USER MOD reduce.3.24.130724 H: found=0, std=0, add=885, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 883 hydrogens (36 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 110 HECFE :(H bumps) USER MOD NoAdj-H: A 105 IMD HN3 : A 105 IMD N3 : A 110 HECFE :(H bumps) USER MOD NoAdj-H: A 110 HEC HAC : A 110 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 110 HEC HAB : A 110 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 78 THR OG1 : rot 130:sc= 1.06 USER MOD Set 1.2: A 79 LYS NZ :NH3+ -177:sc= 1.26 (180deg=0) USER MOD Set 2.1: A 52 ASN : amide:sc= -0.749 X(o=-0.63,f=-0.66) USER MOD Set 2.2: A 67 TYR OH : rot 58:sc= 0.117 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.365 (180deg=0.00549) USER MOD Single : A 5 LYS NZ :NH3+ -146:sc= 1.1 (180deg=0.187) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ -151:sc= 0.985 (180deg=-1.03!) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -136:sc= 0.102 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 19 THR OG1 : rot -120:sc= -0.124 USER MOD Single : A 22 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0734) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=-0.0027) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -0.0197 K(o=-0.02,f=-4.3!) USER MOD Single : A 33 HIS : no HD1:sc= -0.178 K(o=-0.18,f=-0.79) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 68:sc= 0.255 USER MOD Single : A 42 GLN : amide:sc= -0.166 K(o=-0.17,f=-1.7!) USER MOD Single : A 47 THR OG1 : rot 47:sc= 0.726 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc=-0.00919 X(o=-0.0092,f=0) USER MOD Single : A 55 LYS NZ :NH3+ -172:sc= 0.0706 (180deg=0.0282) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 157:sc= 1.03 (180deg=0.359) USER MOD Single : A 63 THR OG1 : rot -161:sc= 1.09 USER MOD Single : A 65 MET CE :methyl 176:sc= -0.0772 (180deg=-0.0941) USER MOD Single : A 70 ASN : amide:sc= -0.188 K(o=-0.19,f=-1.6!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 130:sc= 0 USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ -127:sc= 1.14 (180deg=-0.618) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0711 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -84:sc= 1.11 USER MOD Single : A 103 ASN : amide:sc= -0.188 K(o=-0.19,f=-2.3!) USER MOD Single : A 110 HEC O2A : rot -127:sc= 0.344 USER MOD Single : A 110 HEC O2D : rot 173:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.605 -4.916 -15.511 1.00 10.00 N ATOM 2 CA GLY A 1 -4.212 -4.526 -15.463 1.00 10.00 C ATOM 3 C GLY A 1 -3.463 -5.849 -15.578 1.00 10.00 C ATOM 4 O GLY A 1 -4.086 -6.895 -15.396 1.00 10.00 O ATOM 0 H1 GLY A 1 -6.040 -4.545 -16.380 1.00 10.00 H new ATOM 0 H2 GLY A 1 -5.675 -5.954 -15.504 1.00 10.00 H new ATOM 0 H3 GLY A 1 -6.102 -4.530 -14.683 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -3.957 -3.849 -16.279 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -3.972 -4.010 -14.534 1.00 10.00 H new ATOM 10 N ASP A 2 -2.228 -5.812 -16.011 1.00 10.00 N ATOM 11 CA ASP A 2 -1.379 -6.985 -16.155 1.00 10.00 C ATOM 12 C ASP A 2 -0.929 -7.494 -14.787 1.00 10.00 C ATOM 13 O ASP A 2 -0.264 -6.776 -14.043 1.00 10.00 O ATOM 14 CB ASP A 2 -0.125 -6.680 -16.969 1.00 10.00 C ATOM 15 CG ASP A 2 0.687 -7.954 -17.186 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.143 -9.057 -16.947 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.894 -7.812 -17.469 1.00 10.00 O ATOM 0 H ASP A 2 -1.765 -4.944 -16.283 1.00 10.00 H new ATOM 0 HA ASP A 2 -1.975 -7.738 -16.671 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.403 -6.249 -17.931 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.482 -5.937 -16.451 1.00 10.00 H new ATOM 22 N VAL A 3 -1.233 -8.751 -14.472 1.00 10.00 N ATOM 23 CA VAL A 3 -0.718 -9.389 -13.274 1.00 10.00 C ATOM 24 C VAL A 3 0.804 -9.536 -13.347 1.00 10.00 C ATOM 25 O VAL A 3 1.482 -9.334 -12.340 1.00 10.00 O ATOM 26 CB VAL A 3 -1.439 -10.729 -13.044 1.00 10.00 C ATOM 27 CG1 VAL A 3 -0.815 -11.517 -11.884 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.927 -10.459 -12.775 1.00 10.00 C ATOM 0 H VAL A 3 -1.838 -9.347 -15.037 1.00 10.00 H new ATOM 0 HA VAL A 3 -0.922 -8.758 -12.409 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.332 -11.340 -13.940 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -1.351 -12.457 -11.753 1.00 10.00 H new ATOM 0 HG12 VAL A 3 0.232 -11.724 -12.107 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -0.882 -10.930 -10.968 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.444 -11.404 -12.611 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.029 -9.831 -11.890 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.365 -9.950 -13.633 1.00 10.00 H new ATOM 38 N GLU A 4 1.357 -9.885 -14.512 1.00 10.00 N ATOM 39 CA GLU A 4 2.793 -10.104 -14.610 1.00 10.00 C ATOM 40 C GLU A 4 3.541 -8.801 -14.357 1.00 10.00 C ATOM 41 O GLU A 4 4.381 -8.727 -13.459 1.00 10.00 O ATOM 42 CB GLU A 4 3.169 -10.691 -15.972 1.00 10.00 C ATOM 43 CG GLU A 4 3.340 -12.216 -15.888 1.00 10.00 C ATOM 44 CD GLU A 4 4.642 -12.583 -15.187 1.00 10.00 C ATOM 45 OE1 GLU A 4 5.700 -12.368 -15.821 1.00 10.00 O ATOM 46 OE2 GLU A 4 4.601 -12.969 -13.999 1.00 10.00 O ATOM 0 H GLU A 4 0.840 -10.019 -15.381 1.00 10.00 H new ATOM 0 HA GLU A 4 3.083 -10.826 -13.847 1.00 10.00 H new ATOM 0 HB2 GLU A 4 2.397 -10.448 -16.702 1.00 10.00 H new ATOM 0 HB3 GLU A 4 4.095 -10.237 -16.324 1.00 10.00 H new ATOM 0 HG2 GLU A 4 2.498 -12.651 -15.349 1.00 10.00 H new ATOM 0 HG3 GLU A 4 3.331 -12.642 -16.891 1.00 10.00 H new ATOM 53 N LYS A 5 3.262 -7.766 -15.147 1.00 10.00 N ATOM 54 CA LYS A 5 3.854 -6.475 -14.900 1.00 10.00 C ATOM 55 C LYS A 5 3.521 -6.036 -13.486 1.00 10.00 C ATOM 56 O LYS A 5 4.433 -5.657 -12.769 1.00 10.00 O ATOM 57 CB LYS A 5 3.480 -5.433 -15.947 1.00 10.00 C ATOM 58 CG LYS A 5 4.336 -5.552 -17.215 1.00 10.00 C ATOM 59 CD LYS A 5 4.897 -4.174 -17.598 1.00 10.00 C ATOM 60 CE LYS A 5 6.076 -3.794 -16.683 1.00 10.00 C ATOM 61 NZ LYS A 5 6.380 -2.347 -16.716 1.00 10.00 N ATOM 0 H LYS A 5 2.636 -7.805 -15.951 1.00 10.00 H new ATOM 0 HA LYS A 5 4.936 -6.571 -14.991 1.00 10.00 H new ATOM 0 HB2 LYS A 5 2.428 -5.545 -16.209 1.00 10.00 H new ATOM 0 HB3 LYS A 5 3.598 -4.436 -15.523 1.00 10.00 H new ATOM 0 HG2 LYS A 5 5.153 -6.254 -17.048 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.736 -5.950 -18.033 1.00 10.00 H new ATOM 0 HD2 LYS A 5 5.225 -4.185 -18.637 1.00 10.00 H new ATOM 0 HD3 LYS A 5 4.112 -3.422 -17.520 1.00 10.00 H new ATOM 0 HE2 LYS A 5 5.846 -4.090 -15.659 1.00 10.00 H new ATOM 0 HE3 LYS A 5 6.961 -4.354 -16.986 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 7.405 -2.205 -16.608 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 6.069 -1.948 -17.625 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 5.880 -1.869 -15.939 1.00 10.00 H new ATOM 75 N GLY A 6 2.266 -6.141 -13.049 1.00 10.00 N ATOM 76 CA GLY A 6 1.885 -5.777 -11.697 1.00 10.00 C ATOM 77 C GLY A 6 2.795 -6.393 -10.630 1.00 10.00 C ATOM 78 O GLY A 6 3.217 -5.707 -9.695 1.00 10.00 O ATOM 0 H GLY A 6 1.494 -6.479 -13.623 1.00 10.00 H new ATOM 0 HA2 GLY A 6 1.905 -4.691 -11.600 1.00 10.00 H new ATOM 0 HA3 GLY A 6 0.858 -6.094 -11.517 1.00 10.00 H new ATOM 82 N LYS A 7 3.116 -7.683 -10.780 1.00 10.00 N ATOM 83 CA LYS A 7 3.979 -8.406 -9.872 1.00 10.00 C ATOM 84 C LYS A 7 5.322 -7.703 -9.874 1.00 10.00 C ATOM 85 O LYS A 7 5.811 -7.263 -8.836 1.00 10.00 O ATOM 86 CB LYS A 7 4.086 -9.881 -10.309 1.00 10.00 C ATOM 87 CG LYS A 7 5.039 -10.678 -9.404 1.00 10.00 C ATOM 88 CD LYS A 7 5.248 -12.116 -9.909 1.00 10.00 C ATOM 89 CE LYS A 7 4.474 -13.145 -9.070 1.00 10.00 C ATOM 90 NZ LYS A 7 4.897 -14.528 -9.374 1.00 10.00 N ATOM 0 H LYS A 7 2.772 -8.253 -11.553 1.00 10.00 H new ATOM 0 HA LYS A 7 3.580 -8.414 -8.858 1.00 10.00 H new ATOM 0 HB2 LYS A 7 3.097 -10.339 -10.288 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.438 -9.930 -11.340 1.00 10.00 H new ATOM 0 HG2 LYS A 7 6.001 -10.168 -9.353 1.00 10.00 H new ATOM 0 HG3 LYS A 7 4.639 -10.705 -8.391 1.00 10.00 H new ATOM 0 HD2 LYS A 7 4.929 -12.184 -10.949 1.00 10.00 H new ATOM 0 HD3 LYS A 7 6.311 -12.356 -9.886 1.00 10.00 H new ATOM 0 HE2 LYS A 7 4.630 -12.942 -8.011 1.00 10.00 H new ATOM 0 HE3 LYS A 7 3.406 -13.041 -9.261 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 4.353 -15.194 -8.789 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 4.725 -14.730 -10.380 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 5.911 -14.634 -9.168 1.00 10.00 H new ATOM 104 N LYS A 8 5.926 -7.591 -11.053 1.00 10.00 N ATOM 105 CA LYS A 8 7.268 -7.056 -11.130 1.00 10.00 C ATOM 106 C LYS A 8 7.288 -5.609 -10.636 1.00 10.00 C ATOM 107 O LYS A 8 8.209 -5.220 -9.934 1.00 10.00 O ATOM 108 CB LYS A 8 7.878 -7.225 -12.527 1.00 10.00 C ATOM 109 CG LYS A 8 8.488 -8.621 -12.750 1.00 10.00 C ATOM 110 CD LYS A 8 7.479 -9.752 -12.503 1.00 10.00 C ATOM 111 CE LYS A 8 7.681 -10.986 -13.388 1.00 10.00 C ATOM 112 NZ LYS A 8 7.291 -10.708 -14.784 1.00 10.00 N ATOM 0 H LYS A 8 5.513 -7.859 -11.946 1.00 10.00 H new ATOM 0 HA LYS A 8 7.910 -7.635 -10.466 1.00 10.00 H new ATOM 0 HB2 LYS A 8 7.108 -7.046 -13.278 1.00 10.00 H new ATOM 0 HB3 LYS A 8 8.649 -6.469 -12.675 1.00 10.00 H new ATOM 0 HG2 LYS A 8 8.864 -8.691 -13.771 1.00 10.00 H new ATOM 0 HG3 LYS A 8 9.343 -8.750 -12.086 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.541 -10.056 -11.458 1.00 10.00 H new ATOM 0 HD3 LYS A 8 6.472 -9.366 -12.664 1.00 10.00 H new ATOM 0 HE2 LYS A 8 8.726 -11.295 -13.354 1.00 10.00 H new ATOM 0 HE3 LYS A 8 7.090 -11.816 -13.000 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 6.964 -11.586 -15.235 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 6.524 -10.006 -14.797 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 8.110 -10.335 -15.306 1.00 10.00 H new ATOM 126 N ILE A 9 6.265 -4.816 -10.945 1.00 10.00 N ATOM 127 CA ILE A 9 6.130 -3.453 -10.481 1.00 10.00 C ATOM 128 C ILE A 9 6.174 -3.440 -8.959 1.00 10.00 C ATOM 129 O ILE A 9 7.027 -2.763 -8.384 1.00 10.00 O ATOM 130 CB ILE A 9 4.838 -2.842 -11.057 1.00 10.00 C ATOM 131 CG1 ILE A 9 4.982 -2.617 -12.573 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.503 -1.506 -10.391 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.642 -2.283 -13.241 1.00 10.00 C ATOM 0 H ILE A 9 5.493 -5.118 -11.539 1.00 10.00 H new ATOM 0 HA ILE A 9 6.955 -2.834 -10.832 1.00 10.00 H new ATOM 0 HB ILE A 9 4.031 -3.547 -10.858 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.687 -1.806 -12.752 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.402 -3.512 -13.033 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.586 -1.104 -10.822 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.365 -1.658 -9.321 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.319 -0.803 -10.555 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.796 -2.133 -14.310 1.00 10.00 H new ATOM 0 HD12 ILE A 9 2.944 -3.105 -13.087 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.233 -1.373 -12.802 1.00 10.00 H new ATOM 145 N PHE A 10 5.287 -4.199 -8.312 1.00 10.00 N ATOM 146 CA PHE A 10 5.308 -4.350 -6.866 1.00 10.00 C ATOM 147 C PHE A 10 6.728 -4.684 -6.386 1.00 10.00 C ATOM 148 O PHE A 10 7.264 -4.053 -5.479 1.00 10.00 O ATOM 149 CB PHE A 10 4.287 -5.416 -6.450 1.00 10.00 C ATOM 150 CG PHE A 10 4.323 -5.758 -4.977 1.00 10.00 C ATOM 151 CD1 PHE A 10 3.565 -5.009 -4.061 1.00 10.00 C ATOM 152 CD2 PHE A 10 5.144 -6.804 -4.517 1.00 10.00 C ATOM 153 CE1 PHE A 10 3.672 -5.264 -2.686 1.00 10.00 C ATOM 154 CE2 PHE A 10 5.200 -7.103 -3.147 1.00 10.00 C ATOM 155 CZ PHE A 10 4.467 -6.329 -2.234 1.00 10.00 C ATOM 0 H PHE A 10 4.543 -4.720 -8.776 1.00 10.00 H new ATOM 0 HA PHE A 10 5.024 -3.412 -6.390 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.287 -5.067 -6.708 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.467 -6.323 -7.028 1.00 10.00 H new ATOM 0 HD1 PHE A 10 2.899 -4.236 -4.416 1.00 10.00 H new ATOM 0 HD2 PHE A 10 5.732 -7.377 -5.219 1.00 10.00 H new ATOM 0 HE1 PHE A 10 3.144 -4.643 -1.977 1.00 10.00 H new ATOM 0 HE2 PHE A 10 5.805 -7.926 -2.796 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.515 -6.554 -1.179 1.00 10.00 H new ATOM 165 N VAL A 11 7.378 -5.650 -7.032 1.00 10.00 N ATOM 166 CA VAL A 11 8.708 -6.087 -6.637 1.00 10.00 C ATOM 167 C VAL A 11 9.774 -5.010 -6.895 1.00 10.00 C ATOM 168 O VAL A 11 10.809 -4.974 -6.237 1.00 10.00 O ATOM 169 CB VAL A 11 9.037 -7.427 -7.316 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.445 -7.945 -6.994 1.00 10.00 C ATOM 171 CG2 VAL A 11 8.037 -8.487 -6.847 1.00 10.00 C ATOM 0 H VAL A 11 6.998 -6.146 -7.838 1.00 10.00 H new ATOM 0 HA VAL A 11 8.716 -6.246 -5.559 1.00 10.00 H new ATOM 0 HB VAL A 11 8.980 -7.249 -8.390 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.610 -8.893 -7.506 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.185 -7.219 -7.329 1.00 10.00 H new ATOM 0 HG13 VAL A 11 10.542 -8.092 -5.918 1.00 10.00 H new ATOM 0 HG21 VAL A 11 8.265 -9.439 -7.325 1.00 10.00 H new ATOM 0 HG22 VAL A 11 8.106 -8.599 -5.765 1.00 10.00 H new ATOM 0 HG23 VAL A 11 7.027 -8.179 -7.116 1.00 10.00 H new ATOM 181 N GLN A 12 9.551 -4.140 -7.875 1.00 10.00 N ATOM 182 CA GLN A 12 10.502 -3.124 -8.297 1.00 10.00 C ATOM 183 C GLN A 12 10.266 -1.799 -7.572 1.00 10.00 C ATOM 184 O GLN A 12 11.085 -0.893 -7.705 1.00 10.00 O ATOM 185 CB GLN A 12 10.392 -2.957 -9.816 1.00 10.00 C ATOM 186 CG GLN A 12 10.870 -4.226 -10.542 1.00 10.00 C ATOM 187 CD GLN A 12 12.375 -4.238 -10.764 1.00 10.00 C ATOM 188 OE1 GLN A 12 12.862 -3.689 -11.746 