USER MOD reduce.3.24.130724 H: found=0, std=0, add=618, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 634 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 36 HIS HE2 : A 36 HIS NE2 : A 100 ZNZN :(H bumps) USER MOD Set 1.1: A 92 GLN : amide:sc= -0.825 K(o=-0.76,f=1.1) USER MOD Set 1.2: A 96 TYR OH : rot 110:sc= 0.0636 USER MOD Set 2.1: A 59 GLN : amide:sc= -0.286 K(o=-3.5,f=-6.7!) USER MOD Set 2.2: A 68 ASN : amide:sc= -3.25 K(o=-3.5,f=-14!) USER MOD Set 3.1: A 21 MET CE :methyl 146:sc= -0.588 (180deg=-0.642) USER MOD Set 3.2: A 25 MET CE :methyl 149:sc= -4.73 (180deg=-4.97!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 GLN : amide:sc= 0.18 K(o=0.18,f=-1.5!) USER MOD Single : A 22 GLN : amide:sc= -2.37! K(o=-2.4!,f=-1.3) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0175 USER MOD Single : A 27 SER OG : rot 161:sc= -1.82! USER MOD Single : A 37 ASN : amide:sc= -0.685 X(o=-0.68,f=-0.9) USER MOD Single : A 43 SER OG : rot 106:sc= 0.0138 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot -25:sc= 0.0422 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 161:sc= -1.47! (180deg=-2.16!) USER MOD Single : A 62 ASN : amide:sc= -0.97 K(o=-0.97,f=-4.2!) USER MOD Single : A 63 SER OG : rot 9:sc= 1.21 USER MOD Single : A 64 CYS SG : rot 180:sc= 0.0394 USER MOD Single : A 65 ASN : amide:sc= -1.5 K(o=-1.5,f=-7.8!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.0846 USER MOD Single : A 71 THR OG1 : rot -38:sc= 0.104 USER MOD Single : A 78 LYS NZ :NH3+ -109:sc= -0.049 (180deg=-1.27) USER MOD Single : A 81 TYR OH : rot 100:sc= -3.72! USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 CYS SG : rot 180:sc= -0.17 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 14 2.103 0.583 -2.192 1.00 0.00 N ATOM 2 CA GLU A 14 2.236 -0.485 -1.216 1.00 0.00 C ATOM 3 C GLU A 14 2.084 -1.848 -1.895 1.00 0.00 C ATOM 4 O GLU A 14 1.997 -2.874 -1.223 1.00 0.00 O ATOM 5 CB GLU A 14 1.221 -0.321 -0.082 1.00 0.00 C ATOM 6 CG GLU A 14 -0.206 -0.531 -0.590 1.00 0.00 C ATOM 7 CD GLU A 14 -0.789 0.772 -1.141 1.00 0.00 C ATOM 8 OE1 GLU A 14 -0.680 1.823 -0.492 1.00 0.00 O ATOM 9 OE2 GLU A 14 -1.372 0.667 -2.287 1.00 0.00 O ATOM 0 HA GLU A 14 3.233 -0.428 -0.779 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.438 -1.037 0.711 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.313 0.674 0.353 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.210 -1.293 -1.369 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -0.834 -0.900 0.221 1.00 0.00 H new ATOM 17 N ASP A 15 2.055 -1.813 -3.219 1.00 0.00 N ATOM 18 CA ASP A 15 1.915 -3.032 -3.997 1.00 0.00 C ATOM 19 C ASP A 15 3.293 -3.479 -4.490 1.00 0.00 C ATOM 20 O ASP A 15 4.184 -2.654 -4.684 1.00 0.00 O ATOM 21 CB ASP A 15 1.025 -2.805 -5.221 1.00 0.00 C ATOM 22 CG ASP A 15 0.669 -4.070 -6.004 1.00 0.00 C ATOM 23 OD1 ASP A 15 0.409 -4.019 -7.216 1.00 0.00 O ATOM 24 OD2 ASP A 15 0.662 -5.158 -5.311 1.00 0.00 O ATOM 0 H ASP A 15 2.126 -0.959 -3.773 1.00 0.00 H new ATOM 0 HA ASP A 15 1.462 -3.790 -3.358 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.102 -2.325 -4.896 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.527 -2.109 -5.893 1.00 0.00 H new ATOM 30 N GLN A 16 3.424 -4.784 -4.679 1.00 0.00 N ATOM 31 CA GLN A 16 4.678 -5.350 -5.146 1.00 0.00 C ATOM 32 C GLN A 16 4.881 -5.038 -6.630 1.00 0.00 C ATOM 33 O GLN A 16 6.011 -4.851 -7.079 1.00 0.00 O ATOM 34 CB GLN A 16 4.727 -6.858 -4.891 1.00 0.00 C ATOM 35 CG GLN A 16 6.170 -7.365 -4.881 1.00 0.00 C ATOM 36 CD GLN A 16 6.232 -8.850 -5.249 1.00 0.00 C ATOM 37 OE1 GLN A 16 6.117 -9.236 -6.400 1.00 0.00 O ATOM 38 NE2 GLN A 16 6.419 -9.657 -4.209 1.00 0.00 N ATOM 0 H GLN A 16 2.682 -5.465 -4.517 1.00 0.00 H new ATOM 0 HA GLN A 16 5.492 -4.893 -4.584 1.00 0.00 H new ATOM 0 HB2 GLN A 16 4.251 -7.085 -3.937 1.00 0.00 H new ATOM 0 HB3 GLN A 16 4.160 -7.380 -5.662 1.00 0.00 H new ATOM 0 HG2 GLN A 16 6.767 -6.787 -5.586 1.00 0.00 H new ATOM 0 HG3 GLN A 16 6.606 -7.213 -3.894 1.00 0.00 H new ATOM 0 HE21 GLN A 16 6.507 -9.267 -3.271 1.00 0.00 H new ATOM 0 HE22 GLN A 16 6.474 -10.666 -4.350 1.00 0.00 H new ATOM 47 N GLU A 17 3.770 -4.990 -7.350 1.00 0.00 N ATOM 48 CA GLU A 17 3.812 -4.703 -8.774 1.00 0.00 C ATOM 49 C GLU A 17 4.588 -3.410 -9.032 1.00 0.00 C ATOM 50 O GLU A 17 5.427 -3.354 -9.930 1.00 0.00 O ATOM 51 CB GLU A 17 2.401 -4.622 -9.359 1.00 0.00 C ATOM 52 CG GLU A 17 2.387 -5.071 -10.821 1.00 0.00 C ATOM 53 CD GLU A 17 2.572 -6.585 -10.932 1.00 0.00 C ATOM 54 OE1 GLU A 17 2.415 -7.304 -9.934 1.00 0.00 O ATOM 55 OE2 GLU A 17 2.890 -7.011 -12.108 1.00 0.00 O ATOM 0 H GLU A 17 2.835 -5.145 -6.974 1.00 0.00 H new ATOM 0 HA GLU A 17 4.330 -5.521 -9.275 1.00 0.00 H new ATOM 0 HB2 GLU A 17 1.725 -5.248 -8.776 1.00 0.00 H new ATOM 0 HB3 GLU A 17 2.031 -3.599 -9.285 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.444 -4.781 -11.285 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.181 -4.563 -11.369 1.00 0.00 H new ATOM 63 N GLN A 18 4.280 -2.403 -8.228 1.00 0.00 N ATOM 64 CA GLN A 18 4.938 -1.114 -8.359 1.00 0.00 C ATOM 65 C GLN A 18 6.440 -1.256 -8.103 1.00 0.00 C ATOM 66 O GLN A 18 7.246 -0.548 -8.705 1.00 0.00 O ATOM 67 CB GLN A 18 4.316 -0.083 -7.414 1.00 0.00 C ATOM 68 CG GLN A 18 5.039 -0.067 -6.066 1.00 0.00 C ATOM 69 CD GLN A 18 4.152 0.536 -4.975 1.00 0.00 C ATOM 70 OE1 GLN A 18 3.023 0.934 -5.207 1.00 0.00 O ATOM 71 NE2 GLN A 18 4.726 0.582 -3.776 1.00 0.00 N ATOM 0 H GLN A 18 3.584 -2.453 -7.484 1.00 0.00 H new ATOM 0 HA GLN A 18 4.795 -0.757 -9.379 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.364 0.907 -7.868 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.261 -0.313 -7.262 1.00 0.00 H new ATOM 0 HG2 GLN A 18 5.322 -1.082 -5.789 1.00 0.00 H new ATOM 0 HG3 GLN A 18 5.960 0.509 -6.150 1.00 0.00 H new ATOM 0 HE21 GLN A 18 5.676 0.231 -3.651 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.217 0.968 -2.981 1.00 0.00 H new ATOM 80 N TRP A 19 6.771 -2.175 -7.208 1.00 0.00 N ATOM 81 CA TRP A 19 8.161 -2.419 -6.865 1.00 0.00 C ATOM 82 C TRP A 19 8.865 -2.971 -8.106 1.00 0.00 C ATOM 83 O TRP A 19 10.049 -2.716 -8.318 1.00 0.00 O ATOM 84 CB TRP A 19 8.273 -3.346 -5.653 1.00 0.00 C ATOM 85 CG TRP A 19 9.712 -3.641 -5.225 1.00 0.00 C ATOM 86 CD1 TRP A 19 10.535 -2.863 -4.508 1.00 0.00 C ATOM 87 CD2 TRP A 19 10.469 -4.835 -5.516 1.00 0.00 C ATOM 88 NE1 TRP A 19 11.762 -3.465 -4.318 1.00 0.00 N ATOM 89 CE2 TRP A 19 11.720 -4.702 -4.950 1.00 0.00 C ATOM 90 CE3 TRP A 19 10.108 -5.988 -6.235 1.00 0.00 C ATOM 91 CZ2 TRP A 19 12.712 -5.686 -5.044 1.00 0.00 C ATOM 92 CZ3 TRP A 19 11.110 -6.962 -6.319 1.00 0.00 C ATOM 93 CH2 TRP A 19 12.374 -6.844 -5.755 1.00 0.00 C ATOM 0 H TRP A 19 6.100 -2.760 -6.710 1.00 0.00 H new ATOM 0 HA TRP A 19 8.653 -1.492 -6.569 1.00 0.00 H new ATOM 0 HB2 TRP A 19 7.740 -2.897 -4.815 1.00 0.00 H new ATOM 0 HB3 TRP A 19 7.773 -4.287 -5.881 1.00 0.00 H new ATOM 0 HD1 TRP A 19 10.271 -1.888 -4.127 1.00 0.00 H new ATOM 0 HE1 TRP A 19 12.554 -3.074 -3.808 1.00 0.00 H new ATOM 0 HE3 TRP A 19 9.135 -6.112 -6.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 13.685 -5.559 -4.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 10.884 -7.869 -6.860 1.00 0.00 H new ATOM 0 HH2 TRP A 19 13.093 -7.642 -5.864 1.00 0.00 H new ATOM 104 N ALA A 20 8.106 -3.718 -8.895 1.00 0.00 N ATOM 105 CA ALA A 20 8.641 -4.308 -10.110 1.00 0.00 C ATOM 106 C ALA A 20 8.892 -3.204 -11.140 1.00 0.00 C ATOM 107 O ALA A 20 9.969 -3.134 -11.729 1.00 0.00 O ATOM 108 CB ALA A 20 7.678 -5.379 -10.625 1.00 0.00 C ATOM 0 H ALA A 20 7.124 -3.928 -8.716 1.00 0.00 H new ATOM 0 HA ALA A 20 9.595 -4.797 -9.912 1.00 0.00 H new ATOM 0 HB1 ALA A 20 8.080 -5.821 -11.537 1.00 0.00 H new ATOM 0 HB2 ALA A 20 7.557 -6.154 -9.868 1.00 0.00 H new ATOM 0 HB3 ALA A 20 6.710 -4.926 -10.838 1.00 0.00 H new ATOM 114 N MET A 21 7.879 -2.371 -11.325 1.00 0.00 N ATOM 115 CA MET A 21 7.976 -1.274 -12.274 1.00 0.00 C ATOM 116 C MET A 21 9.248 -0.456 -12.038 1.00 0.00 C ATOM 117 O MET A 21 9.710 0.250 -12.933 1.00 0.00 O ATOM 118 CB MET A 21 6.752 -0.367 -12.133 1.00 0.00 C ATOM 119 CG MET A 21 5.507 -1.030 -12.727 1.00 0.00 C ATOM 120 SD MET A 21 5.295 -0.521 -14.425 1.00 0.00 S ATOM 121 CE MET A 21 4.768 1.167 -14.178 1.00 0.00 C ATOM 0 H MET A 21 6.987 -2.433 -10.834 1.00 0.00 H new ATOM 0 HA MET A 21 8.016 -1.691 -13.280 1.00 0.00 H new ATOM 0 HB2 MET A 21 6.581 -0.142 -11.080 1.00 0.00 H new ATOM 0 HB3 MET A 21 6.938 0.582 -12.636 1.00 0.00 H new ATOM 0 HG2 MET A 21 5.602 -2.115 -12.673 1.00 0.00 H new ATOM 0 HG3 MET A 21 4.627 -0.758 -12.145 1.00 0.00 H new ATOM 0 HE1 MET A 21 5.150 1.789 -14.987 1.00 0.00 H new ATOM 0 HE2 MET A 21 3.679 1.211 -14.169 1.00 0.00 H new ATOM 0 HE3 MET A 21 5.153 1.533 -13.226 1.00 0.00 H new ATOM 131 N GLN A 22 9.776 -0.579 -10.830 1.00 0.00 N ATOM 132 CA GLN A 22 10.985 0.140 -10.465 1.00 0.00 C ATOM 133 C GLN A 22 12.015 0.053 -11.593 1.00 0.00 C ATOM 134 O GLN A 22 12.204 1.011 -12.342 1.00 0.00 O ATOM 135 CB GLN A 22 11.564 -0.391 -9.152 1.00 0.00 C ATOM 136 CG GLN A 22 10.694 0.022 -7.963 1.00 0.00 C ATOM 137 CD GLN A 22 11.441 -0.177 -6.642 1.00 0.00 C ATOM 138 OE1 GLN A 22 11.580 0.728 -5.836 1.00 0.00 O ATOM 139 NE2 GLN A 22 11.912 -1.409 -6.468 1.00 0.00 N ATOM 0 H GLN A 22 9.389 -1.166 -10.091 1.00 0.00 H new ATOM 0 HA GLN A 22 10.729 1.188 -10.313 1.00 0.00 H new ATOM 0 HB2 GLN A 22 11.635 -1.478 -9.195 1.00 0.00 H new ATOM 0 HB3 GLN A 22 12.576 -0.010 -9.016 1.00 0.00 H new ATOM 0 HG2 GLN A 22 10.403 1.067 -8.066 1.00 0.00 H new ATOM 0 HG3 GLN A 22 9.776 -0.566 -7.958 1.00 0.00 H new ATOM 0 HE21 GLN A 