USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 808 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 CYS SG : rot -170:sc= -5.02! USER MOD Set 1.2: A 62 TYR OH : rot -35:sc= -0.204 USER MOD Single : A 4 TYR OH : rot 70:sc= -3.85! USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 99:sc= 0.383 USER MOD Single : A 13 ASN : amide:sc= -1.19 K(o=-1.2,f=-1.8) USER MOD Single : A 14 ASN : amide:sc= -0.212 X(o=-0.21,f=-0.11) USER MOD Single : A 16 THR OG1 : rot 180:sc= -2 USER MOD Single : A 22 GLN : amide:sc= -0.586 K(o=-0.59,f=-1.7) USER MOD Single : A 24 LYS NZ :NH3+ -148:sc= 1.35 (180deg=-0.408) USER MOD Single : A 25 SER OG : rot 58:sc= 1.1 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 180:sc= -2.29 USER MOD Single : A 40 THR OG1 : rot 10:sc= 0.0825! USER MOD Single : A 41 THR OG1 : rot 160:sc= 0.384 USER MOD Single : A 43 SER OG : rot 180:sc= -1.26 USER MOD Single : A 47 SER OG : rot 104:sc= 1.25 USER MOD Single : A 51 SER OG : rot 92:sc= 1.16 USER MOD Single : A 52 HIS : no HD1:sc= -1.34 X(o=-1.3,f=-1.4) USER MOD Single : A 53 ASN : amide:sc= -0.359 K(o=-0.36,f=-3.4!) USER MOD Single : A 54 LYS NZ :NH3+ -147:sc= 0.586 (180deg=0.198) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= -4.36 X(o=-4.4,f=-4.9!) USER MOD Single : A 70 SER OG : rot 130:sc= -0.405 USER MOD Single : A 77 THR OG1 : rot 100:sc= 1.13 USER MOD Single : A 78 MET CE :methyl 175:sc= -1.69! (180deg=-1.82!) USER MOD Single : A 82 TYR OH : rot 165:sc= -1.08 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.322 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -144:sc= -0.0304 (180deg=-0.644) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= -0.106 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -3.953 15.080 8.748 1.00 35.11 N ATOM 21 CA ALA A 2 -5.307 14.542 8.818 1.00 35.11 C ATOM 22 C ALA A 2 -5.531 13.443 7.796 1.00 35.11 C ATOM 23 O ALA A 2 -6.048 12.377 8.133 1.00 35.11 O ATOM 24 CB ALA A 2 -6.328 15.655 8.648 1.00 35.11 C ATOM 0 HA ALA A 2 -5.436 14.096 9.804 1.00 35.11 H new ATOM 0 HB1 ALA A 2 -7.334 15.238 8.703 1.00 35.11 H new ATOM 0 HB2 ALA A 2 -6.198 16.392 9.440 1.00 35.11 H new ATOM 0 HB3 ALA A 2 -6.186 16.134 7.679 1.00 35.11 H new ATOM 30 N GLU A 3 -5.118 13.676 6.557 1.00 71.76 N ATOM 31 CA GLU A 3 -5.261 12.660 5.522 1.00 71.76 C ATOM 32 C GLU A 3 -4.455 11.440 5.929 1.00 71.76 C ATOM 33 O GLU A 3 -4.904 10.304 5.791 1.00 71.76 O ATOM 34 CB GLU A 3 -4.784 13.200 4.171 1.00 71.76 C ATOM 35 CG