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.121 -4.871 -9.863 1.00 10.00 N ATOM 0 H GLN A 12 8.682 -4.124 -8.409 1.00 10.00 H new ATOM 0 HA GLN A 12 11.512 -3.442 -8.037 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.358 -2.744 -10.089 1.00 10.00 H new ATOM 0 HB3 GLN A 12 10.989 -2.103 -10.136 1.00 10.00 H new ATOM 0 HG2 GLN A 12 10.585 -5.103 -9.960 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.363 -4.303 -11.504 1.00 10.00 H new ATOM 0 HE21 GLN A 12 12.680 -5.316 -9.058 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.134 -4.911 -9.977 1.00 10.00 H new ATOM 198 N LYS A 13 9.131 -1.649 -6.877 1.00 10.00 N ATOM 199 CA LYS A 13 8.785 -0.423 -6.162 1.00 10.00 C ATOM 200 C LYS A 13 8.732 -0.654 -4.650 1.00 10.00 C ATOM 201 O LYS A 13 9.175 0.202 -3.887 1.00 10.00 O ATOM 202 CB LYS A 13 7.458 0.160 -6.665 1.00 10.00 C ATOM 203 CG LYS A 13 7.618 1.057 -7.901 1.00 10.00 C ATOM 204 CD LYS A 13 7.774 0.218 -9.171 1.00 10.00 C ATOM 205 CE LYS A 13 8.123 1.066 -10.395 1.00 10.00 C ATOM 206 NZ LYS A 13 8.441 0.211 -11.554 1.00 10.00 N ATOM 0 H LYS A 13 8.426 -2.382 -6.797 1.00 10.00 H new ATOM 0 HA LYS A 13 9.573 0.302 -6.365 1.00 10.00 H new ATOM 0 HB2 LYS A 13 6.777 -0.657 -6.904 1.00 10.00 H new ATOM 0 HB3 LYS A 13 6.996 0.736 -5.864 1.00 10.00 H new ATOM 0 HG2 LYS A 13 6.750 1.709 -7.996 1.00 10.00 H new ATOM 0 HG3 LYS A 13 8.489 1.701 -7.777 1.00 10.00 H new ATOM 0 HD2 LYS A 13 8.553 -0.528 -9.016 1.00 10.00 H new ATOM 0 HD3 LYS A 13 6.847 -0.324 -9.361 1.00 10.00 H new ATOM 0 HE2 LYS A 13 7.286 1.721 -10.639 1.00 10.00 H new ATOM 0 HE3 LYS A 13 8.974 1.708 -10.167 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 9.286 0.579 -12.036 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 8.623 -0.760 -11.229 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 7.638 0.210 -12.215 1.00 10.00 H new ATOM 220 N CYS A 14 8.145 -1.773 -4.218 1.00 10.00 N ATOM 221 CA CYS A 14 7.950 -2.108 -2.816 1.00 10.00 C ATOM 222 C CYS A 14 8.967 -3.190 -2.423 1.00 10.00 C ATOM 223 O CYS A 14 10.006 -2.858 -1.860 1.00 10.00 O ATOM 224 CB CYS A 14 6.497 -2.461 -2.516 1.00 10.00 C ATOM 225 SG CYS A 14 5.311 -2.243 -3.897 1.00 10.00 S ATOM 0 H CYS A 14 7.785 -2.485 -4.854 1.00 10.00 H new ATOM 0 HA CYS A 14 8.143 -1.239 -2.187 1.00 10.00 H new ATOM 0 HB2 CYS A 14 6.457 -3.500 -2.190 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.162 -1.851 -1.677 1.00 10.00 H new ATOM 230 N ALA A 15 8.691 -4.464 -2.732 1.00 10.00 N ATOM 231 CA ALA A 15 9.489 -5.644 -2.376 1.00 10.00 C ATOM 232 C ALA A 15 10.110 -5.624 -0.979 1.00 10.00 C ATOM 233 O ALA A 15 9.576 -6.207 -0.040 1.00 10.00 O ATOM 234 CB ALA A 15 10.585 -5.889 -3.418 1.00 10.00 C ATOM 0 H ALA A 15 7.859 -4.712 -3.267 1.00 10.00 H new ATOM 0 HA ALA A 15 8.769 -6.462 -2.365 1.00 10.00 H new ATOM 0 HB1 ALA A 15 11.165 -6.768 -3.136 1.00 10.00 H new ATOM 0 HB2 ALA A 15 10.129 -6.053 -4.394 1.00 10.00 H new ATOM 0 HB3 ALA A 15 11.242 -5.021 -3.466 1.00 10.00 H new ATOM 240 N GLN A 16 11.265 -4.979 -0.819 1.00 10.00 N ATOM 241 CA GLN A 16 11.966 -4.866 0.451 1.00 10.00 C ATOM 242 C GLN A 16 11.279 -3.794 1.307 1.00 10.00 C ATOM 243 O GLN A 16 11.922 -2.910 1.866 1.00 10.00 O ATOM 244 CB GLN A 16 13.459 -4.606 0.168 1.00 10.00 C ATOM 245 CG GLN A 16 14.317 -5.845 0.457 1.00 10.00 C ATOM 246 CD GLN A 16 14.650 -6.024 1.941 1.00 10.00 C ATOM 247 OE1 GLN A 16 13.959 -5.538 2.831 1.00 10.00 O ATOM 248 NE2 GLN A 16 15.727 -6.747 2.237 1.00 10.00 N ATOM 0 H GLN A 16 11.746 -4.512 -1.588 1.00 10.00 H new ATOM 0 HA GLN A 16 11.921 -5.787 1.032 1.00 10.00 H new ATOM 0 HB2 GLN A 16 13.586 -4.311 -0.874 1.00 10.00 H new ATOM 0 HB3 GLN A 16 13.805 -3.773 0.780 1.00 10.00 H new ATOM 0 HG2 GLN A 16 13.792 -6.732 0.101 1.00 10.00 H new ATOM 0 HG3 GLN A 16 15.245 -5.775 -0.110 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.294 -7.146 1.489 1.00 10.00 H new ATOM 0 HE22 GLN A 16 15.985 -6.902 3.212 1.00 10.00 H new ATOM 257 N CYS A 17 9.952 -3.900 1.425 1.00 10.00 N ATOM 258 CA CYS A 17 9.138 -3.077 2.296 1.00 10.00 C ATOM 259 C CYS A 17 7.758 -3.700 2.494 1.00 10.00 C ATOM 260 O CYS A 17 7.259 -3.652 3.611 1.00 10.00 O ATOM 261 CB CYS A 17 9.042 -1.640 1.834 1.00 10.00 C ATOM 262 SG CYS A 17 8.745 -0.645 3.327 1.00 10.00 S ATOM 0 H CYS A 17 9.408 -4.583 0.898 1.00 10.00 H new ATOM 0 HA CYS A 17 9.642 -3.045 3.262 1.00 10.00 H new ATOM 0 HB2 CYS A 17 9.960 -1.329 1.336 1.00 10.00 H new ATOM 0 HB3 CYS A 17 8.232 -1.515 1.116 1.00 10.00 H new ATOM 267 N HIS A 18 7.141 -4.291 1.457 1.00 10.00 N ATOM 268 CA HIS A 18 5.890 -5.019 1.593 1.00 10.00 C ATOM 269 C HIS A 18 6.044 -6.380 0.957 1.00 10.00 C ATOM 270 O HIS A 18 6.839 -6.552 0.040 1.00 10.00 O ATOM 271 CB HIS A 18 4.772 -4.321 0.838 1.00 10.00 C ATOM 272 CG HIS A 18 4.204 -3.135 1.546 1.00 10.00 C ATOM 273 ND1 HIS A 18 3.181 -3.131 2.470 1.00 10.00 N ATOM 274 CD2 HIS A 18 4.367 -1.865 1.095 1.00 10.00 C ATOM 275 CE1 HIS A 18 2.717 -1.866 2.528 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.423 -1.056 1.711 1.00 10.00 N ATOM 0 H HIS A 18 7.504 -4.271 0.504 1.00 10.00 H new ATOM 0 HA HIS A 18 5.652 -5.081 2.655 1.00 10.00 H new ATOM 0 HB2 HIS A 18 5.148 -4.004 -0.135 1.00 10.00 H new ATOM 0 HB3 HIS A 18 3.972 -5.037 0.652 1.00 10.00 H new ATOM 0 HD1 HIS A 18 2.841 -3.930 3.006 1.00 10.00 H new ATOM 0 HD2 HIS A 18 5.106 -1.539 0.378 1.00 10.00 H new ATOM 0 HE1 HIS A 18 1.891 -1.544 3.145 1.00 10.00 H new ATOM 284 N THR A 19 5.211 -7.314 1.406 1.00 10.00 N ATOM 285 CA THR A 19 5.246 -8.689 0.952 1.00 10.00 C ATOM 286 C THR A 19 3.945 -9.089 0.261 1.00 10.00 C ATOM 287 O THR A 19 3.996 -9.727 -0.780 1.00 10.00 O ATOM 288 CB THR A 19 5.558 -9.567 2.154 1.00 10.00 C ATOM 289 OG1 THR A 19 6.718 -9.094 2.815 1.00 10.00 O ATOM 290 CG2 THR A 19 5.797 -10.992 1.683 1.00 10.00 C ATOM 0 H THR A 19 4.488 -7.130 2.102 1.00 10.00 H new ATOM 0 HA THR A 19 6.023 -8.816 0.198 1.00 10.00 H new ATOM 0 HB THR A 19 4.716 -9.538 2.846 1.00 10.00 H new ATOM 0 HG1 THR A 19 7.402 -9.796 2.818 1.00 10.00 H new ATOM 0 HG21 THR A 19 6.021 -11.626 2.541 1.00 10.00 H new ATOM 0 HG22 THR A 19 4.904 -11.364 1.181 1.00 10.00 H new ATOM 0 HG23 THR A 19 6.638 -11.010 0.989 1.00 10.00 H new ATOM 298 N VAL A 20 2.808 -8.718 0.858 1.00 10.00 N ATOM 299 CA VAL A 20 1.442 -8.954 0.395 1.00 10.00 C ATOM 300 C VAL A 20 1.017 -10.427 0.464 1.00 10.00 C ATOM 301 O VAL A 20 -0.068 -10.762 -0.005 1.00 10.00 O ATOM 302 CB VAL A 20 1.103 -8.278 -0.960 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.242 -6.754 -0.913 1.00 10.00 C ATOM 304 CG2 VAL A 20 1.747 -8.819 -2.243 1.00 10.00 C ATOM 0 H VAL A 20 2.822 -8.208 1.741 1.00 10.00 H new ATOM 0 HA VAL A 20 0.817 -8.438 1.123 1.00 10.00 H new ATOM 0 HB VAL A 20 0.059 -8.575 -1.057 1.00 10.00 H new ATOM 0 HG11 VAL A 20 0.992 -6.336 -1.888 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.565 -6.350 -0.161 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.268 -6.490 -0.657 1.00 10.00 H new ATOM 0 HG21 VAL A 20 1.404 -8.235 -3.097 1.00 10.00 H new ATOM 0 HG22 VAL A 20 2.832 -8.745 -2.165 1.00 10.00 H new ATOM 0 HG23 VAL A 20 1.464 -9.863 -2.380 1.00 10.00 H new ATOM 314 N GLU A 21 1.830 -11.288 1.086 1.00 10.00 N ATOM 315 CA GLU A 21 1.677 -12.736 1.054 1.00 10.00 C ATOM 316 C GLU A 21 1.845 -13.255 2.478 1.00 10.00 C ATOM 317 O GLU A 21 2.641 -12.705 3.240 1.00 10.00 O ATOM 318 CB GLU A 21 2.756 -13.381 0.166 1.00 10.00 C ATOM 319 CG GLU A 21 2.942 -12.745 -1.221 1.00 10.00 C ATOM 320 CD GLU A 21 2.312 -13.527 -2.369 1.00 10.00 C ATOM 321 OE1 GLU A 21 2.691 -14.709 -2.516 1.00 10.00 O ATOM 322 OE2 GLU A 21 1.525 -12.914 -3.123 1.00 10.00 O ATOM 0 H GLU A 21 2.632 -10.983 1.638 1.00 10.00 H new ATOM 0 HA GLU A 21 0.697 -12.987 0.649 1.00 10.00 H new ATOM 0 HB2 GLU A 21 3.708 -13.341 0.695 1.00 10.00 H new ATOM 0 HB3 GLU A 21 2.510 -14.434 0.033 1.00 10.00 H new ATOM 0 HG2 GLU A 21 2.516 -11.742 -1.206 1.00 10.00 H new ATOM 0 HG3 GLU A 21 4.009 -12.636 -1.416 1.00 10.00 H new ATOM 329 N LYS A 22 1.123 -14.314 2.848 1.00 10.00 N ATOM 330 CA LYS A 22 1.231 -14.900 4.176 1.00 10.00 C ATOM 331 C LYS A 22 2.675 -15.343 4.444 1.00 10.00 C ATOM 332 O LYS A 22 3.128 -16.365 3.937 1.00 10.00 O ATOM 333 CB LYS A 22 0.182 -16.003 4.356 1.00 10.00 C ATOM 334 CG LYS A 22 0.370 -17.269 3.507 1.00 10.00 C ATOM 335 CD LYS A 22 0.988 -18.443 4.288 1.00 10.00 C ATOM 336 CE LYS A 22 0.350 -19.764 3.838 1.00 10.00 C ATOM 337 NZ LYS A 22 0.529 -20.003 2.388 1.00 10.00 N ATOM 0 H LYS A 22 0.454 -14.783 2.238 1.00 10.00 H new ATOM 0 HA LYS A 22 1.006 -14.155 4.939 1.00 10.00 H new ATOM 0 HB2 LYS A 22 0.170 -16.295 5.406 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -0.798 -15.583 4.130 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -0.597 -17.577 3.108 1.00 10.00 H new ATOM 0 HG3 LYS A 22 1.007 -17.034 2.654 1.00 10.00 H new ATOM 0 HD2 LYS A 22 2.065 -18.474 4.122 1.00 10.00 H new ATOM 0 HD3 LYS A 22 0.834 -18.301 5.358 1.00 10.00 H new ATOM 0 HE2 LYS A 22 0.791 -20.589 4.398 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -0.714 -19.751 4.074 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 0.253 -20.979 2.160 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -0.066 -19.341 1.851 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 1.527 -19.857 2.133 1.00 10.00 H new ATOM 351 N GLY A 23 3.423 -14.536 5.197 1.00 10.00 N ATOM 352 CA GLY A 23 4.858 -14.714 5.357 1.00 10.00 C ATOM 353 C GLY A 23 5.580 -13.382 5.494 1.00 10.00 C ATOM 354 O GLY A 23 6.639 -13.338 6.120 1.00 10.00 O ATOM 0 H GLY A 23 3.046 -13.740 5.712 1.00 10.00 H new ATOM 0 HA2 GLY A 23 5.053 -15.325 6.238 1.00 10.00 H new ATOM 0 HA3 GLY A 23 5.255 -15.256 4.499 1.00 10.00 H new ATOM 358 N GLY A 24 5.030 -12.302 4.922 1.00 10.00 N ATOM 359 CA GLY A 24 5.594 -10.975 5.121 1.00 10.00 C ATOM 360 C GLY A 24 5.967 -10.704 6.575 1.00 10.00 C ATOM 361 O GLY A 24 5.126 -10.783 7.468 1.00 10.00 O ATOM 0 H GLY A 24 4.203 -12.328 4.325 1.00 10.00 H new ATOM 0 HA2 GLY A 24 6.480 -10.864 4.496 1.00 10.00 H new ATOM 0 HA3 GLY A 24 4.875 -10.226 4.789 1.00 10.00 H new ATOM 365 N LYS A 25 7.249 -10.408 6.795 1.00 10.00 N ATOM 366 CA LYS A 25 7.773 -10.089 8.107 1.00 10.00 C ATOM 367 C LYS A 25 7.457 -8.626 8.417 1.00 10.00 C ATOM 368 O LYS A 25 6.813 -7.940 7.624 1.00 10.00 O ATOM 369 CB LYS A 25 9.282 -10.370 8.148 1.00 10.00 C ATOM 370 CG LYS A 25 9.641 -11.710 7.483 1.00 10.00 C ATOM 371 CD LYS A 25 11.092 -12.099 7.806 1.00 10.00 C ATOM 372 CE LYS A 25 11.164 -12.893 9.120 1.00 10.00 C ATOM 373 NZ LYS A 25 12.551 -13.059 9.606 1.00 10.00 N ATOM 0 H LYS A 25 7.952 -10.385 6.056 1.00 10.00 H new ATOM 0 HA LYS A 25 7.306 -10.713 8.869 1.00 10.00 H new ATOM 0 HB2 LYS A 25 9.814 -9.563 7.645 1.00 10.00 H new ATOM 0 HB3 LYS A 25 9.620 -10.378 9.184 1.00 10.00 H new ATOM 0 HG2 LYS A 25 8.963 -12.489 7.832 1.00 10.00 H new ATOM 0 HG3 LYS A 25 9.510 -11.634 6.404 1.00 10.00 H new ATOM 0 HD2 LYS A 25 11.503 -12.696 6.992 1.00 10.00 H new ATOM 0 HD3 LYS A 25 11.705 -11.201 7.884 1.00 10.00 H new ATOM 0 HE2 LYS A 25 10.574 -12.383 9.882 1.00 10.00 H new ATOM 0 HE3 LYS A 25 10.714 -13.875 8.973 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 12.545 -13.601 10.494 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 13.110 -13.569 8.893 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 12.974 -12.124 9.774 1.00 10.00 H new ATOM 387 N HIS A 26 7.935 -8.142 9.563 1.00 10.00 N ATOM 388 CA HIS A 26 7.586 -6.827 10.067 1.00 10.00 C ATOM 389 C HIS A 26 8.820 -5.932 9.987 1.00 10.00 C ATOM 390 O HIS A 26 9.553 -5.794 10.963 1.00 10.00 O ATOM 391 CB HIS A 26 7.089 -6.976 11.517 1.00 10.00 C ATOM 392 CG HIS A 26 6.085 -8.086 11.699 1.00 10.00 C ATOM 393 ND1 HIS A 26 6.380 -9.379 12.072 1.00 10.00 N ATOM 394 CD2 HIS A 26 4.751 -8.034 11.403 1.00 10.00 C ATOM 395 CE1 HIS A 26 5.242 -10.089 12.000 1.00 10.00 C ATOM 396 NE2 HIS A 26 4.226 -9.316 11.589 1.00 10.00 N ATOM 0 H HIS A 26 8.577 -8.658 10.165 1.00 10.00 H new ATOM 0 HA HIS A 26 6.792 -6.371 9.475 1.00 10.00 H new ATOM 0 HB2 HIS A 26 7.944 -7.160 12.168 1.00 10.00 H new ATOM 0 HB3 HIS A 26 6.641 -6.036 11.837 1.00 10.00 H new ATOM 0 HD2 HIS A 26 4.202 -7.160 11.083 1.00 10.00 H new ATOM 0 HE1 HIS A 26 5.157 -11.139 12.240 1.00 10.00 H new ATOM 0 HE2 HIS A 26 3.260 -9.607 11.441 1.00 10.00 H new ATOM 404 N LYS A 27 9.082 -5.371 8.804 1.00 10.00 N ATOM 405 CA LYS A 27 10.232 -4.506 8.577 1.00 10.00 C ATOM 406 C LYS A 27 9.817 -3.035 8.630 1.00 10.00 C ATOM 407 O LYS A 27 10.169 -2.318 9.564 1.00 10.00 O ATOM 408 CB LYS A 27 10.924 -4.897 7.267 1.00 10.00 C ATOM 409 CG LYS A 27 11.981 -5.967 7.573 1.00 10.00 C ATOM 410 CD LYS A 27 12.237 -6.857 6.356 1.00 10.00 C ATOM 411 CE LYS A 27 13.416 -7.798 6.642 1.00 10.00 C ATOM 412 NZ LYS A 27 13.999 -8.331 5.394 1.00 10.00 N ATOM 0 H LYS A 27 8.499 -5.507 7.978 1.00 10.00 H new ATOM 0 HA LYS A 27 10.963 -4.641 9.374 1.00 10.00 H new ATOM 0 HB2 LYS A 27 10.194 -5.279 6.553 1.00 10.00 H new ATOM 0 HB3 LYS A 27 11.390 -4.024 6.810 1.00 10.00 H new ATOM 0 HG2 LYS A 27 12.911 -5.487 7.877 1.00 10.00 H new ATOM 0 HG3 LYS A 27 11.650 -6.580 8.411 1.00 10.00 H new ATOM 0 HD2 LYS A 27 11.344 -7.437 6.124 1.00 10.00 H new ATOM 0 HD3 LYS A 27 12.454 -6.242 5.483 1.00 10.00 H new ATOM 0 HE2 LYS A 27 14.182 -7.263 7.203 1.00 10.00 H new ATOM 0 HE3 LYS A 27 13.080 -8.624 7.269 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 14.793 -8.963 5.624 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 13.274 -8.862 4.871 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 