22 11.759 -2.119 -7.184 1.00 0.00 H new ATOM 0 HE22 GLN A 22 12.426 -1.643 -5.618 1.00 0.00 H new ATOM 148 N THR A 23 12.654 -1.104 -11.680 1.00 0.00 N ATOM 149 CA THR A 23 13.660 -1.328 -12.704 1.00 0.00 C ATOM 150 C THR A 23 13.017 -1.328 -14.093 1.00 0.00 C ATOM 151 O THR A 23 13.401 -0.544 -14.959 1.00 0.00 O ATOM 152 CB THR A 23 14.390 -2.631 -12.373 1.00 0.00 C ATOM 153 OG1 THR A 23 14.610 -2.558 -10.967 1.00 0.00 O ATOM 154 CG2 THR A 23 15.799 -2.681 -12.968 1.00 0.00 C ATOM 0 H THR A 23 12.495 -1.897 -11.058 1.00 0.00 H new ATOM 0 HA THR A 23 14.394 -0.522 -12.720 1.00 0.00 H new ATOM 0 HB THR A 23 13.809 -3.476 -12.743 1.00 0.00 H new ATOM 0 HG1 THR A 23 15.078 -3.365 -10.667 1.00 0.00 H new ATOM 0 HG21 THR A 23 16.272 -3.626 -12.703 1.00 0.00 H new ATOM 0 HG22 THR A 23 15.739 -2.597 -14.053 1.00 0.00 H new ATOM 0 HG23 THR A 23 16.391 -1.856 -12.572 1.00 0.00 H new ATOM 162 N LEU A 24 12.049 -2.217 -14.261 1.00 0.00 N ATOM 163 CA LEU A 24 11.349 -2.330 -15.529 1.00 0.00 C ATOM 164 C LEU A 24 11.185 -0.938 -16.142 1.00 0.00 C ATOM 165 O LEU A 24 11.784 -0.635 -17.172 1.00 0.00 O ATOM 166 CB LEU A 24 10.028 -3.081 -15.347 1.00 0.00 C ATOM 167 CG LEU A 24 9.066 -3.043 -16.536 1.00 0.00 C ATOM 168 CD1 LEU A 24 8.041 -4.176 -16.447 1.00 0.00 C ATOM 169 CD2 LEU A 24 8.396 -1.673 -16.656 1.00 0.00 C ATOM 0 H LEU A 24 11.733 -2.866 -13.540 1.00 0.00 H new ATOM 0 HA LEU A 24 11.932 -2.923 -16.234 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.254 -4.123 -15.121 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.516 -2.670 -14.477 1.00 0.00 H new ATOM 0 HG LEU A 24 9.643 -3.200 -17.447 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.369 -4.127 -17.304 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.558 -5.135 -16.446 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.465 -4.074 -15.527 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.717 -1.673 -17.509 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.835 -1.462 -15.746 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.158 -0.907 -16.799 1.00 0.00 H new ATOM 181 N MET A 25 10.370 -0.128 -15.482 1.00 0.00 N ATOM 182 CA MET A 25 10.120 1.225 -15.948 1.00 0.00 C ATOM 183 C MET A 25 11.333 2.124 -15.699 1.00 0.00 C ATOM 184 O MET A 25 11.501 3.144 -16.366 1.00 0.00 O ATOM 185 CB MET A 25 8.902 1.799 -15.223 1.00 0.00 C ATOM 186 CG MET A 25 9.305 2.954 -14.304 1.00 0.00 C ATOM 187 SD MET A 25 7.955 3.362 -13.209 1.00 0.00 S ATOM 188 CE MET A 25 6.779 3.999 -14.390 1.00 0.00 C ATOM 0 H MET A 25 9.874 -0.383 -14.628 1.00 0.00 H new ATOM 0 HA MET A 25 9.931 1.190 -17.021 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.171 2.148 -15.953 1.00 0.00 H new ATOM 0 HB3 MET A 25 8.420 1.016 -14.638 1.00 0.00 H new ATOM 0 HG2 MET A 25 10.185 2.677 -13.723 1.00 0.00 H new ATOM 0 HG3 MET A 25 9.577 3.825 -14.899 1.00 0.00 H new ATOM 0 HE1 MET A 25 5.767 3.792 -14.043 1.00 0.00 H new ATOM 0 HE2 MET A 25 6.914 5.076 -14.493 1.00 0.00 H new ATOM 0 HE3 MET A 25 6.937 3.519 -15.356 1.00 0.00 H new ATOM 198 N GLY A 26 12.147 1.713 -14.738 1.00 0.00 N ATOM 199 CA GLY A 26 13.339 2.468 -14.393 1.00 0.00 C ATOM 200 C GLY A 26 14.396 2.359 -15.494 1.00 0.00 C ATOM 201 O GLY A 26 15.410 3.054 -15.458 1.00 0.00 O ATOM 0 H GLY A 26 12.004 0.866 -14.187 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.078 3.515 -14.237 1.00 0.00 H new ATOM 0 HA3 GLY A 26 13.749 2.098 -13.453 1.00 0.00 H new ATOM 205 N SER A 27 14.121 1.482 -16.449 1.00 0.00 N ATOM 206 CA SER A 27 15.035 1.273 -17.559 1.00 0.00 C ATOM 207 C SER A 27 15.158 2.555 -18.384 1.00 0.00 C ATOM 208 O SER A 27 16.001 2.646 -19.275 1.00 0.00 O ATOM 209 CB SER A 27 14.571 0.114 -18.444 1.00 0.00 C ATOM 210 OG SER A 27 13.892 0.572 -19.610 1.00 0.00 O ATOM 0 H SER A 27 13.278 0.908 -16.477 1.00 0.00 H new ATOM 0 HA SER A 27 16.013 1.015 -17.153 1.00 0.00 H new ATOM 0 HB2 SER A 27 15.433 -0.485 -18.738 1.00 0.00 H new ATOM 0 HB3 SER A 27 13.910 -0.537 -17.872 1.00 0.00 H new ATOM 0 HG SER A 27 13.881 -0.140 -20.283 1.00 0.00 H new ATOM 216 N GLY A 28 14.304 3.514 -18.058 1.00 0.00 N ATOM 217 CA GLY A 28 14.306 4.788 -18.758 1.00 0.00 C ATOM 218 C GLY A 28 13.217 4.825 -19.832 1.00 0.00 C ATOM 219 O GLY A 28 13.154 5.763 -20.625 1.00 0.00 O ATOM 0 H GLY A 28 13.606 3.435 -17.319 1.00 0.00 H new ATOM 0 HA2 GLY A 28 14.148 5.598 -18.046 1.00 0.00 H new ATOM 0 HA3 GLY A 28 15.281 4.953 -19.217 1.00 0.00 H new ATOM 223 N VAL A 29 12.388 3.792 -19.824 1.00 0.00 N ATOM 224 CA VAL A 29 11.305 3.694 -20.788 1.00 0.00 C ATOM 225 C VAL A 29 10.208 4.695 -20.419 1.00 0.00 C ATOM 226 O VAL A 29 9.715 5.426 -21.277 1.00 0.00 O ATOM 227 CB VAL A 29 10.798 2.252 -20.862 1.00 0.00 C ATOM 228 CG1 VAL A 29 9.388 2.196 -21.454 1.00 0.00 C ATOM 229 CG2 VAL A 29 11.763 1.372 -21.659 1.00 0.00 C ATOM 0 H VAL A 29 12.444 3.015 -19.165 1.00 0.00 H new ATOM 0 HA VAL A 29 11.658 3.951 -21.787 1.00 0.00 H new ATOM 0 HB VAL A 29 10.750 1.861 -19.846 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.052 1.160 -21.495 1.00 0.00 H new ATOM 0 HG12 VAL A 29 8.708 2.774 -20.828 1.00 0.00 H new ATOM 0 HG13 VAL A 29 9.399 2.614 -22.460 1.00 0.00 H new ATOM 0 HG21 VAL A 29 11.379 0.352 -21.696 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.858 1.761 -22.673 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.740 1.374 -21.177 1.00 0.00 H new ATOM 239 N LEU A 30 9.858 4.697 -19.141 1.00 0.00 N ATOM 240 CA LEU A 30 8.829 5.596 -18.648 1.00 0.00 C ATOM 241 C LEU A 30 9.488 6.771 -17.923 1.00 0.00 C ATOM 242 O LEU A 30 10.711 6.822 -17.801 1.00 0.00 O ATOM 243 CB LEU A 30 7.818 4.833 -17.789 1.00 0.00 C ATOM 244 CG LEU A 30 6.677 4.148 -18.545 1.00 0.00 C ATOM 245 CD1 LEU A 30 5.853 3.262 -17.609 1.00 0.00 C ATOM 246 CD2 LEU A 30 5.809 5.175 -19.275 1.00 0.00 C ATOM 0 H LEU A 30 10.269 4.090 -18.432 1.00 0.00 H new ATOM 0 HA LEU A 30 8.258 6.013 -19.478 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.355 4.076 -17.218 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.385 5.528 -17.069 1.00 0.00 H new ATOM 0 HG LEU A 30 7.112 3.497 -19.303 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.049 2.787 -18.171 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.495 2.495 -17.176 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.427 3.872 -16.812 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.006 4.662 -19.804 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.382 5.870 -18.552 1.00 0.00 H new ATOM 0 HD23 LEU A 30 6.420 5.726 -19.990 1.00 0.00 H new ATOM 258 N ALA A 31 8.649 7.687 -17.463 1.00 0.00 N ATOM 259 CA ALA A 31 9.136 8.858 -16.754 1.00 0.00 C ATOM 260 C ALA A 31 8.446 8.947 -15.391 1.00 0.00 C ATOM 261 O ALA A 31 7.223 8.849 -15.302 1.00 0.00 O ATOM 262 CB ALA A 31 8.902 10.106 -17.608 1.00 0.00 C ATOM 0 H ALA A 31 7.635 7.642 -17.567 1.00 0.00 H new ATOM 0 HA ALA A 31 10.209 8.781 -16.577 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.267 10.985 -17.076 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.436 10.006 -18.553 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.836 10.218 -17.804 1.00 0.00 H new ATOM 268 N ARG A 32 9.260 9.132 -14.362 1.00 0.00 N ATOM 269 CA ARG A 32 8.744 9.235 -13.008 1.00 0.00 C ATOM 270 C ARG A 32 8.633 10.704 -12.592 1.00 0.00 C ATOM 271 O ARG A 32 9.583 11.470 -12.747 1.00 0.00 O ATOM 272 CB ARG A 32 9.647 8.499 -12.017 1.00 0.00 C ATOM 273 CG ARG A 32 9.541 6.983 -12.200 1.00 0.00 C ATOM 274 CD ARG A 32 8.429 6.401 -11.326 1.00 0.00 C ATOM 275 NE ARG A 32 7.149 7.086 -11.613 1.00 0.00 N ATOM 276 CZ ARG A 32 6.666 8.109 -10.895 1.00 0.00 C ATOM 277 NH1 ARG A 32 7.354 8.572 -9.842 1.00 0.00 N ATOM 278 NH2 ARG A 32 5.496 8.670 -11.229 1.00 0.00 N ATOM 0 H ARG A 32 10.274 9.213 -14.439 1.00 0.00 H new ATOM 0 HA ARG A 32 7.756 8.774 -12.994 1.00 0.00 H new ATOM 0 HB2 ARG A 32 10.681 8.815 -12.158 1.00 0.00 H new ATOM 0 HB3 ARG A 32 9.368 8.766 -10.998 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.344 6.753 -13.247 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.492 6.515 -11.944 1.00 0.00 H new ATOM 0 HD2 ARG A 32 8.329 5.332 -11.514 1.00 0.00 H new ATOM 0 HD3 ARG A 32 8.685 6.517 -10.273 1.00 0.00 H new ATOM 0 HE ARG A 32 6.600 6.759 -12.408 1.00 0.00 H new ATOM 0 HH11 ARG A 32 8.245 8.146 -9.587 1.00 0.00 H new ATOM 0 HH12 ARG A 32 6.987 9.351 -9.295 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.972 8.318 -12.030 1.00 0.00 H new ATOM 0 HH22 ARG A 32 5.129 9.449 -10.682 1.00 0.00 H new ATOM 292 N CYS A 33 7.465 11.052 -12.073 1.00 0.00 N ATOM 293 CA CYS A 33 7.218 12.415 -11.634 1.00 0.00 C ATOM 294 C CYS A 33 7.613 12.524 -10.160 1.00 0.00 C ATOM 295 O CYS A 33 7.115 11.773 -9.323 1.00 0.00 O ATOM 296 CB CYS A 33 5.763 12.829 -11.867 1.00 0.00 C ATOM 297 SG CYS A 33 5.550 13.427 -13.583 1.00 0.00 S ATOM 0 H CYS A 33 6.679 10.414 -11.947 1.00 0.00 H new ATOM 0 HA CYS A 33 7.822 13.105 -12.223 1.00 0.00 H new ATOM 0 HB2 CYS A 33 5.101 11.982 -11.683 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.482 13.612 -11.163 1.00 0.00 H new ATOM 302 N ARG A 34 8.505 13.465 -9.888 1.00 0.00 N ATOM 303 CA ARG A 34 8.973 13.682 -8.530 1.00 0.00 C ATOM 304 C ARG A 34 7.894 14.383 -7.702 1.00 0.00 C ATOM 305 O ARG A 34 8.082 14.631 -6.512 1.00 0.00 O ATOM 306 CB ARG A 34 10.248 14.529 -8.515 1.00 0.00 C ATOM 307 CG ARG A 34 9.965 15.954 -8.997 1.00 0.00 C ATOM 308 CD ARG A 34 11.125 16.890 -8.650 1.00 0.00 C ATOM 309 NE ARG A 34 12.380 16.385 -9.251 1.00 0.00 N ATOM 310 CZ ARG A 34 12.773 16.651 -10.504 1.00 0.00 C ATOM 311 NH1 ARG A 34 12.012 17.418 -11.296 