 16 0.204 -3.904 -1.279 1.00 0.00 C ATOM 295 CD GLU A 16 1.597 -4.406 -0.954 1.00 0.00 C ATOM 296 OE1 GLU A 16 1.782 -5.636 -0.849 1.00 0.00 O ATOM 297 OE2 GLU A 16 2.519 -3.592 -0.753 1.00 0.00 O ATOM 0 H GLU A 16 -2.722 -4.904 -2.045 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.823 -3.670 0.612 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -0.433 -3.181 0.646 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -0.628 -4.909 0.434 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.215 -4.507 -2.085 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.269 -2.880 -1.648 1.00 0.00 H new ATOM 304 N ILE A 17 -2.654 -1.325 -0.120 1.00 0.00 N ATOM 305 CA ILE A 17 -2.776 0.107 -0.551 1.00 0.00 C ATOM 306 C ILE A 17 -1.584 0.956 0.014 1.00 0.00 C ATOM 307 O ILE A 17 -1.090 0.691 1.113 1.00 0.00 O ATOM 308 CB ILE A 17 -4.172 0.738 -0.190 1.00 0.00 C ATOM 309 CG1 ILE A 17 -4.520 0.746 1.328 1.00 0.00 C ATOM 310 CG2 ILE A 17 -5.320 0.110 -1.019 1.00 0.00 C ATOM 311 CD1 ILE A 17 -5.603 1.755 1.743 1.00 0.00 C ATOM 0 H ILE A 17 -2.615 -1.441 0.893 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.719 0.122 -1.639 1.00 0.00 H new ATOM 0 HB ILE A 17 -4.070 1.788 -0.465 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.847 -0.253 1.615 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -3.612 0.959 1.892 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.266 0.573 -0.739 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -5.135 0.275 -2.080 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -5.368 -0.961 -0.821 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.774 1.684 2.817 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -5.275 2.764 1.494 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -6.529 1.533 1.213 1.00 0.00 H new ATOM 323 N ASP A 18 -1.158 1.995 -0.731 1.00 0.00 N ATOM 324 CA ASP A 18 -0.135 2.985 -0.274 1.00 0.00 C ATOM 325 C ASP A 18 -0.505 4.364 -0.936 1.00 0.00 C ATOM 326 O ASP A 18 -0.341 4.537 -2.149 1.00 0.00 O ATOM 327 CB ASP A 18 1.271 2.430 -0.647 1.00 0.00 C ATOM 328 CG ASP A 18 2.457 3.138 0.002 1.00 0.00 C ATOM 329 OD1 ASP A 18 2.493 3.227 1.245 1.00 0.00 O ATOM 330 OD2 ASP A 18 3.383 3.573 -0.714 1.00 0.00 O ATOM 0 H ASP A 18 -1.508 2.181 -1.671 1.00 0.00 H new ATOM 0 HA ASP A 18 -0.117 3.144 0.804 1.00 0.00 H new ATOM 0 HB2 ASP A 18 1.308 1.375 -0.375 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.387 2.485 -1.729 1.00 0.00 H new ATOM 335 N ILE A 19 -1.111 5.297 -0.172 1.00 0.00 N ATOM 336 CA ILE A 19 -1.836 6.488 -0.738 1.00 0.00 C ATOM 337 C ILE A 19 -1.947 7.633 0.336 1.00 0.00 C ATOM 338 O ILE A 19 -2.686 7.497 1.318 1.00 0.00 O ATOM 339 CB ILE A 19 -3.267 6.169 -1.340 1.00 0.00 C ATOM 340 CG1 ILE A 19 -4.153 5.224 -0.467 1.00 0.00 C ATOM 341 CG2 ILE A 19 -3.198 5.664 -2.803 1.00 0.00 C ATOM 342 CD1 ILE A 19 -5.666 5.270 -0.743 1.00 0.00 C ATOM 0 H ILE A 19 -1.120 5.261 0.847 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.226 6.817 -1.580 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.771 7.136 -1.333 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.809 4.200 -0.612 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -3.988 5.471 0.582 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.206 5.461 -3.166 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -2.734 6.426 -3.429 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -2.606 4.750 -2.845 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.178 4.574 -0.079 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.037 6.280 -0.567 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.856 4.989 -1.779 1.00 0.00 H new ATOM 354 N ARG A 20 -1.264 8.785 0.146 1.00 0.00 N ATOM 355 CA ARG A 20 -1.283 9.892 1.155 1.00 0.00 C ATOM 356 C ARG A 20 -2.579 10.772 1.174 1.00 0.00 C ATOM 357 O ARG A 20 -3.042 11.266 0.143 1.00 0.00 O ATOM 358 CB ARG A 20 0.042 10.693 1.146 1.00 0.00 C ATOM 359 CG ARG A 20 0.343 11.639 -0.039 1.00 0.00 C ATOM 360 CD ARG A 20 1.779 12.174 0.094 1.00 0.00 C ATOM 361 NE ARG A 20 2.083 13.181 -0.951 1.00 0.00 N ATOM 362 CZ ARG A 20 3.288 13.717 -1.161 1.00 0.00 C ATOM 363 NH1 ARG A 20 4.360 13.397 -0.474 1.00 0.00 N ATOM 364 NH2 ARG A 20 3.406 14.612 -2.097 1.00 0.00 N ATOM 0 H ARG A 20 -0.698 8.980 -0.680 1.00 0.00 H new ATOM 0 HA ARG A 20 -1.343 9.398 2.125 1.00 0.00 H new ATOM 0 HB2 ARG A 20 0.071 11.290 2.058 1.00 0.00 H new ATOM 0 HB3 ARG A 20 0.860 9.975 1.209 1.00 0.00 H new ATOM 0 HG2 ARG A 20 0.226 11.107 -0.983 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -0.367 12.466 -0.049 1.00 0.00 H new ATOM 0 HD2 ARG A 20 1.912 12.620 1.080 1.00 0.00 H new ATOM 0 HD3 ARG A 20 2.485 11.347 0.020 1.00 0.00 H new ATOM 0 HE ARG A 20 1.317 13.486 -1.552 1.00 0.00 H new ATOM 0 HH11 ARG A 20 4.300 12.702 0.270 1.00 0.00 H new ATOM 0 HH12 ARG A 20 5.253 13.844 -0.684 1.00 0.00 H new ATOM 0 HH21 ARG A 20 2.591 14.886 -2.646 1.00 0.00 H new ATOM 0 HH22 ARG A 20 4.313 15.040 -2.282 1.00 0.00 H new ATOM 378 N VAL A 21 -3.159 10.948 2.375 1.00 0.00 N ATOM 379 CA VAL A 21 -4.567 11.410 2.557 1.00 0.00 C ATOM 380 C VAL A 21 -4.634 12.598 3.576 1.00 0.00 C ATOM 381 O VAL A 21 -4.835 12.410 4.784 1.00 0.00 O ATOM 382 CB VAL A 21 -5.525 10.214 2.929 1.00 0.00 C ATOM 383 CG1 VAL A 21 -5.896 9.348 1.705 1.00 0.00 C ATOM 384 CG2 VAL A 21 -5.052 9.280 4.072 1.00 0.00 C ATOM 0 H VAL A 21 -2.672 10.776 3.255 1.00 0.00 H new ATOM 0 HA VAL A 21 -4.932 11.796 1.605 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.401 10.741 3.308 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.557 8.540 2.018 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -6.403 9.965 0.963 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -4.990 8.928 1.269 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.794 8.498 4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.100 8.825 3.800 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -4.929 9.859 4.987 1.00 0.00 H new ATOM 394 N SER A 22 -4.551 13.849 3.078 1.00 0.00 N ATOM 395 CA SER A 22 -4.709 15.081 3.904 1.00 0.00 C ATOM 396 C SER A 22 -6.189 15.330 4.342 1.00 0.00 C ATOM 397 O SER A 22 -6.986 15.903 3.592 1.00 0.00 O ATOM 398 CB SER A 22 -4.126 16.274 3.107 1.00 0.00 C ATOM 399 OG SER A 22 -4.949 16.603 1.985 1.00 0.00 O ATOM 0 H SER A 22 -4.373 14.042 2.092 1.00 0.00 H new ATOM 0 HA SER A 22 -4.159 14.958 4.837 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.036 17.141 3.761 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.121 16.028 2.764 1.00 0.00 H new ATOM 0 HG SER A 22 -5.889 16.440 2.210 1.00 0.00 H new ATOM 405 N THR A 23 -6.538 14.806 5.525 1.00 0.00 N ATOM 406 CA THR A 23 -7.952 14.450 5.861 1.00 0.00 C ATOM 407 C THR A 23 -8.301 14.705 7.365 1.00 0.00 C ATOM 408 O THR A 23 -7.467 14.521 8.260 1.00 0.00 O ATOM 409 CB THR A 23 -8.224 12.949 5.494 1.00 0.00 C ATOM 410 OG1 THR A 23 -7.210 12.066 5.978 1.00 0.00 O ATOM 411 CG2 THR A 23 -8.382 12.693 3.988 1.00 0.00 C ATOM 0 H THR A 23 -5.873 14.614 6.274 1.00 0.00 H new ATOM 0 HA THR A 23 -8.596 15.102 5.271 1.00 0.00 H new ATOM 0 HB THR A 23 -9.172 12.740 5.990 1.00 0.00 H new ATOM 0 HG1 THR A 23 -6.337 12.352 5.637 1.00 0.00 H new ATOM 0 HG21 THR A 23 -8.567 11.633 3.817 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.221 13.274 3.606 1.00 0.00 H new ATOM 0 HG23 THR A 23 -7.470 12.990 3.471 1.00 0.00 H new ATOM 419 N GLY A 24 -9.570 15.072 7.639 1.00 0.00 N ATOM 420 CA GLY A 24 -10.132 15.102 9.019 1.00 0.00 C ATOM 421 C GLY A 24 -11.184 13.998 9.246 1.00 0.00 C ATOM 422 O GLY A 24 -10.831 12.889 9.655 1.00 0.00 O ATOM 0 H GLY A 24 -10.236 15.355 6.920 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -9.324 14.985 9.741 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.585 16.076 9.203 1.00 0.00 H new ATOM 426 N LYS A 25 -12.465 14.282 8.949 1.00 0.00 N ATOM 427 CA LYS A 25 -13.542 13.237 8.965 1.00 0.00 C ATOM 428 C LYS A 25 -13.800 12.577 7.560 1.00 0.00 C ATOM 429 O LYS A 25 -14.933 12.488 7.081 1.00 0.00 O ATOM 430 CB LYS A 25 -14.790 13.793 9.707 1.00 0.00 C ATOM 431 CG LYS A 25 -15.565 14.967 9.056 1.00 0.00 C ATOM 432 CD LYS A 25 -16.882 15.318 9.779 1.00 0.00 C ATOM 433 CE LYS A 25 -16.728 16.033 11.137 1.00 0.00 C ATOM 434 NZ LYS A 25 -18.075 16.218 11.746 1.00 0.00 N ATOM 0 H LYS A 25 -12.793 15.214 8.695 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.204 12.377 9.543 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -15.489 12.969 9.846 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.472 14.113 10.699 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -14.924 15.849 9.039 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.786 14.714 8.019 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -17.479 15.950 9.122 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -17.446 14.398 9.935 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -16.093 15.447 11.801 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -16.241 16.999 11.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -17.978 16.700 12.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -18.666 16.794 11.