14.342 -7.544 4.807 1.00 10.00 H new ATOM 426 N THR A 28 9.068 -2.589 7.621 1.00 10.00 N ATOM 427 CA THR A 28 8.620 -1.209 7.504 1.00 10.00 C ATOM 428 C THR A 28 7.178 -1.188 7.000 1.00 10.00 C ATOM 429 O THR A 28 6.300 -0.706 7.710 1.00 10.00 O ATOM 430 CB THR A 28 9.616 -0.406 6.659 1.00 10.00 C ATOM 431 OG1 THR A 28 10.874 -0.371 7.302 1.00 10.00 O ATOM 432 CG2 THR A 28 9.139 1.032 6.435 1.00 10.00 C ATOM 0 H THR A 28 8.754 -3.186 6.856 1.00 10.00 H new ATOM 0 HA THR A 28 8.604 -0.712 8.474 1.00 10.00 H new ATOM 0 HB THR A 28 9.696 -0.901 5.691 1.00 10.00 H new ATOM 0 HG1 THR A 28 11.506 0.142 6.756 1.00 10.00 H new ATOM 0 HG21 THR A 28 9.872 1.569 5.832 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.180 1.021 5.916 1.00 10.00 H new ATOM 0 HG23 THR A 28 9.025 1.532 7.397 1.00 10.00 H new ATOM 440 N GLY A 29 6.903 -1.715 5.805 1.00 10.00 N ATOM 441 CA GLY A 29 5.535 -1.874 5.348 1.00 10.00 C ATOM 442 C GLY A 29 4.994 -3.189 5.907 1.00 10.00 C ATOM 443 O GLY A 29 5.703 -4.196 5.894 1.00 10.00 O ATOM 0 H GLY A 29 7.611 -2.035 5.144 1.00 10.00 H new ATOM 0 HA2 GLY A 29 4.922 -1.038 5.684 1.00 10.00 H new ATOM 0 HA3 GLY A 29 5.496 -1.880 4.259 1.00 10.00 H new ATOM 447 N PRO A 30 3.765 -3.220 6.437 1.00 10.00 N ATOM 448 CA PRO A 30 3.211 -4.460 6.929 1.00 10.00 C ATOM 449 C PRO A 30 2.840 -5.401 5.789 1.00 10.00 C ATOM 450 O PRO A 30 2.650 -5.001 4.632 1.00 10.00 O ATOM 451 CB PRO A 30 2.012 -4.080 7.801 1.00 10.00 C ATOM 452 CG PRO A 30 1.627 -2.673 7.339 1.00 10.00 C ATOM 453 CD PRO A 30 2.913 -2.087 6.749 1.00 10.00 C ATOM 0 HA PRO A 30 3.941 -5.015 7.518 1.00 10.00 H new ATOM 0 HB2 PRO A 30 1.187 -4.780 7.668 1.00 10.00 H new ATOM 0 HB3 PRO A 30 2.272 -4.092 8.859 1.00 10.00 H new ATOM 0 HG2 PRO A 30 0.830 -2.705 6.596 1.00 10.00 H new ATOM 0 HG3 PRO A 30 1.263 -2.070 8.171 1.00 10.00 H new ATOM 0 HD2 PRO A 30 2.700 -1.501 5.855 1.00 10.00 H new ATOM 0 HD3 PRO A 30 3.399 -1.418 7.460 1.00 10.00 H new ATOM 461 N ASN A 31 2.741 -6.681 6.154 1.00 10.00 N ATOM 462 CA ASN A 31 2.299 -7.730 5.266 1.00 10.00 C ATOM 463 C ASN A 31 0.829 -7.522 4.944 1.00 10.00 C ATOM 464 O ASN A 31 -0.038 -7.912 5.720 1.00 10.00 O ATOM 465 CB ASN A 31 2.476 -9.098 5.914 1.00 10.00 C ATOM 466 CG ASN A 31 2.055 -10.157 4.903 1.00 10.00 C ATOM 467 OD1 ASN A 31 2.269 -9.979 3.704 1.00 10.00 O ATOM 468 ND2 ASN A 31 1.439 -11.241 5.359 1.00 10.00 N ATOM 0 H ASN A 31 2.972 -7.011 7.091 1.00 10.00 H new ATOM 0 HA ASN A 31 2.898 -7.693 4.356 1.00 10.00 H new ATOM 0 HB2 ASN A 31 3.514 -9.247 6.212 1.00 10.00 H new ATOM 0 HB3 ASN A 31 1.871 -9.172 6.818 1.00 10.00 H new ATOM 0 HD21 ASN A 31 1.126 -11.961 4.708 1.00 10.00 H new ATOM 0 HD22 ASN A 31 1.279 -11.354 6.360 1.00 10.00 H new ATOM 475 N LEU A 32 0.566 -6.868 3.818 1.00 10.00 N ATOM 476 CA LEU A 32 -0.742 -6.304 3.560 1.00 10.00 C ATOM 477 C LEU A 32 -1.865 -7.351 3.592 1.00 10.00 C ATOM 478 O LEU A 32 -2.857 -7.163 4.288 1.00 10.00 O ATOM 479 CB LEU A 32 -0.708 -5.537 2.237 1.00 10.00 C ATOM 480 CG LEU A 32 -0.682 -4.016 2.383 1.00 10.00 C ATOM 481 CD1 LEU A 32 -0.668 -3.446 0.961 1.00 10.00 C ATOM 482 CD2 LEU A 32 -1.855 -3.486 3.204 1.00 10.00 C ATOM 0 H LEU A 32 1.246 -6.718 3.072 1.00 10.00 H new ATOM 0 HA LEU A 32 -0.978 -5.612 4.368 1.00 10.00 H new ATOM 0 HB2 LEU A 32 0.171 -5.850 1.674 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -1.581 -5.817 1.647 1.00 10.00 H new ATOM 0 HG LEU A 32 0.203 -3.701 2.937 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -0.649 -2.357 1.006 1.00 10.00 H new ATOM 0 HD12 LEU A 32 0.217 -3.803 0.435 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -1.562 -3.772 0.430 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -1.787 -2.401 3.276 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -2.792 -3.760 2.719 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -1.824 -3.919 4.204 1.00 10.00 H new ATOM 494 N HIS A 33 -1.679 -8.424 2.810 1.00 10.00 N ATOM 495 CA HIS A 33 -2.409 -9.691 2.814 1.00 10.00 C ATOM 496 C HIS A 33 -3.837 -9.614 3.389 1.00 10.00 C ATOM 497 O HIS A 33 -4.042 -9.756 4.593 1.00 10.00 O ATOM 498 CB HIS A 33 -1.533 -10.730 3.523 1.00 10.00 C ATOM 499 CG HIS A 33 -2.049 -12.136 3.395 1.00 10.00 C ATOM 500 ND1 HIS A 33 -2.119 -12.891 2.243 1.00 10.00 N ATOM 501 CD2 HIS A 33 -2.528 -12.896 4.424 1.00 10.00 C ATOM 502 CE1 HIS A 33 -2.655 -14.079 2.581 1.00 10.00 C ATOM 503 NE2 HIS A 33 -2.920 -14.128 3.898 1.00 10.00 N ATOM 0 H HIS A 33 -0.949 -8.423 2.098 1.00 10.00 H new ATOM 0 HA HIS A 33 -2.588 -9.987 1.780 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -0.524 -10.683 3.114 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -1.461 -10.473 4.580 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -2.592 -12.597 5.460 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -2.846 -14.884 1.887 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -3.327 -14.910 4.411 1.00 10.00 H new ATOM 511 N GLY A 34 -4.823 -9.412 2.507 1.00 10.00 N ATOM 512 CA GLY A 34 -6.224 -9.185 2.857 1.00 10.00 C ATOM 513 C GLY A 34 -6.651 -7.733 2.625 1.00 10.00 C ATOM 514 O GLY A 34 -7.656 -7.287 3.173 1.00 10.00 O ATOM 0 H GLY A 34 -4.660 -9.402 1.500 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.856 -9.847 2.265 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.382 -9.445 3.904 1.00 10.00 H new ATOM 518 N LEU A 35 -5.898 -7.002 1.794 1.00 10.00 N ATOM 519 CA LEU A 35 -6.121 -5.595 1.493 1.00 10.00 C ATOM 520 C LEU A 35 -7.558 -5.359 1.018 1.00 10.00 C ATOM 521 O LEU A 35 -8.297 -4.567 1.603 1.00 10.00 O ATOM 522 CB LEU A 35 -5.074 -5.178 0.442 1.00 10.00 C ATOM 523 CG LEU A 35 -5.007 -3.703 0.002 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.587 -2.760 1.124 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.994 -3.626 -1.137 1.00 10.00 C ATOM 0 H LEU A 35 -5.094 -7.391 1.301 1.00 10.00 H new ATOM 0 HA LEU A 35 -6.001 -4.980 2.385 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.092 -5.451 0.828 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -5.245 -5.781 -0.450 1.00 10.00 H new ATOM 0 HG LEU A 35 -6.003 -3.382 -0.304 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.559 -1.737 0.748 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.303 -2.827 1.943 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -3.597 -3.041 1.484 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -3.913 -2.595 -1.483 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -3.021 -3.968 -0.783 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.323 -4.260 -1.960 1.00 10.00 H new ATOM 537 N PHE A 36 -7.965 -6.085 -0.029 1.00 10.00 N ATOM 538 CA PHE A 36 -9.295 -6.000 -0.624 1.00 10.00 C ATOM 539 C PHE A 36 -10.324 -6.701 0.269 1.00 10.00 C ATOM 540 O PHE A 36 -10.925 -7.692 -0.140 1.00 10.00 O ATOM 541 CB PHE A 36 -9.303 -6.592 -2.043 1.00 10.00 C ATOM 542 CG PHE A 36 -8.320 -5.950 -3.004 1.00 10.00 C ATOM 543 CD1 PHE A 36 -6.979 -6.351 -2.968 1.00 10.00 C ATOM 544 CD2 PHE A 36 -8.723 -4.964 -3.922 1.00 10.00 C ATOM 545 CE1 PHE A 36 -6.023 -5.729 -3.782 1.00 10.00 C ATOM 546 CE2 PHE A 36 -7.769 -4.338 -4.746 1.00 10.00 C ATOM 547 CZ PHE A 36 -6.414 -4.712 -4.669 1.00 10.00 C ATOM 0 H PHE A 36 -7.361 -6.763 -0.494 1.00 10.00 H new ATOM 0 HA PHE A 36 -9.569 -4.948 -0.703 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -9.084 -7.658 -1.978 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -10.308 -6.498 -2.456 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -6.678 -7.149 -2.305 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -9.764 -4.687 -3.995 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -4.987 -6.031 -3.728 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -8.077 -3.569 -5.439 1.00 10.00 H new ATOM 0 HZ PHE A 36 -5.679 -4.220 -5.288 1.00 10.00 H new ATOM 557 N GLY A 37 -10.531 -6.186 1.481 1.00 10.00 N ATOM 558 CA GLY A 37 -11.501 -6.717 2.429 1.00 10.00 C ATOM 559 C GLY A 37 -11.128 -6.367 3.868 1.00 10.00 C ATOM 560 O GLY A 37 -11.214 -7.212 4.758 1.00 10.00 O ATOM 0 H GLY A 37 -10.020 -5.376 1.834 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -12.490 -6.318 2.201 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.561 -7.800 2.321 1.00 10.00 H new ATOM 564 N ARG A 38 -10.739 -5.112 4.107 1.00 10.00 N ATOM 565 CA ARG A 38 -10.379 -4.604 5.421 1.00 10.00 C ATOM 566 C ARG A 38 -10.555 -3.088 5.410 1.00 10.00 C ATOM 567 O ARG A 38 -10.912 -2.511 4.381 1.00 10.00 O ATOM 568 CB ARG A 38 -8.929 -4.997 5.778 1.00 10.00 C ATOM 569 CG ARG A 38 -8.817 -5.679 7.153 1.00 10.00 C ATOM 570 CD ARG A 38 -8.868 -7.216 7.056 1.00 10.00 C ATOM 571 NE ARG A 38 -9.894 -7.818 7.925 1.00 10.00 N ATOM 572 CZ ARG A 38 -9.857 -7.851 9.268 1.00 10.00 C ATOM 573 NH1 ARG A 38 -8.876 -7.216 9.919 1.00 10.00 N ATOM 574 NH2 ARG A 38 -10.800 -8.510 9.952 1.00 10.00 N ATOM 0 H ARG A 38 -10.666 -4.409 3.371 1.00 10.00 H new ATOM 0 HA ARG A 38 -11.025 -5.041 6.183 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -8.540 -5.668 5.012 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -8.303 -4.105 5.768 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -7.883 -5.379 7.629 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -9.627 -5.332 7.794 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -9.063 -7.502 6.022 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -7.892 -7.623 7.321 1.00 10.00 H new ATOM 0 HE ARG A 38 -10.700 -8.246 7.469 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -8.161 -6.710 9.396 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -8.843 -7.238 10.938 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -11.550 -8.989 9.454 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -10.769 -8.533 10.971 1.00 10.00 H new ATOM 588 N LYS A 39 -10.309 -2.464 6.565 1.00 10.00 N ATOM 589 CA LYS A 39 -10.249 -1.022 6.730 1.00 10.00 C ATOM 590 C LYS A 39 -8.789 -0.596 6.933 1.00 10.00 C ATOM 591 O LYS A 39 -7.905 -1.444 7.033 1.00 10.00 O ATOM 592 CB LYS A 39 -11.119 -0.599 7.929 1.00 10.00 C ATOM 593 CG LYS A 39 -12.571 -0.269 7.578 1.00 10.00 C ATOM 594 CD LYS A 39 -13.398 -1.536 7.328 1.00 10.00 C ATOM 595 CE LYS A 39 -14.894 -1.192 7.294 1.00 10.00 C ATOM 596 NZ LYS A 39 -15.578 -1.466 8.578 1.00 10.00 N ATOM 0 H LYS A 39 -10.142 -2.971 7.434 1.00 10.00 H new ATOM 0 HA LYS A 39 -10.636 -0.529 5.838 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -11.111 -1.401 8.668 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -10.666 0.273 8.400 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -13.020 0.304 8.389 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -12.596 0.363 6.690 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -13.101 -1.993 6.384 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -13.203 -2.268 8.112 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -15.014 -0.138 7.042 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -15.376 -1.766 6.502 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -16.584 -1.215 8.496 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -15.491 -2.476 8.809 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -15.140 -0.899 9.332 1.00 10.00 H new ATOM 610 N THR A 40 -8.546 0.714 7.011 1.00 10.00 N ATOM 611 CA THR A 40 -7.257 1.310 7.310 1.00 10.00 C ATOM 612 C THR A 40 -6.904 1.232 8.793 1.00 10.00 C ATOM 613 O THR A 40 -7.735 0.864 9.621 1.00 10.00 O ATOM 614 CB THR A 40 -7.332 2.781 6.886 1.00 10.00 C ATOM 615 OG1 THR A 40 -8.529 3.359 7.373 1.00 10.00 O ATOM 616 CG2 THR A 40 -7.381 2.855 5.375 1.00 10.00 C ATOM 0 H THR A 40 -9.276 1.410 6.860 1.00 10.00 H new ATOM 0 HA THR A 40 -6.482 0.763 6.773 1.00 10.00 H new ATOM 0 HB THR A 40 -6.463 3.308 7.282 1.00 10.00 H new ATOM 0 HG1 THR A 40 -8.490 3.417 8.351 1.00 10.00 H new ATOM 0 HG21 THR A 40 -7.435 3.898 5.063 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.483 2.398 4.959 1.00 10.00 H new ATOM 0 HG23 THR A 40 -8.261 2.323 5.013 1.00 10.00 H new ATOM 624 N GLY A 41 -5.678 1.669 9.103 1.00 10.00 N ATOM 625 CA GLY A 41 -5.126 1.830 10.443 1.00 10.00 C ATOM 626 C GLY A 41 -5.525 0.702 11.378 1.00 10.00 C ATOM 627 O GLY A 41 -6.137 0.933 12.419 1.00 10.00 O ATOM 0 H GLY A 41 -5.010 1.934 8.379 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -4.039 1.878 10.381 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.464 2.779 10.860 1.00 10.00 H new ATOM 631 N GLN A 42 -5.175 -0.514 10.971 1.00 10.00 N ATOM 632 CA GLN A 42 -5.531 -1.739 11.665 1.00 10.00 C ATOM 633 C GLN A 42 -4.274 -2.506 12.033 1.00 10.00 C ATOM 634 O GLN A 42 -4.095 -2.844 13.198 1.00 10.00 O ATOM 635 CB GLN A 42 -6.568 -2.538 10.866 1.00 10.00 C ATOM 636 CG GLN A 42 -6.279 -2.735 9.371 1.00 10.00 C ATOM 637 CD GLN A 42 -5.481 -3.988 9.024 1.00 10.00 C ATOM 638 OE1 GLN A 42 -5.339 -4.897 9.836 1.00 10.00 O ATOM 639 NE2 GLN A 42 -4.976 -4.062 7.797 1.00 10.00 N ATOM 0 H GLN A 42 -4.623 -0.675 10.129 1.00 10.00 H new ATOM 0 HA GLN A 42 -6.026 -1.511 12.609 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -6.669 -3.521 11.326 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.532 -2.039 10.964 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -7.228 -2.768 8.835 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -5.735 -1.864 9.004 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -5.110 -3.291 7.143 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -4.455 -4.890 7.509 1.00 10.00 H new ATOM 648 N ALA A 43 -3.402 -2.716 11.042 1.00 10.00 N ATOM 649 CA ALA A 43 -2.114 -3.375 11.177 1.00 10.00 C ATOM 650 C ALA A 43 -2.264 -4.780 11.763 1.00 10.00 C ATOM 651 O ALA A 43 -2.345 -4.926 12.981 1.00 10.00 O ATOM 652 CB ALA A 43 -1.184 -2.540 12.049 1.00 10.00 C ATOM 0 H ALA A 43 -3.590 -2.416 10.085 1.00 10.00 H new ATOM 0 HA ALA A 43 -1.682 -3.471 10.181 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -0.222 -3.045 12.142 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -1.037 -1.562 11.592 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -1.626 -2.416 13.038 1.00 10.00 H new ATOM 658 N PRO A 44 -2.277 -5.835 10.937 1.00 10.00 N ATOM 659 CA PRO A 44 -2.533 -7.174 11.424 1.00 10.00 C ATOM 660 C PRO A 44 -1.283 -7.713 12.135 1.00 10.00 C ATOM 661 O PRO A 44 -0.559 -8.548 11.601 1.00 10.00 O ATOM 662 CB PRO A 44 -2.973 -7.964 10.187 1.00 10.00 C ATOM 663 CG PRO A 44 -2.279 -7.259 9.018 1.00 10.00 C ATOM 664 CD PRO A 44 -2.087 -5.817 9.496 1.00 10.00 C ATOM 0 HA PRO A 44 -3.315 -7.239 12.181 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -2.672 -9.009 10.256 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -4.057 -7.951 10.072 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -1.324 -7.729 8.782 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -2.886 -7.299 8.114 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -1.092 -5.452 9.240 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -2.804 -5.150 9.018 1.00 10.00 H new ATOM 672 N GLY A 45 -1.039 -7.205 13.348 1.00 10.00 N ATOM 673 CA GLY A 45 0.127 -7.483 14.167 1.00 10.00 C ATOM 674 C GLY A 45 1.334 -6.670 13.701 1.00 10.00 C ATOM 675 O GLY A 45 2.371 -7.232 13.364 1.00 10.00 O ATOM 0 H GLY A 45 -1.686 -6.558 13.799 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -0.092 -7.249 15.209 1.00 10.00 H new ATOM 0 HA3 GLY A 45 0.362 -8.546 14.122 1.00 10.00 H new ATOM 679 N PHE A 46 1.220 -5.337 13.697 1.00 10.00 N ATOM 680 CA PHE A 46 2.312 -4.439 13.336 1.00 10.00 C ATOM 681 C PHE A 46 2.053 -3.064 13.976 1.00 10.00 C ATOM 682 O PHE A 46 0.940 -2.799 14.428 1.00 10.00 O ATOM 683 CB PHE A 46 2.429 -4.377 11.804 1.00 10.00 C ATOM 684 CG PHE A 46 3.321 -3.273 11.273 1.00 10.00 C ATOM 685 CD1 PHE A 46 4.719 -3.391 11.376 1.00 10.00 C ATOM 686 CD2 PHE A 46 2.753 -2.076 10.795 1.00 10.00 C ATOM 687 CE1 PHE A 46 5.547 -2.324 10.985 1.00 10.00 C ATOM 688 CE2 PHE A 46 3.581 -1.021 10.381 1.00 10.00 C ATOM 689 CZ PHE A 46 4.977 -1.140 10.488 1.00 10.00 C ATOM 0 H PHE A 46 0.358 -4.852 13.947 1.00 10.00 H new ATOM 0 HA PHE A 46 3.268 -4.801 13.715 1.00 10.00 H new ATOM 0 HB2 PHE A 46 2.808 -5.334 11.445 1.00 10.00 H new ATOM 0 HB3 PHE A 46 1.431 -4.251 11.383 1.00 10.00 H new ATOM 0 HD1 PHE A 46 5.157 -4.302 11.756 1.00 10.00 H new ATOM 0 HD2 PHE A 46 1.679 -1.970 10.747 1.00 10.00 H new ATOM 0 HE1 PHE A 46 6.620 -2.415 11.067 1.00 10.00 H new ATOM 0 HE2 PHE A 46 3.145 -0.118 9.980 1.00 10.00 H new ATOM 0 HZ PHE A 46 5.613 -0.320 10.188 1.00 10.00 H new ATOM 699 N THR A 47 3.076 -2.207 14.040 1.00 10.00 N ATOM 700 CA THR A 47 3.054 -0.900 14.678 1.00 10.00 C ATOM 701 C THR A 47 2.772 0.185 13.630 1.00 10.00 C ATOM 702 O THR A 47 3.687 0.593 12.915 1.00 10.00 O ATOM 703 CB THR A 47 4.431 -0.699 15.325 1.00 10.00 C ATOM 704 OG1 THR A 47 5.429 -0.926 14.348 1.00 10.00 O ATOM 705 CG2 THR A 47 4.654 -1.692 16.471 1.00 10.00 C ATOM 0 H THR A 47 3.983 -2.422 13.626 1.00 10.00 H new ATOM 0 HA THR A 47 2.269 -0.835 15.432 1.00 10.00 H new ATOM 0 HB THR A 47 4.481 0.316 15.719 1.00 10.00 H new ATOM 0 HG1 THR A 47 5.199 -0.443 13.527 1.00 10.00 H new ATOM 0 HG21 THR A 47 5.638 -1.526 16.910 1.00 10.00 H new ATOM 0 HG22 THR A 47 3.887 -1.547 17.232 1.00 10.00 H new ATOM 0 HG23 THR A 47 4.596 -2.710 16.087 1.00 10.00 H new ATOM 713 N TYR A 48 1.524 0.649 13.538 1.00 10.00 N ATOM 714 CA TYR A 48 1.088 1.636 12.560 1.00 10.00 C ATOM 715 C TYR A 48 1.414 3.043 13.040 1.00 10.00 C ATOM 716 O TYR A 48 1.855 3.236 14.172 1.00 10.00 O ATOM 717 CB TYR A 48 -0.420 1.494 12.304 1.00 10.00 C ATOM 718 CG TYR A 48 -1.290 1.525 13.546 1.00 10.00 C ATOM 719 CD1 TYR A 48 -1.550 0.335 14.248 1.00 10.00 C ATOM 720 CD2 TYR A 48 -1.801 2.744 14.029 1.00 10.00 C ATOM 721 CE1 TYR A 48 -2.341 0.353 15.407 1.00 10.00 C ATOM 722 CE2 TYR A 48 -2.567 2.768 15.208 1.00 10.00 C ATOM 723 CZ TYR A 48 -2.840 1.571 15.893 1.00 10.00 C ATOM 724 OH TYR A 48 -3.562 1.591 17.049 1.00 10.00 O ATOM 0 H TYR A 48 0.775 0.339 14.157 1.00 10.00 H new ATOM 0 HA TYR A 48 1.621 1.460 11.626 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -0.737 2.296 11.638 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -0.597 0.555 11.779 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -1.139 -0.598 13.893 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -1.605 3.661 13.494 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -2.565 -0.569 15.924 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -2.946 3.706 15.587 1.00 10.00 H new ATOM 0 HH TYR A 48 -3.834 2.511 17.249 1.00 10.00 H new ATOM 734 N THR A 49 1.167 4.025 12.170 1.00 10.00 N ATOM 735 CA THR A 49 1.363 5.434 12.470 1.00 10.00 C ATOM 736 C THR A 49 0.006 6.122 12.661 1.00 10.00 C ATOM 737 O THR A 49 -0.957 5.771 11.970 1.00 10.00 O ATOM 738 CB THR A 49 2.172 6.069 11.327 1.00 10.00 C ATOM 739 OG1 THR A 49 3.316 5.288 11.044 1.00 10.00 O ATOM 740 CG2 THR A 49 2.667 7.470 11.683 1.00 10.00 C ATOM 0 H THR A 49 0.821 3.855 11.226 1.00 10.00 H new ATOM 0 HA THR A 49 1.919 5.555 13.400 1.00 10.00 H new ATOM 0 HB THR A 49 1.501 6.123 10.469 1.00 10.00 H new ATOM 0 HG1 THR A 49 3.822 5.702 10.314 1.00 10.00 H new ATOM 0 HG21 THR A 49 3.233 7.879 10.846 1.00 10.00 H new ATOM 0 HG22 THR A 49 1.814 8.115 11.894 1.00 10.00 H new ATOM 0 HG23 THR A 49 3.308 7.417 12.563 1.00 10.00 H new ATOM 748 N ASP A 50 -0.054 7.111 13.567 1.00 10.00 N ATOM 749 CA ASP A 50 -1.222 7.939 13.882 1.00 10.00 C ATOM 750 C ASP A 50 -1.583 8.817 12.685 1.00 10.00 C ATOM 751 O ASP A 50 -1.414 10.034 12.691 1.00 10.00 O ATOM 752 CB ASP A 50 -0.949 8.794 15.133 1.00 10.00 C ATOM 753 CG ASP A 50 -1.019 8.020 16.444 1.00 10.00 C ATOM 754 OD1 ASP A 50 -1.262 6.795 16.387 1.00 10.00 O ATOM 755 OD2 ASP A 50 -0.841 8.682 17.487 1.00 10.00 O ATOM 0 H ASP A 50 0.758 7.366 14.129 1.00 10.00 H new ATOM 0 HA ASP A 50 -2.070 7.289 14.096 1.00 10.00 H new ATOM 0 HB2 ASP A 50 0.039 9.246 15.043 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -1.671 9.610 15.167 1.00 10.00 H new ATOM 760 N ALA A 51 -2.073 8.165 11.637 1.00 10.00 N ATOM 761 CA ALA A 51 -2.324 8.746 10.338 1.00 10.00 C ATOM 762 C ALA A 51 -3.181 7.767 9.543 1.00 10.00 C ATOM 763 O ALA A 51 -4.253 8.124 9.064 1.00 10.00 O ATOM 764 CB ALA A 51 -0.991 9.039 9.641 1.00 10.00 C ATOM 0 H ALA A 51 -2.314 7.175 11.679 1.00 10.00 H new ATOM 0 HA ALA A 51 -2.858 9.692 10.424 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -1.181 9.477 8.661 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -0.411 9.737 10.244 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -0.432 8.111 9.521 1.00 10.00 H new ATOM 770 N ASN A 52 -2.761 6.501 9.452 1.00 10.00 N ATOM 771 CA ASN A 52 -3.544 5.508 8.717 1.00 10.00 C ATOM 772 C ASN A 52 -4.914 5.320 9.372 1.00 10.00 C ATOM 773 O ASN A 52 -5.932 5.267 8.685 1.00 10.00 O ATOM 774 CB ASN A 52 -2.761 4.198 8.554 1.00 10.00 C ATOM 775 CG ASN A 52 -1.551 4.426 7.645 1.00 10.00 C ATOM 776 OD1 ASN A 52 -1.674 4.903 6.515 1.00 10.00 O ATOM 777 ND2 ASN A 52 -0.356 4.157 8.147 1.00 10.00 N ATOM 0 H ASN A 52 -1.901 6.146 9.870 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.728 5.873 7.706 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -2.432 3.837 9.528 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -3.406 3.429 8.130 1.00 10.00 H new ATOM 0 HD21 ASN A 52 0.482 4.344 7.597 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -0.273 3.762 9.084 1.00 10.00 H new ATOM 784 N LYS A 53 -4.968 5.304 10.706 1.00 10.00 N ATOM 785 CA LYS A 53 -6.236 5.254 11.435 1.00 10.00 C ATOM 786 C LYS A 53 -7.076 6.497 11.142 1.00 10.00 C ATOM 787 O LYS A 53 -8.302 6.430 11.117 1.00 10.00 O ATOM 788 CB LYS A 53 -5.967 5.086 12.943 1.00 10.00 C ATOM 789 CG LYS A 53 -6.898 4.051 13.607 1.00 10.00 C ATOM 790 CD LYS A 53 -8.300 4.585 13.935 1.00 10.00 C ATOM 791 CE LYS A 53 -8.298 5.497 15.174 1.00 10.00 C ATOM 792 NZ LYS A 53 -8.661 4.764 16.404 1.00 10.00 N ATOM 0 H LYS A 53 -4.143 5.325 11.305 1.00 10.00 H new ATOM 0 HA LYS A 53 -6.810 4.391 11.098 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -4.931 4.782 13.090 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.091 6.049 13.438 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -6.995 3.189 12.946 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -6.432 3.697 14.526 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -8.686 5.138 13.079 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -8.976 3.747 14.104 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -7.310 5.941 15.295 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.999 6.317 15.021 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.647 5.416 17.214 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -9.614 4.362 16.300 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -7.977 3.997 16.566 1.00 10.00 H new ATOM 806 N ASN A 54 -6.419 7.630 10.890 1.00 10.00 N ATOM 807 CA ASN A 54 -7.106 8.861 10.540 1.00 10.00 C ATOM 808 C ASN A 54 -7.821 8.732 9.195 1.00 10.00 C ATOM 809 O ASN A 54 -8.711 9.524 8.904 1.00 10.00 O ATOM 810 CB ASN A 54 -6.109 10.027 10.520 1.00 10.00 C ATOM 811 CG ASN A 54 -6.775 11.322 10.958 1.00 10.00 C ATOM 812 OD1 ASN A 54 -7.021 12.219 10.160 1.00 10.00 O ATOM 813 ND2 ASN A 54 -7.053 11.426 12.255 1.00 10.00 N ATOM 0 H ASN A 54 -5.403 7.714 10.924 1.00 10.00 H new ATOM 0 HA ASN A 54 -7.866 9.060 11.296 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.270 9.804 11.180 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -5.702 10.145 9.516 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -7.487 12.275 12.617 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -6.833 10.656 12.887 1.00 10.00 H new ATOM 820 N LYS A 55 -7.430 7.755 8.364 1.00 10.00 N ATOM 821 CA LYS A 55 -7.981 7.611 7.031 1.00 10.00 C ATOM 822 C LYS A 55 -9.412 7.074 7.112 1.00 10.00 C ATOM 823 O LYS A 55 -10.344 7.701 6.619 1.00 10.00 O ATOM 824 CB LYS A 55 -7.053 6.699 6.217 1.00 10.00 C ATOM 825 CG LYS A 55 -7.118 7.002 4.716 1.00 10.00 C ATOM 826 CD LYS A 55 -5.726 7.268 4.139 1.00 10.00 C ATOM 827 CE LYS A 55 -5.833 7.933 2.764 1.00 10.00 C ATOM 828 NZ LYS A 55 -6.667 7.186 1.799 1.00 10.00 N ATOM 0 H LYS A 55 -6.729 7.054 8.604 1.00 10.00 H new ATOM 0 HA LYS A 55 -8.038 8.576 6.527 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -6.028 6.821 6.567 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -7.327 5.658 6.388 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.576 6.162 4.193 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -7.756 7.869 4.546 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -5.162 7.909 4.816 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -5.176 6.331 4.054 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -6.246 8.934 2.887 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -4.832 8.050 2.349 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -6.583 7.621 0.858 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -6.345 6.198 1.753 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -7.660 7.212 2.106 1.00 10.00 H new ATOM 842 N GLY A 56 -9.573 5.905 7.733 1.00 10.00 N ATOM 843 CA GLY A 56 -10.864 5.291 7.998 1.00 10.00 C ATOM 844 C GLY A 56 -11.622 4.945 6.716 1.00 10.00 C ATOM 845 O GLY A 56 -12.791 5.297 6.572 1.00 10.00 O ATOM 0 H GLY A 56 -8.787 5.350 8.072 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.718 4.385 8.586 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.468 5.968 8.602 1.00 10.00 H new ATOM 849 N ILE A 57 -10.967 4.237 5.792 1.00 10.00 N ATOM 850 CA ILE A 57 -11.526 3.860 4.491 1.00 10.00 C ATOM 851 C ILE A 57 -11.266 2.385 4.212 1.00 10.00 C ATOM 852 O ILE A 57 -10.737 1.684 5.072 1.00 10.00 O ATOM 853 CB ILE A 57 -10.983 4.780 3.377 1.00 10.00 C ATOM 854 CG1 ILE A 57 -9.457 4.851 3.337 1.00 10.00 C ATOM 855 CG2 ILE A 57 -11.578 6.181 3.557 1.00 10.00 C ATOM 856 CD1 ILE A 57 -8.761 3.769 2.503 1.00 10.00 C ATOM 0 H ILE A 57 -10.013 3.903 5.930 1.00 10.00 H new ATOM 0 HA ILE A 57 -12.607 3.997 4.511 1.00 10.00 H new ATOM 0 HB ILE A 57 -11.287 4.352 2.422 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -9.167 5.827 2.947 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -9.082 4.793 4.359 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -11.201 6.840 2.775 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -12.665 6.126 3.492 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -11.292 6.575 4.532 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -7.682 3.915 2.545 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -9.010 2.786 2.902 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -9.096 3.836 1.468 1.00 10.00 H new ATOM 868 N THR A 58 -11.650 1.928 3.017 1.00 10.00 N ATOM 869 CA THR A 58 -11.458 0.571 2.535 1.00 10.00 C ATOM 870 C THR A 58 -10.535 0.610 1.316 1.00 10.00 C ATOM 871 O THR A 58 -10.491 1.606 0.590 1.00 10.00 O ATOM 872 CB THR A 58 -12.820 -0.049 2.191 1.00 10.00 C ATOM 873 OG1 THR A 58 -13.555 0.800 1.331 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.635 -0.286 3.465 1.00 10.00 C ATOM 0 H THR A 58 -12.122 2.523 2.336 1.00 10.00 H new ATOM 0 HA THR A 58 -10.995 -0.048 3.303 1.00 10.00 H new ATOM 0 HB THR A 58 -12.635 -0.999 1.690 1.00 10.00 H new ATOM 0 HG1 THR A 58 -14.419 0.386 1.122 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.598 -0.726 3.205 1.00 10.00 H new ATOM 0 HG22 THR A 58 -13.092 -0.965 4.123 1.00 10.00 H new ATOM 0 HG23 THR A 58 -13.796 0.663 3.976 1.00 10.00 H new ATOM 882 N TRP A 59 -9.784 -0.467 1.100 1.00 10.00 N ATOM 883 CA TRP A 59 -8.860 -0.591 -0.011 1.00 10.00 C ATOM 884 C TRP A 59 -9.524 -1.418 -1.098 1.00 10.00 C ATOM 885 O TRP A 59 -9.972 -2.530 -0.833 1.00 10.00 O ATOM 886 CB TRP A 59 -7.587 -1.240 0.492 1.00 10.00 C ATOM 887 CG TRP A 59 -6.974 -0.480 1.614 1.00 10.00 C ATOM 888 CD1 TRP A 59 -7.074 -0.793 2.925 1.00 10.00 C ATOM 889 CD2 TRP A 59 -6.220 0.764 1.542 1.00 10.00 C ATOM 890 NE1 TRP A 59 -6.345 0.125 3.649 1.00 10.00 N ATOM 891 CE2 TRP A 59 -5.811 1.117 2.853 1.00 10.00 C ATOM 892 CE3 TRP A 59 -5.820 1.622 0.499 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -5.009 2.242 3.111 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -5.078 2.786 0.755 1.00 10.00 C ATOM 895 CH2 TRP A 59 -4.667 3.099 2.059 1.00 10.00 C ATOM 0 H TRP A 59 -9.805 -1.288 1.705 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.604 0.382 -0.430 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -7.805 -2.256 0.820 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -6.872 -1.316 -0.327 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -7.631 -1.622 3.336 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -6.215 0.077 4.660 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -6.090 1.380 -0.518 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -4.660 2.443 4.113 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -4.821 3.447 -0.060 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -4.092 3.993 2.249 1.00 10.00 H new ATOM 906 N LYS A 60 -9.637 -0.861 -2.303 1.00 10.00 N ATOM 907 CA LYS A 60 -10.394 -1.488 -3.376 1.00 10.00 C ATOM 908 C LYS A 60 -9.995 -0.882 -4.717 1.00 10.00 C ATOM 909 O LYS A 60 -10.848 -0.443 -5.482 1.00 10.00 O ATOM 910 CB LYS A 60 -11.901 -1.374 -3.087 1.00 10.00 C ATOM 911 CG LYS A 60 -12.377 0.082 -2.947 1.00 10.00 C ATOM 912 CD LYS A 60 -13.765 0.131 -2.304 1.00 10.00 C ATOM 913 CE LYS A 60 -14.261 1.581 -2.187 1.00 10.00 C ATOM 914 NZ LYS A 60 -15.113 1.985 -3.324 1.00 10.00 N ATOM 0 H LYS A 60 -9.209 0.029 -2.558 1.00 10.00 H new ATOM 0 HA LYS A 60 -10.161 -2.551 -3.430 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -12.457 -1.857 -3.891 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -12.132 -1.916 -2.170 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -11.668 0.646 -2.341 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -12.407 0.557 -3.927 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -14.468 -0.452 -2.900 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -13.729 -0.327 -1.315 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -14.822 1.695 -1.259 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -13.403 2.250 -2.125 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -15.721 2.778 -3.037 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -14.512 2.280 -4.120 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -15.706 1.182 -3.616 1.00 10.00 H new ATOM 928 N GLU A 61 -8.686 -0.833 -4.981 1.00 10.00 N ATOM 929 CA GLU A 61 -8.116 -0.181 -6.152 1.00 10.00 C ATOM 930 C GLU A 61 -8.329 1.331 -6.102 1.00 10.00 C ATOM 931 O GLU A 61 -7.354 2.036 -5.903 1.00 10.00 O ATOM 932 CB GLU A 61 -8.552 -0.875 -7.450 1.00 10.00 C ATOM 933 CG GLU A 61 -8.435 -0.037 -8.731 1.00 10.00 C ATOM 934 CD GLU A 61 -8.692 -0.906 -9.956 1.00 10.00 C ATOM 935 OE1 GLU A 61 -9.697 -1.652 -9.926 1.00 10.00 O ATOM 936 OE2 GLU A 61 -7.838 -0.866 -10.865 1.00 10.00 O ATOM 0 H GLU A 61 -7.984 -1.255 -4.372 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.033 -0.301 -6.140 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -7.955 -1.778 -7.574 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -9.589 -1.191 -7.339 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -9.151 0.785 -8.703 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -7.442 0.407 -8.794 1.00 10.00 H new ATOM 943 N GLU A 62 -9.561 1.832 -6.215 1.00 10.00 N ATOM 944 CA GLU A 62 -9.926 3.250 -6.139 1.00 10.00 C ATOM 945 C GLU A 62 -9.037 4.064 -5.189 1.00 10.00 C ATOM 946 O GLU A 62 -8.332 4.985 -5.593 1.00 10.00 O ATOM 947 CB GLU A 62 -11.392 3.339 -5.690 1.00 10.00 C ATOM 948 CG GLU A 62 -12.346 3.480 -6.881 1.00 10.00 C ATOM 949 CD GLU A 62 -13.740 2.981 -6.537 1.00 10.00 C ATOM 950 OE1 GLU A 62 -14.099 3.081 -5.342 1.00 10.00 O ATOM 951 OE2 GLU A 62 -14.420 2.464 -7.444 1.00 10.00 O ATOM 0 H GLU A 62 -10.371 1.232 -6.369 1.00 10.00 H new ATOM 0 HA GLU A 62 -9.781 3.686 -7.128 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -11.652 2.447 -5.120 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.516 4.191 -5.022 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -12.397 4.525 -7.186 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -11.956 2.918 -7.730 1.00 10.00 H new ATOM 958 N THR A 63 -9.082 3.731 -3.901 1.00 10.00 N ATOM 959 CA THR A 63 -8.333 4.433 -2.879 1.00 10.00 C ATOM 960 C THR A 63 -6.828 4.293 -3.120 1.00 10.00 C ATOM 961 O THR A 63 -6.080 5.261 -2.987 1.00 10.00 O ATOM 962 CB THR A 63 -8.782 3.870 -1.526 1.00 10.00 C ATOM 963 OG1 THR A 63 -9.049 2.481 -1.641 1.00 10.00 O ATOM 964 CG2 THR A 63 -10.086 4.559 -1.120 1.00 10.00 C ATOM 0 H THR A 63 -9.645 2.960 -3.542 1.00 10.00 H new ATOM 0 HA THR A 63 -8.530 5.505 -2.901 1.00 10.00 H new ATOM 0 HB THR A 63 -7.995 4.039 -0.791 1.00 10.00 H new ATOM 0 HG1 THR A 63 -9.607 2.192 -0.889 1.00 10.00 H new ATOM 0 HG21 THR A 63 -10.419 4.169 -0.158 1.00 10.00 H new ATOM 0 HG22 THR A 63 -9.920 5.633 -1.038 1.00 10.00 H new ATOM 0 HG23 THR A 63 -10.849 4.366 -1.874 1.00 10.00 H new ATOM 972 N LEU A 64 -6.391 3.090 -3.490 1.00 10.00 N ATOM 973 CA LEU A 64 -5.008 2.779 -3.809 1.00 10.00 C ATOM 974 C LEU A 64 -4.481 3.649 -4.953 1.00 10.00 C ATOM 975 O LEU A 64 -3.441 4.286 -4.801 1.00 10.00 O ATOM 976 CB LEU A 64 -4.873 1.278 -4.131 1.00 10.00 C ATOM 977 CG LEU A 64 -4.150 0.482 -3.044 1.00 10.00 C ATOM 978 CD1 LEU A 64 -5.085 -0.574 -2.445 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.895 -0.185 -3.634 1.00 10.00 C ATOM 0 H LEU A 64 -7.011 2.285 -3.577 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.393 3.006 -2.938 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -5.867 0.856 -4.279 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -4.335 1.164 -5.072 1.00 10.00 H new ATOM 0 HG LEU A 64 -3.847 1.163 -2.248 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -4.556 -1.132 -1.673 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -5.954 -0.084 -2.007 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -5.411 -1.258 -3.229 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.384 -0.751 -2.855 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -3.186 -0.858 -4.440 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.225 0.581 -4.025 1.00 10.00 H new ATOM 991 N MET A 65 -5.184 3.684 -6.086 1.00 10.00 N ATOM 992 CA MET A 65 -4.918 4.549 -7.217 1.00 10.00 C ATOM 993 C MET A 65 -4.531 5.957 -6.773 1.00 10.00 C ATOM 994 O MET A 65 -3.564 6.500 -7.297 1.00 10.00 O ATOM 995 CB MET A 65 -6.142 4.567 -8.144 1.00 10.00 C ATOM 996 CG MET A 65 -6.019 3.571 -9.302 1.00 10.00 C ATOM 997 SD MET A 65 -5.714 4.385 -10.896 1.00 10.00 S ATOM 998 CE MET A 65 -5.599 2.965 -11.997 1.00 10.00 C ATOM 0 H MET A 65 -5.990 3.078 -6.239 1.00 10.00 H new ATOM 0 HA MET A 65 -4.064 4.153 -7.767 1.00 10.00 H new ATOM 0 HB2 MET A 65 -7.036 4.336 -7.564 1.00 10.00 H new ATOM 0 HB3 MET A 65 -6.274 5.572 -8.546 1.00 10.00 H new ATOM 0 HG2 MET A 65 -5.207 2.875 -9.093 1.00 10.00 H new ATOM 0 HG3 MET A 65 -6.934 2.982 -9.368 1.00 10.00 H new ATOM 0 HE1 MET A 65 -5.484 3.310 -13.025 1.00 10.00 H new ATOM 0 HE2 MET A 65 -4.737 2.358 -11.719 1.00 10.00 H new ATOM 0 HE3 MET A 65 -6.506 2.366 -11.915 1.00 10.00 H new ATOM 1008 N GLU A 66 -5.241 6.533 -5.800 1.00 10.00 N ATOM 1009 CA GLU A 66 -4.892 7.850 -5.302 1.00 10.00 C ATOM 1010 C GLU A 66 -3.692 7.751 -4.364 1.00 10.00 C ATOM 1011 O GLU A 66 -2.709 8.470 -4.518 1.00 10.00 O ATOM 1012 CB GLU A 66 -6.101 8.481 -4.613 1.00 10.00 C ATOM 1013 CG GLU A 66 -7.215 8.770 -5.631 1.00 10.00 C ATOM 1014 CD GLU A 66 -7.898 10.097 -5.330 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -7.169 11.112 -5.301 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -9.119 10.064 -5.077 1.00 10.00 O ATOM 0 H GLU A 66 -6.051 6.107 -5.350 1.00 10.00 H new ATOM 0 HA GLU A 66 -4.609 8.495 -6.134 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -6.474 7.812 -3.838 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -5.803 9.406 -4.120 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -6.796 8.792 -6.637 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -7.950 7.965 -5.609 1.00 10.00 H new ATOM 1023 N TYR A 67 -3.762 6.851 -3.384 1.00 10.00 N ATOM 1024 CA TYR A 67 -2.738 6.668 -2.366 1.00 10.00 C ATOM 1025 C TYR A 67 -1.335 6.574 -2.992 1.00 10.00 C ATOM 1026 O TYR A 67 -0.451 7.364 -2.657 1.00 10.00 O ATOM 1027 CB TYR A 67 -3.116 5.438 -1.529 1.00 10.00 C ATOM 1028 CG TYR A 67 -2.454 5.329 -0.165 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.753 6.255 0.855 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -1.637 4.224 0.128 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -2.177 6.119 2.135 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -1.062 4.093 1.401 1.00 10.00 C ATOM 1033 CZ TYR A 67 -1.309 5.045 2.403 1.00 10.00 C ATOM 1034 OH TYR A 67 -0.637 4.954 3.592 1.00 10.00 O ATOM 0 H TYR A 67 -4.553 6.216 -3.277 1.00 10.00 H new ATOM 0 HA TYR A 67 -2.693 7.534 -1.706 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -4.197 5.438 -1.387 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -2.870 4.544 -2.102 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -3.428 7.074 0.655 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -1.451 3.475 -0.627 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -2.402 6.838 2.908 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -0.422 3.250 1.613 1.00 10.00 H new ATOM 0 HH TYR A 67 -1.280 4.950 4.332 1.00 10.00 H new ATOM 1044 N LEU A 68 -1.140 5.655 -3.948 1.00 10.00 N ATOM 1045 CA LEU A 68 0.145 5.451 -4.621 1.00 10.00 C ATOM 1046 C LEU A 68 0.400 6.471 -5.746 1.00 10.00 C ATOM 1047 O LEU A 68 1.307 6.273 -6.567 1.00 10.00 O ATOM 1048 CB LEU A 68 0.270 4.034 -5.203 1.00 10.00 C ATOM 1049 CG LEU A 68 -0.349 2.869 -4.425 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -0.102 1.602 -5.249 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.214 2.709 -3.012 1.00 10.00 C ATOM 0 H LEU A 68 -1.876 5.030 -4.276 1.00 10.00 H new ATOM 0 HA LEU A 68 0.897 5.595 -3.845 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.176 4.043 -6.197 1.00 10.00 H new ATOM 0 HB3 LEU A 68 1.331 3.821 -5.332 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.412 3.064 -4.286 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -0.528 0.742 -4.731 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -0.573 1.706 -6.227 1.00 10.00 H new ATOM 0 HD13 LEU A 68 0.970 1.454 -5.376 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -0.270 1.865 -2.521 1.00 10.00 H new ATOM 0 HD22 LEU A 68 1.288 2.530 -3.066 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.026 3.618 -2.440 1.00 10.00 H new ATOM 1063 N GLU A 69 -0.422 7.520 -5.838 1.00 10.00 N ATOM 1064 CA GLU A 69 -0.219 8.691 -6.669 1.00 10.00 C ATOM 1065 C GLU A 69 -0.095 9.945 -5.798 1.00 10.00 C ATOM 1066 O GLU A 69 0.089 11.037 -6.324 1.00 10.00 O ATOM 1067 CB GLU A 69 -1.380 8.765 -7.675 1.00 10.00 C ATOM 1068 CG GLU A 69 -1.024 9.472 -8.990 1.00 10.00 C ATOM 1069 CD GLU A 69 -1.576 10.889 -9.091 1.00 10.00 C ATOM 1070 OE1 GLU A 69 -2.779 11.049 -8.800 1.00 10.00 O ATOM 1071 OE2 GLU A 69 -0.797 11.762 -9.528 1.00 10.00 O ATOM 0 H GLU A 69 -1.289 7.570 -5.304 1.00 10.00 H new ATOM 0 HA GLU A 69 0.714 8.623 -7.228 1.00 10.00 H new ATOM 0 HB2 GLU A 69 -1.718 7.753 -7.899 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -2.217 9.285 -7.210 1.00 10.00 H new ATOM 0 HG2 GLU A 69 0.061 9.506 -9.092 1.00 10.00 H new ATOM 0 HG3 GLU A 69 -1.405 8.883 -9.824 1.00 10.00 H new ATOM 1078 N ASN A 70 -0.175 9.822 -4.465 1.00 10.00 N ATOM 1079 CA ASN A 70 -0.250 11.003 -3.616 1.00 10.00 C ATOM 1080 C ASN A 70 0.031 10.665 -2.145 1.00 10.00 C ATOM 1081 O ASN A 70 -0.799 10.900 -1.262 1.00 10.00 O ATOM 1082 CB ASN A 70 -1.632 11.652 -3.841 1.00 10.00 C ATOM 1083 CG ASN A 70 -1.576 12.998 -4.552 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.600 13.737 -4.449 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -2.657 13.357 -5.237 1.00 10.00 N ATOM 0 H ASN A 70 -0.189 8.932 -3.966 1.00 10.00 H new ATOM 0 HA ASN A 70 0.526 11.720 -3.885 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -2.252 10.970 -4.424 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -2.122 11.782 -2.876 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -2.691 14.268 -5.695 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -3.452 12.722 -5.305 1.00 10.00 H new ATOM 1092 N PRO A 71 1.225 10.139 -1.830 1.00 10.00 N ATOM 1093 CA PRO A 71 1.503 9.652 -0.493 1.00 10.00 C ATOM 1094 C PRO A 71 1.780 10.757 0.523 1.00 10.00 C ATOM 1095 O PRO A 71 1.685 10.503 1.722 1.00 10.00 O ATOM 1096 CB PRO A 71 2.689 8.694 -0.651 1.00 10.00 C ATOM 1097 CG PRO A 71 3.439 9.261 -1.859 1.00 