1.00 0.00 N ATOM 312 NH2 ARG A 34 13.927 16.150 -10.964 1.00 0.00 N ATOM 0 H ARG A 34 8.916 14.086 -10.585 1.00 0.00 H new ATOM 0 HA ARG A 34 9.193 12.707 -8.096 1.00 0.00 H new ATOM 0 HB2 ARG A 34 10.658 14.557 -7.506 1.00 0.00 H new ATOM 0 HB3 ARG A 34 11.002 14.069 -9.153 1.00 0.00 H new ATOM 0 HG2 ARG A 34 9.804 15.952 -10.075 1.00 0.00 H new ATOM 0 HG3 ARG A 34 9.047 16.321 -8.539 1.00 0.00 H new ATOM 0 HD2 ARG A 34 10.915 17.895 -9.017 1.00 0.00 H new ATOM 0 HD3 ARG A 34 11.234 16.962 -7.568 1.00 0.00 H new ATOM 0 HE ARG A 34 12.983 15.798 -8.675 1.00 0.00 H new ATOM 0 HH11 ARG A 34 11.133 17.799 -10.945 1.00 0.00 H new ATOM 0 HH12 ARG A 34 12.311 17.621 -12.250 1.00 0.00 H new ATOM 0 HH21 ARG A 34 14.506 15.566 -10.360 1.00 0.00 H new ATOM 0 HH22 ARG A 34 14.227 16.352 -11.918 1.00 0.00 H new ATOM 326 N ILE A 35 6.787 14.684 -8.365 1.00 0.00 N ATOM 327 CA ILE A 35 5.678 15.351 -7.706 1.00 0.00 C ATOM 328 C ILE A 35 4.551 14.344 -7.468 1.00 0.00 C ATOM 329 O ILE A 35 3.679 14.568 -6.629 1.00 0.00 O ATOM 330 CB ILE A 35 5.243 16.583 -8.502 1.00 0.00 C ATOM 331 CG1 ILE A 35 6.347 17.642 -8.519 1.00 0.00 C ATOM 332 CG2 ILE A 35 3.921 17.141 -7.971 1.00 0.00 C ATOM 333 CD1 ILE A 35 7.116 17.612 -9.842 1.00 0.00 C ATOM 0 H ILE A 35 6.635 14.478 -9.352 1.00 0.00 H new ATOM 0 HA ILE A 35 5.985 15.724 -6.729 1.00 0.00 H new ATOM 0 HB ILE A 35 5.072 16.279 -9.535 1.00 0.00 H new ATOM 0 HG12 ILE A 35 5.911 18.630 -8.370 1.00 0.00 H new ATOM 0 HG13 ILE A 35 7.034 17.469 -7.691 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.635 18.016 -8.554 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.145 16.380 -8.054 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.040 17.425 -6.925 1.00 0.00 H new ATOM 0 HD11 ILE A 35 7.895 18.375 -9.828 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.571 16.631 -9.976 1.00 0.00 H new ATOM 0 HD13 ILE A 35 6.430 17.809 -10.666 1.00 0.00 H new ATOM 345 N HIS A 36 4.605 13.255 -8.221 1.00 0.00 N ATOM 346 CA HIS A 36 3.600 12.212 -8.102 1.00 0.00 C ATOM 347 C HIS A 36 4.165 10.892 -8.629 1.00 0.00 C ATOM 348 O HIS A 36 4.842 10.868 -9.656 1.00 0.00 O ATOM 349 CB HIS A 36 2.304 12.625 -8.803 1.00 0.00 C ATOM 350 CG HIS A 36 2.461 13.794 -9.746 1.00 0.00 C ATOM 351 ND1 HIS A 36 2.056 15.077 -9.423 1.00 0.00 N ATOM 352 CD2 HIS A 36 2.983 13.861 -11.004 1.00 0.00 C ATOM 353 CE1 HIS A 36 2.326 15.872 -10.448 1.00 0.00 C ATOM 354 NE2 HIS A 36 2.900 15.116 -11.427 1.00 0.00 N ATOM 0 H HIS A 36 5.329 13.072 -8.916 1.00 0.00 H new ATOM 0 HA HIS A 36 3.346 12.064 -7.052 1.00 0.00 H new ATOM 0 HB2 HIS A 36 1.916 11.772 -9.360 1.00 0.00 H new ATOM 0 HB3 HIS A 36 1.559 12.878 -8.048 1.00 0.00 H new ATOM 0 HD1 HIS A 36 1.623 15.362 -8.545 1.00 0.00 H new ATOM 0 HD2 HIS A 36 3.394 13.033 -11.562 1.00 0.00 H new ATOM 0 HE1 HIS A 36 2.127 16.932 -10.499 1.00 0.00 H new ATOM 362 N ASN A 37 3.866 9.825 -7.903 1.00 0.00 N ATOM 363 CA ASN A 37 4.336 8.504 -8.284 1.00 0.00 C ATOM 364 C ASN A 37 3.224 7.770 -9.037 1.00 0.00 C ATOM 365 O ASN A 37 3.463 6.725 -9.640 1.00 0.00 O ATOM 366 CB ASN A 37 4.701 7.673 -7.053 1.00 0.00 C ATOM 367 CG ASN A 37 4.539 6.177 -7.334 1.00 0.00 C ATOM 368 OD1 ASN A 37 3.504 5.582 -7.087 1.00 0.00 O ATOM 369 ND2 ASN A 37 5.618 5.606 -7.862 1.00 0.00 N ATOM 0 H ASN A 37 3.304 9.848 -7.052 1.00 0.00 H new ATOM 0 HA ASN A 37 5.220 8.628 -8.910 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.730 7.882 -6.760 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.066 7.960 -6.215 1.00 0.00 H new ATOM 0 HD21 ASN A 37 5.611 4.611 -8.085 1.00 0.00 H new ATOM 0 HD22 ASN A 37 6.453 6.163 -8.044 1.00 0.00 H new ATOM 376 N ASP A 38 2.033 8.347 -8.978 1.00 0.00 N ATOM 377 CA ASP A 38 0.884 7.760 -9.647 1.00 0.00 C ATOM 378 C ASP A 38 0.740 8.377 -11.040 1.00 0.00 C ATOM 379 O ASP A 38 -0.275 8.183 -11.707 1.00 0.00 O ATOM 380 CB ASP A 38 -0.406 8.038 -8.872 1.00 0.00 C ATOM 381 CG ASP A 38 -0.801 9.513 -8.781 1.00 0.00 C ATOM 382 OD1 ASP A 38 -0.893 10.213 -9.800 1.00 0.00 O ATOM 383 OD2 ASP A 38 -1.023 9.946 -7.586 1.00 0.00 O ATOM 0 H ASP A 38 1.839 9.214 -8.478 1.00 0.00 H new ATOM 0 HA ASP A 38 1.043 6.683 -9.708 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -1.221 7.488 -9.343 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -0.297 7.644 -7.862 1.00 0.00 H new ATOM 389 N VAL A 39 1.771 9.109 -11.437 1.00 0.00 N ATOM 390 CA VAL A 39 1.772 9.755 -12.738 1.00 0.00 C ATOM 391 C VAL A 39 3.017 9.324 -13.516 1.00 0.00 C ATOM 392 O VAL A 39 4.140 9.610 -13.104 1.00 0.00 O ATOM 393 CB VAL A 39 1.668 11.272 -12.569 1.00 0.00 C ATOM 394 CG1 VAL A 39 2.495 12.000 -13.631 1.00 0.00 C ATOM 395 CG2 VAL A 39 0.208 11.729 -12.602 1.00 0.00 C ATOM 0 H VAL A 39 2.611 9.269 -10.881 1.00 0.00 H new ATOM 0 HA VAL A 39 0.903 9.446 -13.319 1.00 0.00 H new ATOM 0 HB VAL A 39 2.077 11.529 -11.592 1.00 0.00 H new ATOM 0 HG11 VAL A 39 2.404 13.077 -13.488 1.00 0.00 H new ATOM 0 HG12 VAL A 39 3.542 11.709 -13.540 1.00 0.00 H new ATOM 0 HG13 VAL A 39 2.130 11.733 -14.623 1.00 0.00 H new ATOM 0 HG21 VAL A 39 0.163 12.811 -12.480 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.238 11.453 -13.557 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.342 11.249 -11.792 1.00 0.00 H new ATOM 405 N ILE A 40 2.776 8.644 -14.627 1.00 0.00 N ATOM 406 CA ILE A 40 3.864 8.171 -15.466 1.00 0.00 C ATOM 407 C ILE A 40 3.827 8.909 -16.806 1.00 0.00 C ATOM 408 O ILE A 40 2.753 9.171 -17.345 1.00 0.00 O ATOM 409 CB ILE A 40 3.813 6.648 -15.601 1.00 0.00 C ATOM 410 CG1 ILE A 40 3.983 5.970 -14.240 1.00 0.00 C ATOM 411 CG2 ILE A 40 4.841 6.153 -16.620 1.00 0.00 C ATOM 412 CD1 ILE A 40 3.244 4.631 -14.198 1.00 0.00 C ATOM 0 H ILE A 40 1.843 8.409 -14.966 1.00 0.00 H new ATOM 0 HA ILE A 40 4.826 8.395 -15.005 1.00 0.00 H new ATOM 0 HB ILE A 40 2.828 6.372 -15.977 1.00 0.00 H new ATOM 0 HG12 ILE A 40 5.042 5.811 -14.039 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.604 6.623 -13.454 1.00 0.00 H new ATOM 0 HG21 ILE A 40 4.784 5.067 -16.697 1.00 0.00 H new ATOM 0 HG22 ILE A 40 4.632 6.597 -17.593 1.00 0.00 H new ATOM 0 HG23 ILE A 40 5.841 6.442 -16.297 1.00 0.00 H new ATOM 0 HD11 ILE A 40 3.381 4.170 -13.220 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.181 4.796 -14.375 1.00 0.00 H new ATOM 0 HD13 ILE A 40 3.642 3.971 -14.969 1.00 0.00 H new ATOM 424 N LEU A 41 5.013 9.224 -17.304 1.00 0.00 N ATOM 425 CA LEU A 41 5.130 9.927 -18.571 1.00 0.00 C ATOM 426 C LEU A 41 5.812 9.016 -19.594 1.00 0.00 C ATOM 427 O LEU A 41 6.707 8.247 -19.246 1.00 0.00 O ATOM 428 CB LEU A 41 5.838 11.269 -18.375 1.00 0.00 C ATOM 429 CG LEU A 41 5.609 11.958 -17.028 1.00 0.00 C ATOM 430 CD1 LEU A 41 6.672 13.028 -16.772 1.00 0.00 C ATOM 431 CD2 LEU A 41 4.191 12.525 -16.936 1.00 0.00 C ATOM 0 H LEU A 41 5.902 9.006 -16.854 1.00 0.00 H new ATOM 0 HA LEU A 41 4.143 10.168 -18.966 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.909 11.114 -18.504 1.00 0.00 H new ATOM 0 HB3 LEU A 41 5.516 11.946 -19.166 1.00 0.00 H new ATOM 0 HG LEU A 41 5.708 11.211 -16.241 1.00 0.00 H new ATOM 0 HD11 LEU A 41 6.486 13.502 -15.808 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.659 12.566 -16.765 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.629 13.779 -17.560 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.055 13.009 -15.969 1.00 0.00 H new ATOM 0 HD22 LEU A 41 4.038 13.254 -17.732 1.00 0.00 H new ATOM 0 HD23 LEU A 41 3.468 11.716 -17.042 1.00 0.00 H new ATOM 443 N ASP A 42 5.363 9.132 -20.834 1.00 0.00 N ATOM 444 CA ASP A 42 5.918 8.328 -21.910 1.00 0.00 C ATOM 445 C ASP A 42 7.154 9.029 -22.479 1.00 0.00 C ATOM 446 O ASP A 42 7.050 10.120 -23.038 1.00 0.00 O ATOM 447 CB ASP A 42 4.908 8.155 -23.046 1.00 0.00 C ATOM 448 CG ASP A 42 5.214 7.011 -24.015 1.00 0.00 C ATOM 449 OD1 ASP A 42 5.928 6.057 -23.671 1.00 0.00 O ATOM 450 OD2 ASP A 42 4.679 7.127 -25.182 1.00 0.00 O ATOM 0 H ASP A 42 4.621 9.771 -21.119 1.00 0.00 H new ATOM 0 HA ASP A 42 6.173 7.350 -21.503 1.00 0.00 H new ATOM 0 HB2 ASP A 42 3.921 7.990 -22.613 1.00 0.00 H new ATOM 0 HB3 ASP A 42 4.856 9.086 -23.611 1.00 0.00 H new ATOM 456 N SER A 43 8.294 8.374 -22.317 1.00 0.00 N ATOM 457 CA SER A 43 9.547 8.921 -22.807 1.00 0.00 C ATOM 458 C SER A 43 9.520 9.003 -24.334 1.00 0.00 C ATOM 459 O SER A 43 9.926 10.011 -24.912 1.00 0.00 O ATOM 460 CB SER A 43 10.736 8.076 -22.342 1.00 0.00 C ATOM 461 OG SER A 43 10.973 8.213 -20.944 1.00 0.00 O ATOM 0 H SER A 43 8.376 7.469 -21.853 1.00 0.00 H new ATOM 0 HA SER A 43 9.666 9.924 -22.397 1.00 0.00 H new ATOM 0 HB2 SER A 43 10.550 7.028 -22.577 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.629 8.373 -22.892 1.00 0.00 H new ATOM 0 HG SER A 43 10.676 7.402 -20.481 1.00 0.00 H new ATOM 467 N GLY A 44 9.038 7.931 -24.945 1.00 0.00 N ATOM 468 CA GLY A 44 8.953 7.870 -26.394 1.00 0.00 C ATOM 469 C GLY A 44 10.085 7.020 -26.975 1.00 0.00 C ATOM 470 O GLY A 44 10.433 7.160 -28.146 1.00 0.00 O ATOM 0 H GLY A 44 8.702 7.097 -24.463 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.991 7.450 -26.688 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.001 8.877 -26.807 1.00 0.00 H new ATOM 474 N ASN A 45 10.629 6.158 -26.128 1.00 0.00 N ATOM 475 CA ASN A 45 11.715 5.286 -26.543 1.00 0.00 C ATOM 476 C ASN A 45 11.207 3.845 -26.613 1.00 0.00 C ATOM 477 O ASN A 45 10.092 3.554 -26.182 1.00 0.00 O ATOM 478 CB ASN A 45 12.871 5.332 -25.541 1.00 0.00 C ATOM 479 CG ASN A 45 13.854 6.452 -25.890 1.00 0.00 C ATOM 480 OD1 ASN A 45 14.905 6.233 -26.469 1.00 0.00 O ATOM 481 ND2 ASN A 45 13.455 7.661 -25.505 1.00 0.00 N ATOM 0 H ASN A 45 10.338 