GLU A 3 -5.508 14.455 3.729 1.00 71.76 C ATOM 36 CD GLU A 3 -5.830 14.457 2.246 1.00 71.76 C ATOM 37 OE1 GLU A 3 -4.957 14.863 1.449 1.00 71.76 O ATOM 38 OE2 GLU A 3 -6.953 14.051 1.883 1.00 71.76 O ATOM 0 H GLU A 3 -4.687 14.547 6.247 1.00 71.76 H new ATOM 0 HA GLU A 3 -6.310 12.386 5.415 1.00 71.76 H new ATOM 0 HB2 GLU A 3 -3.716 13.409 4.229 1.00 71.76 H new ATOM 0 HB3 GLU A 3 -4.917 12.428 3.413 1.00 71.76 H new ATOM 0 HG2 GLU A 3 -6.433 14.554 4.297 1.00 71.76 H new ATOM 0 HG3 GLU A 3 -4.894 15.325 3.964 1.00 71.76 H new ATOM 45 N TYR A 4 -3.261 11.696 6.458 1.00112.05 N ATOM 46 CA TYR A 4 -2.392 10.630 6.915 1.00112.05 C ATOM 47 C TYR A 4 -3.057 9.863 8.053 1.00112.05 C ATOM 48 O TYR A 4 -3.007 8.633 8.091 1.00112.05 O ATOM 49 CB TYR A 4 -1.030 11.178 7.352 1.00112.05 C ATOM 50 CG TYR A 4 -0.032 10.097 7.677 1.00112.05 C ATOM 51 CD1 TYR A 4 0.400 9.209 6.702 1.00112.05 C ATOM 52 CD2 TYR A 4 0.472 9.959 8.961 1.00112.05 C ATOM 53 CE1 TYR A 4 1.310 8.213 6.998 1.00112.05 C ATOM 54 CE2 TYR A 4 1.377 8.968 9.265 1.00112.05 C ATOM 55 CZ TYR A 4 1.795 8.096 8.281 1.00112.05 C ATOM 56 OH TYR A 4 2.697 7.102 8.583 1.00112.05 O ATOM 0 H TYR A 4 -2.879 12.634 6.578 1.00112.05 H new ATOM 0 HA TYR A 4 -2.222 9.945 6.084 1.00112.05 H new ATOM 0 HB2 TYR A 4 -0.628 11.808 6.559 1.00112.05 H new ATOM 0 HB3 TYR A 4 -1.165 11.814 8.227 1.00112.05 H new ATOM 0 HD1 TYR A 4 0.019 9.298 5.696 1.00112.05 H new ATOM 0 HD2 TYR A 4 0.149 10.640 9.735 1.00112.05 H new ATOM 0 HE1 TYR A 4 1.639 7.531 6.228 1.00112.05 H new ATOM 0 HE2 TYR A 4 1.759 8.873 10.271 1.00112.05 H new ATOM 0 HH TYR A 4 3.556 7.299 8.156 1.00112.05 H new ATOM 66 N GLY A 5 -3.702 10.591 8.978 1.00 23.54 N ATOM 67 CA GLY A 5 -4.381 9.933 10.083 1.00 23.54 C ATOM 68 C GLY A 5 -5.444 8.979 9.582 1.00 23.54 C ATOM 69 O GLY A 5 -5.529 7.833 10.021 1.00 23.54 O ATOM 0 H GLY A 5 -3.763 11.609 8.977 1.00 23.54 H new ATOM 0 HA2 GLY A 5 -3.655 9.388 10.687 1.00 23.54 H new ATOM 0 HA3 GLY A 5 -4.837 10.682 10.731 1.00 23.54 H new ATOM 73 N THR A 6 -6.233 9.460 8.630 1.00 90.84 N ATOM 74 CA THR A 6 -7.276 8.669 8.016 1.00 90.84 C ATOM 75 C THR A 6 -6.664 7.573 7.163 1.00 90.84 C ATOM 76 O THR A 6 -7.166 6.458 7.129 1.00 90.84 O ATOM 77 CB THR A 6 -8.193 9.573 7.170 1.00 90.84 C ATOM 78 OG1 THR A 6 -8.878 10.507 8.014 1.00 90.84 O ATOM 79 CG2 THR A 6 -9.198 8.770 6.375 1.00 90.84 C ATOM 0 H THR A 6 -6.163 10.410 8.266 1.00 90.84 H new ATOM 0 HA THR A 6 -7.877 8.201 8.796 1.00 90.84 