10.00 C ATOM 1098 CD PRO A 71 2.313 9.807 -2.739 1.00 10.00 C ATOM 0 HA PRO A 71 0.626 9.153 -0.080 1.00 10.00 H new ATOM 0 HB2 PRO A 71 3.316 8.679 0.241 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.359 7.670 -0.826 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.139 10.044 -1.568 1.00 10.00 H new ATOM 0 HG3 PRO A 71 4.016 8.492 -2.373 1.00 10.00 H new ATOM 0 HD2 PRO A 71 2.641 10.686 -3.294 1.00 10.00 H new ATOM 0 HD3 PRO A 71 1.997 9.066 -3.474 1.00 10.00 H new ATOM 1106 N LYS A 72 2.096 11.970 0.062 1.00 10.00 N ATOM 1107 CA LYS A 72 2.219 13.148 0.906 1.00 10.00 C ATOM 1108 C LYS A 72 1.074 14.113 0.594 1.00 10.00 C ATOM 1109 O LYS A 72 1.303 15.285 0.309 1.00 10.00 O ATOM 1110 CB LYS A 72 3.610 13.793 0.760 1.00 10.00 C ATOM 1111 CG LYS A 72 4.055 14.149 -0.672 1.00 10.00 C ATOM 1112 CD LYS A 72 4.548 12.926 -1.465 1.00 10.00 C ATOM 1113 CE LYS A 72 5.736 13.247 -2.383 1.00 10.00 C ATOM 1114 NZ LYS A 72 5.361 14.075 -3.545 1.00 10.00 N ATOM 0 H LYS A 72 2.275 12.158 -0.924 1.00 10.00 H new ATOM 0 HA LYS A 72 2.136 12.862 1.955 1.00 10.00 H new ATOM 0 HB2 LYS A 72 3.629 14.703 1.359 1.00 10.00 H new ATOM 0 HB3 LYS A 72 4.348 13.114 1.188 1.00 10.00 H new ATOM 0 HG2 LYS A 72 3.221 14.608 -1.203 1.00 10.00 H new ATOM 0 HG3 LYS A 72 4.852 14.892 -0.626 1.00 10.00 H new ATOM 0 HD2 LYS A 72 4.837 12.140 -0.768 1.00 10.00 H new ATOM 0 HD3 LYS A 72 3.727 12.534 -2.065 1.00 10.00 H new ATOM 0 HE2 LYS A 72 6.503 13.765 -1.807 1.00 10.00 H new ATOM 0 HE3 LYS A 72 6.177 12.315 -2.736 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 6.203 14.258 -4.127 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 4.650 13.573 -4.114 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 4.965 14.978 -3.214 1.00 10.00 H new ATOM 1128 N LYS A 73 -0.160 13.602 0.616 1.00 10.00 N ATOM 1129 CA LYS A 73 -1.346 14.380 0.278 1.00 10.00 C ATOM 1130 C LYS A 73 -2.482 14.038 1.235 1.00 10.00 C ATOM 1131 O LYS A 73 -3.037 14.924 1.878 1.00 10.00 O ATOM 1132 CB LYS A 73 -1.714 14.139 -1.197 1.00 10.00 C ATOM 1133 CG LYS A 73 -2.097 15.432 -1.934 1.00 10.00 C ATOM 1134 CD LYS A 73 -3.610 15.708 -1.957 1.00 10.00 C ATOM 1135 CE LYS A 73 -3.961 17.098 -1.401 1.00 10.00 C ATOM 1136 NZ LYS A 73 -5.159 17.668 -2.052 1.00 10.00 N ATOM 0 H LYS A 73 -0.361 12.635 0.870 1.00 10.00 H new ATOM 0 HA LYS A 73 -1.147 15.445 0.393 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -0.870 13.673 -1.706 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -2.546 13.436 -1.249 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -1.591 16.273 -1.460 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -1.731 15.377 -2.959 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -3.976 15.626 -2.980 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -4.125 14.945 -1.372 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -4.132 17.026 -0.327 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -3.115 17.770 -1.545 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -5.361 18.605 -1.648 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -4.988 17.761 -3.074 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -5.973 17.040 -1.893 1.00 10.00 H new ATOM 1150 N TYR A 74 -2.814 12.749 1.346 1.00 10.00 N ATOM 1151 CA TYR A 74 -3.830 12.299 2.286 1.00 10.00 C ATOM 1152 C TYR A 74 -3.415 12.573 3.732 1.00 10.00 C ATOM 1153 O TYR A 74 -4.191 13.119 4.510 1.00 10.00 O ATOM 1154 CB TYR A 74 -4.102 10.808 2.075 1.00 10.00 C ATOM 1155 CG TYR A 74 -5.077 10.506 0.953 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -6.423 10.889 1.095 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -4.698 9.686 -0.126 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -7.393 10.403 0.204 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -5.672 9.211 -1.023 1.00 10.00 C ATOM 1160 CZ TYR A 74 -7.016 9.603 -0.886 1.00 10.00 C ATOM 1161 OH TYR A 74 -7.985 8.967 -1.598 1.00 10.00 O ATOM 0 H TYR A 74 -2.391 12.003 0.794 1.00 10.00 H new ATOM 0 HA TYR A 74 -4.745 12.861 2.099 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -3.158 10.304 1.866 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -4.490 10.386 3.002 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -6.711 11.559 1.892 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -3.660 9.422 -0.265 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -8.434 10.646 0.358 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -5.386 8.542 -1.821 1.00 10.00 H new ATOM 0 HH TYR A 74 -7.856 9.141 -2.554 1.00 10.00 H new ATOM 1171 N ILE A 75 -2.203 12.152 4.096 1.00 10.00 N ATOM 1172 CA ILE A 75 -1.678 12.239 5.452 1.00 10.00 C ATOM 1173 C ILE A 75 -0.235 12.747 5.377 1.00 10.00 C ATOM 1174 O ILE A 75 0.690 11.940 5.333 1.00 10.00 O ATOM 1175 CB ILE A 75 -1.801 10.875 6.173 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.722 9.665 5.217 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -3.103 10.855 6.986 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -1.651 8.315 5.941 1.00 10.00 C ATOM 0 H ILE A 75 -1.547 11.732 3.438 1.00 10.00 H new ATOM 0 HA ILE A 75 -2.259 12.944 6.047 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.943 10.774 6.837 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -2.594 9.672 4.563 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -0.844 9.773 4.580 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.198 9.897 7.498 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -3.085 11.659 7.722 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -3.952 10.995 6.317 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.598 7.511 5.207 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -0.764 8.288 6.574 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -2.541 8.185 6.557 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.008 14.070 5.323 1.00 10.00 N ATOM 1191 CA PRO A 76 1.327 14.630 5.175 1.00 10.00 C ATOM 1192 C PRO A 76 2.128 14.505 6.480 1.00 10.00 C ATOM 1193 O PRO A 76 2.359 15.489 7.177 1.00 10.00 O ATOM 1194 CB PRO A 76 1.111 16.075 4.709 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.270 16.441 5.253 1.00 10.00 C ATOM 1196 CD PRO A 76 -1.024 15.111 5.292 1.00 10.00 C ATOM 0 HA PRO A 76 1.933 14.093 4.445 1.00 10.00 H new ATOM 0 HB2 PRO A 76 1.882 16.739 5.100 1.00 10.00 H new ATOM 0 HB3 PRO A 76 1.144 16.152 3.622 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.201 16.889 6.244 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -0.772 17.164 4.611 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -1.667 15.054 6.170 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -1.667 15.002 4.418 1.00 10.00 H new ATOM 1204 N GLY A 77 2.571 13.282 6.790 1.00 10.00 N ATOM 1205 CA GLY A 77 3.433 12.982 7.928 1.00 10.00 C ATOM 1206 C GLY A 77 3.337 11.509 8.328 1.00 10.00 C ATOM 1207 O GLY A 77 3.186 11.190 9.503 1.00 10.00 O ATOM 0 H GLY A 77 2.332 12.457 6.241 1.00 10.00 H new ATOM 0 HA2 GLY A 77 4.466 13.226 7.679 1.00 10.00 H new ATOM 0 HA3 GLY A 77 3.153 13.609 8.774 1.00 10.00 H new ATOM 1211 N THR A 78 3.422 10.606 7.344 1.00 10.00 N ATOM 1212 CA THR A 78 3.344 9.159 7.555 1.00 10.00 C ATOM 1213 C THR A 78 4.731 8.513 7.564 1.00 10.00 C ATOM 1214 O THR A 78 4.955 7.562 8.306 1.00 10.00 O ATOM 1215 CB THR A 78 2.399 8.513 6.520 1.00 10.00 C ATOM 1216 OG1 THR A 78 2.606 7.112 6.434 1.00 10.00 O ATOM 1217 CG2 THR A 78 2.512 9.109 5.109 1.00 10.00 C ATOM 0 H THR A 78 3.549 10.865 6.366 1.00 10.00 H new ATOM 0 HA THR A 78 2.920 8.979 8.543 1.00 10.00 H new ATOM 0 HB THR A 78 1.398 8.731 6.892 1.00 10.00 H new ATOM 0 HG1 THR A 78 1.745 6.649 6.508 1.00 10.00 H new ATOM 0 HG21 THR A 78 1.816 8.600 4.442 1.00 10.00 H new ATOM 0 HG22 THR A 78 2.272 10.172 5.143 1.00 10.00 H new ATOM 0 HG23 THR A 78 3.529 8.978 4.739 1.00 10.00 H new ATOM 1225 N LYS A 79 5.620 8.986 6.690 1.00 10.00 N ATOM 1226 CA LYS A 79 6.959 8.454 6.442 1.00 10.00 C ATOM 1227 C LYS A 79 7.645 9.374 5.430 1.00 10.00 C ATOM 1228 O LYS A 79 8.811 9.719 5.585 1.00 10.00 O ATOM 1229 CB LYS A 79 6.961 6.964 6.002 1.00 10.00 C ATOM 1230 CG LYS A 79 6.665 6.620 4.526 1.00 10.00 C ATOM 1231 CD LYS A 79 5.206 6.896 4.136 1.00 10.00 C ATOM 1232 CE LYS A 79 4.374 5.630 3.881 1.00 10.00 C ATOM 1233 NZ LYS A 79 2.927 5.897 4.051 1.00 10.00 N ATOM 0 H LYS A 79 5.413 9.795 6.104 1.00 10.00 H new ATOM 0 HA LYS A 79 7.521 8.447 7.376 1.00 10.00 H new ATOM 0 HB2 LYS A 79 7.939 6.550 6.247 1.00 10.00 H new ATOM 0 HB3 LYS A 79 6.229 6.438 6.616 1.00 10.00 H new ATOM 0 HG2 LYS A 79 7.325 7.201 3.882 1.00 10.00 H new ATOM 0 HG3 LYS A 79 6.892 5.569 4.349 1.00 10.00 H new ATOM 0 HD2 LYS A 79 4.733 7.475 4.929 1.00 10.00 H new ATOM 0 HD3 LYS A 79 5.192 7.514 3.238 1.00 10.00 H new ATOM 0 HE2 LYS A 79 4.563 5.265 2.872 1.00 10.00 H new ATOM 0 HE3 LYS A 79 4.685 4.843 4.568 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 2.394 5.013 3.923 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 2.753 6.271 5.006 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 2.617 6.594 3.344 1.00 10.00 H new ATOM 1247 N MET A 80 6.858 9.788 4.426 1.00 10.00 N ATOM 1248 CA MET A 80 7.228 10.627 3.297 1.00 10.00 C ATOM 1249 C MET A 80 8.034 9.806 2.294 1.00 10.00 C ATOM 1250 O MET A 80 8.867 8.997 2.693 1.00 10.00 O ATOM 1251 CB MET A 80 7.978 11.894 3.742 1.00 10.00 C ATOM 1252 CG MET A 80 7.749 13.058 2.765 1.00 10.00 C ATOM 1253 SD MET A 80 6.921 14.508 3.470 1.00 10.00 S ATOM 1254 CE MET A 80 8.259 15.175 4.486 1.00 10.00 C ATOM 0 H MET A 80 5.875 9.520 4.388 1.00 10.00 H new ATOM 0 HA MET A 80 6.318 10.975 2.809 1.00 10.00 H new ATOM 0 HB2 MET A 80 7.645 12.184 4.739 1.00 10.00 H new ATOM 0 HB3 MET A 80 9.045 11.681 3.812 1.00 10.00 H new ATOM 0 HG2 MET A 80 8.714 13.370 2.364 1.00 10.00 H new ATOM 0 HG3 MET A 80 7.157 12.695 1.925 1.00 10.00 H new ATOM 0 HE1 MET A 80 7.916 16.077 4.993 1.00 10.00 H new ATOM 0 HE2 MET A 80 8.558 14.433 5.227 1.00 10.00 H new ATOM 0 HE3 MET A 80 9.111 15.418 3.851 1.00 10.00 H new ATOM 1264 N ILE A 81 7.774 9.981 0.993 1.00 10.00 N ATOM 1265 CA ILE A 81 8.548 9.306 -0.034 1.00 10.00 C ATOM 1266 C ILE A 81 8.410 10.016 -1.380 1.00 10.00 C ATOM 1267 O ILE A 81 7.813 11.091 -1.434 1.00 10.00 O ATOM 1268 CB ILE A 81 8.241 7.784 -0.034 1.00 10.00 C ATOM 1269 CG1 ILE A 81 9.233 6.912 -0.821 1.00 10.00 C ATOM 1270 CG2 ILE A 81 6.781 7.501 -0.435 1.00 10.00 C ATOM 1271 CD1 ILE A 81 9.141 5.475 -0.329 1.00 10.00 C ATOM 0 H ILE A 81 7.034 10.585 0.635 1.00 10.00 H new ATOM 0 HA ILE A 81 9.612 9.372 0.191 1.00 10.00 H new ATOM 0 HB ILE A 81 8.382 7.476 1.002 1.00 10.00 H new ATOM 0 HG12 ILE A 81 9.009 6.958 -1.887 1.00 10.00 H new ATOM 0 HG13 ILE A 81 10.248 7.288 -0.692 1.00 10.00 H new ATOM 0 HG21 ILE A 81 6.603 6.426 -0.424 1.00 10.00 H new ATOM 0 HG22 ILE A 81 6.109 7.988 0.272 1.00 10.00 H new ATOM 0 HG23 ILE A 81 6.597 7.889 -1.437 1.00 10.00 H new ATOM 0 HD11 ILE A 81 9.843 4.854 -0.885 1.00 10.00 H new ATOM 0 HD12 ILE A 81 9.386 5.438 0.733 1.00 10.00 H new ATOM 0 HD13 ILE A 81 8.128 5.102 -0.481 1.00 10.00 H new ATOM 1283 N PHE A 82 9.004 9.434 -2.430 1.00 10.00 N ATOM 1284 CA PHE A 82 8.934 9.861 -3.821 1.00 10.00 C ATOM 1285 C PHE A 82 7.508 10.199 -4.274 1.00 10.00 C ATOM 1286 O PHE A 82 6.533 9.928 -3.574 1.00 10.00 O ATOM 1287 CB PHE A 82 9.570 8.789 -4.734 1.00 10.00 C ATOM 1288 CG PHE A 82 8.734 7.564 -5.104 1.00 10.00 C ATOM 1289 CD1 PHE A 82 7.715 7.072 -4.263 1.00 10.00 C ATOM 1290 CD2 PHE A 82 9.014 6.882 -6.305 1.00 10.00 C ATOM 1291 CE1 PHE A 82 7.010 5.904 -4.599 1.00 10.00 C ATOM 1292 CE2 PHE A 82 8.291 5.727 -6.654 1.00 10.00 C ATOM 1293 CZ PHE A 82 7.293 5.232 -5.798 1.00 10.00 C ATOM 0 H PHE A 82 9.581 8.601 -2.316 1.00 10.00 H new ATOM 0 HA PHE A 82 9.502 10.788 -3.904 1.00 10.00 H new ATOM 0 HB2 PHE A 82 9.872 9.278 -5.660 1.00 10.00 H new ATOM 0 HB3 PHE A 82 10.480 8.436 -4.249 1.00 10.00 H new ATOM 0 HD1 PHE A 82 7.474 7.598 -3.351 1.00 10.00 H new ATOM 0 HD2 PHE A 82 9.789 7.249 -6.962 1.00 10.00 H new ATOM 0 HE1 PHE A 82 6.249 5.523 -3.934 1.00 10.00 H new ATOM 0 HE2 PHE A 82 8.504 5.219 -7.583 1.00 10.00 H new ATOM 0 HZ PHE A 82 6.746 4.339 -6.061 1.00 10.00 H new ATOM 1303 N ALA A 83 7.390 10.776 -5.473 1.00 10.00 N ATOM 1304 CA ALA A 83 6.109 11.108 -6.079 1.00 10.00 C ATOM 1305 C ALA A 83 5.102 9.960 -5.962 1.00 10.00 C ATOM 1306 O ALA A 83 4.035 10.142 -5.381 1.00 10.00 O ATOM 1307 CB ALA A 83 6.321 11.523 -7.538 1.00 10.00 C ATOM 0 H ALA A 83 8.192 11.026 -6.051 1.00 10.00 H new ATOM 0 HA ALA A 83 5.680 11.948 -5.533 1.00 10.00 H new ATOM 0 HB1 ALA A 83 5.360 11.771 -7.989 1.00 10.00 H new ATOM 0 HB2 ALA A 83 6.976 12.394 -7.577 1.00 10.00 H new ATOM 0 HB3 ALA A 83 6.778 10.700 -8.088 1.00 10.00 H new ATOM 1313 N GLY A 84 5.434 8.790 -6.509 1.00 10.00 N ATOM 1314 CA GLY A 84 4.538 7.651 -6.526 1.00 10.00 C ATOM 1315 C GLY A 84 4.918 6.739 -7.682 1.00 10.00 C ATOM 1316 O GLY A 84 5.987 6.894 -8.273 1.00 10.00 O ATOM 0 H GLY A 84 6.336 8.613 -6.952 1.00 10.00 H new ATOM 0 HA2 GLY A 84 4.601 7.109 -5.583 1.00 10.00 H new ATOM 0 HA3 GLY A 84 3.506 7.985 -6.634 1.00 10.00 H new ATOM 1320 N ILE A 85 4.032 5.800 -8.023 1.00 10.00 N ATOM 1321 CA ILE A 85 4.237 4.928 -9.168 1.00 10.00 C ATOM 1322 C ILE A 85 4.354 5.761 -10.441 1.00 10.00 C ATOM 1323 O ILE A 85 3.802 6.858 -10.516 1.00 10.00 O ATOM 1324 CB ILE A 85 3.095 3.901 -9.240 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.505 2.598 -8.555 1.00 10.00 C ATOM 1326 CG2 ILE A 85 2.579 3.599 -10.648 1.00 10.00 C ATOM 1327 CD1 ILE A 85 4.360 1.677 -9.428 