6.045 -25.157 1.00 0.00 H new ATOM 0 HA ASN A 45 12.068 5.626 -27.517 1.00 0.00 H new ATOM 0 HB2 ASN A 45 12.480 5.487 -24.536 1.00 0.00 H new ATOM 0 HB3 ASN A 45 13.392 4.374 -25.537 1.00 0.00 H new ATOM 0 HD21 ASN A 45 14.041 8.475 -25.691 1.00 0.00 H new ATOM 0 HD22 ASN A 45 12.563 7.774 -25.024 1.00 0.00 H new ATOM 488 N ASP A 46 12.050 2.980 -27.159 1.00 0.00 N ATOM 489 CA ASP A 46 11.701 1.576 -27.291 1.00 0.00 C ATOM 490 C ASP A 46 11.223 1.044 -25.938 1.00 0.00 C ATOM 491 O ASP A 46 12.010 0.928 -25.000 1.00 0.00 O ATOM 492 CB ASP A 46 12.910 0.746 -27.725 1.00 0.00 C ATOM 493 CG ASP A 46 13.555 1.182 -29.042 1.00 0.00 C ATOM 494 OD1 ASP A 46 13.846 2.369 -29.249 1.00 0.00 O ATOM 495 OD2 ASP A 46 13.760 0.231 -29.890 1.00 0.00 O ATOM 0 H ASP A 46 12.974 3.225 -27.515 1.00 0.00 H new ATOM 0 HA ASP A 46 10.918 1.493 -28.045 1.00 0.00 H new ATOM 0 HB2 ASP A 46 13.663 0.789 -26.938 1.00 0.00 H new ATOM 0 HB3 ASP A 46 12.603 -0.296 -27.816 1.00 0.00 H new ATOM 501 N ALA A 47 9.936 0.735 -25.881 1.00 0.00 N ATOM 502 CA ALA A 47 9.344 0.219 -24.658 1.00 0.00 C ATOM 503 C ALA A 47 9.739 -1.250 -24.487 1.00 0.00 C ATOM 504 O ALA A 47 9.703 -1.780 -23.378 1.00 0.00 O ATOM 505 CB ALA A 47 7.828 0.413 -24.703 1.00 0.00 C ATOM 0 H ALA A 47 9.287 0.832 -26.662 1.00 0.00 H new ATOM 0 HA ALA A 47 9.716 0.765 -23.791 1.00 0.00 H new ATOM 0 HB1 ALA A 47 7.384 0.026 -23.786 1.00 0.00 H new ATOM 0 HB2 ALA A 47 7.600 1.475 -24.797 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.418 -0.123 -25.559 1.00 0.00 H new ATOM 511 N SER A 48 10.106 -1.865 -25.601 1.00 0.00 N ATOM 512 CA SER A 48 10.507 -3.261 -25.588 1.00 0.00 C ATOM 513 C SER A 48 11.598 -3.483 -24.540 1.00 0.00 C ATOM 514 O SER A 48 11.642 -4.530 -23.896 1.00 0.00 O ATOM 515 CB SER A 48 10.997 -3.707 -26.968 1.00 0.00 C ATOM 516 OG SER A 48 11.668 -4.963 -26.916 1.00 0.00 O ATOM 0 H SER A 48 10.134 -1.422 -26.519 1.00 0.00 H new ATOM 0 HA SER A 48 9.636 -3.864 -25.329 1.00 0.00 H new ATOM 0 HB2 SER A 48 10.149 -3.777 -27.649 1.00 0.00 H new ATOM 0 HB3 SER A 48 11.671 -2.953 -27.375 1.00 0.00 H new ATOM 0 HG SER A 48 11.964 -5.213 -27.816 1.00 0.00 H new ATOM 522 N SER A 49 12.453 -2.480 -24.401 1.00 0.00 N ATOM 523 CA SER A 49 13.542 -2.552 -23.441 1.00 0.00 C ATOM 524 C SER A 49 12.985 -2.774 -22.034 1.00 0.00 C ATOM 525 O SER A 49 13.457 -3.646 -21.306 1.00 0.00 O ATOM 526 CB SER A 49 14.395 -1.283 -23.481 1.00 0.00 C ATOM 527 OG SER A 49 15.652 -1.464 -22.834 1.00 0.00 O ATOM 0 H SER A 49 12.414 -1.613 -24.937 1.00 0.00 H new ATOM 0 HA SER A 49 14.180 -3.394 -23.709 1.00 0.00 H new ATOM 0 HB2 SER A 49 14.560 -0.990 -24.518 1.00 0.00 H new ATOM 0 HB3 SER A 49 13.854 -0.467 -23.001 1.00 0.00 H new ATOM 0 HG SER A 49 16.168 -0.632 -22.882 1.00 0.00 H new ATOM 533 N ALA A 50 11.990 -1.969 -21.692 1.00 0.00 N ATOM 534 CA ALA A 50 11.364 -2.066 -20.384 1.00 0.00 C ATOM 535 C ALA A 50 10.672 -3.425 -20.255 1.00 0.00 C ATOM 536 O ALA A 50 10.719 -4.051 -19.197 1.00 0.00 O ATOM 537 CB ALA A 50 10.395 -0.898 -20.194 1.00 0.00 C ATOM 0 H ALA A 50 11.602 -1.246 -22.298 1.00 0.00 H new ATOM 0 HA ALA A 50 12.112 -2.000 -19.594 1.00 0.00 H new ATOM 0 HB1 ALA A 50 9.925 -0.971 -19.213 1.00 0.00 H new ATOM 0 HB2 ALA A 50 10.941 0.043 -20.266 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.627 -0.933 -20.967 1.00 0.00 H new ATOM 543 N TYR A 51 10.046 -3.841 -21.346 1.00 0.00 N ATOM 544 CA TYR A 51 9.345 -5.113 -21.368 1.00 0.00 C ATOM 545 C TYR A 51 10.300 -6.270 -21.065 1.00 0.00 C ATOM 546 O TYR A 51 9.991 -7.137 -20.249 1.00 0.00 O ATOM 547 CB TYR A 51 8.804 -5.273 -22.790 1.00 0.00 C ATOM 548 CG TYR A 51 7.407 -4.682 -22.994 1.00 0.00 C ATOM 549 CD1 TYR A 51 6.309 -5.296 -22.427 1.00 0.00 C ATOM 550 CD2 TYR A 51 7.246 -3.536 -23.745 1.00 0.00 C ATOM 551 CE1 TYR A 51 4.994 -4.741 -22.620 1.00 0.00 C ATOM 552 CE2 TYR A 51 5.931 -2.980 -23.937 1.00 0.00 C ATOM 553 CZ TYR A 51 4.871 -3.610 -23.365 1.00 0.00 C ATOM 554 OH TYR A 51 3.629 -3.085 -23.547 1.00 0.00 O ATOM 0 H TYR A 51 10.010 -3.319 -22.222 1.00 0.00 H new ATOM 0 HA TYR A 51 8.555 -5.129 -20.617 1.00 0.00 H new ATOM 0 HB2 TYR A 51 9.494 -4.797 -23.486 1.00 0.00 H new ATOM 0 HB3 TYR A 51 8.779 -6.333 -23.041 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.436 -6.193 -21.839 1.00 0.00 H new ATOM 0 HD2 TYR A 51 8.106 -3.056 -24.189 1.00 0.00 H new ATOM 0 HE1 TYR A 51 4.126 -5.212 -22.183 1.00 0.00 H new ATOM 0 HE2 TYR A 51 5.791 -2.083 -24.522 1.00 0.00 H new ATOM 0 HH TYR A 51 3.693 -2.277 -24.099 1.00 0.00 H new ATOM 564 N LYS A 52 11.440 -6.246 -21.740 1.00 0.00 N ATOM 565 CA LYS A 52 12.442 -7.281 -21.553 1.00 0.00 C ATOM 566 C LYS A 52 12.893 -7.291 -20.091 1.00 0.00 C ATOM 567 O LYS A 52 12.925 -8.343 -19.455 1.00 0.00 O ATOM 568 CB LYS A 52 13.589 -7.103 -22.550 1.00 0.00 C ATOM 569 CG LYS A 52 14.762 -8.024 -22.207 1.00 0.00 C ATOM 570 CD LYS A 52 15.894 -7.873 -23.225 1.00 0.00 C ATOM 571 CE LYS A 52 16.905 -9.013 -23.094 1.00 0.00 C ATOM 572 NZ LYS A 52 18.038 -8.811 -24.025 1.00 0.00 N ATOM 0 H LYS A 52 11.692 -5.526 -22.417 1.00 0.00 H new ATOM 0 HA LYS A 52 12.018 -8.263 -21.762 1.00 0.00 H new ATOM 0 HB2 LYS A 52 13.236 -7.318 -23.558 1.00 0.00 H new ATOM 0 HB3 LYS A 52 13.923 -6.065 -22.544 1.00 0.00 H new ATOM 0 HG2 LYS A 52 15.132 -7.791 -21.209 1.00 0.00 H new ATOM 0 HG3 LYS A 52 14.422 -9.059 -22.187 1.00 0.00 H new ATOM 0 HD2 LYS A 52 15.481 -7.862 -24.234 1.00 0.00 H new ATOM 0 HD3 LYS A 52 16.397 -6.917 -23.076 1.00 0.00 H new ATOM 0 HE2 LYS A 52 17.273 -9.064 -22.069 1.00 0.00 H new ATOM 0 HE3 LYS A 52 16.418 -9.965 -23.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 18.715 -9.594 -23.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 17.684 -8.785 -25.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 18.512 -7.912 -23.805 1.00 0.00 H new ATOM 586 N LEU A 53 13.232 -6.108 -19.602 1.00 0.00 N ATOM 587 CA LEU A 53 13.680 -5.967 -18.227 1.00 0.00 C ATOM 588 C LEU A 53 12.529 -6.316 -17.282 1.00 0.00 C ATOM 589 O LEU A 53 12.757 -6.769 -16.161 1.00 0.00 O ATOM 590 CB LEU A 53 14.265 -4.572 -17.994 1.00 0.00 C ATOM 591 CG LEU A 53 15.060 -4.386 -16.701 1.00 0.00 C ATOM 592 CD1 LEU A 53 14.158 -3.893 -15.568 1.00 0.00 C ATOM 593 CD2 LEU A 53 15.803 -5.669 -16.324 1.00 0.00 C ATOM 0 H LEU A 53 13.206 -5.238 -20.133 1.00 0.00 H new ATOM 0 HA LEU A 53 14.489 -6.666 -18.017 1.00 0.00 H new ATOM 0 HB2 LEU A 53 14.914 -4.327 -18.835 1.00 0.00 H new ATOM 0 HB3 LEU A 53 13.448 -3.851 -18.001 1.00 0.00 H new ATOM 0 HG LEU A 53 15.813 -3.616 -16.872 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.749 -3.769 -14.660 1.00 0.00 H new ATOM 0 HD12 LEU A 53 13.715 -2.937 -15.846 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.367 -4.621 -15.390 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.360 -5.509 -15.401 1.00 0.00 H new ATOM 0 HD22 LEU A 53 15.085 -6.476 -16.179 1.00 0.00 H new ATOM 0 HD23 LEU A 53 16.494 -5.937 -17.123 1.00 0.00 H new ATOM 605 N GLY A 54 11.317 -6.092 -17.768 1.00 0.00 N ATOM 606 CA GLY A 54 10.130 -6.377 -16.980 1.00 0.00 C ATOM 607 C GLY A 54 9.947 -7.885 -16.791 1.00 0.00 C ATOM 608 O GLY A 54 9.764 -8.355 -15.669 1.00 0.00 O ATOM 0 H GLY A 54 11.131 -5.716 -18.698 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.210 -5.892 -16.007 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.252 -5.959 -17.474 1.00 0.00 H new ATOM 612 N THR A 55 10.002 -8.599 -17.905 1.00 0.00 N ATOM 613 CA THR A 55 9.844 -10.044 -17.876 1.00 0.00 C ATOM 614 C THR A 55 10.982 -10.688 -17.083 1.00 0.00 C ATOM 615 O THR A 55 10.782 -11.701 -16.413 1.00 0.00 O ATOM 616 CB THR A 55 9.754 -10.539 -19.321 1.00 0.00 C ATOM 617 OG1 THR A 55 10.981 -10.117 -19.910 1.00 0.00 O ATOM 618 CG2 THR A 55 8.682 -9.802 -20.127 1.00 0.00 C ATOM 0 H THR A 55 10.154 -8.205 -18.833 1.00 0.00 H new ATOM 0 HA THR A 55 8.927 -10.332 -17.361 1.00 0.00 H new ATOM 0 HB THR A 55 9.541 -11.608 -19.325 1.00 0.00 H new ATOM 0 HG1 THR A 55 11.325 -9.338 -19.426 1.00 0.00 H new ATOM 0 HG21 THR A 55 8.660 -10.192 -21.145 1.00 0.00 H new ATOM 0 HG22 THR A 55 7.709 -9.952 -19.660 1.00 0.00 H new ATOM 0 HG23 THR A 55 8.913 -8.737 -20.151 1.00 0.00 H new ATOM 626 N TYR A 56 12.153 -10.076 -17.185 1.00 0.00 N ATOM 627 CA TYR A 56 13.323 -10.577 -16.485 1.00 0.00 C ATOM 628 C TYR A 56 13.140 -10.480 -14.969 1.00 0.00 C ATOM 629 O TYR A 56 13.323 -11.464 -14.254 1.00 0.00 O ATOM 630 CB TYR A 56 14.485 -9.674 -16.905 1.00 0.00 C ATOM 631 CG TYR A 56 15.812 -10.008 -16.220 1.00 0.00 C ATOM 632 CD1 TYR A 56 16.473 -11.179 -16.530 1.00 0.00 C ATOM 633 CD2 TYR A 56 16.347 -9.138 -15.292 1.00 0.00 C ATOM 634 CE1 TYR A 56 17.722 -11.493 -15.886 1.00 0.00 C ATOM 635 CE2 TYR A 56 17.596 -9.452 -14.648 1.00 0.00 C ATOM 636 CZ TYR A 56 18.222 -10.614 -14.976 1.00 0.00 C ATOM 637 OH TYR A 56 19.401 -10.911 -14.367 1.00 0.00 O ATOM 0 H TYR A 56 12.316 -9.237 -17.742 1.00 0.00 H new ATOM 0 HA TYR A 56 13.497 -11.625 -16.731 1.00 0.00 H new ATOM 0 HB2 TYR A 56 14.617 -9.747 -17.985 1.00 0.00 H new ATOM 0 HB3 TYR A 56 14.225 -8.639 -16.685 1.00 0.00 H new ATOM 0 HD1 TYR A 56 16.053 -11.860 -17.256 1.00 0.00 H new ATOM 0 HD2 TYR A 56 15.829 -8.222 -15.049 1.00 0.00 H new ATOM 0 HE1 TYR A 56 18.250 -12.406 -16.120 1.00 0.00 H new ATOM 0 HE2 TYR A 56 18.026 -8.780 -13.921 1.00 0.00 H new ATOM 0 HH TYR A 56 19.637 -10.193 -13.743 1.00 0.00 H new ATOM 647 N LEU A 57 12.779 -9.285 -14.524 1.00 0.00 N ATOM 648 CA LEU A 57 12.569 -9.047 -13.107 1.00 0.00 C ATOM 649 C LEU A 57 11.369 -9.868 -12.628 1.00 0.00 C ATOM 650 O LEU A 57 11.454 -10.567 -11.620 1.00 0.00 