H new ATOM 0 HB THR A 6 -7.561 10.111 6.463 1.00 90.84 H new ATOM 0 HG1 THR A 6 -9.457 11.078 7.467 1.00 90.84 H new ATOM 0 HG21 THR A 6 -9.825 9.446 5.793 1.00 90.84 H new ATOM 0 HG22 THR A 6 -8.672 8.093 5.702 1.00 90.84 H new ATOM 0 HG23 THR A 6 -9.823 8.192 7.056 1.00 90.84 H new ATOM 87 N LEU A 7 -5.562 7.885 6.492 1.00 63.89 N ATOM 88 CA LEU A 7 -4.876 6.896 5.665 1.00 63.89 C ATOM 89 C LEU A 7 -4.593 5.641 6.486 1.00 63.89 C ATOM 90 O LEU A 7 -5.029 4.541 6.146 1.00 63.89 O ATOM 91 CB LEU A 7 -3.564 7.481 5.132 1.00 63.89 C ATOM 92 CG LEU A 7 -2.575 6.453 4.576 1.00 63.89 C ATOM 93 CD1 LEU A 7 -3.215 5.642 3.459 1.00 63.89 C ATOM 94 CD2 LEU A 7 -1.285 7.124 4.124 1.00 63.89 C ATOM 0 H LEU A 7 -5.126 8.807 6.503 1.00 63.89 H new ATOM 0 HA LEU A 7 -5.514 6.632 4.821 1.00 63.89 H new ATOM 0 HB2 LEU A 7 -3.797 8.200 4.347 1.00 63.89 H new ATOM 0 HB3 LEU A 7 -3.077 8.033 5.936 1.00 63.89 H new ATOM 0 HG LEU A 7 -2.312 5.760 5.375 1.00 63.89 H new ATOM 0 HD11 LEU A 7 -2.496 4.917 3.077 1.00 63.89 H new ATOM 0 HD12 LEU A 7 -4.089 5.117 3.845 1.00 63.89 H new ATOM 0 HD13 LEU A 7 -3.519 6.310 2.653 1.00 63.89 H new ATOM 0 HD21 LEU A 7 -0.601 6.371 3.734 1.00 63.89 H new ATOM 0 HD22 LEU A 7 -1.507 7.852 3.343 1.00 63.89 H new ATOM 0 HD23 LEU A 7 -0.822 7.631 4.971 1.00 63.89 H new ATOM 106 N LEU A 8 -3.874 5.837 7.578 1.00 67.93 N ATOM 107 CA LEU A 8 -3.538 4.751 8.474 1.00 67.93 C ATOM 108 C LEU A 8 -4.802 4.109 9.031 1.00 67.93 C ATOM 109 O LEU A 8 -4.879 2.894 9.165 1.00 67.93 O ATOM 110 CB LEU A 8 -2.651 5.270 9.607 1.00 67.93 C ATOM 111 CG LEU A 8 -1.146 5.353 9.298 1.00 67.93 C ATOM 112 CD1 LEU A 8 -0.878 5.825 7.874 1.00 67.93 C ATOM 113 CD2 LEU A 8 -0.445 6.264 10.297 1.00 67.93 C ATOM 0 H LEU A 8 -3.511 6.746 7.864 1.00 67.93 H new ATOM 0 HA LEU A 8 -2.989 3.990 7.919 1.00 67.93 H new ATOM 0 HB2 LEU A 8 -3.000 6.263 9.889 1.00 67.93 H new ATOM 0 HB3 LEU A 8 -2.789 4.625 10.475 1.00 67.93 H new ATOM 0 HG LEU A 8 -0.742 4.345 9.390 1.00 67.93 H new ATOM 0 HD11 LEU A 8 0.197 5.868 7.701 1.00 67.93 H new ATOM 0 HD12 LEU A 8 -1.331 5.129 7.168 1.00 67.93 H new ATOM 0 HD13 LEU A 8 -1.308 6.816 7.732 1.00 67.93 H new ATOM 0 HD21 LEU A 8 0.619 6.311 10.063 1.00 67.93 H new ATOM 0 HD22 LEU A 8 -0.873 7.265 10.240 1.00 67.93 H new ATOM 0 HD23 LEU A 8 -0.578 5.870 11.304 1.00 67.93 H new ATOM 125 N GLN A 9 -5.802 4.935 9.324 1.00 42.21 N ATOM 126 CA GLN A 9 -7.072 4.453 9.839 1.00 42.21 C ATOM 127 C GLN A 9 -7.762 3.597 8.776 