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -18.522 15.290 11.888 1.00 0.00 H new ATOM 448 N GLU A 26 -12.721 12.089 6.924 1.00 0.00 N ATOM 449 CA GLU A 26 -12.734 11.535 5.535 1.00 0.00 C ATOM 450 C GLU A 26 -11.974 10.167 5.483 1.00 0.00 C ATOM 451 O GLU A 26 -12.564 9.155 5.094 1.00 0.00 O ATOM 452 CB GLU A 26 -12.148 12.553 4.520 1.00 0.00 C ATOM 453 CG GLU A 26 -12.890 13.910 4.364 1.00 0.00 C ATOM 454 CD GLU A 26 -12.009 15.134 4.562 1.00 0.00 C ATOM 455 OE1 GLU A 26 -11.470 15.323 5.675 1.00 0.00 O ATOM 456 OE2 GLU A 26 -11.849 15.912 3.600 1.00 0.00 O ATOM 0 H GLU A 26 -11.797 12.062 7.355 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.770 11.354 5.248 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -11.118 12.763 4.809 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.113 12.073 3.542 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -13.335 13.955 3.370 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -13.709 13.947 5.082 1.00 0.00 H new ATOM 463 N LEU A 27 -10.706 10.100 5.963 1.00 0.00 N ATOM 464 CA LEU A 27 -10.092 8.829 6.459 1.00 0.00 C ATOM 465 C LEU A 27 -10.925 8.036 7.523 1.00 0.00 C ATOM 466 O LEU A 27 -10.921 6.811 7.472 1.00 0.00 O ATOM 467 CB LEU A 27 -8.637 9.115 6.933 1.00 0.00 C ATOM 468 CG LEU A 27 -7.778 7.916 7.439 1.00 0.00 C ATOM 469 CD1 LEU A 27 -7.657 6.765 6.423 1.00 0.00 C ATOM 470 CD2 LEU A 27 -6.373 8.409 7.823 1.00 0.00 C ATOM 0 H LEU A 27 -10.085 10.907 6.019 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.082 8.144 5.611 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.103 9.581 6.105 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.687 9.851 7.735 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.299 7.512 8.307 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -7.045 5.968 6.847 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -8.649 6.377 6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -7.191 7.134 5.509 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -5.776 7.568 8.176 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -5.893 8.854 6.952 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.453 9.155 8.614 1.00 0.00 H new ATOM 482 N GLU A 28 -11.697 8.692 8.409 1.00 0.00 N ATOM 483 CA GLU A 28 -12.874 8.077 9.097 1.00 0.00 C ATOM 484 C GLU A 28 -13.809 7.152 8.225 1.00 0.00 C ATOM 485 O GLU A 28 -14.079 6.013 8.616 1.00 0.00 O ATOM 486 CB GLU A 28 -13.623 9.289 9.722 1.00 0.00 C ATOM 487 CG GLU A 28 -14.809 8.960 10.660 1.00 0.00 C ATOM 488 CD GLU A 28 -15.708 10.162 10.891 1.00 0.00 C ATOM 489 OE1 GLU A 28 -15.422 10.989 11.778 1.00 0.00 O ATOM 490 OE2 GLU A 28 -16.703 10.302 10.150 1.00 0.00 O ATOM 0 H GLU A 28 -11.532 9.663 8.676 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.529 7.350 9.832 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.901 9.884 10.281 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -13.993 9.916 8.911 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.395 8.147 10.231 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.426 8.606 11.617 1.00 0.00 H new ATOM 497 N ARG A 29 -14.255 7.617 7.042 1.00 0.00 N ATOM 498 CA ARG A 29 -15.002 6.778 6.061 1.00 0.00 C ATOM 499 C ARG A 29 -14.148 5.682 5.329 1.00 0.00 C ATOM 500 O ARG A 29 -14.617 4.546 5.217 1.00 0.00 O ATOM 501 CB ARG A 29 -15.772 7.689 5.057 1.00 0.00 C ATOM 502 CG ARG A 29 -16.966 8.497 5.640 1.00 0.00 C ATOM 503 CD ARG A 29 -16.613 9.915 6.170 1.00 0.00 C ATOM 504 NE ARG A 29 -17.279 10.250 7.463 1.00 0.00 N ATOM 505 CZ ARG A 29 -18.535 10.636 7.632 1.00 0.00 C ATOM 506 NH1 ARG A 29 -19.375 10.839 6.652 1.00 0.00 N ATOM 507 NH2 ARG A 29 -18.924 10.811 8.857 1.00 0.00 N ATOM 0 H ARG A 29 -14.113 8.578 6.733 1.00 0.00 H new ATOM 0 HA ARG A 29 -15.715 6.197 6.646 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -15.063 8.392 4.620 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -16.145 7.065 4.245 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -17.728 8.595 4.867 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -17.409 7.923 6.454 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -15.533 9.988 6.297 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -16.897 10.655 5.422 1.00 0.00 H new ATOM 0 HE ARG A 29 -16.707 10.174 8.304 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -19.076 10.700 5.687 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -20.330 11.136 6.852 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -18.274 10.652 9.626 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -19.880 11.108 9.051 1.00 0.00 H new ATOM 521 N ALA A 30 -12.914 5.973 4.859 1.00 0.00 N ATOM 522 CA ALA A 30 -11.983 4.918 4.347 1.00 0.00 C ATOM 523 C ALA A 30 -11.523 3.837 5.390 1.00 0.00 C ATOM 524 O ALA A 30 -11.565 2.647 5.073 1.00 0.00 O ATOM 525 CB ALA A 30 -10.796 5.593 3.631 1.00 0.00 C ATOM 0 H ALA A 30 -12.533 6.919 4.820 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.560 4.324 3.638 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.115 4.829 3.256 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.166 6.190 2.797 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.267 6.238 4.333 1.00 0.00 H new ATOM 531 N LEU A 31 -11.150 4.216 6.627 1.00 0.00 N ATOM 532 CA LEU A 31 -10.971 3.273 7.773 1.00 0.00 C ATOM 533 C LEU A 31 -12.240 2.445 8.187 1.00 0.00 C ATOM 534 O LEU A 31 -12.090 1.269 8.518 1.00 0.00 O ATOM 535 CB LEU A 31 -10.341 4.094 8.934 1.00 0.00 C ATOM 536 CG LEU A 31 -9.853 3.293 10.180 1.00 0.00 C ATOM 537 CD1 LEU A 31 -8.390 3.621 10.537 1.00 0.00 C ATOM 538 CD2 LEU A 31 -10.756 3.555 11.398 1.00 0.00 C ATOM 0 H LEU A 31 -10.961 5.188 6.872 1.00 0.00 H new ATOM 0 HA LEU A 31 -10.305 2.468 7.463 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -9.493 4.651 8.535 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -11.075 4.827 9.268 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.911 2.237 9.916 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -8.090 3.042 11.410 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -7.745 3.369 9.695 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.299 4.684 10.758 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.391 2.983 12.251 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -10.741 4.618 11.640 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -11.777 3.250 11.167 1.00 0.00 H new ATOM 550 N GLN A 32 -13.468 3.000 8.122 1.00 0.00 N ATOM 551 CA GLN A 32 -14.735 2.213 8.191 1.00 0.00 C ATOM 552 C GLN A 32 -14.965 1.165 7.039 1.00 0.00 C ATOM 553 O GLN A 32 -15.455 0.065 7.314 1.00 0.00 O ATOM 554 CB GLN A 32 -15.870 3.265 8.300 1.00 0.00 C ATOM 555 CG GLN A 32 -17.272 2.716 8.645 1.00 0.00 C ATOM 556 CD GLN A 32 -18.338 3.814 8.736 1.00 0.00 C ATOM 557 OE1 GLN A 32 -18.910 4.251 7.743 1.00 0.00 O ATOM 558 NE2 GLN A 32 -18.629 4.313 9.914 1.00 0.00 N ATOM 0 H GLN A 32 -13.618 4.004 8.020 1.00 0.00 H new ATOM 0 HA GLN A 32 -14.699 1.553 9.057 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -15.590 3.995 9.060 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -15.934 3.800 7.353 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -17.569 1.991 7.888 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -17.224 2.184 9.595 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -18.161 3.959 10.748 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -19.324 5.055 9.996 1.00 0.00 H new ATOM 567 N GLU A 33 -14.598 1.456 5.772 1.00 0.00 N ATOM 568 CA GLU A 33 -14.465 0.396 4.731 1.00 0.00 C ATOM 569 C GLU A 33 -13.261 -0.587 4.930 1.00 0.00 C ATOM 570 O GLU A 33 -13.465 -1.779 4.715 1.00 0.00 O ATOM 571 CB GLU A 33 -14.557 0.987 3.300 1.00 0.00 C ATOM 572 CG GLU A 33 -14.742 -0.076 2.172 1.00 0.00 C ATOM 573 CD GLU A 33 -15.999 -0.938 2.250 1.00 0.00 C ATOM 574 OE1 GLU A 33 -17.119 -0.390 2.290 1.00 0.00 O ATOM 575 OE2 GLU A 33 -15.895 -2.185 2.264 1.00 0.00 O ATOM 0 H GLU A 33 -14.390 2.398 5.442 1.00 0.00 H new ATOM 0 HA GLU A 33 -15.330 -0.252 4.868 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.392 1.687 3.263 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -13.652 1.559 3.098 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -14.741 0.441 1.212 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -13.874 -0.736 2.179 1.00 0.00 H new ATOM 582 N LEU A 34 -12.058 -0.172 5.381 1.00 0.00 N ATOM 583 CA LEU A 34 -11.010 -1.130 5.875 1.00 0.00 C ATOM 584 C LEU A 34 -11.479 -2.076 7.043 1.00 0.00 C ATOM 585 O LEU A 34 -11.291 -3.292 6.949 1.00 0.00 O ATOM 586 CB LEU A 34 -9.689 -0.388 6.236 1.00 0.00 C ATOM 587 CG LEU A 34 -8.933 0.353 5.098 1.00 0.00 C ATOM 588 CD1 LEU A 34 -7.800 1.220 5.679 1.00 0.00 C ATOM 589 CD2 LEU A 34 -8.345 -0.607 4.047 1.00 0.00 C ATOM 0 H LEU A 34 -11.777 0.808 5.419 1.00 0.00 H new ATOM 0 HA LEU A 34 -10.819 -1.798 5.035 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -9.917 0.340 7.014 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -9.005 -1.117 6.672 1.00 0.00 H new ATOM 0 HG LEU A 34 -9.671 0.981 4.599 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.281 1.732 4.868 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -8.220 1.957 6.363 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.096 0.586 6.217 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.829 -0.032 3.278 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.640 -1.285 4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -9.149 -1.184 3.591 1.00 0.00 H new ATOM 601 N GLU A 35 -12.155 -1.542 8.084 1.00 0.00 N ATOM 602 CA GLU A 35 -12.942 -2.331 9.079 1.00 0.00 C ATOM 603 C GLU A 35 -13.910 -3.406 8.469 1.00 0.00 C ATOM 604 O GLU A 35 -13.781 -4.597 8.771 1.00 0.00 O ATOM 605 CB GLU A 35 -13.694 -1.288 9.959 1.00 0.00 C ATOM 606 CG GLU A 35 -14.394 -1.833 11.230 1.00 0.00 C ATOM 607 CD GLU A 35 -15.373 -0.862 