O ATOM 651 CB LEU A 57 12.438 -7.548 -12.829 1.00 0.00 C ATOM 652 CG LEU A 57 12.923 -7.075 -11.457 1.00 0.00 C ATOM 653 CD1 LEU A 57 14.432 -6.822 -11.467 1.00 0.00 C ATOM 654 CD2 LEU A 57 12.139 -5.847 -10.992 1.00 0.00 C ATOM 0 H LEU A 57 12.627 -8.472 -15.120 1.00 0.00 H new ATOM 0 HA LEU A 57 13.434 -9.380 -12.533 1.00 0.00 H new ATOM 0 HB2 LEU A 57 12.993 -7.007 -13.595 1.00 0.00 H new ATOM 0 HB3 LEU A 57 11.390 -7.269 -12.938 1.00 0.00 H new ATOM 0 HG LEU A 57 12.734 -7.869 -10.735 1.00 0.00 H new ATOM 0 HD11 LEU A 57 14.751 -6.487 -10.480 1.00 0.00 H new ATOM 0 HD12 LEU A 57 14.954 -7.744 -11.723 1.00 0.00 H new ATOM 0 HD13 LEU A 57 14.667 -6.055 -12.205 1.00 0.00 H new ATOM 0 HD21 LEU A 57 12.503 -5.531 -10.014 1.00 0.00 H new ATOM 0 HD22 LEU A 57 12.274 -5.037 -11.708 1.00 0.00 H new ATOM 0 HD23 LEU A 57 11.080 -6.097 -10.921 1.00 0.00 H new ATOM 666 N TYR A 58 10.281 -9.757 -13.375 1.00 0.00 N ATOM 667 CA TYR A 58 9.066 -10.480 -13.040 1.00 0.00 C ATOM 668 C TYR A 58 9.291 -11.992 -13.113 1.00 0.00 C ATOM 669 O TYR A 58 8.628 -12.756 -12.413 1.00 0.00 O ATOM 670 CB TYR A 58 8.032 -10.079 -14.095 1.00 0.00 C ATOM 671 CG TYR A 58 7.367 -8.727 -13.831 1.00 0.00 C ATOM 672 CD1 TYR A 58 6.896 -8.424 -12.570 1.00 0.00 C ATOM 673 CD2 TYR A 58 7.237 -7.810 -14.855 1.00 0.00 C ATOM 674 CE1 TYR A 58 6.270 -7.151 -12.322 1.00 0.00 C ATOM 675 CE2 TYR A 58 6.611 -6.538 -14.607 1.00 0.00 C ATOM 676 CZ TYR A 58 6.158 -6.271 -13.352 1.00 0.00 C ATOM 677 OH TYR A 58 5.567 -5.069 -13.118 1.00 0.00 O ATOM 0 H TYR A 58 10.215 -9.177 -14.211 1.00 0.00 H new ATOM 0 HA TYR A 58 8.744 -10.241 -12.027 1.00 0.00 H new ATOM 0 HB2 TYR A 58 8.516 -10.050 -15.071 1.00 0.00 H new ATOM 0 HB3 TYR A 58 7.261 -10.848 -14.144 1.00 0.00 H new ATOM 0 HD1 TYR A 58 6.997 -9.141 -11.769 1.00 0.00 H new ATOM 0 HD2 TYR A 58 7.605 -8.047 -15.842 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.898 -6.901 -11.339 1.00 0.00 H new ATOM 0 HE2 TYR A 58 6.503 -5.812 -15.399 1.00 0.00 H new ATOM 0 HH TYR A 58 5.558 -4.543 -13.945 1.00 0.00 H new ATOM 687 N GLN A 59 10.228 -12.379 -13.966 1.00 0.00 N ATOM 688 CA GLN A 59 10.548 -13.785 -14.138 1.00 0.00 C ATOM 689 C GLN A 59 12.026 -13.953 -14.496 1.00 0.00 C ATOM 690 O GLN A 59 12.493 -13.406 -15.494 1.00 0.00 O ATOM 691 CB GLN A 59 9.651 -14.426 -15.199 1.00 0.00 C ATOM 692 CG GLN A 59 9.459 -15.919 -14.927 1.00 0.00 C ATOM 693 CD GLN A 59 8.387 -16.148 -13.859 1.00 0.00 C ATOM 694 OE1 GLN A 59 8.399 -15.554 -12.794 1.00 0.00 O ATOM 695 NE2 GLN A 59 7.464 -17.041 -14.203 1.00 0.00 N ATOM 0 H GLN A 59 10.776 -11.743 -14.545 1.00 0.00 H new ATOM 0 HA GLN A 59 10.362 -14.298 -13.194 1.00 0.00 H new ATOM 0 HB2 GLN A 59 8.682 -13.927 -15.210 1.00 0.00 H new ATOM 0 HB3 GLN A 59 10.093 -14.287 -16.186 1.00 0.00 H new ATOM 0 HG2 GLN A 59 9.174 -16.427 -15.848 1.00 0.00 H new ATOM 0 HG3 GLN A 59 10.402 -16.357 -14.601 1.00 0.00 H new ATOM 0 HE21 GLN A 59 7.514 -17.502 -15.112 1.00 0.00 H new ATOM 0 HE22 GLN A 59 6.706 -17.265 -13.558 1.00 0.00 H new ATOM 704 N LYS A 60 12.722 -14.712 -13.662 1.00 0.00 N ATOM 705 CA LYS A 60 14.137 -14.959 -13.878 1.00 0.00 C ATOM 706 C LYS A 60 14.306 -15.991 -14.994 1.00 0.00 C ATOM 707 O LYS A 60 15.348 -16.040 -15.647 1.00 0.00 O ATOM 708 CB LYS A 60 14.818 -15.354 -12.566 1.00 0.00 C ATOM 709 CG LYS A 60 15.130 -14.121 -11.716 1.00 0.00 C ATOM 710 CD LYS A 60 16.451 -13.480 -12.143 1.00 0.00 C ATOM 711 CE LYS A 60 17.631 -14.107 -11.398 1.00 0.00 C ATOM 712 NZ LYS A 60 17.802 -15.522 -11.795 1.00 0.00 N ATOM 0 H LYS A 60 12.332 -15.164 -12.835 1.00 0.00 H new ATOM 0 HA LYS A 60 14.637 -14.048 -14.208 1.00 0.00 H new ATOM 0 HB2 LYS A 60 14.172 -16.031 -12.007 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.740 -15.895 -12.779 1.00 0.00 H new ATOM 0 HG2 LYS A 60 14.322 -13.395 -11.811 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.182 -14.404 -10.665 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.588 -13.603 -13.217 1.00 0.00 H new ATOM 0 HD3 LYS A 60 16.420 -12.408 -11.946 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.543 -13.550 -11.614 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.465 -14.042 -10.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.762 -15.838 -11.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.105 -16.110 -11.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 17.660 -15.614 -12.821 1.00 0.00 H new ATOM 726 N ASP A 61 13.266 -16.790 -15.180 1.00 0.00 N ATOM 727 CA ASP A 61 13.286 -17.819 -16.206 1.00 0.00 C ATOM 728 C ASP A 61 11.852 -18.127 -16.641 1.00 0.00 C ATOM 729 O ASP A 61 10.983 -18.363 -15.804 1.00 0.00 O ATOM 730 CB ASP A 61 13.908 -19.113 -15.677 1.00 0.00 C ATOM 731 CG ASP A 61 15.094 -18.920 -14.730 1.00 0.00 C ATOM 732 OD1 ASP A 61 14.920 -18.757 -13.513 1.00 0.00 O ATOM 733 OD2 ASP A 61 16.253 -18.942 -15.296 1.00 0.00 O ATOM 0 H ASP A 61 12.403 -16.746 -14.637 1.00 0.00 H new ATOM 0 HA ASP A 61 13.879 -17.450 -17.042 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.137 -19.683 -15.158 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.234 -19.715 -16.525 1.00 0.00 H new ATOM 739 N ASN A 62 11.650 -18.115 -17.951 1.00 0.00 N ATOM 740 CA ASN A 62 10.336 -18.390 -18.507 1.00 0.00 C ATOM 741 C ASN A 62 9.921 -19.817 -18.142 1.00 0.00 C ATOM 742 O ASN A 62 10.611 -20.775 -18.485 1.00 0.00 O ATOM 743 CB ASN A 62 10.350 -18.278 -20.033 1.00 0.00 C ATOM 744 CG ASN A 62 11.216 -19.375 -20.656 1.00 0.00 C ATOM 745 OD1 ASN A 62 12.276 -19.721 -20.160 1.00 0.00 O ATOM 746 ND2 ASN A 62 10.707 -19.901 -21.766 1.00 0.00 N ATOM 0 H ASN A 62 12.374 -17.919 -18.643 1.00 0.00 H new ATOM 0 HA ASN A 62 9.637 -17.661 -18.098 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.332 -18.352 -20.416 1.00 0.00 H new ATOM 0 HB3 ASN A 62 10.730 -17.299 -20.326 1.00 0.00 H new ATOM 0 HD21 ASN A 62 11.209 -20.641 -22.257 1.00 0.00 H new ATOM 0 HD22 ASN A 62 9.814 -19.565 -22.127 1.00 0.00 H new ATOM 753 N SER A 63 8.795 -19.913 -17.450 1.00 0.00 N ATOM 754 CA SER A 63 8.280 -21.206 -17.034 1.00 0.00 C ATOM 755 C SER A 63 6.844 -21.059 -16.526 1.00 0.00 C ATOM 756 O SER A 63 6.375 -19.945 -16.295 1.00 0.00 O ATOM 757 CB SER A 63 9.164 -21.829 -15.952 1.00 0.00 C ATOM 758 OG SER A 63 10.355 -22.393 -16.495 1.00 0.00 O ATOM 0 H SER A 63 8.225 -19.116 -17.167 1.00 0.00 H new ATOM 0 HA SER A 63 8.287 -21.870 -17.898 1.00 0.00 H new ATOM 0 HB2 SER A 63 9.426 -21.069 -15.216 1.00 0.00 H new ATOM 0 HB3 SER A 63 8.603 -22.602 -15.427 1.00 0.00 H new ATOM 0 HG SER A 63 10.438 -22.136 -17.437 1.00 0.00 H new ATOM 764 N CYS A 64 6.187 -22.198 -16.368 1.00 0.00 N ATOM 765 CA CYS A 64 4.814 -22.210 -15.892 1.00 0.00 C ATOM 766 C CYS A 64 4.786 -22.894 -14.524 1.00 0.00 C ATOM 767 O CYS A 64 3.719 -23.255 -14.028 1.00 0.00 O ATOM 768 CB CYS A 64 3.875 -22.890 -16.890 1.00 0.00 C ATOM 769 SG CYS A 64 4.508 -24.555 -17.310 1.00 0.00 S ATOM 0 H CYS A 64 6.580 -23.119 -16.561 1.00 0.00 H new ATOM 0 HA CYS A 64 4.452 -21.187 -15.793 1.00 0.00 H new ATOM 0 HB2 CYS A 64 2.874 -22.969 -16.465 1.00 0.00 H new ATOM 0 HB3 CYS A 64 3.791 -22.285 -17.793 1.00 0.00 H new ATOM 0 HG CYS A 64 3.702 -25.125 -18.156 1.00 0.00 H new ATOM 775 N ASN A 65 5.970 -23.053 -13.953 1.00 0.00 N ATOM 776 CA ASN A 65 6.095 -23.687 -12.652 1.00 0.00 C ATOM 777 C ASN A 65 5.909 -22.636 -11.556 1.00 0.00 C ATOM 778 O ASN A 65 6.103 -22.923 -10.376 1.00 0.00 O ATOM 779 CB ASN A 65 7.479 -24.315 -12.475 1.00 0.00 C ATOM 780 CG ASN A 65 8.562 -23.238 -12.387 1.00 0.00 C ATOM 781 OD1 ASN A 65 8.674 -22.363 -13.229 1.00 0.00 O ATOM 782 ND2 ASN A 65 9.351 -23.350 -11.322 1.00 0.00 N ATOM 0 H ASN A 65 6.852 -22.753 -14.368 1.00 0.00 H new ATOM 0 HA ASN A 65 5.335 -24.465 -12.583 1.00 0.00 H new ATOM 0 HB2 ASN A 65 7.493 -24.925 -11.571 1.00 0.00 H new ATOM 0 HB3 ASN A 65 7.690 -24.981 -13.312 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.104 -22.679 -11.173 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.203 -24.107 -10.655 1.00 0.00 H new ATOM 789 N LEU A 66 5.536 -21.439 -11.985 1.00 0.00 N ATOM 790 CA LEU A 66 5.322 -20.343 -11.056 1.00 0.00 C ATOM 791 C LEU A 66 3.915 -19.778 -11.255 1.00 0.00 C ATOM 792 O LEU A 66 3.603 -19.240 -12.317 1.00 0.00 O ATOM 793 CB LEU A 66 6.430 -19.298 -11.196 1.00 0.00 C ATOM 794 CG LEU A 66 6.820 -18.558 -9.915 1.00 0.00 C ATOM 795 CD1 LEU A 66 5.584 -18.004 -9.204 1.00 0.00 C ATOM 796 CD2 LEU A 66 7.656 -19.452 -8.997 1.00 0.00 C ATOM 0 H LEU A 66 5.376 -21.204 -12.965 1.00 0.00 H new ATOM 0 HA LEU A 66 5.380 -20.699 -10.027 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.318 -19.790 -11.592 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.116 -18.562 -11.936 1.00 0.00 H new ATOM 0 HG LEU A 66 7.443 -17.707 -10.189 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.889 -17.483 -8.297 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.065 -17.309 -9.864 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.916 -18.825 -8.944 1.00 0.00 H new ATOM 0 HD21 LEU A 66 7.919 -18.901 -8.094 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.079 -20.337 -8.727 1.00 0.00 H new ATOM 0 HD23 LEU A 66 8.566 -19.756 -9.515 1.00 0.00 H new ATOM 808 N PHE A 67 3.102 -19.919 -10.218 1.00 0.00 N ATOM 809 CA PHE A 67 1.735 -19.430 -10.267 1.00 0.00 C ATOM 810 C PHE A 67 1.660 -18.083 -10.990 1.00 0.00 C ATOM 811 O PHE A 67 0.783 -17.872 -11.826 1.00 0.00 O ATOM 812 CB PHE A 67 1.275 -19.244 -8.819 1.00 0.00 C ATOM 813 CG PHE A 67 0.734 -20.519 -8.169 1.00 0.00 C ATOM 814 CD1 PHE A 67 -0.551 -20.904 -8.394 1.00 0.00 C ATOM 815 CD2 PHE A 67 