1.00 10.00 C ATOM 0 H ILE A 85 3.164 5.629 -7.516 1.00 10.00 H new ATOM 0 HA ILE A 85 5.170 4.375 -9.060 1.00 10.00 H new ATOM 0 HB ILE A 85 2.264 4.372 -8.715 1.00 10.00 H new ATOM 0 HG12 ILE A 85 4.058 2.836 -7.646 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.606 2.061 -8.250 1.00 10.00 H new ATOM 0 HG21 ILE A 85 1.776 2.864 -10.591 1.00 10.00 H new ATOM 0 HG22 ILE A 85 2.201 4.515 -11.101 1.00 10.00 H new ATOM 0 HG23 ILE A 85 3.392 3.202 -11.256 1.00 10.00 H new ATOM 0 HD11 ILE A 85 4.609 0.775 -8.870 1.00 10.00 H new ATOM 0 HD12 ILE A 85 3.804 1.407 -10.325 1.00 10.00 H new ATOM 0 HD13 ILE A 85 5.277 2.193 -9.712 1.00 10.00 H new ATOM 1339 N LYS A 86 5.047 5.189 -11.433 1.00 10.00 N ATOM 1340 CA LYS A 86 5.370 5.805 -12.712 1.00 10.00 C ATOM 1341 C LYS A 86 4.219 6.660 -13.247 1.00 10.00 C ATOM 1342 O LYS A 86 4.442 7.809 -13.615 1.00 10.00 O ATOM 1343 CB LYS A 86 5.769 4.742 -13.750 1.00 10.00 C ATOM 1344 CG LYS A 86 6.783 3.710 -13.236 1.00 10.00 C ATOM 1345 CD LYS A 86 7.470 2.988 -14.419 1.00 10.00 C ATOM 1346 CE LYS A 86 8.946 3.393 -14.575 1.00 10.00 C ATOM 1347 NZ LYS A 86 9.526 2.948 -15.862 1.00 10.00 N ATOM 0 H LYS A 86 5.412 4.240 -11.356 1.00 10.00 H new ATOM 0 HA LYS A 86 6.220 6.465 -12.539 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.872 4.219 -14.081 1.00 10.00 H new ATOM 0 HB3 LYS A 86 6.188 5.242 -14.623 1.00 10.00 H new ATOM 0 HG2 LYS A 86 7.533 4.205 -12.619 1.00 10.00 H new ATOM 0 HG3 LYS A 86 6.279 2.981 -12.601 1.00 10.00 H new ATOM 0 HD2 LYS A 86 7.405 1.910 -14.270 1.00 10.00 H new ATOM 0 HD3 LYS A 86 6.934 3.215 -15.341 1.00 10.00 H new ATOM 0 HE2 LYS A 86 9.031 4.477 -14.498 1.00 10.00 H new ATOM 0 HE3 LYS A 86 9.524 2.968 -13.754 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 10.521 3.246 -15.916 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 9.471 1.912 -15.928 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 8.994 3.373 -16.648 1.00 10.00 H new ATOM 1361 N LYS A 87 3.012 6.082 -13.319 1.00 10.00 N ATOM 1362 CA LYS A 87 1.778 6.732 -13.713 1.00 10.00 C ATOM 1363 C LYS A 87 0.618 5.742 -13.549 1.00 10.00 C ATOM 1364 O LYS A 87 0.804 4.622 -13.070 1.00 10.00 O ATOM 1365 CB LYS A 87 1.877 7.231 -15.158 1.00 10.00 C ATOM 1366 CG LYS A 87 1.855 6.074 -16.163 1.00 10.00 C ATOM 1367 CD LYS A 87 2.840 6.276 -17.319 1.00 10.00 C ATOM 1368 CE LYS A 87 4.281 6.044 -16.839 1.00 10.00 C ATOM 1369 NZ LYS A 87 5.249 6.073 -17.952 1.00 10.00 N ATOM 0 H LYS A 87 2.875 5.098 -13.090 1.00 10.00 H new ATOM 0 HA LYS A 87 1.598 7.598 -13.076 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.049 7.909 -15.366 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.796 7.803 -15.283 1.00 10.00 H new ATOM 0 HG2 LYS A 87 2.094 5.145 -15.646 1.00 10.00 H new ATOM 0 HG3 LYS A 87 0.847 5.966 -16.564 1.00 10.00 H new ATOM 0 HD2 LYS A 87 2.605 5.588 -18.131 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.741 7.285 -17.718 1.00 10.00 H new ATOM 0 HE2 LYS A 87 4.547 6.808 -16.108 1.00 10.00 H new ATOM 0 HE3 LYS A 87 4.343 5.082 -16.331 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 6.208 5.912 -17.583 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 5.012 5.327 -18.637 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 5.210 7.000 -18.422 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.565 6.142 -14.016 1.00 10.00 N ATOM 1384 CA LYS A 88 -1.804 5.390 -13.897 1.00 10.00 C ATOM 1385 C LYS A 88 -1.654 3.996 -14.499 1.00 10.00 C ATOM 1386 O LYS A 88 -2.053 3.025 -13.876 1.00 10.00 O ATOM 1387 CB LYS A 88 -2.988 6.203 -14.458 1.00 10.00 C ATOM 1388 CG LYS A 88 -3.020 6.376 -15.988 1.00 10.00 C ATOM 1389 CD LYS A 88 -3.690 5.178 -16.697 1.00 10.00 C ATOM 1390 CE LYS A 88 -5.069 5.486 -17.311 1.00 10.00 C ATOM 1391 NZ LYS A 88 -6.091 4.480 -16.923 1.00 10.00 N ATOM 0 H LYS A 88 -0.686 7.030 -14.504 1.00 10.00 H new ATOM 0 HA LYS A 88 -2.033 5.226 -12.844 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -3.915 5.721 -14.147 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -2.974 7.192 -14.000 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -3.558 7.291 -16.237 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -2.002 6.493 -16.360 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -3.027 4.822 -17.486 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -3.799 4.364 -15.981 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -5.395 6.475 -16.991 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -4.983 5.515 -18.397 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -6.551 4.105 -17.777 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -5.634 3.702 -16.406 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -6.805 4.928 -16.314 1.00 10.00 H new ATOM 1405 N THR A 89 -1.054 3.897 -15.686 1.00 10.00 N ATOM 1406 CA THR A 89 -0.885 2.665 -16.437 1.00 10.00 C ATOM 1407 C THR A 89 -0.264 1.579 -15.554 1.00 10.00 C ATOM 1408 O THR A 89 -0.843 0.522 -15.314 1.00 10.00 O ATOM 1409 CB THR A 89 -0.003 3.015 -17.647 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.468 4.236 -18.201 1.00 10.00 O ATOM 1411 CG2 THR A 89 -0.013 1.908 -18.698 1.00 10.00 C ATOM 0 H THR A 89 -0.659 4.707 -16.164 1.00 10.00 H new ATOM 0 HA THR A 89 -1.839 2.260 -16.776 1.00 10.00 H new ATOM 0 HB THR A 89 1.030 3.120 -17.315 1.00 10.00 H new ATOM 0 HG1 THR A 89 0.085 4.476 -18.974 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.622 2.196 -19.536 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.363 0.985 -18.258 1.00 10.00 H new ATOM 0 HG23 THR A 89 -1.032 1.752 -19.052 1.00 10.00 H new ATOM 1419 N GLU A 90 0.917 1.890 -15.025 1.00 10.00 N ATOM 1420 CA GLU A 90 1.625 1.024 -14.109 1.00 10.00 C ATOM 1421 C GLU A 90 0.796 0.780 -12.851 1.00 10.00 C ATOM 1422 O GLU A 90 0.702 -0.356 -12.405 1.00 10.00 O ATOM 1423 CB GLU A 90 2.970 1.670 -13.775 1.00 10.00 C ATOM 1424 CG GLU A 90 4.050 1.329 -14.832 1.00 10.00 C ATOM 1425 CD GLU A 90 5.195 0.429 -14.344 1.00 10.00 C ATOM 1426 OE1 GLU A 90 5.701 0.650 -13.217 1.00 10.00 O ATOM 1427 OE2 GLU A 90 5.634 -0.422 -15.156 1.00 10.00 O ATOM 0 H GLU A 90 1.407 2.761 -15.228 1.00 10.00 H new ATOM 0 HA GLU A 90 1.798 0.052 -14.571 1.00 10.00 H new ATOM 0 HB2 GLU A 90 2.849 2.752 -13.715 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.302 1.331 -12.794 1.00 10.00 H new ATOM 0 HG2 GLU A 90 3.564 0.842 -15.678 1.00 10.00 H new ATOM 0 HG3 GLU A 90 4.477 2.261 -15.203 1.00 10.00 H new ATOM 1434 N ARG A 91 0.214 1.827 -12.260 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.560 1.684 -11.027 1.00 10.00 C ATOM 1436 C ARG A 91 -1.712 0.682 -11.229 1.00 10.00 C ATOM 1437 O ARG A 91 -2.001 -0.146 -10.367 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.053 3.071 -10.582 1.00 10.00 C ATOM 1439 CG ARG A 91 -1.302 3.145 -9.069 1.00 10.00 C ATOM 1440 CD ARG A 91 -1.558 4.587 -8.606 1.00 10.00 C ATOM 1441 NE ARG A 91 -0.382 5.465 -8.788 1.00 10.00 N ATOM 1442 CZ ARG A 91 -0.212 6.359 -9.777 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -1.162 6.534 -10.703 1.00 10.00 N ATOM 1444 NH2 ARG A 91 0.916 7.074 -9.841 1.00 10.00 N ATOM 0 H ARG A 91 0.265 2.781 -12.616 1.00 10.00 H new ATOM 0 HA ARG A 91 0.066 1.279 -10.232 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.316 3.823 -10.864 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -1.974 3.313 -11.112 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -2.158 2.522 -8.810 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -0.441 2.740 -8.538 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -2.401 4.998 -9.161 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -1.842 4.581 -7.554 1.00 10.00 H new ATOM 0 HE ARG A 91 0.368 5.385 -8.101 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -2.022 5.987 -10.661 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -1.026 7.214 -11.451 1.00 10.00 H new ATOM 0 HH21 ARG A 91 1.645 6.940 -9.140 1.00 10.00 H new ATOM 0 HH22 ARG A 91 1.048 7.753 -10.591 1.00 10.00 H new ATOM 1458 N GLU A 92 -2.341 0.754 -12.401 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.485 -0.035 -12.824 1.00 10.00 C ATOM 1460 C GLU A 92 -3.059 -1.507 -12.930 1.00 10.00 C ATOM 1461 O GLU A 92 -3.652 -2.392 -12.307 1.00 10.00 O ATOM 1462 CB GLU A 92 -3.988 0.613 -14.133 1.00 10.00 C ATOM 1463 CG GLU A 92 -5.302 0.074 -14.698 1.00 10.00 C ATOM 1464 CD GLU A 92 -6.213 1.159 -15.300 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -5.701 2.184 -15.825 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -7.440 0.945 -15.242 1.00 10.00 O ATOM 0 H GLU A 92 -2.042 1.409 -13.123 1.00 10.00 H new ATOM 0 HA GLU A 92 -4.317 -0.040 -12.120 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -4.103 1.683 -13.962 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.215 0.493 -14.892 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -5.079 -0.667 -15.466 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -5.843 -0.442 -13.905 1.00 10.00 H new ATOM 1473 N ASP A 93 -1.971 -1.764 -13.661 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.317 -3.072 -13.694 1.00 10.00 C ATOM 1475 C ASP A 93 -0.996 -3.556 -12.272 1.00 10.00 C ATOM 1476 O ASP A 93 -1.259 -4.704 -11.919 1.00 10.00 O ATOM 1477 CB ASP A 93 -0.069 -2.994 -14.586 1.00 10.00 C ATOM 1478 CG ASP A 93 -0.393 -2.904 -16.075 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.539 -3.255 -16.446 1.00 10.00 O ATOM 1480 OD2 ASP A 93 0.526 -2.508 -16.823 1.00 10.00 O ATOM 0 H ASP A 93 -1.518 -1.065 -14.250 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.991 -3.812 -14.126 1.00 10.00 H new ATOM 0 HB2 ASP A 93 0.521 -2.124 -14.297 1.00 10.00 H new ATOM 0 HB3 ASP A 93 0.551 -3.873 -14.409 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.465 -2.672 -11.428 1.00 10.00 N ATOM 1486 CA LEU A 94 -0.134 -2.964 -10.037 1.00 10.00 C ATOM 1487 C LEU A 94 -1.319 -3.584 -9.298 1.00 10.00 C ATOM 1488 O LEU A 94 -1.189 -4.670 -8.725 1.00 10.00 O ATOM 1489 CB LEU A 94 0.352 -1.690 -9.334 1.00 10.00 C ATOM 1490 CG LEU A 94 1.605 -1.922 -8.493 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.139 -0.559 -8.073 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.319 -2.749 -7.250 1.00 10.00 C ATOM 0 H LEU A 94 -0.249 -1.713 -11.700 1.00 10.00 H new ATOM 0 HA LEU A 94 0.672 -3.698 -10.024 1.00 10.00 H new ATOM 0 HB2 LEU A 94 0.558 -0.924 -10.081 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -0.444 -1.307 -8.695 1.00 10.00 H new ATOM 0 HG LEU A 94 2.329 -2.476 -9.090 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.037 -0.690 -7.469 1.00 10.00 H new ATOM 0 HD12 LEU A 94 2.381 0.026 -8.960 1.00 10.00 H new ATOM 0 HD13 LEU A 94 1.382 -0.036 -7.489 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.241 -2.887 -6.685 1.00 10.00 H new ATOM 0 HD22 LEU A 94 0.587 -2.232 -6.630 1.00 10.00 H new ATOM 0 HD23 LEU A 94 0.924 -3.722 -7.543 1.00 10.00 H new ATOM 1504 N ILE A 95 -2.475 -2.906 -9.320 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.688 -3.443 -8.718 1.00 10.00 C ATOM 1506 C ILE A 95 -3.940 -4.861 -9.208 1.00 10.00 C ATOM 1507 O ILE A 95 -4.322 -5.713 -8.415 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.916 -2.547 -8.973 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -5.012 -1.472 -7.889 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -6.221 -3.363 -8.956 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.914 -0.414 -7.917 1.00 10.00 C ATOM 0 H ILE A 95 -2.588 -1.987 -9.749 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.533 -3.464 -7.639 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.790 -2.093 -9.956 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -5.977 -0.973 -7.981 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.998 -1.960 -6.915 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -7.067 -2.700 -9.139 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -6.183 -4.126 -9.733 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -6.338 -3.841 -7.984 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -4.075 0.299 -7.109 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.943 -0.893 -7.790 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -3.938 0.110 -8.873 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.784 -5.108 -10.508 1.00 10.00 N ATOM 1524 CA ALA A 96 -4.072 -6.419 -11.068 1.00 10.00 C ATOM 1525 C ALA A 96 -3.311 -7.521 -10.336 1.00 10.00 C ATOM 1526 O ALA A 96 -3.907 -8.521 -9.938 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.755 -6.452 -12.554 1.00 10.00 C ATOM 0 H ALA A 96 -3.461 -4.418 -11.187 1.00 10.00 H new ATOM 0 HA ALA A 96 -5.138 -6.605 -10.935 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.978 -7.442 -12.952 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.360 -5.708 -13.072 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.699 -6.230 -12.706 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.002 -7.338 -10.145 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.237 -8.269 -9.330 1.00 10.00 C ATOM 1535 C TYR A 97 -1.830 -8.332 -7.939 1.00 10.00 C ATOM 1536 O TYR A 97 -2.228 -9.400 -7.476 1.00 10.00 O ATOM 1537 CB TYR A 97 0.228 -7.853 -9.238 1.00 10.00 C ATOM 1538 CG TYR A 97 1.026 -8.607 -8.187 1.00 10.00 C ATOM 1539 CD1 TYR A 97 1.183 -10.003 -8.285 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.602 -7.917 -7.103 1.00 10.00 C ATOM 1541 CE1 TYR A 97 1.965 -10.695 -7.343 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.405 -8.608 -6.178 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.593 -9.993 -6.300 1.00 10.00 C