11.864 1.00 0.00 C ATOM 608 OE1 GLU A 35 -16.572 -0.886 11.523 1.00 0.00 O ATOM 609 OE2 GLU A 35 -14.983 -0.114 12.786 1.00 0.00 O ATOM 0 H GLU A 35 -12.175 -0.539 8.266 1.00 0.00 H new ATOM 0 HA GLU A 35 -12.257 -2.944 9.665 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.981 -0.522 10.264 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.445 -0.797 9.340 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -14.923 -2.751 10.975 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -13.634 -2.097 11.965 1.00 0.00 H new ATOM 616 N LYS A 36 -14.836 -2.993 7.582 1.00 0.00 N ATOM 617 CA LYS A 36 -15.713 -3.936 6.839 1.00 0.00 C ATOM 618 C LYS A 36 -14.975 -4.881 5.831 1.00 0.00 C ATOM 619 O LYS A 36 -15.291 -6.066 5.841 1.00 0.00 O ATOM 620 CB LYS A 36 -16.881 -3.133 6.216 1.00 0.00 C ATOM 621 CG LYS A 36 -18.027 -4.015 5.655 1.00 0.00 C ATOM 622 CD LYS A 36 -19.344 -3.278 5.315 1.00 0.00 C ATOM 623 CE LYS A 36 -19.339 -2.406 4.042 1.00 0.00 C ATOM 624 NZ LYS A 36 -18.624 -1.120 4.268 1.00 0.00 N ATOM 0 H LYS A 36 -15.001 -2.012 7.358 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.114 -4.655 7.553 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -17.290 -2.462 6.971 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.491 -2.509 5.412 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -17.669 -4.512 4.754 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -18.248 -4.796 6.383 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -20.135 -4.022 5.215 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -19.608 -2.644 6.161 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -18.862 -2.951 3.228 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -20.365 -2.204 3.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -17.862 -1.019 3.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -19.292 -0.329 4.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -18.218 -1.112 5.225 1.00 0.00 H new ATOM 638 N ALA A 37 -14.009 -4.424 5.010 1.00 0.00 N ATOM 639 CA ALA A 37 -13.106 -5.301 4.208 1.00 0.00 C ATOM 640 C ALA A 37 -12.354 -6.446 4.965 1.00 0.00 C ATOM 641 O ALA A 37 -12.307 -7.567 4.455 1.00 0.00 O ATOM 642 CB ALA A 37 -12.138 -4.383 3.443 1.00 0.00 C ATOM 0 H ALA A 37 -13.825 -3.430 4.878 1.00 0.00 H new ATOM 0 HA ALA A 37 -13.748 -5.877 3.542 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -11.459 -4.989 2.843 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -12.705 -3.719 2.790 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -11.562 -3.789 4.153 1.00 0.00 H new ATOM 648 N LEU A 38 -11.842 -6.205 6.187 1.00 0.00 N ATOM 649 CA LEU A 38 -11.388 -7.283 7.121 1.00 0.00 C ATOM 650 C LEU A 38 -12.433 -8.421 7.421 1.00 0.00 C ATOM 651 O LEU A 38 -12.090 -9.602 7.301 1.00 0.00 O ATOM 652 CB LEU A 38 -10.825 -6.590 8.406 1.00 0.00 C ATOM 653 CG LEU A 38 -9.292 -6.326 8.448 1.00 0.00 C ATOM 654 CD1 LEU A 38 -8.737 -5.514 7.264 1.00 0.00 C ATOM 655 CD2 LEU A 38 -8.907 -5.596 9.747 1.00 0.00 C ATOM 0 H LEU A 38 -11.727 -5.265 6.565 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.604 -7.851 6.620 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -11.337 -5.636 8.529 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -11.087 -7.206 9.266 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.845 -7.319 8.391 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.662 -5.383 7.385 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -8.936 -6.045 6.333 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -9.220 -4.537 7.234 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.831 -5.419 9.760 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -9.432 -4.642 9.798 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.184 -6.209 10.605 1.00 0.00 H new ATOM 667 N ALA A 39 -13.694 -8.076 7.755 1.00 0.00 N ATOM 668 CA ALA A 39 -14.818 -9.056 7.826 1.00 0.00 C ATOM 669 C ALA A 39 -15.340 -9.609 6.451 1.00 0.00 C ATOM 670 O ALA A 39 -15.422 -10.826 6.273 1.00 0.00 O ATOM 671 CB ALA A 39 -15.938 -8.378 8.646 1.00 0.00 C ATOM 0 H ALA A 39 -13.969 -7.121 7.983 1.00 0.00 H new ATOM 0 HA ALA A 39 -14.447 -9.963 8.304 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -16.789 -9.055 8.729 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -15.566 -8.139 9.642 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -16.251 -7.461 8.146 1.00 0.00 H new ATOM 677 N ARG A 40 -15.673 -8.728 5.488 1.00 0.00 N ATOM 678 CA ARG A 40 -16.096 -9.075 4.095 1.00 0.00 C ATOM 679 C ARG A 40 -15.159 -10.045 3.293 1.00 0.00 C ATOM 680 O ARG A 40 -15.654 -10.959 2.630 1.00 0.00 O ATOM 681 CB ARG A 40 -16.303 -7.700 3.381 1.00 0.00 C ATOM 682 CG ARG A 40 -16.884 -7.688 1.940 1.00 0.00 C ATOM 683 CD ARG A 40 -16.222 -6.659 0.987 1.00 0.00 C ATOM 684 NE ARG A 40 -16.632 -5.235 1.205 1.00 0.00 N ATOM 685 CZ ARG A 40 -17.549 -4.580 0.490 1.00 0.00 C ATOM 686 NH1 ARG A 40 -18.377 -5.162 -0.341 1.00 0.00 N ATOM 687 NH2 ARG A 40 -17.632 -3.290 0.623 1.00 0.00 N ATOM 0 H ARG A 40 -15.658 -7.721 5.651 1.00 0.00 H new ATOM 0 HA ARG A 40 -17.005 -9.675 4.140 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -16.961 -7.098 4.008 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -15.338 -7.194 3.353 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -16.776 -8.684 1.510 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -17.952 -7.479 1.995 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -15.140 -6.730 1.096 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -16.457 -6.935 -0.041 1.00 0.00 H new ATOM 0 HE ARG A 40 -16.174 -4.725 1.960 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -18.343 -6.173 -0.470 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -19.056 -4.604 -0.859 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -17.005 -2.802 1.262 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.324 -2.766 0.088 1.00 0.00 H new ATOM 701 N ALA A 41 -13.834 -9.831 3.332 1.00 0.00 N ATOM 702 CA ALA A 41 -12.840 -10.714 2.664 1.00 0.00 C ATOM 703 C ALA A 41 -12.283 -11.932 3.479 1.00 0.00 C ATOM 704 O ALA A 41 -11.833 -12.900 2.860 1.00 0.00 O ATOM 705 CB ALA A 41 -11.689 -9.788 2.236 1.00 0.00 C ATOM 0 H ALA A 41 -13.413 -9.044 3.825 1.00 0.00 H new ATOM 0 HA ALA A 41 -13.358 -11.211 1.844 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.918 -10.374 1.735 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.068 -9.028 1.553 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.264 -9.305 3.116 1.00 0.00 H new ATOM 711 N GLY A 42 -12.245 -11.876 4.825 1.00 0.00 N ATOM 712 CA GLY A 42 -11.648 -12.949 5.667 1.00 0.00 C ATOM 713 C GLY A 42 -10.134 -12.816 5.931 1.00 0.00 C ATOM 714 O GLY A 42 -9.351 -13.665 5.496 1.00 0.00 O ATOM 0 H GLY A 42 -12.622 -11.095 5.362 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -12.167 -12.967 6.625 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -11.833 -13.910 5.187 1.00 0.00 H new ATOM 718 N ALA A 43 -9.716 -11.766 6.655 1.00 0.00 N ATOM 719 CA ALA A 43 -8.285 -11.491 6.905 1.00 0.00 C ATOM 720 C ALA A 43 -7.674 -12.272 8.111 1.00 0.00 C ATOM 721 O ALA A 43 -8.013 -12.031 9.274 1.00 0.00 O ATOM 722 CB ALA A 43 -8.208 -9.970 7.088 1.00 0.00 C ATOM 0 H ALA A 43 -10.349 -11.089 7.081 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.678 -11.843 6.071 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.175 -9.678 7.279 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.563 -9.476 6.183 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.831 -9.673 7.932 1.00 0.00 H new ATOM 728 N ARG A 44 -6.724 -13.185 7.827 1.00 0.00 N ATOM 729 CA ARG A 44 -5.941 -13.888 8.885 1.00 0.00 C ATOM 730 C ARG A 44 -4.884 -12.990 9.615 1.00 0.00 C ATOM 731 O ARG A 44 -4.851 -12.992 10.848 1.00 0.00 O ATOM 732 CB ARG A 44 -5.304 -15.170 8.275 1.00 0.00 C ATOM 733 CG ARG A 44 -4.685 -16.137 9.325 1.00 0.00 C ATOM 734 CD ARG A 44 -3.792 -17.250 8.747 1.00 0.00 C ATOM 735 NE ARG A 44 -2.508 -16.687 8.239 1.00 0.00 N ATOM 736 CZ ARG A 44 -1.557 -17.379 7.621 1.00 0.00 C ATOM 737 NH1 ARG A 44 -1.581 -18.672 7.445 1.00 0.00 N ATOM 738 NH2 ARG A 44 -0.533 -16.742 7.146 1.00 0.00 N ATOM 0 H ARG A 44 -6.474 -13.459 6.877 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.638 -14.162 9.677 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -6.065 -15.706 7.709 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.529 -14.876 7.568 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.097 -15.552 10.032 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.494 -16.600 9.890 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.589 -17.996 9.516 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.316 -17.760 7.939 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.347 -15.689 8.377 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -2.368 -19.220 7.793 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.813 -19.135 6.960 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.469 -15.729 7.250 1.00 0.00 H new ATOM 0 HH22 ARG A 44 0.209 -17.253 6.668 1.00 0.00 H new ATOM 752 N ASN A 45 -3.993 -12.287 8.891 1.00 0.00 N ATOM 753 CA ASN A 45 -2.929 -11.449 9.510 1.00 0.00 C ATOM 754 C ASN A 45 -2.697 -10.145 8.688 1.00 0.00 C ATOM 755 O ASN A 45 -2.548 -10.180 7.463 1.00 0.00 O ATOM 756 CB ASN A 45 -1.647 -12.278 9.818 1.00 0.00 C ATOM 757 CG ASN A 45 -0.955 -13.006 8.666 1.00 0.00 C ATOM 758 OD1 ASN A 45 -1.367 -14.083 8.240 1.00 0.00 O ATOM 759 ND2 ASN A 45 0.127 -12.480 8.155 