1.539 -21.268 -7.368 1.00 0.00 C ATOM 816 CE1 PHE A 67 -1.053 -22.087 -7.791 1.00 0.00 C ATOM 817 CE2 PHE A 67 1.036 -22.451 -6.765 1.00 0.00 C ATOM 818 CZ PHE A 67 -0.249 -22.836 -6.989 1.00 0.00 C ATOM 0 H PHE A 67 3.364 -20.365 -9.339 1.00 0.00 H new ATOM 0 HA PHE A 67 1.106 -20.137 -10.807 1.00 0.00 H new ATOM 0 HB2 PHE A 67 2.112 -18.874 -8.227 1.00 0.00 H new ATOM 0 HB3 PHE A 67 0.501 -18.477 -8.790 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.189 -20.310 -9.031 1.00 0.00 H new ATOM 0 HD2 PHE A 67 2.560 -20.963 -7.191 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -2.073 -22.392 -7.969 1.00 0.00 H new ATOM 0 HE2 PHE A 67 1.674 -23.045 -6.128 1.00 0.00 H new ATOM 0 HZ PHE A 67 -0.631 -23.736 -6.530 1.00 0.00 H new ATOM 828 N ASN A 68 2.592 -17.208 -10.641 1.00 0.00 N ATOM 829 CA ASN A 68 2.642 -15.888 -11.247 1.00 0.00 C ATOM 830 C ASN A 68 2.759 -16.033 -12.765 1.00 0.00 C ATOM 831 O ASN A 68 3.597 -16.786 -13.258 1.00 0.00 O ATOM 832 CB ASN A 68 3.857 -15.101 -10.752 1.00 0.00 C ATOM 833 CG ASN A 68 5.062 -15.317 -11.670 1.00 0.00 C ATOM 834 OD1 ASN A 68 5.529 -16.425 -11.874 1.00 0.00 O ATOM 835 ND2 ASN A 68 5.536 -14.198 -12.211 1.00 0.00 N ATOM 0 H ASN A 68 3.318 -17.387 -9.947 1.00 0.00 H new ATOM 0 HA ASN A 68 1.731 -15.356 -10.973 1.00 0.00 H new ATOM 0 HB2 ASN A 68 3.614 -14.039 -10.709 1.00 0.00 H new ATOM 0 HB3 ASN A 68 4.108 -15.412 -9.738 1.00 0.00 H new ATOM 0 HD21 ASN A 68 6.339 -14.236 -12.839 1.00 0.00 H new ATOM 0 HD22 ASN A 68 5.097 -13.302 -11.997 1.00 0.00 H new ATOM 842 N THR A 69 1.907 -15.298 -13.465 1.00 0.00 N ATOM 843 CA THR A 69 1.904 -15.335 -14.918 1.00 0.00 C ATOM 844 C THR A 69 2.583 -14.087 -15.484 1.00 0.00 C ATOM 845 O THR A 69 2.529 -13.018 -14.878 1.00 0.00 O ATOM 846 CB THR A 69 0.457 -15.505 -15.384 1.00 0.00 C ATOM 847 OG1 THR A 69 0.470 -15.044 -16.732 1.00 0.00 O ATOM 848 CG2 THR A 69 -0.503 -14.549 -14.672 1.00 0.00 C ATOM 0 H THR A 69 1.214 -14.673 -13.053 1.00 0.00 H new ATOM 0 HA THR A 69 2.482 -16.179 -15.294 1.00 0.00 H new ATOM 0 HB THR A 69 0.139 -16.533 -15.213 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.430 -15.121 -17.113 1.00 0.00 H new ATOM 0 HG21 THR A 69 -1.516 -14.711 -15.039 1.00 0.00 H new ATOM 0 HG22 THR A 69 -0.472 -14.735 -13.598 1.00 0.00 H new ATOM 0 HG23 THR A 69 -0.205 -13.519 -14.871 1.00 0.00 H new ATOM 856 N LEU A 70 3.206 -14.264 -16.640 1.00 0.00 N ATOM 857 CA LEU A 70 3.894 -13.165 -17.295 1.00 0.00 C ATOM 858 C LEU A 70 2.863 -12.167 -17.828 1.00 0.00 C ATOM 859 O LEU A 70 3.125 -10.967 -17.880 1.00 0.00 O ATOM 860 CB LEU A 70 4.849 -13.693 -18.368 1.00 0.00 C ATOM 861 CG LEU A 70 6.091 -12.841 -18.639 1.00 0.00 C ATOM 862 CD1 LEU A 70 5.702 -11.408 -19.008 1.00 0.00 C ATOM 863 CD2 LEU A 70 7.057 -12.887 -17.454 1.00 0.00 C ATOM 0 H LEU A 70 3.249 -15.152 -17.140 1.00 0.00 H new ATOM 0 HA LEU A 70 4.518 -12.628 -16.581 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.174 -14.692 -18.077 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.294 -13.798 -19.300 1.00 0.00 H new ATOM 0 HG LEU A 70 6.615 -13.263 -19.497 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.603 -10.823 -19.196 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.083 -11.419 -19.905 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.143 -10.960 -18.187 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.931 -12.273 -17.673 1.00 0.00 H new ATOM 0 HD22 LEU A 70 6.559 -12.504 -16.563 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.371 -13.916 -17.280 1.00 0.00 H new ATOM 875 N THR A 71 1.712 -12.702 -18.209 1.00 0.00 N ATOM 876 CA THR A 71 0.640 -11.874 -18.735 1.00 0.00 C ATOM 877 C THR A 71 0.337 -10.721 -17.776 1.00 0.00 C ATOM 878 O THR A 71 -0.053 -9.637 -18.206 1.00 0.00 O ATOM 879 CB THR A 71 -0.566 -12.776 -19.002 1.00 0.00 C ATOM 880 OG1 THR A 71 -1.215 -12.167 -20.115 1.00 0.00 O ATOM 881 CG2 THR A 71 -1.606 -12.710 -17.882 1.00 0.00 C ATOM 0 H THR A 71 1.499 -13.698 -18.164 1.00 0.00 H new ATOM 0 HA THR A 71 0.928 -11.405 -19.676 1.00 0.00 H new ATOM 0 HB THR A 71 -0.229 -13.805 -19.124 1.00 0.00 H new ATOM 0 HG1 THR A 71 -1.170 -11.192 -20.027 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.441 -13.369 -18.121 1.00 0.00 H new ATOM 0 HG22 THR A 71 -1.151 -13.027 -16.944 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.968 -11.687 -17.782 1.00 0.00 H new ATOM 889 N GLU A 72 0.527 -10.995 -16.494 1.00 0.00 N ATOM 890 CA GLU A 72 0.278 -9.995 -15.470 1.00 0.00 C ATOM 891 C GLU A 72 1.302 -8.862 -15.575 1.00 0.00 C ATOM 892 O GLU A 72 0.964 -7.696 -15.378 1.00 0.00 O ATOM 893 CB GLU A 72 0.296 -10.622 -14.074 1.00 0.00 C ATOM 894 CG GLU A 72 -0.120 -9.604 -13.011 1.00 0.00 C ATOM 895 CD GLU A 72 -0.759 -10.300 -11.807 1.00 0.00 C ATOM 896 OE1 GLU A 72 -0.437 -11.462 -11.519 1.00 0.00 O ATOM 897 OE2 GLU A 72 -1.618 -9.588 -11.159 1.00 0.00 O ATOM 0 H GLU A 72 0.851 -11.896 -16.141 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.716 -9.578 -15.632 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -0.379 -11.478 -14.047 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.295 -10.997 -13.853 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.751 -9.035 -12.687 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.825 -8.892 -13.440 1.00 0.00 H new ATOM 905 N ALA A 73 2.531 -9.245 -15.885 1.00 0.00 N ATOM 906 CA ALA A 73 3.606 -8.277 -16.019 1.00 0.00 C ATOM 907 C ALA A 73 3.419 -7.489 -17.317 1.00 0.00 C ATOM 908 O ALA A 73 3.425 -6.259 -17.308 1.00 0.00 O ATOM 909 CB ALA A 73 4.954 -8.998 -15.964 1.00 0.00 C ATOM 0 H ALA A 73 2.807 -10.213 -16.047 1.00 0.00 H new ATOM 0 HA ALA A 73 3.584 -7.564 -15.195 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.760 -8.271 -16.065 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.050 -9.517 -15.010 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.014 -9.721 -16.778 1.00 0.00 H new ATOM 915 N ARG A 74 3.256 -8.231 -18.403 1.00 0.00 N ATOM 916 CA ARG A 74 3.068 -7.617 -19.707 1.00 0.00 C ATOM 917 C ARG A 74 1.819 -6.733 -19.701 1.00 0.00 C ATOM 918 O ARG A 74 1.809 -5.663 -20.309 1.00 0.00 O ATOM 919 CB ARG A 74 2.928 -8.679 -20.800 1.00 0.00 C ATOM 920 CG ARG A 74 1.456 -9.010 -21.057 1.00 0.00 C ATOM 921 CD ARG A 74 1.320 -10.163 -22.054 1.00 0.00 C ATOM 922 NE ARG A 74 2.266 -11.247 -21.707 1.00 0.00 N ATOM 923 CZ ARG A 74 2.718 -12.157 -22.580 1.00 0.00 C ATOM 924 NH1 ARG A 74 2.314 -12.120 -23.857 1.00 0.00 N ATOM 925 NH2 ARG A 74 3.575 -13.105 -22.176 1.00 0.00 N ATOM 0 H ARG A 74 3.250 -9.251 -18.407 1.00 0.00 H new ATOM 0 HA ARG A 74 3.947 -7.008 -19.918 1.00 0.00 H new ATOM 0 HB2 ARG A 74 3.390 -8.322 -21.720 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.462 -9.582 -20.505 1.00 0.00 H new ATOM 0 HG2 ARG A 74 0.970 -9.277 -20.118 1.00 0.00 H new ATOM 0 HG3 ARG A 74 0.943 -8.129 -21.442 1.00 0.00 H new ATOM 0 HD2 ARG A 74 0.299 -10.544 -22.045 1.00 0.00 H new ATOM 0 HD3 ARG A 74 1.518 -9.806 -23.065 1.00 0.00 H new ATOM 0 HE ARG A 74 2.594 -11.305 -20.743 1.00 0.00 H new ATOM 0 HH11 ARG A 74 1.662 -11.399 -24.165 1.00 0.00 H new ATOM 0 HH12 ARG A 74 2.659 -12.813 -24.521 1.00 0.00 H new ATOM 0 HH21 ARG A 74 3.883 -13.133 -21.204 1.00 0.00 H new ATOM 0 HH22 ARG A 74 3.919 -13.798 -22.841 1.00 0.00 H new ATOM 939 N ASP A 75 0.796 -7.212 -19.009 1.00 0.00 N ATOM 940 CA ASP A 75 -0.454 -6.479 -18.917 1.00 0.00 C ATOM 941 C ASP A 75 -0.288 -5.317 -17.936 1.00 0.00 C ATOM 942 O ASP A 75 -0.945 -4.286 -18.072 1.00 0.00 O ATOM 943 CB ASP A 75 -1.582 -7.375 -18.401 1.00 0.00 C ATOM 944 CG ASP A 75 -2.063 -8.441 -19.388 1.00 0.00 C ATOM 945 OD1 ASP A 75 -1.277 -8.975 -20.184 1.00 0.00 O ATOM 946 OD2 ASP A 75 -3.320 -8.722 -19.316 1.00 0.00 O ATOM 0 H ASP A 75 0.808 -8.100 -18.506 1.00 0.00 H new ATOM 0 HA ASP A 75 -0.707 -6.119 -19.914 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -1.245 -7.870 -17.490 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -2.429 -6.746 -18.127 1.00 0.00 H new ATOM 952 N ALA A 76 0.595 -5.522 -16.969 1.00 0.00 N ATOM 953 CA ALA A 76 0.856 -4.504 -15.966 1.00 0.00 C ATOM 954 C ALA A 76 1.400 -3.248 -16.649 1.00 0.00 C ATOM 955 O ALA A 76 0.889 -2.150 -16.435 1.00 0.00 O ATOM 956 CB ALA A 76 1.819 -5.059 -14.914 1.00 0.00 C ATOM 0 H ALA A 76 1.138 -6.378 -16.859 1.00 0.00 H new ATOM 0 HA ALA A 76 -0.064 -4.227 -15.452 1.00 0.00 H new ATOM 0 HB1 ALA A 76 2.015 -4.295 -14.161 1.00 0.00 H new ATOM 0 HB2 ALA A 76 1.373 -5.932 -14.438 1.00 0.00 H new ATOM 0 HB3 ALA A 76 2.755 -5.345 -15.393 1.00 0.00 H new ATOM 962 N ILE A 77 2.430 -3.452 -17.458 1.00 0.00 N ATOM 963 CA ILE A 77 3.048 -2.349 -18.174 1.00 0.00 C ATOM 964 C ILE A 77 2.101 -1.866 -19.274 1.00 0.00 C ATOM 965 O ILE A 77 2.041 -0.673 -19.566 1.00 0.00 O ATOM 966 CB ILE A 77 4.432 -2.753 -18.687 1.00 0.00 C ATOM 967 CG1 ILE A 77 4.336 -3.941 -19.647 1.00 0.00 C ATOM 968 CG2 ILE A 77 5.388 -3.031 -17.525 1.00 0.00 C ATOM 969 CD1 ILE A 77 5.545 -4.866 -19.498 1.00 0.00 C ATOM 0 H ILE A 77 2.852 -4.364 -17.633 1.00 0.00 H new ATOM 0 HA ILE A 77 3.215 -1.505 -17.504 1.00 0.00 H new ATOM 0 HB ILE A 77 4.845 -1.916 -19.251 1.00 0.00 H new ATOM 0 HG12 ILE A 77 3.420 -4.499 -19.450 1.00 0.00 H new ATOM 0 HG13 ILE A 77 4.275 -3.579 -20.673 1.00 0.00 H new ATOM 0 HG21 ILE A 77 6.364 -3.316 -17.917 1.00 0.00 H new ATOM 0 HG22 ILE A 77 5.490 -2.133 -16.915 1.00 0.00 H new ATOM 0 HG23 ILE A 77 4.992 -3.842 -16.914 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.451 -5.702 -20.191 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.457 -4.311 -19.719 1.00 0.00 H new ATOM 0 HD13 ILE A 77 5.589 -5.245 -18.477 1.00 0.00 H new ATOM 981 N LYS A 78 1.385 -2.818 -19.854 1.00 0.00 N ATOM 982 CA LYS A 78 0.443 -2.504 -20.915 1.00 0.00 C ATOM 983 C LYS A 78 -0.732 -1.717 -20.333 1.00 0.00 C ATOM 984 O LYS A 78 -1.355 -0.918 -21.030 1.00 0.00 O ATOM 985 CB LYS A 78 0.025 -3.777 -21.654 1.00 0.00 C ATOM 986 CG LYS A 78 -0.620 -3.442 -23.001 1.00 0.00 C ATOM 987 CD LYS A 78 -1.974 -2.756 -22.804 1.00 0.00 C ATOM 988 CE LYS A 78 -3.035 -3.364 -23.724 1.00 0.00 C ATOM 989 NZ LYS A 78 -3.917 -2.307 -24.266 1.00 0.00 N ATOM 0 H LYS A 78 1.438 -3.807 -19.609 1.00 0.00 H new ATOM 0 HA LYS A 78 0.913 -1.867 -21.665 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.896 -4.413 -21.812 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.676 -4.344 -21.042 1.00 0.00 H new ATOM 0 HG2 LYS A 78 0.041 -2.792 -23.574 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -0.752 -4.355 -23.582 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -2.288 -2.855 -21.765 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.879 -1.689 -23.008 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.552 -3.898 -24.542 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -3.628 -4.094 -23.