ATOM 1544 OH TYR A 97 3.440 -10.638 -5.450 1.00 10.00 O ATOM 0 H TYR A 97 -1.463 -6.567 -10.538 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.285 -9.250 -9.802 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.698 -8.002 -10.210 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.278 -6.786 -9.020 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.701 -10.544 -9.086 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.427 -6.858 -6.982 1.00 10.00 H new ATOM 0 HE1 TYR A 97 2.083 -11.766 -7.421 1.00 10.00 H new ATOM 0 HE2 TYR A 97 2.879 -8.070 -5.370 1.00 10.00 H new ATOM 0 HH TYR A 97 3.787 -10.003 -4.789 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.847 -7.174 -7.283 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.267 -7.057 -5.901 1.00 10.00 C ATOM 1556 C LEU A 98 -3.563 -7.820 -5.635 1.00 10.00 C ATOM 1557 O LEU A 98 -3.609 -8.588 -4.681 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.350 -5.579 -5.489 1.00 10.00 C ATOM 1559 CG LEU A 98 -1.294 -5.223 -4.425 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -0.292 -4.223 -4.975 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.940 -4.668 -3.164 1.00 10.00 C ATOM 0 H LEU A 98 -1.567 -6.288 -7.704 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.512 -7.527 -5.271 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -2.209 -4.948 -6.367 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.345 -5.365 -5.099 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.771 -6.143 -4.165 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.444 -3.986 -4.207 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.212 -4.652 -5.841 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.812 -3.313 -5.272 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -1.167 -4.427 -2.435 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.501 -3.766 -3.409 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.616 -5.412 -2.744 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.585 -7.655 -6.480 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.834 -8.400 -6.411 1.00 10.00 C ATOM 1575 C LYS A 99 -5.575 -9.880 -6.134 1.00 10.00 C ATOM 1576 O LYS A 99 -6.082 -10.413 -5.152 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.649 -8.241 -7.707 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.624 -7.056 -7.677 1.00 10.00 C ATOM 1579 CD LYS A 99 -8.720 -7.274 -8.733 1.00 10.00 C ATOM 1580 CE LYS A 99 -9.751 -6.134 -8.711 1.00 10.00 C ATOM 1581 NZ LYS A 99 -10.936 -6.432 -9.544 1.00 10.00 N ATOM 0 H LYS A 99 -4.561 -6.983 -7.247 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.414 -7.988 -5.586 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -5.963 -8.115 -8.545 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -7.210 -9.158 -7.889 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -8.070 -6.962 -6.687 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -7.091 -6.126 -7.876 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -8.267 -7.339 -9.722 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -9.221 -8.224 -8.549 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -10.068 -5.954 -7.684 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -9.282 -5.216 -9.066 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -11.602 -5.635 -9.498 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -10.639 -6.578 -10.530 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -11.401 -7.293 -9.191 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.801 -10.556 -6.985 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.524 -11.961 -6.806 1.00 10.00 C ATOM 1597 C LYS A 100 -3.617 -12.156 -5.589 1.00 10.00 C ATOM 1598 O LYS A 100 -3.878 -13.038 -4.780 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.927 -12.502 -8.108 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.498 -13.969 -7.989 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.228 -14.893 -8.974 1.00 10.00 C ATOM 1602 CE LYS A 100 -5.673 -15.193 -8.532 1.00 10.00 C ATOM 1603 NZ LYS A 100 -5.761 -16.295 -7.540 1.00 10.00 N ATOM 0 H LYS A 100 -4.359 -10.141 -7.805 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.432 -12.527 -6.600 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.660 -12.404 -8.909 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -3.066 -11.896 -8.389 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.424 -14.042 -8.160 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.683 -14.314 -6.972 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.241 -14.431 -9.961 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -3.677 -15.829 -9.067 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -6.111 -14.291 -8.104 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -6.268 -15.452 -9.408 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -6.756 -16.450 -7.281 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -5.371 -17.166 -7.953 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -5.218 -16.041 -6.690 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.553 -11.361 -5.472 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.510 -11.559 -4.474 1.00 10.00 C ATOM 1619 C ALA A 101 -2.101 -11.516 -3.062 1.00 10.00 C ATOM 1620 O ALA A 101 -1.996 -12.461 -2.287 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.429 -10.490 -4.670 1.00 10.00 C ATOM 0 H ALA A 101 -2.393 -10.554 -6.075 1.00 10.00 H new ATOM 0 HA ALA A 101 -1.057 -12.543 -4.599 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.358 -10.628 -3.928 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -0.005 -10.581 -5.670 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.870 -9.500 -4.551 1.00 10.00 H new ATOM 1627 N THR A 102 -2.767 -10.406 -2.746 1.00 10.00 N ATOM 1628 CA THR A 102 -3.347 -10.171 -1.435 1.00 10.00 C ATOM 1629 C THR A 102 -4.463 -11.161 -1.113 1.00 10.00 C ATOM 1630 O THR A 102 -4.610 -11.550 0.044 1.00 10.00 O ATOM 1631 CB THR A 102 -3.880 -8.742 -1.351 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.880 -8.543 -2.318 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.771 -7.712 -1.538 1.00 10.00 C ATOM 0 H THR A 102 -2.918 -9.640 -3.403 1.00 10.00 H new ATOM 0 HA THR A 102 -2.558 -10.316 -0.697 1.00 10.00 H new ATOM 0 HB THR A 102 -4.300 -8.606 -0.354 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.465 -8.310 -3.175 1.00 10.00 H new ATOM 0 HG21 THR A 102 -3.191 -6.709 -1.471 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.018 -7.842 -0.760 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.309 -7.848 -2.516 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.274 -11.508 -2.120 1.00 10.00 N ATOM 1642 CA ASN A 103 -6.335 -12.501 -1.998 1.00 10.00 C ATOM 1643 C ASN A 103 -5.717 -13.855 -1.640 1.00 10.00 C ATOM 1644 O ASN A 103 -6.151 -14.495 -0.686 1.00 10.00 O ATOM 1645 CB ASN A 103 -7.130 -12.522 -3.311 1.00 10.00 C ATOM 1646 CG ASN A 103 -8.368 -13.412 -3.305 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -8.421 -14.454 -2.668 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -9.401 -13.001 -4.038 1.00 10.00 N ATOM 0 H ASN A 103 -5.206 -11.099 -3.052 1.00 10.00 H new ATOM 0 HA ASN A 103 -7.032 -12.254 -1.197 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.436 -11.503 -3.549 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.469 -12.852 -4.112 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -10.254 -13.558 -4.074 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -9.339 -12.129 -4.563 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.663 -14.220 -2.374 1.00 10.00 N ATOM 1656 CA GLU A 104 -3.891 -15.444 -2.238 1.00 10.00 C ATOM 1657 C GLU A 104 -4.754 -16.620 -2.727 1.00 10.00 C ATOM 1658 O GLU A 104 -5.178 -16.548 -3.911 1.00 10.00 O ATOM 1659 CB GLU A 104 -3.263 -15.542 -0.822 1.00 10.00 C ATOM 1660 CG GLU A 104 -1.803 -16.062 -0.764 1.00 10.00 C ATOM 1661 CD GLU A 104 -1.597 -17.373 0.001 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -1.878 -17.384 1.219 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -1.038 -18.328 -0.582 1.00 10.00 O ATOM 1664 OXT GLU A 104 -4.989 -17.561 -1.938 1.00 10.00 O ATOM 0 H GLU A 104 -4.309 -13.627 -3.125 1.00 10.00 H new ATOM 0 HA GLU A 104 -3.010 -15.463 -2.880 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -3.295 -14.554 -0.362 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -3.886 -16.197 -0.214 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -1.444 -16.197 -1.784 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -1.180 -15.293 -0.306 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 N1 IMD A 105 3.332 4.701 -0.154 1.00 10.00 N HETATM 1673 C2 IMD A 105 3.711 3.412 -0.120 1.00 10.00 C HETATM 1674 N3 IMD A 105 3.064 2.743 0.848 1.00 10.00 N HETATM 1675 C4 IMD A 105 2.239 3.681 1.463 1.00 10.00 C HETATM 1676 C5 IMD A 105 2.378 4.884 0.822 1.00 10.00 C HETATM 0 HN1 IMD A 105 3.687 5.416 -0.789 1.00 10.00 H new HETATM 0 H5 IMD A 105 1.839 5.806 1.042 1.00 10.00 H new HETATM 0 H4 IMD A 105 1.588 3.489 2.316 1.00 10.00 H new HETATM 0 H2 IMD A 105 4.447 2.968 -0.790 1.00 10.00 H new HETATM 1681 FE HEC A 110 3.171 0.821 1.253 1.00 10.00 FE HETATM 1682 CHA HEC A 110 0.744 1.220 3.655 1.00 10.00 C HETATM 1683 CHB HEC A 110 0.820 -0.165 -0.985 1.00 10.00 C HETATM 1684 CHC HEC A 110 5.612 0.660 -1.154 1.00 10.00 C HETATM 1685 CHD HEC A 110 5.600 1.349 3.616 1.00 10.00 C HETATM 1686 NA HEC A 110 1.156 0.602 1.318 1.00 10.00 N HETATM 1687 C1A HEC A 110 0.354 0.816 2.402 1.00 10.00 C HETATM 1688 C2A HEC A 110 -1.020 0.557 2.013 1.00 10.00 C HETATM 1689 C3A HEC A 110 -0.993 0.208 0.680 1.00 10.00 C HETATM 1690 C4A HEC A 110 0.396 0.198 0.273 1.00 10.00 C HETATM 1691 CMA HEC A 110 -2.182 -0.075 -0.222 1.00 10.00 C HETATM 1692 CAA HEC A 110 -2.272 0.762 2.851 1.00 10.00 C HETATM 1693 CBA HEC A 110 -2.294 0.153 4.262 1.00 10.00 C HETATM 1694 CGA HEC A 110 -3.641 -0.476 4.668 1.00 10.00 C HETATM 1695 O1A HEC A 110 -4.391 0.148 5.458 1.00 10.00 O HETATM 1696 O2A HEC A 110 -3.948 -1.565 4.138 1.00 10.00 O HETATM 1697 NB HEC A 110 3.212 0.357 -0.673 1.00 10.00 N HETATM 1698 C1B HEC A 110 2.139 -0.079 -1.381 1.00 10.00 C HETATM 1699 C2B HEC A 110 2.605 -0.511 -2.677 1.00 10.00 C HETATM 1700 C3B HEC A 110 3.940 -0.182 -2.766 1.00 10.00 C HETATM 1701 C4B HEC A 110 4.319 0.330 -1.472 1.00 10.00 C HETATM 1702 CMB HEC A 110 1.803 -1.329 -3.662 1.00 10.00 C HETATM 1703 CAB HEC A 110 4.884 -0.478 -3.921 1.00 10.00 C HETATM 1704 CBB HEC A 110 4.332 -0.087 -5.297 1.00 10.00 C HETATM 1705 NC HEC A 110 5.214 1.021 1.221 1.00 10.00 N HETATM 1706 C1C HEC A 110 6.005 0.924 0.124 1.00 10.00 C HETATM 1707 C2C HEC A 110 7.382 1.112 0.512 1.00 10.00 C HETATM 1708 C3C HEC A 110 7.387 1.191 1.885 1.00 10.00 C HETATM 1709 C4C HEC A 110 6.000 1.201 2.310 1.00 10.00 C HETATM 1710 CMC HEC A 110 8.590 1.159 -0.408 1.00 10.00 C HETATM 1711 CAC HEC A 110 8.585 1.084 2.811 1.00 10.00 C HETATM 1712 CBC HEC A 110 9.920 1.672 2.339 1.00 10.00 C HETATM 1713 ND HEC A 110 3.170 1.241 3.234 1.00 10.00 N HETATM 1714 C1D HEC A 110 4.284 1.402 3.995 1.00 10.00 C HETATM 1715 C2D HEC A 110 3.867 1.689 5.346 1.00 10.00 C HETATM 1716 C3D HEC A 110 2.496 1.717 5.345 1.00 10.00 C HETATM 1717 C4D HEC A 110 2.062 1.364 4.015 1.00 10.00 C HETATM 1718 CMD HEC A 110 4.761 1.970 6.531 1.00 10.00 C HETATM 1719 CAD HEC A 110 1.611 2.076 6.514 1.00 10.00 C HETATM 1720 CBD HEC A 110 1.184 0.872 7.359 1.00 10.00 C HETATM 1721 CGD HEC A 110 0.036 1.253 8.298 1.00 10.00 C HETATM 1722 O1D HEC A 110 0.319 1.917 9.325 1.00 10.00 O HETATM 1723 O2D HEC A 110 -1.127 1.001 7.922 1.00 10.00 O HETATM 0 HMD3 HEC A 110 5.410 1.113 6.708 1.00 10.00 H new HETATM 0 HMD2 HEC A 110 5.370 2.851 6.327 1.00 10.00 H new HETATM 0 HMD1 HEC A 110 4.148 2.150 7.414 1.00 10.00 H new HETATM 0 HMC3 HEC A 110 8.670 0.218 -0.952 1.00 10.00 H new HETATM 0 HMC2 HEC A 110 8.476 1.979 -1.117 1.00 10.00 H new HETATM 0 HMC1 HEC A 110 9.492 1.314 0.184 1.00 10.00 H new HETATM 0 HMB3 HEC A 110 1.532 -2.282 -3.208 1.00 10.00 H new HETATM 0 HMB2 HEC A 110 0.898 -0.786 -3.934 1.00 10.00 H new HETATM 0 HMB1 HEC A 110 2.400 -1.510 -4.556 1.00 10.00 H new HETATM 0 HMA3 HEC A 110 -2.753 -0.912 0.180 1.00 10.00 H new HETATM 0 HMA2 HEC A 110 -2.819 0.808 -0.272 1.00 10.00 H new HETATM 0 HMA1 HEC A 110 -1.829 -0.324 -1.223 1.00 10.00 H new HETATM 0 HBD2 HEC A 110 0.872 0.056 6.707 1.00 10.00 H new HETATM 0 HBD1 HEC A 110 2.032 0.510 7.941 1.00 10.00 H new HETATM 0 HBC3 HEC A 110 10.231 1.177 1.419 1.00 10.00 H new HETATM 0 HBC2 HEC A 110 9.802 2.740 2.154 1.00 10.00 H new HETATM 0 HBC1 HEC A 110 10.677 1.518 3.108 1.00 10.00 H new HETATM 0 HBB3 HEC A 110 3.410 -0.636 -5.488 1.00 10.00 H new HETATM 0 HBB2 HEC A 110 4.128 0.984 -5.316 1.00 10.00 H new HETATM 0 HBB1 HEC A 110 5.065 -0.331 -6.066 1.00 10.00 H new HETATM 0 HBA2 HEC A 110 -1.518 -0.609 4.327 1.00 10.00 H new HETATM 0 HBA1 HEC A 110 -2.039 0.930 4.983 1.00 10.00 H new HETATM 0 HAD2 HEC A 110 2.137 2.787 7.151 1.00 10.00 H new HETATM 0 HAD1 HEC A 110 0.720 2.581 6.141 1.00 10.00 H new HETATM 0 HAA2 HEC A 110 -2.440 1.835 2.946 1.00 10.00 H new HETATM 0 HAA1 HEC A 110 -3.117 0.355 2.296 1.00 10.00 H new HETATM 0 HHD HEC A 110 6.366 1.428 4.388 1.00 10.00 H new HETATM 0 HHC HEC A 110 6.352 0.713 -1.953 1.00 10.00 H new HETATM 0 HHB HEC A 110 0.084 -0.536 -1.698 1.00 10.00 H new HETATM 0 HHA HEC A 110 -0.025 1.436 4.396 1.00 10.00 H new HETATM 0 H2D HEC A 110 -1.754 1.181 8.654 1.00 10.00 H new HETATM 0 H2A HEC A 110 -4.841 -1.495 3.740 1.00 10.00 H new