1.00 0.00 N ATOM 0 H ASN A 45 -3.983 -12.278 7.871 1.00 0.00 H new ATOM 0 HA ASN A 45 -3.267 -11.109 10.489 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -0.918 -11.606 10.271 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -1.906 -13.021 10.572 1.00 0.00 H new ATOM 0 HD21 ASN A 45 0.625 -12.963 7.407 1.00 0.00 H new ATOM 0 HD22 ASN A 45 0.474 -11.587 8.504 1.00 0.00 H new ATOM 766 N VAL A 46 -2.735 -8.982 9.360 1.00 0.00 N ATOM 767 CA VAL A 46 -2.838 -7.655 8.680 1.00 0.00 C ATOM 768 C VAL A 46 -1.741 -6.702 9.257 1.00 0.00 C ATOM 769 O VAL A 46 -1.637 -6.518 10.477 1.00 0.00 O ATOM 770 CB VAL A 46 -4.286 -7.043 8.782 1.00 0.00 C ATOM 771 CG1 VAL A 46 -4.459 -5.788 7.889 1.00 0.00 C ATOM 772 CG2 VAL A 46 -5.438 -8.001 8.388 1.00 0.00 C ATOM 0 H VAL A 46 -2.696 -8.922 10.377 1.00 0.00 H new ATOM 0 HA VAL A 46 -2.660 -7.787 7.613 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.362 -6.809 9.844 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.473 -5.404 7.994 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -3.747 -5.022 8.196 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -4.278 -6.055 6.848 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.392 -7.485 8.492 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.309 -8.319 7.354 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.425 -8.874 9.041 1.00 0.00 H new ATOM 782 N GLN A 47 -0.964 -6.061 8.364 1.00 0.00 N ATOM 783 CA GLN A 47 0.076 -5.068 8.751 1.00 0.00 C ATOM 784 C GLN A 47 -0.452 -3.630 8.444 1.00 0.00 C ATOM 785 O GLN A 47 -0.455 -3.179 7.292 1.00 0.00 O ATOM 786 CB GLN A 47 1.420 -5.364 8.022 1.00 0.00 C ATOM 787 CG GLN A 47 2.170 -6.676 8.393 1.00 0.00 C ATOM 788 CD GLN A 47 1.647 -7.986 7.779 1.00 0.00 C ATOM 789 OE1 GLN A 47 0.997 -8.803 8.424 1.00 0.00 O ATOM 790 NE2 GLN A 47 1.932 -8.251 6.525 1.00 0.00 N ATOM 0 H GLN A 47 -1.033 -6.210 7.357 1.00 0.00 H new ATOM 0 HA GLN A 47 0.276 -5.141 9.820 1.00 0.00 H new ATOM 0 HB2 GLN A 47 1.223 -5.382 6.950 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.094 -4.528 8.209 1.00 0.00 H new ATOM 0 HG2 GLN A 47 3.214 -6.561 8.103 1.00 0.00 H new ATOM 0 HG3 GLN A 47 2.150 -6.781 9.478 1.00 0.00 H new ATOM 0 HE21 GLN A 47 2.471 -7.584 5.973 1.00 0.00 H new ATOM 0 HE22 GLN A 47 1.614 -9.124 6.103 1.00 0.00 H new ATOM 799 N ILE A 48 -0.901 -2.914 9.489 1.00 0.00 N ATOM 800 CA ILE A 48 -1.484 -1.544 9.373 1.00 0.00 C ATOM 801 C ILE A 48 -0.323 -0.538 9.644 1.00 0.00 C ATOM 802 O ILE A 48 0.102 -0.400 10.796 1.00 0.00 O ATOM 803 CB ILE A 48 -2.688 -1.346 10.373 1.00 0.00 C ATOM 804 CG1 ILE A 48 -3.918 -2.282 10.160 1.00 0.00 C ATOM 805 CG2 ILE A 48 -3.219 0.115 10.378 1.00 0.00 C ATOM 806 CD1 ILE A 48 -3.763 -3.704 10.722 1.00 0.00 C ATOM 0 H ILE A 48 -0.875 -3.261 10.448 1.00 0.00 H new ATOM 0 HA ILE A 48 -1.901 -1.379 8.379 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.232 -1.613 11.327 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.791 -1.819 10.621 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.121 -2.351 9.091 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.047 0.199 11.082 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.419 0.792 10.677 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.564 0.380 9.379 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -4.670 -4.275 10.523 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.914 -4.194 10.244 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.594 -3.654 11.798 1.00 0.00 H new ATOM 818 N THR A 49 0.179 0.166 8.615 1.00 0.00 N ATOM 819 CA THR A 49 1.295 1.143 8.794 1.00 0.00 C ATOM 820 C THR A 49 0.815 2.580 8.441 1.00 0.00 C ATOM 821 O THR A 49 0.609 2.903 7.268 1.00 0.00 O ATOM 822 CB THR A 49 2.564 0.690 8.018 1.00 0.00 C ATOM 823 OG1 THR A 49 2.846 -0.681 8.279 1.00 0.00 O ATOM 824 CG2 THR A 49 3.827 1.488 8.376 1.00 0.00 C ATOM 0 H THR A 49 -0.158 0.087 7.656 1.00 0.00 H new ATOM 0 HA THR A 49 1.592 1.170 9.842 1.00 0.00 H new ATOM 0 HB THR A 49 2.330 0.865 6.968 1.00 0.00 H new ATOM 0 HG1 THR A 49 3.646 -0.951 7.782 1.00 0.00 H new ATOM 0 HG21 THR A 49 4.670 1.115 7.795 1.00 0.00 H new ATOM 0 HG22 THR A 49 3.668 2.542 8.149 1.00 0.00 H new ATOM 0 HG23 THR A 49 4.040 1.374 9.439 1.00 0.00 H new ATOM 832 N ILE A 50 0.648 3.443 9.459 1.00 0.00 N ATOM 833 CA ILE A 50 0.233 4.864 9.244 1.00 0.00 C ATOM 834 C ILE A 50 1.504 5.766 9.368 1.00 0.00 C ATOM 835 O ILE A 50 2.049 5.950 10.463 1.00 0.00 O ATOM 836 CB ILE A 50 -0.945 5.351 10.164 1.00 0.00 C ATOM 837 CG1 ILE A 50 -2.126 4.361 10.381 1.00 0.00 C ATOM 838 CG2 ILE A 50 -1.489 6.729 9.708 1.00 0.00 C ATOM 839 CD1 ILE A 50 -2.982 3.947 9.175 1.00 0.00 C ATOM 0 H ILE A 50 0.790 3.195 10.438 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.190 4.942 8.242 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.469 5.426 11.142 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.717 3.452 10.821 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.793 4.802 11.122 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.302 7.035 10.366 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -0.689 7.468 9.751 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -1.859 6.654 8.685 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.759 3.255 9.501 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.444 4.831 8.736 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.351 3.460 8.431 1.00 0.00 H new ATOM 851 N SER A 51 1.955 6.352 8.249 1.00 0.00 N ATOM 852 CA SER A 51 3.105 7.297 8.232 1.00 0.00 C ATOM 853 C SER A 51 2.665 8.724 8.690 1.00 0.00 C ATOM 854 O SER A 51 2.144 9.515 7.893 1.00 0.00 O ATOM 855 CB SER A 51 3.681 7.253 6.801 1.00 0.00 C ATOM 856 OG SER A 51 4.867 8.040 6.700 1.00 0.00 O ATOM 0 H SER A 51 1.542 6.192 7.330 1.00 0.00 H new ATOM 0 HA SER A 51 3.881 7.012 8.942 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.901 6.221 6.526 1.00 0.00 H new ATOM 0 HB3 SER A 51 2.936 7.620 6.095 1.00 0.00 H new ATOM 0 HG SER A 51 5.534 7.559 6.167 1.00 0.00 H new ATOM 862 N ALA A 52 2.812 9.015 9.996 1.00 0.00 N ATOM 863 CA ALA A 52 2.211 10.217 10.627 1.00 0.00 C ATOM 864 C ALA A 52 3.176 11.441 10.752 1.00 0.00 C ATOM 865 O ALA A 52 4.407 11.328 10.725 1.00 0.00 O ATOM 866 CB ALA A 52 1.665 9.736 11.989 1.00 0.00 C ATOM 0 H ALA A 52 3.344 8.433 10.643 1.00 0.00 H new ATOM 0 HA ALA A 52 1.421 10.617 9.992 1.00 0.00 H new ATOM 0 HB1 ALA A 52 1.205 10.574 12.513 1.00 0.00 H new ATOM 0 HB2 ALA A 52 0.921 8.956 11.828 1.00 0.00 H new ATOM 0 HB3 ALA A 52 2.483 9.338 12.589 1.00 0.00 H new ATOM 872 N GLU A 53 2.580 12.631 10.920 1.00 0.00 N ATOM 873 CA GLU A 53 3.319 13.925 11.014 1.00 0.00 C ATOM 874 C GLU A 53 4.089 14.214 12.352 1.00 0.00 C ATOM 875 O GLU A 53 5.201 14.741 12.313 1.00 0.00 O ATOM 876 CB GLU A 53 2.320 15.057 10.626 1.00 0.00 C ATOM 877 CG GLU A 53 1.163 15.329 11.628 1.00 0.00 C ATOM 878 CD GLU A 53 -0.011 16.127 11.104 1.00 0.00 C ATOM 879 OE1 GLU A 53 0.139 17.307 10.733 1.00 0.00 O ATOM 880 OE2 GLU A 53 -1.130 15.572 11.056 1.00 0.00 O ATOM 0 H GLU A 53 1.568 12.737 10.996 1.00 0.00 H new ATOM 0 HA GLU A 53 4.154 13.869 10.316 1.00 0.00 H new ATOM 0 HB2 GLU A 53 2.884 15.981 10.496 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.883 14.811 9.658 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.790 14.370 11.987 1.00 0.00 H new ATOM 0 HG3 GLU A 53 1.575 15.854 12.490 1.00 0.00 H new ATOM 887 N ASN A 54 3.485 13.914 13.516 1.00 0.00 N ATOM 888 CA ASN A 54 4.053 14.238 14.859 1.00 0.00 C ATOM 889 C ASN A 54 3.781 13.083 15.880 1.00 0.00 C ATOM 890 O ASN A 54 2.863 12.276 15.707 1.00 0.00 O ATOM 891 CB ASN A 54 3.453 15.585 15.373 1.00 0.00 C ATOM 892 CG ASN A 54 4.076 16.843 14.763 1.00 0.00 C ATOM 893 OD1 ASN A 54 5.231 17.168 15.014 1.00 0.00 O ATOM 894 ND2 ASN A 54 3.357 17.605 13.975 1.00 0.00 N ATOM 0 H ASN A 54 2.584 13.438 13.563 1.00 0.00 H new ATOM 0 HA ASN A 54 5.134 14.344 14.764 1.00 0.00 H new ATOM 0 HB2 ASN A 54 2.383 15.591 15.167 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.570 15.628 16.456 1.00 0.00 H new ATOM 0 HD21 ASN A 54 3.760 18.455 13.580 1.00 0.00 H new ATOM 0 HD22 ASN A 54 2.394 17.348 13.757 1.00 0.00 H new ATOM 901 N ASP A 55 4.552 13.044 16.986 1.00 0.00 N ATOM 902 CA ASP A 55 4.349 12.069 18.105 1.00 0.00 C ATOM 903 C ASP A 55 2.913 12.063 18.757 1.00 0.00 C ATOM 904 O ASP A 55 2.312 10.994 18.883 1.00 0.00 O ATOM 905 CB ASP A 55 5.498 12.327 19.119 1.00 0.00 C ATOM 906 CG ASP A 55 5.590 11.328 20.273 1.00 0.00 C ATOM 907 OD1 ASP A 55 6.045 10.188 20.046 1.00 0.00 O ATOM 908 OD2 ASP A 55 5.204 11.682 21.406 1.00 0.00 O ATOM 0 H ASP A 55 5.334 13.681 17.139 1.00 0.00 H new ATOM 0 HA ASP A 55 4.393 11.055 17.707 1.00 0.00 H new ATOM 0 HB2 ASP A 55 6.445 12.321 18.579 1.00 0.00 H new ATOM 0 HB3 ASP A 55 5.375 13.327 19.535 1.00 0.00 H new ATOM 913 N GLU A 56 2.335 13.233 19.101 1.00 0.00 N ATOM 914 CA GLU A 56 0.912 13.354 19.556 1.00 0.00 C ATOM 915 C GLU A 56 -0.167 12.817 18.545 1.00 0.00 C ATOM 916 O GLU A 56 -1.052 12.046 18.929 1.00 0.00 O ATOM 917 CB GLU A 56 0.634 14.836 19.939 1.00 0.00 C ATOM 918 CG GLU A 56 1.375 15.372 21.192 1.00 0.00 C ATOM 919 CD GLU A 56 1.139 16.851 21.455 1.00 0.00 C ATOM 920 OE1 GLU A 56 1.777 17.689 20.782 1.00 0.00 O ATOM 921 OE2 GLU A 56 0.324 17.180 22.343 1.00 0.00 O ATOM 0 H GLU A 56 2.830 14.124 19.075 1.00 0.00 H new ATOM 0 HA GLU A 56 0.807 12.699 20.421 1.00 0.00 H new ATOM 0 HB2 GLU A 56 0.900 15.465 19.089 