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -4.858 -2.383 -23.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -3.511 -1.373 -24.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.003 -2.421 -25.296 1.00 0.00 H new ATOM 1003 N ASP A 79 -1.000 -1.971 -19.060 1.00 0.00 N ATOM 1004 CA ASP A 79 -2.089 -1.296 -18.376 1.00 0.00 C ATOM 1005 C ASP A 79 -1.677 0.145 -18.066 1.00 0.00 C ATOM 1006 O ASP A 79 -2.404 1.085 -18.385 1.00 0.00 O ATOM 1007 CB ASP A 79 -2.421 -1.987 -17.052 1.00 0.00 C ATOM 1008 CG ASP A 79 -3.297 -1.172 -16.098 1.00 0.00 C ATOM 1009 OD1 ASP A 79 -2.895 -0.866 -14.966 1.00 0.00 O ATOM 1010 OD2 ASP A 79 -4.454 -0.845 -16.566 1.00 0.00 O ATOM 0 H ASP A 79 -0.481 -2.635 -18.485 1.00 0.00 H new ATOM 0 HA ASP A 79 -2.963 -1.323 -19.027 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.925 -2.929 -17.268 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.488 -2.233 -16.544 1.00 0.00 H new ATOM 1016 N ALA A 80 -0.512 0.273 -17.449 1.00 0.00 N ATOM 1017 CA ALA A 80 0.006 1.584 -17.093 1.00 0.00 C ATOM 1018 C ALA A 80 0.217 2.407 -18.365 1.00 0.00 C ATOM 1019 O ALA A 80 -0.172 3.572 -18.426 1.00 0.00 O ATOM 1020 CB ALA A 80 1.294 1.421 -16.283 1.00 0.00 C ATOM 0 H ALA A 80 0.088 -0.509 -17.186 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.707 2.122 -16.468 1.00 0.00 H new ATOM 0 HB1 ALA A 80 1.683 2.404 -16.016 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.084 0.855 -15.375 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.034 0.888 -16.880 1.00 0.00 H new ATOM 1026 N TYR A 81 0.832 1.768 -19.349 1.00 0.00 N ATOM 1027 CA TYR A 81 1.099 2.427 -20.617 1.00 0.00 C ATOM 1028 C TYR A 81 -0.203 2.845 -21.303 1.00 0.00 C ATOM 1029 O TYR A 81 -0.292 3.938 -21.861 1.00 0.00 O ATOM 1030 CB TYR A 81 1.811 1.391 -21.489 1.00 0.00 C ATOM 1031 CG TYR A 81 3.307 1.255 -21.197 1.00 0.00 C ATOM 1032 CD1 TYR A 81 3.752 1.186 -19.892 1.00 0.00 C ATOM 1033 CD2 TYR A 81 4.211 1.201 -22.238 1.00 0.00 C ATOM 1034 CE1 TYR A 81 5.160 1.057 -19.617 1.00 0.00 C ATOM 1035 CE2 TYR A 81 5.619 1.073 -21.963 1.00 0.00 C ATOM 1036 CZ TYR A 81 6.024 1.007 -20.667 1.00 0.00 C ATOM 1037 OH TYR A 81 7.353 0.886 -20.407 1.00 0.00 O ATOM 0 H TYR A 81 1.153 0.801 -19.294 1.00 0.00 H new ATOM 0 HA TYR A 81 1.696 3.326 -20.464 1.00 0.00 H new ATOM 0 HB2 TYR A 81 1.334 0.421 -21.346 1.00 0.00 H new ATOM 0 HB3 TYR A 81 1.679 1.660 -22.537 1.00 0.00 H new ATOM 0 HD1 TYR A 81 3.044 1.229 -19.077 1.00 0.00 H new ATOM 0 HD2 TYR A 81 3.863 1.255 -23.259 1.00 0.00 H new ATOM 0 HE1 TYR A 81 5.522 1.001 -18.601 1.00 0.00 H new ATOM 0 HE2 TYR A 81 6.337 1.030 -22.769 1.00 0.00 H new ATOM 0 HH TYR A 81 7.625 -0.048 -20.522 1.00 0.00 H new ATOM 1047 N GLU A 82 -1.181 1.953 -21.239 1.00 0.00 N ATOM 1048 CA GLU A 82 -2.474 2.216 -21.847 1.00 0.00 C ATOM 1049 C GLU A 82 -3.234 3.273 -21.043 1.00 0.00 C ATOM 1050 O GLU A 82 -4.103 3.959 -21.579 1.00 0.00 O ATOM 1051 CB GLU A 82 -3.292 0.929 -21.973 1.00 0.00 C ATOM 1052 CG GLU A 82 -4.752 1.239 -22.312 1.00 0.00 C ATOM 1053 CD GLU A 82 -5.541 -0.048 -22.561 1.00 0.00 C ATOM 1054 OE1 GLU A 82 -5.439 -1.000 -21.773 1.00 0.00 O ATOM 1055 OE2 GLU A 82 -6.283 -0.037 -23.616 1.00 0.00 O ATOM 0 H GLU A 82 -1.104 1.048 -20.775 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.309 2.603 -22.853 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.862 0.295 -22.748 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -3.243 0.369 -21.039 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.208 1.797 -21.495 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.797 1.874 -23.196 1.00 0.00 H new ATOM 1063 N SER A 83 -2.878 3.371 -19.771 1.00 0.00 N ATOM 1064 CA SER A 83 -3.516 4.333 -18.888 1.00 0.00 C ATOM 1065 C SER A 83 -2.949 5.732 -19.141 1.00 0.00 C ATOM 1066 O SER A 83 -3.701 6.695 -19.276 1.00 0.00 O ATOM 1067 CB SER A 83 -3.329 3.942 -17.420 1.00 0.00 C ATOM 1068 OG SER A 83 -3.833 4.938 -16.534 1.00 0.00 O ATOM 0 H SER A 83 -2.156 2.801 -19.330 1.00 0.00 H new ATOM 0 HA SER A 83 -4.585 4.337 -19.102 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.837 2.997 -17.229 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.270 3.781 -17.220 1.00 0.00 H new ATOM 0 HG SER A 83 -3.696 4.651 -15.607 1.00 0.00 H new ATOM 1074 N TYR A 84 -1.627 5.798 -19.197 1.00 0.00 N ATOM 1075 CA TYR A 84 -0.950 7.062 -19.431 1.00 0.00 C ATOM 1076 C TYR A 84 -0.619 7.240 -20.914 1.00 0.00 C ATOM 1077 O TYR A 84 0.041 8.206 -21.295 1.00 0.00 O ATOM 1078 CB TYR A 84 0.354 6.997 -18.634 1.00 0.00 C ATOM 1079 CG TYR A 84 0.185 6.472 -17.207 1.00 0.00 C ATOM 1080 CD1 TYR A 84 -0.602 7.160 -16.307 1.00 0.00 C ATOM 1081 CD2 TYR A 84 0.821 5.309 -16.820 1.00 0.00 C ATOM 1082 CE1 TYR A 84 -0.760 6.666 -14.964 1.00 0.00 C ATOM 1083 CE2 TYR A 84 0.662 4.814 -15.477 1.00 0.00 C ATOM 1084 CZ TYR A 84 -0.121 5.517 -14.615 1.00 0.00 C ATOM 1085 OH TYR A 84 -0.270 5.050 -13.347 1.00 0.00 O ATOM 0 H TYR A 84 -1.006 4.996 -19.084 1.00 0.00 H new ATOM 0 HA TYR A 84 -1.582 7.897 -19.130 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.060 6.358 -19.164 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.794 7.994 -18.594 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.100 8.069 -16.610 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.438 4.771 -17.524 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -1.372 7.196 -14.249 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.153 3.905 -15.161 1.00 0.00 H new ATOM 0 HH TYR A 84 0.243 4.221 -13.241 1.00 0.00 H new ATOM 1095 N CYS A 85 -1.092 6.294 -21.711 1.00 0.00 N ATOM 1096 CA CYS A 85 -0.855 6.334 -23.144 1.00 0.00 C ATOM 1097 C CYS A 85 -1.284 7.707 -23.664 1.00 0.00 C ATOM 1098 O CYS A 85 -2.285 8.261 -23.212 1.00 0.00 O ATOM 1099 CB CYS A 85 -1.579 5.197 -23.870 1.00 0.00 C ATOM 1100 SG CYS A 85 -2.064 5.736 -25.550 1.00 0.00 S ATOM 0 H CYS A 85 -1.639 5.494 -21.392 1.00 0.00 H new ATOM 0 HA CYS A 85 0.206 6.186 -23.343 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -0.930 4.323 -23.933 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -2.462 4.898 -23.306 1.00 0.00 H new ATOM 0 HG CYS A 85 -2.676 4.763 -26.158 1.00 0.00 H new ATOM 1106 N GLY A 86 -0.505 8.218 -24.607 1.00 0.00 N ATOM 1107 CA GLY A 86 -0.792 9.516 -25.193 1.00 0.00 C ATOM 1108 C GLY A 86 -0.120 10.637 -24.398 1.00 0.00 C ATOM 1109 O GLY A 86 -0.087 11.784 -24.841 1.00 0.00 O ATOM 0 H GLY A 86 0.325 7.756 -24.979 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -0.443 9.538 -26.225 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -1.870 9.678 -25.217 1.00 0.00 H new ATOM 1113 N ILE A 87 0.400 10.266 -23.236 1.00 0.00 N ATOM 1114 CA ILE A 87 1.069 11.226 -22.375 1.00 0.00 C ATOM 1115 C ILE A 87 2.579 10.982 -22.423 1.00 0.00 C ATOM 1116 O ILE A 87 3.059 9.951 -21.953 1.00 0.00 O ATOM 1117 CB ILE A 87 0.483 11.179 -20.963 1.00 0.00 C ATOM 1118 CG1 ILE A 87 -1.036 11.003 -21.006 1.00 0.00 C ATOM 1119 CG2 ILE A 87 0.894 12.413 -20.157 1.00 0.00 C ATOM 1120 CD1 ILE A 87 -1.607 10.815 -19.599 1.00 0.00 C ATOM 0 H ILE A 87 0.371 9.314 -22.871 1.00 0.00 H new ATOM 0 HA ILE A 87 0.898 12.242 -22.732 1.00 0.00 H new ATOM 0 HB ILE A 87 0.894 10.309 -20.451 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.493 11.875 -21.474 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -1.288 10.140 -21.623 1.00 0.00 H new ATOM 0 HG21 ILE A 87 0.464 12.354 -19.157 1.00 0.00 H new ATOM 0 HG22 ILE A 87 1.981 12.454 -20.083 1.00 0.00 H new ATOM 0 HG23 ILE A 87 0.530 13.311 -20.656 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -2.688 10.692 -19.659 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -1.166 9.929 -19.143 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.374 11.690 -18.992 1.00 0.00 H new ATOM 1132 N ASP A 88 3.285 11.946 -22.994 1.00 0.00 N ATOM 1133 CA ASP A 88 4.730 11.849 -23.109 1.00 0.00 C ATOM 1134 C ASP A 88 5.376 13.037 -22.394 1.00 0.00 C ATOM 1135 O ASP A 88 6.600 13.150 -22.351 1.00 0.00 O ATOM 1136 CB ASP A 88 5.170 11.882 -24.574 1.00 0.00 C ATOM 1137 CG ASP A 88 4.267 11.111 -25.538 1.00 0.00 C ATOM 1138 OD1 ASP A 88 4.612 10.011 -25.995 1.00 0.00 O ATOM 1139 OD2 ASP A 88 3.150 11.691 -25.821 1.00 0.00 O ATOM 0 H ASP A 88 2.883 12.799 -23.383 1.00 0.00 H new ATOM 0 HA ASP A 88 5.041 10.905 -22.661 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.220 12.921 -24.899 