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.438 14.953 20.099 1.00 0.00 H new ATOM 0 HG2 GLU A 56 1.056 14.801 22.064 1.00 0.00 H new ATOM 0 HG3 GLU A 56 2.445 15.199 21.072 1.00 0.00 H new ATOM 928 N GLN A 57 -0.050 13.175 17.249 1.00 0.00 N ATOM 929 CA GLN A 57 -0.804 12.525 16.134 1.00 0.00 C ATOM 930 C GLN A 57 -0.580 10.977 16.000 1.00 0.00 C ATOM 931 O GLN A 57 -1.557 10.224 15.932 1.00 0.00 O ATOM 932 CB GLN A 57 -0.466 13.281 14.811 1.00 0.00 C ATOM 933 CG GLN A 57 -1.036 14.719 14.669 1.00 0.00 C ATOM 934 CD GLN A 57 -2.533 14.785 14.344 1.00 0.00 C ATOM 935 OE1 GLN A 57 -3.390 14.728 15.217 1.00 0.00 O ATOM 936 NE2 GLN A 57 -2.907 14.898 13.091 1.00 0.00 N ATOM 0 H GLN A 57 0.569 13.923 16.936 1.00 0.00 H new ATOM 0 HA GLN A 57 -1.866 12.607 16.364 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.619 13.333 14.715 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.831 12.685 13.975 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.855 15.260 15.598 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -0.485 15.238 13.885 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -2.206 14.947 12.352 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -3.899 14.937 12.856 1.00 0.00 H new ATOM 945 N ALA A 58 0.681 10.498 15.999 1.00 0.00 N ATOM 946 CA ALA A 58 1.017 9.056 16.095 1.00 0.00 C ATOM 947 C ALA A 58 0.473 8.277 17.342 1.00 0.00 C ATOM 948 O ALA A 58 -0.049 7.177 17.157 1.00 0.00 O ATOM 949 CB ALA A 58 2.548 8.960 15.952 1.00 0.00 C ATOM 0 H ALA A 58 1.501 11.101 15.931 1.00 0.00 H new ATOM 0 HA ALA A 58 0.489 8.538 15.294 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.855 7.916 16.015 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.850 9.369 14.988 1.00 0.00 H new ATOM 0 HB3 ALA A 58 3.024 9.527 16.752 1.00 0.00 H new ATOM 955 N LYS A 59 0.522 8.838 18.570 1.00 0.00 N ATOM 956 CA LYS A 59 -0.200 8.304 19.768 1.00 0.00 C ATOM 957 C LYS A 59 -1.734 8.081 19.569 1.00 0.00 C ATOM 958 O LYS A 59 -2.217 6.970 19.813 1.00 0.00 O ATOM 959 CB LYS A 59 0.140 9.230 20.977 1.00 0.00 C ATOM 960 CG LYS A 59 -0.384 8.811 22.382 1.00 0.00 C ATOM 961 CD LYS A 59 -1.844 9.229 22.721 1.00 0.00 C ATOM 962 CE LYS A 59 -2.793 8.051 23.026 1.00 0.00 C ATOM 963 NZ LYS A 59 -4.180 8.526 23.284 1.00 0.00 N ATOM 0 H LYS A 59 1.064 9.679 18.769 1.00 0.00 H new ATOM 0 HA LYS A 59 0.153 7.291 19.960 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.225 9.318 21.037 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.249 10.224 20.757 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -0.309 7.727 22.467 1.00 0.00 H new ATOM 0 HG3 LYS A 59 0.278 9.236 23.136 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -1.826 9.897 23.582 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.249 9.798 21.884 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -2.795 7.356 22.186 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -2.427 7.502 23.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.685 7.825 23.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.147 9.434 23.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.678 8.652 22.380 1.00 0.00 H new ATOM 977 N GLU A 60 -2.485 9.107 19.127 1.00 0.00 N ATOM 978 CA GLU A 60 -3.947 8.970 18.857 1.00 0.00 C ATOM 979 C GLU A 60 -4.310 7.998 17.683 1.00 0.00 C ATOM 980 O GLU A 60 -5.202 7.163 17.848 1.00 0.00 O ATOM 981 CB GLU A 60 -4.621 10.367 18.718 1.00 0.00 C ATOM 982 CG GLU A 60 -4.487 11.354 19.916 1.00 0.00 C ATOM 983 CD GLU A 60 -4.872 10.855 21.305 1.00 0.00 C ATOM 984 OE1 GLU A 60 -5.608 9.855 21.443 1.00 0.00 O ATOM 985 OE2 GLU A 60 -4.362 11.414 22.295 1.00 0.00 O ATOM 0 H GLU A 60 -2.115 10.040 18.947 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.367 8.478 19.735 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -4.208 10.853 17.834 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.683 10.211 18.529 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.451 11.689 19.958 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -5.097 12.230 19.696 1.00 0.00 H new ATOM 992 N LEU A 61 -3.582 8.036 16.547 1.00 0.00 N ATOM 993 CA LEU A 61 -3.633 6.967 15.503 1.00 0.00 C ATOM 994 C LEU A 61 -3.304 5.517 16.015 1.00 0.00 C ATOM 995 O LEU A 61 -4.096 4.606 15.773 1.00 0.00 O ATOM 996 CB LEU A 61 -2.730 7.388 14.305 1.00 0.00 C ATOM 997 CG LEU A 61 -3.189 8.625 13.480 1.00 0.00 C ATOM 998 CD1 LEU A 61 -2.011 9.201 12.675 1.00 0.00 C ATOM 999 CD2 LEU A 61 -4.358 8.288 12.537 1.00 0.00 C ATOM 0 H LEU A 61 -2.944 8.799 16.320 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.671 6.887 15.181 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.729 7.588 14.688 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.648 6.539 13.627 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.542 9.374 14.189 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.349 10.066 12.104 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.218 9.505 13.358 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.631 8.441 11.992 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.646 9.180 11.981 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.050 7.509 11.839 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.207 7.935 13.122 1.00 0.00 H new ATOM 1011 N LEU A 62 -2.195 5.307 16.756 1.00 0.00 N ATOM 1012 CA LEU A 62 -1.881 4.034 17.479 1.00 0.00 C ATOM 1013 C LEU A 62 -3.036 3.445 18.359 1.00 0.00 C ATOM 1014 O LEU A 62 -3.489 2.320 18.120 1.00 0.00 O ATOM 1015 CB LEU A 62 -0.551 4.317 18.250 1.00 0.00 C ATOM 1016 CG LEU A 62 -0.009 3.188 19.170 1.00 0.00 C ATOM 1017 CD1 LEU A 62 1.479 2.897 18.899 1.00 0.00 C ATOM 1018 CD2 LEU A 62 -0.206 3.510 20.664 1.00 0.00 C ATOM 0 H LEU A 62 -1.476 6.021 16.877 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.761 3.218 16.767 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.220 4.555 17.517 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.697 5.209 18.860 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.592 2.299 18.930 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.821 2.102 19.562 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.606 2.585 17.862 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.065 3.798 19.081 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.188 2.692 21.267 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.323 4.431 20.911 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.269 3.635 20.872 1.00 0.00 H new ATOM 1030 N GLU A 63 -3.513 4.226 19.339 1.00 0.00 N ATOM 1031 CA GLU A 63 -4.712 3.890 20.158 1.00 0.00 C ATOM 1032 C GLU A 63 -6.034 3.643 19.350 1.00 0.00 C ATOM 1033 O GLU A 63 -6.707 2.637 19.588 1.00 0.00 O ATOM 1034 CB GLU A 63 -4.883 4.999 21.230 1.00 0.00 C ATOM 1035 CG GLU A 63 -5.781 4.599 22.434 1.00 0.00 C ATOM 1036 CD GLU A 63 -6.538 5.761 23.046 1.00 0.00 C ATOM 1037 OE1 GLU A 63 -5.908 6.609 23.714 1.00 0.00 O ATOM 1038 OE2 GLU A 63 -7.766 5.841 22.838 1.00 0.00 O ATOM 0 H GLU A 63 -3.084 5.115 19.596 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.528 2.920 20.621 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.899 5.279 21.605 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -5.307 5.884 20.755 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -6.496 3.844 22.107 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.159 4.138 23.202 1.00 0.00 H new ATOM 1045 N LEU A 64 -6.387 4.514 18.381 1.00 0.00 N ATOM 1046 CA LEU A 64 -7.475 4.259 17.388 1.00 0.00 C ATOM 1047 C LEU A 64 -7.375 2.905 16.606 1.00 0.00 C ATOM 1048 O LEU A 64 -8.364 2.169 16.559 1.00 0.00 O ATOM 1049 CB LEU A 64 -7.576 5.535 16.499 1.00 0.00 C ATOM 1050 CG LEU A 64 -8.671 5.679 15.405 1.00 0.00 C ATOM 1051 CD1 LEU A 64 -8.339 4.921 14.107 1.00 0.00 C ATOM 1052 CD2 LEU A 64 -10.086 5.329 15.896 1.00 0.00 C ATOM 0 H LEU A 64 -5.930 5.418 18.257 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.416 4.097 17.913 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.690 6.383 17.174 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.613 5.651 16.001 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.671 6.743 15.170 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.144 5.064 13.386 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -7.407 5.304 13.690 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.230 3.858 14.324 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.796 5.453 15.078 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -10.106 4.295 16.241 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -10.360 5.991 16.718 1.00 0.00 H new ATOM 1064 N ILE A 65 -6.202 2.540 16.053 1.00 0.00 N ATOM 1065 CA ILE A 65 -5.960 1.184 15.460 1.00 0.00 C ATOM 1066 C ILE A 65 -6.099 0.021 16.513 1.00 0.00 C ATOM 1067 O ILE A 65 -6.810 -0.947 16.234 1.00 0.00 O ATOM 1068 CB ILE A 65 -4.594 1.124 14.691 1.00 0.00 C ATOM 1069 CG1 ILE A 65 -4.362 2.241 13.630 1.00 0.00 C ATOM 1070 CG2 ILE A 65 -4.383 -0.241 13.988 1.00 0.00 C ATOM 1071 CD1 ILE A 65 -2.872 2.581 13.470 1.00 0.00 C ATOM 0 H ILE A 65 -5.394 3.161 15.998 1.00 0.00 H new ATOM 0 HA ILE A 65 -6.752 1.021 14.729 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.868 1.280 15.489 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.766 1.919 12.670 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.909 3.137 13.921 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -3.425 -0.238 13.468 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -4.390 -1.038 14.731 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.185 -0.408 13.269 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.756 3.364 12.721 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.474 2.929 14.423 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.328 1.692 13.152 1.00 0.00 H new ATOM 1083 N ALA A 66 -5.467 0.102 17.706 1.00 0.00 N ATOM 1084 CA ALA A 66 -5.735 -0.844 18.827 1.00 0.00 C ATOM 1085 C ALA A 66 -7.232 -0.999 19.278 1.00 0.00 C ATOM 1086 O ALA A 66 -7.706 -2.129 19.419 1.00 0.00 O ATOM 1087 CB ALA A 66 -4.800 -0.430 19.980 1.00 0.00 C ATOM 0 H ALA A 66 -4.767 0.811 17.923 1.00 0.00 H new ATOM 0 HA ALA A 66 -5.526 -1.853 18.471 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -4.956 -1.093 20.831 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -3.763 -0.500 19.651 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -5.019 0.596 20.275 1.00 0.00 H new ATOM 1093 N ARG A 67 -7.990 0.104 19.442 1.00 0.00 N ATOM 1094 CA ARG A 67 -9.484 0.090 19.528 1.00 0.00 C ATOM 1095 C ARG A 67 -10.228 -0.600 18.326 1.00 0.00 C ATOM 1096 O ARG A 67 -11.099 -1.442 18.556 1.00 0.00 O ATOM 1097 CB ARG A 67 -9.954 1.564 19.744 1.00 0.00 C ATOM 1098 CG ARG A 67 -9.744 2.151 21.170 1.00 0.00 C ATOM 1099 CD ARG A 67 -9.487 3.672 21.277 1.00 0.00 C ATOM 1100 NE ARG A 67 -10.539 4.524 20.659 1.00 0.00 N ATOM 1101 CZ ARG A 67 -10.425 5.841 20.455 1.00 0.00 C ATOM 1102 NH1 ARG A 67 -9.451 6.584 20.931 1.00 0.00 N ATOM 1103 NH2 ARG A 67 -11.338 6.436 19.745 1.00 0.00 N ATOM 0 H ARG A 67 -7.591 1.040 19.520 1.00 0.00 H new ATOM 0 HA ARG A 67 -9.761 -0.544 20.370 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.428 2.199 19.031 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.015 1.624 19.502 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -10.626 1.915 21.766 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -8.901 1.633 21.628 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -9.395 3.938 22.330 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -8.531 3.899 20.806 1.00 0.00 H new ATOM 0 HE ARG A 67 -11.407 4.072 20.371 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -8.716 6.160 21.498 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -9.430 7.584 20.734 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -12.115 5.899 19.360 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -11.277 7.440 19.573 1.00 0.00 H new ATOM 1117 N LEU A 68 -9.876 -0.280 17.066 1.00 0.00 N ATOM 1118 CA LEU A 68 -10.416 -0.958 15.852 1.00 0.00 C ATOM 1119 C LEU A 68 -10.140 -2.499 15.741 1.00 0.00 C ATOM 1120 O LEU A 68 -11.069 -3.274 15.507 1.00 0.00 O ATOM 1121 CB LEU A 68 -9.841 -0.166 14.643 1.00 0.00 C ATOM 1122 CG LEU A 68 -10.511 -0.454 13.276 1.00 0.00 C ATOM 1123 CD1 LEU A 68 -11.844 0.306 13.166 1.00 0.00 C ATOM 1124 CD2 LEU A 68 -9.570 -0.075 12.122 1.00 0.00 C ATOM 0 H LEU A 68 -9.206 0.459 16.851 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.505 -0.936 15.893 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -9.930 0.900 14.854 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -8.777 -0.387 14.560 1.00 0.00 H new ATOM 0 HG LEU A 68 -10.717 -1.522 13.207 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -12.305 0.095 12.201 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -12.513 -0.015 13.965 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -11.661 1.377 13.254 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -10.058 -0.285 11.170 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -9.331 0.987 12.181 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -8.652 -0.658 12.195 1.00 0.00 H new ATOM 1136 N LEU A 69 -8.886 -2.949 15.907 1.00 0.00 N ATOM 1137 CA LEU A 69 -8.518 -4.396 15.847 1.00 0.00 C ATOM 1138 C LEU A 69 -9.044 -5.255 17.055 1.00 0.00 C ATOM 1139 O LEU A 69 -9.458 -6.400 16.850 1.00 0.00 O ATOM 1140 CB LEU A 69 -6.990 -4.515 15.592 1.00 0.00 C ATOM 1141 CG LEU A 69 -6.423 -3.772 14.343 1.00 0.00 C ATOM 1142 CD1 LEU A 69 -4.893 -3.834 14.315 1.00 0.00 C ATOM 1143 CD2 LEU A 69 -6.994 -4.274 13.004 1.00 0.00 C ATOM 0 H LEU A 69 -8.093 -2.333 16.086 1.00 0.00 H new ATOM 0 HA LEU A 69 -9.044 -4.847 15.006 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.469 -4.142 16.474 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.743 -5.573 15.499 1.00 0.00 H new ATOM 0 HG LEU A 69 -6.748 -2.737 14.450 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.524 -3.309 13.434 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.493 -3.363 15.213 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.572 -4.875 14.278 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.551 -3.708 12.185 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.760 -5.332 12.883 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.075 -4.138 12.996 1.00 0.00 H new ATOM 1155 N GLN A 70 -9.133 -4.698 18.281 1.00 0.00 N ATOM 1156 CA GLN A 70 -10.021 -5.237 19.358 1.00 0.00 C ATOM 1157 C GLN A 70 -11.559 -5.293 19.016 1.00 0.00 C ATOM 1158 O GLN A 70 -12.186 -6.309 19.323 1.00 0.00 O ATOM 1159 CB GLN A 70 -9.764 -4.446 20.670 1.00 0.00 C ATOM 1160 CG GLN A 70 -8.384 -4.696 21.340 1.00 0.00 C ATOM 1161 CD GLN A 70 -8.117 -3.823 22.569 1.00 0.00 C ATOM 1162 OE1 GLN A 70 -8.310 -4.222 23.710 1.00 0.00 O ATOM 1163 NE2 GLN A 70 -7.655 -2.611 22.376 1.00 0.00 N ATOM 0 H GLN A 70 -8.603 -3.872 18.560 1.00 0.00 H new ATOM 0 HA GLN A 70 -9.748 -6.286 19.474 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -9.858 -3.381 20.456 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -10.547 -4.698 21.385 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.319 -5.744 21.631 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.598 -4.520 20.605 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -7.492 -2.272 21.428 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -7.459 -2.007 23.174 1.00 0.00 H new ATOM 1172 N LYS A 71 -12.161 -4.266 18.366 1.00 0.00 N ATOM 1173 CA LYS A 71 -13.566 -4.323 17.839 1.00 0.00 C ATOM 1174 C LYS A 71 -13.877 -5.505 16.854 1.00 0.00 C ATOM 1175 O LYS A 71 -14.899 -6.172 17.033 1.00 0.00 O ATOM 1176 CB LYS A 71 -13.921 -2.933 17.225 1.00 0.00 C ATOM 1177 CG LYS A 71 -15.389 -2.742 16.755 1.00 0.00 C ATOM 1178 CD LYS A 71 -15.580 -1.467 15.904 1.00 0.00 C ATOM 1179 CE LYS A 71 -16.976 -1.385 15.253 1.00 0.00 C ATOM 1180 NZ LYS A 71 -17.055 -0.169 14.402 1.00 0.00 N ATOM 0 H LYS A 71 -11.697 -3.375 18.188 1.00 0.00 H new ATOM 0 HA LYS A 71 -14.212 -4.546 18.688 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -13.696 -2.165 17.965 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -13.264 -2.757 16.373 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -15.696 -3.611 16.174 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -16.042 -2.694 17.626 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.425 -0.590 16.532 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.819 -1.439 15.124 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -17.162 -2.275 14.652 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -17.747 -1.354 16.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -17.696 -0.346 13.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -17.417 0.626 14.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.108 0.065 14.042 1.00 0.00 H new ATOM 1194 N LEU A 72 -13.028 -5.774 15.841 1.00 0.00 N ATOM 1195 CA LEU A 72 -13.123 -7.026 15.029 1.00 0.00 C ATOM 1196 C LEU A 72 -12.837 -8.350 15.827 1.00 0.00 C ATOM 1197 O LEU A 72 -13.582 -9.322 15.675 1.00 0.00 O ATOM 1198 CB LEU A 72 -12.189 -6.940 13.782 1.00 0.00 C ATOM 1199 CG LEU A 72 -12.526 -6.023 12.574 1.00 0.00 C ATOM 1200 CD1 LEU A 72 -13.964 -6.183 12.053 1.00 0.00 C ATOM 1201 CD2 LEU A 72 -12.207 -4.544 12.823 1.00 0.00 C ATOM 0 H LEU A 72 -12.270 -5.152 15.559 1.00 0.00 H new ATOM 0 HA LEU A 72 -14.166 -7.088 14.718 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -11.206 -6.638 14.143 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -12.088 -7.953 13.392 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.859 -6.376 11.788 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -14.123 -5.510 11.210 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.122 -7.212 11.731 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.668 -5.940 12.849 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.467 -3.962 11.939 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -12.784 -4.186 13.676 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.143 -4.431 13.032 1.00 0.00 H new ATOM 1213 N GLY A 73 -11.761 -8.393 16.634 1.00 0.00 N ATOM 1214 CA GLY A 73 -11.394 -9.573 17.462 1.00 0.00 C ATOM 1215 C GLY A 73 -9.991 -10.163 17.199 1.00 0.00 C ATOM 1216 O GLY A 73 -9.852 -11.377 17.038 1.00 0.00 O ATOM 0 H GLY A 73 -11.114 -7.611 16.736 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -11.459 -9.291 18.513 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.134 -10.355 17.296 1.00 0.00 H new ATOM 1220 N TYR A 74 -8.951 -9.316 17.210 1.00 0.00 N ATOM 1221 CA TYR A 74 -7.552 -9.738 16.941 1.00 0.00 C ATOM 1222 C TYR A 74 -6.752 -9.699 18.279 1.00 0.00 C ATOM 1223 O TYR A 74 -6.321 -8.634 18.730 1.00 0.00 O ATOM 1224 CB TYR A 74 -6.929 -8.799 15.873 1.00 0.00 C ATOM 1225 CG TYR A 74 -7.430 -8.943 14.423 1.00 0.00 C ATOM 1226 CD1 TYR A 74 -8.512 -8.171 13.984 1.00 0.00 C ATOM 1227 CD2 TYR A 74 -6.777 -9.778 13.513 1.00 0.00 C ATOM 1228 CE1 TYR A 74 -8.935 -8.246 12.659 