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.180 11.477 -24.644 1.00 0.00 H new ATOM 1145 N ASP A 89 4.523 13.894 -21.851 1.00 0.00 N ATOM 1146 CA ASP A 89 4.996 15.070 -21.140 1.00 0.00 C ATOM 1147 C ASP A 89 4.025 15.398 -20.004 1.00 0.00 C ATOM 1148 O ASP A 89 2.831 15.121 -20.103 1.00 0.00 O ATOM 1149 CB ASP A 89 5.064 16.285 -22.069 1.00 0.00 C ATOM 1150 CG ASP A 89 5.979 16.119 -23.283 1.00 0.00 C ATOM 1151 OD1 ASP A 89 7.212 16.097 -23.155 1.00 0.00 O ATOM 1152 OD2 ASP A 89 5.369 16.010 -24.415 1.00 0.00 O ATOM 0 H ASP A 89 3.508 13.797 -21.889 1.00 0.00 H new ATOM 0 HA ASP A 89 5.993 14.854 -20.755 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.057 16.512 -22.420 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.403 17.146 -21.493 1.00 0.00 H new ATOM 1158 N CYS A 90 4.574 15.984 -18.950 1.00 0.00 N ATOM 1159 CA CYS A 90 3.772 16.352 -17.796 1.00 0.00 C ATOM 1160 C CYS A 90 3.576 17.869 -17.811 1.00 0.00 C ATOM 1161 O CYS A 90 4.501 18.621 -17.506 1.00 0.00 O ATOM 1162 CB CYS A 90 4.406 15.872 -16.489 1.00 0.00 C ATOM 1163 SG CYS A 90 3.203 16.018 -15.118 1.00 0.00 S ATOM 0 H CYS A 90 5.565 16.213 -18.871 1.00 0.00 H new ATOM 0 HA CYS A 90 2.801 15.860 -17.854 1.00 0.00 H new ATOM 0 HB2 CYS A 90 4.729 14.836 -16.591 1.00 0.00 H new ATOM 0 HB3 CYS A 90 5.295 16.463 -16.268 1.00 0.00 H new ATOM 1168 N PRO A 91 2.335 18.285 -18.179 1.00 0.00 N ATOM 1169 CA PRO A 91 2.006 19.699 -18.239 1.00 0.00 C ATOM 1170 C PRO A 91 1.822 20.279 -16.834 1.00 0.00 C ATOM 1171 O PRO A 91 1.989 21.480 -16.628 1.00 0.00 O ATOM 1172 CB PRO A 91 0.745 19.775 -19.083 1.00 0.00 C ATOM 1173 CG PRO A 91 0.154 18.375 -19.076 1.00 0.00 C ATOM 1174 CD PRO A 91 1.215 17.424 -18.548 1.00 0.00 C ATOM 0 HA PRO A 91 2.802 20.297 -18.683 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.042 20.498 -18.670 1.00 0.00 H new ATOM 0 HB3 PRO A 91 0.974 20.097 -20.099 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -0.737 18.340 -18.448 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -0.153 18.085 -20.081 1.00 0.00 H new ATOM 0 HD2 PRO A 91 0.850 16.860 -17.690 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.507 16.697 -19.306 1.00 0.00 H new ATOM 1182 N GLN A 92 1.480 19.398 -15.906 1.00 0.00 N ATOM 1183 CA GLN A 92 1.270 19.806 -14.527 1.00 0.00 C ATOM 1184 C GLN A 92 2.608 20.140 -13.864 1.00 0.00 C ATOM 1185 O GLN A 92 2.710 21.113 -13.119 1.00 0.00 O ATOM 1186 CB GLN A 92 0.524 18.726 -13.742 1.00 0.00 C ATOM 1187 CG GLN A 92 0.088 19.247 -12.372 1.00 0.00 C ATOM 1188 CD GLN A 92 -0.104 18.095 -11.383 1.00 0.00 C ATOM 1189 OE1 GLN A 92 0.230 18.185 -10.213 1.00 0.00 O ATOM 1190 NE2 GLN A 92 -0.660 17.011 -11.917 1.00 0.00 N ATOM 0 H GLN A 92 1.343 18.403 -16.082 1.00 0.00 H new ATOM 0 HA GLN A 92 0.650 20.703 -14.524 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -0.350 18.400 -14.306 1.00 0.00 H new ATOM 0 HB3 GLN A 92 1.166 17.854 -13.616 1.00 0.00 H new ATOM 0 HG2 GLN A 92 0.836 19.940 -11.988 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -0.843 19.805 -12.471 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.916 17.003 -12.904 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -0.831 16.188 -11.339 1.00 0.00 H new ATOM 1199 N CYS A 93 3.601 19.314 -14.159 1.00 0.00 N ATOM 1200 CA CYS A 93 4.928 19.509 -13.600 1.00 0.00 C ATOM 1201 C CYS A 93 5.451 20.868 -14.068 1.00 0.00 C ATOM 1202 O CYS A 93 6.161 21.551 -13.332 1.00 0.00 O ATOM 1203 CB CYS A 93 5.876 18.370 -13.982 1.00 0.00 C ATOM 1204 SG CYS A 93 5.914 17.114 -12.652 1.00 0.00 S ATOM 0 H CYS A 93 3.513 18.508 -14.778 1.00 0.00 H new ATOM 0 HA CYS A 93 4.872 19.497 -12.511 1.00 0.00 H new ATOM 0 HB2 CYS A 93 5.550 17.913 -14.916 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.879 18.762 -14.152 1.00 0.00 H new ATOM 1209 N SER A 94 5.080 21.220 -15.290 1.00 0.00 N ATOM 1210 CA SER A 94 5.503 22.486 -15.865 1.00 0.00 C ATOM 1211 C SER A 94 4.555 23.603 -15.426 1.00 0.00 C ATOM 1212 O SER A 94 4.949 24.766 -15.358 1.00 0.00 O ATOM 1213 CB SER A 94 5.558 22.406 -17.392 1.00 0.00 C ATOM 1214 OG SER A 94 5.565 23.697 -17.995 1.00 0.00 O ATOM 0 H SER A 94 4.491 20.651 -15.898 1.00 0.00 H new ATOM 0 HA SER A 94 6.507 22.707 -15.503 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.452 21.860 -17.694 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.700 21.840 -17.756 1.00 0.00 H new ATOM 0 HG SER A 94 5.602 23.603 -18.970 1.00 0.00 H new ATOM 1220 N LYS A 95 3.322 23.211 -15.139 1.00 0.00 N ATOM 1221 CA LYS A 95 2.314 24.165 -14.709 1.00 0.00 C ATOM 1222 C LYS A 95 2.630 24.626 -13.284 1.00 0.00 C ATOM 1223 O LYS A 95 2.312 25.753 -12.908 1.00 0.00 O ATOM 1224 CB LYS A 95 0.913 23.572 -14.867 1.00 0.00 C ATOM 1225 CG LYS A 95 -0.162 24.607 -14.529 1.00 0.00 C ATOM 1226 CD LYS A 95 -0.071 25.817 -15.461 1.00 0.00 C ATOM 1227 CE LYS A 95 -1.390 26.591 -15.485 1.00 0.00 C ATOM 1228 NZ LYS A 95 -1.279 27.778 -16.362 1.00 0.00 N ATOM 0 H LYS A 95 2.998 22.245 -15.196 1.00 0.00 H new ATOM 0 HA LYS A 95 2.333 25.051 -15.343 1.00 0.00 H new ATOM 0 HB2 LYS A 95 0.776 23.221 -15.890 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.806 22.705 -14.215 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.149 24.152 -14.613 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -0.047 24.931 -13.495 1.00 0.00 H new ATOM 0 HD2 LYS A 95 0.734 26.474 -15.132 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.179 25.486 -16.469 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.192 25.943 -15.839 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -1.654 26.902 -14.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -2.183 28.292 -16.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -0.527 28.403 -16.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -1.048 27.474 -17.330 1.00 0.00 H new ATOM 1242 N TYR A 96 3.252 23.730 -12.531 1.00 0.00 N ATOM 1243 CA TYR A 96 3.614 24.031 -11.156 1.00 0.00 C ATOM 1244 C TYR A 96 4.926 24.815 -11.094 1.00 0.00 C ATOM 1245 O TYR A 96 5.994 24.266 -11.359 1.00 0.00 O ATOM 1246 CB TYR A 96 3.808 22.679 -10.466 1.00 0.00 C ATOM 1247 CG TYR A 96 2.512 22.055 -9.944 1.00 0.00 C ATOM 1248 CD1 TYR A 96 1.294 22.494 -10.421 1.00 0.00 C ATOM 1249 CD2 TYR A 96 2.562 21.054 -8.996 1.00 0.00 C ATOM 1250 CE1 TYR A 96 0.074 21.907 -9.929 1.00 0.00 C ATOM 1251 CE2 TYR A 96 1.342 20.466 -8.504 1.00 0.00 C ATOM 1252 CZ TYR A 96 0.159 20.922 -8.995 1.00 0.00 C ATOM 1253 OH TYR A 96 -0.993 20.367 -8.531 1.00 0.00 O ATOM 0 H TYR A 96 3.514 22.796 -12.847 1.00 0.00 H new ATOM 0 HA TYR A 96 2.843 24.637 -10.680 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.275 21.988 -11.168 1.00 0.00 H new ATOM 0 HB3 TYR A 96 4.500 22.804 -9.633 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.255 23.278 -11.163 1.00 0.00 H new ATOM 0 HD2 TYR A 96 3.516 20.711 -8.623 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -0.886 22.241 -10.293 1.00 0.00 H new ATOM 0 HE2 TYR A 96 1.367 19.681 -7.762 1.00 0.00 H new ATOM 0 HH TYR A 96 -1.069 19.447 -8.861 1.00 0.00 H new ATOM 1263 N ILE A 97 4.802 26.086 -10.741 1.00 0.00 N ATOM 1264 CA ILE A 97 5.965 26.951 -10.640 1.00 0.00 C ATOM 1265 C ILE A 97 6.628 26.750 -9.276 1.00 0.00 C ATOM 1266 O ILE A 97 5.968 26.369 -8.311 1.00 0.00 O ATOM 1267 CB ILE A 97 5.579 28.404 -10.928 1.00 0.00 C ATOM 1268 CG1 ILE A 97 5.410 28.638 -12.431 1.00 0.00 C ATOM 1269 CG2 ILE A 97 6.587 29.372 -10.306 1.00 0.00 C ATOM 1270 CD1 ILE A 97 4.949 30.070 -12.713 1.00 0.00 C ATOM 0 H ILE A 97 3.914 26.537 -10.521 1.00 0.00 H new ATOM 0 HA ILE A 97 6.704 26.686 -11.396 1.00 0.00 H new ATOM 0 HB ILE A 97 4.614 28.601 -10.461 1.00 0.00 H new ATOM 0 HG12 ILE A 97 6.355 28.449 -12.941 1.00 0.00 H new ATOM 0 HG13 ILE A 97 4.684 27.932 -12.833 1.00 0.00 H new ATOM 0 HG21 ILE A 97 6.290 30.397 -10.525 1.00 0.00 H new ATOM 0 HG22 ILE A 97 6.614 29.225 -9.226 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.577 29.184 -10.723 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.836 30.211 -13.788 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.992 30.248 -12.221 1.00 0.00 H new ATOM 0 HD13 ILE A 97 5.689 30.773 -12.331 1.00 0.00 H new ATOM 1282 N ASP A 98 7.926 27.015 -9.240 1.00 0.00 N ATOM 1283 CA ASP A 98 8.685 26.868 -8.010 1.00 0.00 C ATOM 1284 C ASP A 98 8.784 28.226 -7.311 1.00 0.00 C ATOM 1285 O ASP A 98 9.578 29.077 -7.710 1.00 0.00 O ATOM 1286 CB ASP A 98 10.107 26.379 -8.296 1.00 0.00 C ATOM 1287 CG ASP A 98 10.921 26.000 -7.057 1.00 0.00 C ATOM 1288 OD1 ASP A 98 12.160 26.064 -7.063 1.00 0.00 O ATOM 1289 OD2 ASP A 98 10.223 25.620 -6.041 1.00 0.00 O ATOM 0 H ASP A 98 8.471 27.330 -10.043 1.00 0.00 H new ATOM 0 HA ASP A 98 8.172 26.140 -7.382 1.00 0.00 H new ATOM 0 HB2 ASP A 98 10.052 25.513 -8.955 1.00 0.00 H new ATOM 0 HB3 ASP A 98 10.641 27.159 -8.839 1.00 0.00 H new ATOM 1295 N ASP A 99 7.967 28.386 -6.280 1.00 0.00 N ATOM 1296 CA ASP A 99 7.953 29.625 -5.522 1.00 0.00 C ATOM 1297 C ASP A 99 9.146 29.647 -4.565 1.00 0.00 C ATOM 1298 O ASP A 99 9.212 30.486 -3.668 1.00 0.00 O ATOM 1299 CB ASP A 99 6.676 29.746 -4.689 1.00 0.00 C ATOM 1300 CG ASP A 99 6.570 28.763 -3.521 1.00 0.00 C ATOM 1301 OD1 ASP A 99 7.174 28.968 -2.457 1.00 0.00 O ATOM 1302 OD2 ASP A 99 5.820 27.736 -3.738 1.00 0.00 O ATOM 0 H ASP A 99 7.310 27.678 -5.952 1.00 0.00 H new ATOM 0 HA ASP A 99 8.002 30.453 -6.229 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.611 30.761 -4.297 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.817 29.602 -5.345 1.00 0.00 H new TER 1308 ASP A 99 HETATM 1309 ZN ZN A 100 4.299 15.282 -13.038 1.00 0.00 ZN