1.00 0.00 C ATOM 1229 CE2 TYR A 74 -7.184 -9.830 12.178 1.00 0.00 C ATOM 1230 CZ TYR A 74 -8.273 -9.067 11.760 1.00 0.00 C ATOM 1231 OH TYR A 74 -8.697 -9.139 10.462 1.00 0.00 O ATOM 0 H TYR A 74 -9.047 -8.319 17.404 1.00 0.00 H new ATOM 0 HA TYR A 74 -7.522 -10.755 16.550 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -7.101 -7.770 16.188 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -5.850 -8.957 15.874 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -9.021 -7.515 14.675 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -5.950 -10.389 13.845 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.782 -7.662 12.331 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -6.658 -10.458 11.474 1.00 0.00 H new ATOM 0 HH TYR A 74 -8.490 -10.025 10.099 1.00 0.00 H new ATOM 1241 N LYS A 75 -6.561 -10.866 18.917 1.00 0.00 N ATOM 1242 CA LYS A 75 -5.878 -10.949 20.244 1.00 0.00 C ATOM 1243 C LYS A 75 -4.317 -10.811 20.278 1.00 0.00 C ATOM 1244 O LYS A 75 -3.797 -10.303 21.275 1.00 0.00 O ATOM 1245 CB LYS A 75 -6.393 -12.197 21.015 1.00 0.00 C ATOM 1246 CG LYS A 75 -5.970 -13.592 20.479 1.00 0.00 C ATOM 1247 CD LYS A 75 -6.528 -14.777 21.295 1.00 0.00 C ATOM 1248 CE LYS A 75 -5.854 -14.961 22.671 1.00 0.00 C ATOM 1249 NZ LYS A 75 -6.445 -16.136 23.368 1.00 0.00 N ATOM 0 H LYS A 75 -6.864 -11.767 18.548 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.167 -10.033 20.759 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -6.057 -12.117 22.049 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.482 -12.158 21.030 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -6.302 -13.688 19.445 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.882 -13.651 20.471 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -7.598 -14.632 21.442 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.407 -15.693 20.717 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.781 -15.103 22.545 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.987 -14.063 23.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -5.988 -16.256 24.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -7.465 -15.983 23.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -6.296 -16.991 22.795 1.00 0.00 H new ATOM 1263 N ASP A 76 -3.578 -11.269 19.247 1.00 0.00 N ATOM 1264 CA ASP A 76 -2.096 -11.141 19.198 1.00 0.00 C ATOM 1265 C ASP A 76 -1.719 -9.879 18.360 1.00 0.00 C ATOM 1266 O ASP A 76 -1.914 -9.851 17.139 1.00 0.00 O ATOM 1267 CB ASP A 76 -1.535 -12.479 18.652 1.00 0.00 C ATOM 1268 CG ASP A 76 -0.015 -12.651 18.727 1.00 0.00 C ATOM 1269 OD1 ASP A 76 0.628 -12.087 19.634 1.00 0.00 O ATOM 1270 OD2 ASP A 76 0.532 -13.413 17.898 1.00 0.00 O ATOM 0 H ASP A 76 -3.979 -11.733 18.432 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.647 -10.980 20.178 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -2.001 -13.297 19.202 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -1.841 -12.580 17.611 1.00 0.00 H new ATOM 1275 N ILE A 77 -1.254 -8.819 19.048 1.00 0.00 N ATOM 1276 CA ILE A 77 -1.114 -7.454 18.459 1.00 0.00 C ATOM 1277 C ILE A 77 0.376 -6.999 18.638 1.00 0.00 C ATOM 1278 O ILE A 77 0.794 -6.642 19.746 1.00 0.00 O ATOM 1279 CB ILE A 77 -2.127 -6.415 19.099 1.00 0.00 C ATOM 1280 CG1 ILE A 77 -3.610 -6.887 19.259 1.00 0.00 C ATOM 1281 CG2 ILE A 77 -2.103 -5.070 18.322 1.00 0.00 C ATOM 1282 CD1 ILE A 77 -4.521 -6.011 20.140 1.00 0.00 C ATOM 0 H ILE A 77 -0.963 -8.874 20.024 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.367 -7.490 17.399 1.00 0.00 H new ATOM 0 HB ILE A 77 -1.754 -6.299 20.117 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.056 -6.952 18.267 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.604 -7.896 19.672 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.806 -4.373 18.779 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.099 -4.648 18.357 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.388 -5.244 17.284 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.521 -6.443 20.172 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.114 -5.964 21.150 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.573 -5.005 19.723 1.00 0.00 H new ATOM 1294 N ASN A 78 1.165 -6.947 17.548 1.00 0.00 N ATOM 1295 CA ASN A 78 2.544 -6.384 17.573 1.00 0.00 C ATOM 1296 C ASN A 78 2.498 -4.831 17.356 1.00 0.00 C ATOM 1297 O ASN A 78 2.303 -4.339 16.239 1.00 0.00 O ATOM 1298 CB ASN A 78 3.391 -7.171 16.536 1.00 0.00 C ATOM 1299 CG ASN A 78 4.884 -6.808 16.472 1.00 0.00 C ATOM 1300 OD1 ASN A 78 5.491 -6.348 17.433 1.00 0.00 O ATOM 1301 ND2 ASN A 78 5.548 -7.017 15.361 1.00 0.00 N ATOM 0 H ASN A 78 0.876 -7.288 16.631 1.00 0.00 H new ATOM 0 HA ASN A 78 3.027 -6.508 18.542 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.305 -8.235 16.758 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.957 -7.016 15.548 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.543 -6.798 15.313 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.070 -7.399 14.545 1.00 0.00 H new ATOM 1308 N VAL A 79 2.664 -4.079 18.456 1.00 0.00 N ATOM 1309 CA VAL A 79 2.512 -2.593 18.478 1.00 0.00 C ATOM 1310 C VAL A 79 3.930 -1.927 18.373 1.00 0.00 C ATOM 1311 O VAL A 79 4.670 -1.893 19.362 1.00 0.00 O ATOM 1312 CB VAL A 79 1.718 -2.183 19.777 1.00 0.00 C ATOM 1313 CG1 VAL A 79 1.590 -0.657 19.987 1.00 0.00 C ATOM 1314 CG2 VAL A 79 0.282 -2.755 19.864 1.00 0.00 C ATOM 0 H VAL A 79 2.908 -4.474 19.364 1.00 0.00 H new ATOM 0 HA VAL A 79 1.936 -2.236 17.625 1.00 0.00 H new ATOM 0 HB VAL A 79 2.342 -2.623 20.555 1.00 0.00 H new ATOM 0 HG11 VAL A 79 1.031 -0.461 20.902 1.00 0.00 H new ATOM 0 HG12 VAL A 79 2.584 -0.216 20.068 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.065 -0.216 19.140 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -0.187 -2.421 20.789 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.302 -2.403 19.014 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.323 -3.844 19.850 1.00 0.00 H new ATOM 1324 N ARG A 80 4.298 -1.362 17.204 1.00 0.00 N ATOM 1325 CA ARG A 80 5.571 -0.598 17.042 1.00 0.00 C ATOM 1326 C ARG A 80 5.291 0.768 16.345 1.00 0.00 C ATOM 1327 O ARG A 80 5.104 0.813 15.126 1.00 0.00 O ATOM 1328 CB ARG A 80 6.604 -1.479 16.272 1.00 0.00 C ATOM 1329 CG ARG A 80 7.968 -0.804 15.946 1.00 0.00 C ATOM 1330 CD ARG A 80 8.978 -1.765 15.294 1.00 0.00 C ATOM 1331 NE ARG A 80 10.163 -1.015 14.783 1.00 0.00 N ATOM 1332 CZ ARG A 80 11.270 -1.571 14.289 1.00 0.00 C ATOM 1333 NH1 ARG A 80 11.499 -2.860 14.304 1.00 0.00 N ATOM 1334 NH2 ARG A 80 12.174 -0.796 13.766 1.00 0.00 N ATOM 0 H ARG A 80 3.737 -1.416 16.354 1.00 0.00 H new ATOM 0 HA ARG A 80 6.004 -0.364 18.015 1.00 0.00 H new ATOM 0 HB2 ARG A 80 6.797 -2.376 16.860 1.00 0.00 H new ATOM 0 HB3 ARG A 80 6.149 -1.803 15.336 1.00 0.00 H new ATOM 0 HG2 ARG A 80 7.798 0.041 15.279 1.00 0.00 H new ATOM 0 HG3 ARG A 80 8.397 -0.404 16.865 1.00 0.00 H new ATOM 0 HD2 ARG A 80 9.299 -2.511 16.021 1.00 0.00 H new ATOM 0 HD3 ARG A 80 8.500 -2.302 14.475 1.00 0.00 H new ATOM 0 HE ARG A 80 10.123 0.004 14.814 1.00 0.00 H new ATOM 0 HH11 ARG A 80 10.811 -3.495 14.709 1.00 0.00 H new ATOM 0 HH12 ARG A 80 12.365 -3.229 13.911 1.00 0.00 H new ATOM 0 HH21 ARG A 80 12.028 0.213 13.740 1.00 0.00 H new ATOM 0 HH22 ARG A 80 13.029 -1.197 13.382 1.00 0.00 H new ATOM 1348 N VAL A 81 5.379 1.897 17.075 1.00 0.00 N ATOM 1349 CA VAL A 81 5.627 3.225 16.446 1.00 0.00 C ATOM 1350 C VAL A 81 7.164 3.411 16.174 1.00 0.00 C ATOM 1351 O VAL A 81 7.973 3.469 17.106 1.00 0.00 O ATOM 1352 CB VAL A 81 4.934 4.367 17.262 1.00 0.00 C ATOM 1353 CG1 VAL A 81 5.547 4.709 18.638 1.00 0.00 C ATOM 1354 CG2 VAL A 81 4.869 5.665 16.441 1.00 0.00 C ATOM 0 H VAL A 81 5.284 1.925 18.090 1.00 0.00 H new ATOM 0 HA VAL A 81 5.157 3.280 15.464 1.00 0.00 H new ATOM 0 HB VAL A 81 3.947 3.951 17.466 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.976 5.514 19.100 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.516 3.828 19.279 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.581 5.026 18.507 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.383 6.444 17.029 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.879 5.983 16.182 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.298 5.490 15.529 1.00 0.00 H new ATOM 1364 N ASN A 82 7.573 3.476 14.895 1.00 0.00 N ATOM 1365 CA ASN A 82 8.999 3.697 14.508 1.00 0.00 C ATOM 1366 C ASN A 82 9.234 5.219 14.228 1.00 0.00 C ATOM 1367 O ASN A 82 9.105 5.699 13.097 1.00 0.00 O ATOM 1368 CB ASN A 82 9.324 2.729 13.333 1.00 0.00 C ATOM 1369 CG ASN A 82 10.812 2.517 13.049 1.00 0.00 C ATOM 1370 OD1 ASN A 82 11.529 1.914 13.844 1.00 0.00 O ATOM 1371 ND2 ASN A 82 11.312 2.941 11.913 1.00 0.00 N ATOM 0 H ASN A 82 6.941 3.379 14.100 1.00 0.00 H new ATOM 0 HA ASN A 82 9.703 3.458 15.305 1.00 0.00 H new ATOM 0 HB2 ASN A 82 8.871 1.761 13.546 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.850 3.111 12.429 1.00 0.00 H new ATOM 0 HD21 ASN A 82 12.293 2.770 11.692 1.00 0.00 H new ATOM 0 HD22 ASN A 82 10.720 3.442 11.251 1.00 0.00 H new ATOM 1378 N GLY A 83 9.506 5.991 15.300 1.00 0.00 N ATOM 1379 CA GLY A 83 9.488 7.480 15.241 1.00 0.00 C ATOM 1380 C GLY A 83 8.060 8.056 15.188 1.00 0.00 C ATOM 1381 O GLY A 83 7.397 8.182 16.218 1.00 0.00 O ATOM 0 H GLY A 83 9.741 5.615 16.219 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.005 7.880 16.113 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.042 7.811 14.363 1.00 0.00 H new ATOM 1385 N THR A 84 7.588 8.334 13.966 1.00 0.00 N ATOM 1386 CA THR A 84 6.133 8.564 13.688 1.00 0.00 C ATOM 1387 C THR A 84 5.455 7.485 12.753 1.00 0.00 C ATOM 1388 O THR A 84 4.252 7.593 12.496 1.00 0.00 O ATOM 1389 CB THR A 84 5.867 10.010 13.166 1.00 0.00 C ATOM 1390 OG1 THR A 84 6.372 10.194 11.845 1.00 0.00 O ATOM 1391 CG2 THR A 84 6.408 11.158 14.033 1.00 0.00 C ATOM 0 H THR A 84 8.182 8.409 13.140 1.00 0.00 H new ATOM 0 HA THR A 84 5.648 8.445 14.657 1.00 0.00 H new ATOM 0 HB THR A 84 4.779 10.073 13.200 1.00 0.00 H new ATOM 0 HG1 THR A 84 5.624 10.263 11.216 1.00 0.00 H new ATOM 0 HG21 THR A 84 6.162 12.112 13.568 1.00 0.00 H new ATOM 0 HG22 THR A 84 5.956 11.110 15.024 1.00 0.00 H new ATOM 0 HG23 THR A 84 7.490 11.067 14.123 1.00 0.00 H new ATOM 1399 N GLU A 85 6.159 6.435 12.263 1.00 0.00 N ATOM 1400 CA GLU A 85 5.556 5.337 11.451 1.00 0.00 C ATOM 1401 C GLU A 85 4.779 4.350 12.382 1.00 0.00 C ATOM 1402 O GLU A 85 5.386 3.553 13.108 1.00 0.00 O ATOM 1403 CB GLU A 85 6.676 4.554 10.708 1.00 0.00 C ATOM 1404 CG GLU A 85 7.613 5.283 9.711 1.00 0.00 C ATOM 1405 CD GLU A 85 8.763 4.395 9.246 1.00 0.00 C ATOM 1406 OE1 GLU A 85 9.706 4.171 10.039 1.00 0.00 O ATOM 1407 OE2 GLU A 85 8.724 3.902 8.102 1.00 0.00 O ATOM 0 H GLU A 85 7.161 6.321 12.417 1.00 0.00 H new ATOM 0 HA GLU A 85 4.869 5.774 10.726 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.308 4.096 11.469 1.00 0.00 H new ATOM 0 HB3 GLU A 85 6.194 3.742 10.163 1.00 0.00 H new ATOM 0 HG2 GLU A 85 7.036 5.610 8.846 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.016 6.179 10.183 1.00 0.00 H new ATOM 1414 N VAL A 86 3.442 4.400 12.389 1.00 0.00 N ATOM 1415 CA VAL A 86 2.608 3.611 13.347 1.00 0.00 C ATOM 1416 C VAL A 86 2.351 2.191 12.743 1.00 0.00 C ATOM 1417 O VAL A 86 1.372 2.002 12.016 1.00 0.00 O ATOM 1418 CB VAL A 86 1.305 4.413 13.686 1.00 0.00 C ATOM 1419 CG1 VAL A 86 0.367 3.653 14.641 1.00 0.00 C ATOM 1420 CG2 VAL A 86 1.534 5.805 14.318 1.00 0.00 C ATOM 0 H VAL A 86 2.899 4.976 11.746 1.00 0.00 H new ATOM 0 HA VAL A 86 3.121 3.457 14.296 1.00 0.00 H new ATOM 0 HB VAL A 86 0.856 4.540 12.701 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -0.518 4.258 14.839 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.067 2.710 14.183 1.00 0.00 H new ATOM 0 HG13 VAL A 86 0.887 3.452 15.578 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.572 6.278 14.515 1.00 0.00 H new ATOM 0 HG22 VAL A 86 2.082 5.694 15.254 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.110 6.426 13.632 1.00 0.00 H new ATOM 1430 N LYS A 87 3.227 1.209 13.033 1.00 0.00 N ATOM 1431 CA LYS A 87 3.188 -0.135 12.398 1.00 0.00 C ATOM 1432 C LYS A 87 2.530 -1.170 13.363 1.00 0.00 C ATOM 1433 O LYS A 87 3.180 -1.709 14.267 1.00 0.00 O ATOM 1434 CB LYS A 87 4.638 -0.515 11.968 1.00 0.00 C ATOM 1435 CG LYS A 87 4.721 -1.461 10.741 1.00 0.00 C ATOM 1436 CD LYS A 87 5.621 -2.706 10.894 1.00 0.00 C ATOM 1437 CE LYS A 87 4.840 -3.945 11.370 1.00 0.00 C ATOM 1438 NZ LYS A 87 5.719 -5.146 11.369 1.00 0.00 N ATOM 0 H LYS A 87 3.981 1.318 13.711 1.00 0.00 H new ATOM 0 HA LYS A 87 2.566 -0.131 11.503 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.188 0.399 11.743 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.140 -0.990 12.811 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.712 -1.796 10.499 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.078 -0.884 9.888 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.097 -2.926 9.938 1.00 0.00 H new ATOM 0 HD3 LYS A 87 6.419 -2.488 11.604 1.00 0.00 H new ATOM 0 HE2 LYS A 87 4.450 -3.773 12.373 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.982 -4.114 10.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 5.184 -5.967 11.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 6.536 -4.978 10.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.052 -5.333 12.336 1.00 0.00 H new ATOM 1452 N ILE A 88 1.224 -1.425 13.173 1.00 0.00 N ATOM 1453 CA ILE A 88 0.423 -2.316 14.066 1.00 0.00 C ATOM 1454 C ILE A 88 0.148 -3.637 13.280 1.00 0.00 C ATOM 1455 O ILE A 88 -0.565 -3.652 12.270 1.00 0.00 O ATOM 1456 CB ILE A 88 -0.888 -1.629 14.588 1.00 0.00 C ATOM 1457 CG1 ILE A 88 -0.737 -0.179 15.142 1.00 0.00 C ATOM 1458 CG2 ILE A 88 -1.629 -2.500 15.637 1.00 0.00 C ATOM 1459 CD1 ILE A 88 0.236 0.027 16.314 1.00 0.00 C ATOM 0 H ILE A 88 0.685 -1.027 12.403 1.00 0.00 H new ATOM 0 HA ILE A 88 0.984 -2.538 14.973 1.00 0.00 H new ATOM 0 HB ILE A 88 -1.480 -1.539 13.678 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.419 0.465 14.322 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.722 0.167 15.456 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.529 -1.983 15.969 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.903 -3.455 15.189 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.976 -2.675 16.492 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.244 1.079 16.599 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.084 -0.577 17.163 1.00 0.00 H new ATOM 0 HD13 ILE A 88 1.239 -0.275 16.012 1.00 0.00 H new ATOM 1471 N GLU A 89 0.743 -4.738 13.750 1.00 0.00 N ATOM 1472 CA GLU A 89 0.751 -6.040 13.032 1.00 0.00 C ATOM 1473 C GLU A 89 -0.040 -7.103 13.851 1.00 0.00 C ATOM 1474 O GLU A 89 0.400 -7.546 14.916 1.00 0.00 O ATOM 1475 CB GLU A 89 2.248 -6.342 12.766 1.00 0.00 C ATOM 1476 CG GLU A 89 2.620 -7.771 12.303 1.00 0.00 C ATOM 1477 CD GLU A 89 4.105 -7.884 12.040 1.00 0.00 C ATOM 1478 OE1 GLU A 89 4.551 -7.443 10.957 1.00 0.00 O ATOM 1479 OE2 GLU A 89 4.855 -8.288 12.949 1.00 0.00 O ATOM 0 H GLU A 89 1.238 -4.763 14.642 1.00 0.00 H new ATOM 0 HA GLU A 89 0.233 -6.038 12.073 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.603 -5.641 12.010 1.00 0.00 H new ATOM 0 HB3 GLU A 89 2.801 -6.131 13.681 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.326 -8.493 13.065 1.00 0.00 H new ATOM 0 HG3 GLU A 89 2.066 -8.020 11.398 1.00 0.00 H new ATOM 1486 N VAL A 90 -1.214 -7.510 13.346 1.00 0.00 N ATOM 1487 CA VAL A 90 -2.091 -8.511 14.032 1.00 0.00 C ATOM 1488 C VAL A 90 -2.104 -9.898 13.328 1.00 0.00 C ATOM 1489 O VAL A 90 -1.981 -9.989 12.105 1.00 0.00 O ATOM 1490 CB VAL A 90 -3.548 -7.987 14.258 1.00 0.00 C ATOM 1491 CG1 VAL A 90 -3.613 -6.959 15.395 1.00 0.00 C ATOM 1492 CG2 VAL A 90 -4.305 -7.456 13.022 1.00 0.00 C ATOM 0 H VAL A 90 -1.592 -7.168 12.462 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.638 -8.654 15.013 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.082 -8.897 14.531 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -4.641 -6.620 15.520 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.267 -7.418 16.321 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.977 -6.108 15.153 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.300 -7.125 13.319 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -3.757 -6.617 12.592 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.393 -8.250 12.280 1.00 0.00 H new ATOM 1502 N ARG A 91 -2.322 -10.974 14.113 1.00 0.00 N ATOM 1503 CA ARG A 91 -2.518 -12.349 13.564 1.00 0.00 C ATOM 1504 C ARG A 91 -3.633 -13.161 14.303 1.00 0.00 C ATOM 1505 O ARG A 91 -3.659 -13.245 15.535 1.00 0.00 O ATOM 1506 CB ARG A 91 -1.161 -13.108 13.464 1.00 0.00 C ATOM 1507 CG ARG A 91 -0.363 -13.369 14.773 1.00 0.00 C ATOM 1508 CD ARG A 91 -0.112 -14.847 15.132 1.00 0.00 C ATOM 1509 NE ARG A 91 -1.330 -15.508 15.692 1.00 0.00 N ATOM 1510 CZ ARG A 91 -1.438 -16.036 16.911 1.00 0.00 C ATOM 1511 NH1 ARG A 91 -0.580 -15.840 17.878 1.00 0.00 N ATOM 1512 NH2 ARG A 91 -2.474 -16.777 17.160 1.00 0.00 N ATOM 0 H ARG A 91 -2.368 -10.926 15.131 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.897 -12.237 12.548 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -1.354 -14.073 12.994 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -0.516 -12.547 12.788 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.601 -12.867 14.693 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.898 -12.901 15.600 1.00 0.00 H new ATOM 0 HD2 ARG A 91 0.214 -15.385 14.242 1.00 0.00 H new ATOM 0 HD3 ARG A 91 0.699 -14.910 15.857 1.00 0.00 H new ATOM 0 HE ARG A 91 -2.151 -15.560 15.088 1.00 0.00 H new ATOM 0 HH11 ARG A 91 0.237 -15.249 17.723 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -0.728 -16.278 18.787 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.172 -16.938 16.434 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -2.590 -17.198 18.082 1.00 0.00 H new ATOM 1526 N VAL A 92 -4.525 -13.818 13.532 1.00 0.00 N ATOM 1527 CA VAL A 92 -5.590 -14.712 14.081 1.00 0.00 C ATOM 1528 C VAL A 92 -5.013 -16.147 14.150 1.00 0.00 C ATOM 1529 O VAL A 92 -4.225 -16.492 15.035 1.00 0.00 O ATOM 1530 CB VAL A 92 -6.897 -14.675 13.211 1.00 0.00 C ATOM 1531 CG1 VAL A 92 -8.047 -15.532 13.797 1.00 0.00 C ATOM 1532 CG2 VAL A 92 -7.492 -13.265 12.994 1.00 0.00 C ATOM 0 H VAL A 92 -4.535 -13.750 12.514 1.00 0.00 H new ATOM 0 HA VAL A 92 -5.876 -14.366 15.074 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.543 -15.077 12.262 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.920 -15.462 13.148 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.727 -16.572 13.865 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -8.304 -15.165 14.791 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -8.391 -13.340 12.383 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -7.745 -12.824 13.958 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.760 -12.635 12.488 1.00 0.00 H new TER 1542 VAL A 92