1.00 42.21 C ATOM 128 O GLN A 9 -8.402 2.593 9.089 1.00 42.21 O ATOM 129 CB GLN A 9 -7.904 5.682 10.259 1.00 42.21 C ATOM 130 CG GLN A 9 -9.413 5.522 10.208 1.00 42.21 C ATOM 131 CD GLN A 9 -10.093 5.917 11.506 1.00 42.21 C ATOM 132 OE1 GLN A 9 -10.777 6.937 11.576 1.00 42.21 O ATOM 133 NE2 GLN A 9 -9.902 5.109 12.543 1.00 42.21 N ATOM 0 H GLN A 9 -5.753 5.948 9.211 1.00 42.21 H new ATOM 0 HA GLN A 9 -6.941 3.814 10.712 1.00 42.21 H new ATOM 0 HB2 GLN A 9 -7.623 5.954 11.276 1.00 42.21 H new ATOM 0 HB3 GLN A 9 -7.627 6.518 9.617 1.00 42.21 H new ATOM 0 HG2 GLN A 9 -9.811 6.130 9.396 1.00 42.21 H new ATOM 0 HG3 GLN A 9 -9.656 4.485 9.978 1.00 42.21 H new ATOM 0 HE21 GLN A 9 -9.327 4.273 12.439 1.00 42.21 H new ATOM 0 HE22 GLN A 9 -10.331 5.324 13.443 1.00 42.21 H new ATOM 142 N ASP A 10 -7.625 4.005 7.522 1.00 76.39 N ATOM 143 CA ASP A 10 -8.230 3.283 6.413 1.00 76.39 C ATOM 144 C ASP A 10 -7.683 1.865 6.308 1.00 76.39 C ATOM 145 O ASP A 10 -8.456 0.909 6.303 1.00 76.39 O ATOM 146 CB ASP A 10 -8.010 4.039 5.103 1.00 76.39 C ATOM 147 CG ASP A 10 -8.768 5.353 5.049 1.00 76.39 C ATOM 148 OD1 ASP A 10 -9.617 5.588 5.933 1.00 76.39 O ATOM 149 OD2 ASP A 10 -8.510 6.147 4.120 1.00 76.39 O ATOM 0 H ASP A 10 -7.099 4.834 7.247 1.00 76.39 H new ATOM 0 HA ASP A 10 -9.301 3.213 6.604 1.00 76.39 H new ATOM 0 HB2 ASP A 10 -6.945 4.233 4.975 1.00 76.39 H new ATOM 0 HB3 ASP A 10 -8.322 3.410 4.269 1.00 76.39 H new ATOM 154 N LEU A 11 -6.356 1.708 6.262 1.00140.58 N ATOM 155 CA LEU A 11 -5.785 0.370 6.209 1.00140.58 C ATOM 156 C LEU A 11 -6.106 -0.339 7.507 1.00140.58 C ATOM 157 O LEU A 11 -6.368 -1.533 7.508 1.00140.58 O ATOM 158 CB LEU A 11 -4.290 0.399 5.914 1.00140.58 C ATOM 159 CG LEU A 11 -3.394 0.861 7.051 1.00140.58 C ATOM 160 CD1 LEU A 11 -2.948 -0.337 7.880 1.00140.58 C ATOM 161 CD2 LEU A 11 -2.196 1.622 6.490 1.00140.58 C ATOM 0 H LEU A 11 -5.679 2.470 6.261 1.00140.58 H new ATOM 0 HA LEU A 11 -6.229 -0.184 5.382 1.00140.58 H new ATOM 0 HB2 LEU A 11 -3.979 -0.603 5.617 1.00140.58 H new ATOM 0 HB3 LEU A 11 -4.122 1.052 5.057 1.00140.58 H new ATOM 0 HG LEU A 11 -3.950 1.535 7.702 1.00140.58 H new ATOM 0 HD11 LEU A 11 -2.306 0.002 8.693 1.00140.58 H new ATOM 0 HD12 LEU A 11 -3.823 -0.839 8.293 1.00140.58 H new ATOM 0 HD13 LEU A 11 -2.396 -1.032 7.247 1.00140.58 H new ATOM 0 HD21 LEU A 11 -1.557 1.951 7.310 1.00140.58 H new ATOM 0 HD22 LEU A 11 -1.628 0.969 5.827 1.00140.58 H new ATOM 0 HD23 LEU A 11 -2.546 2.491 5.932 1.00140.58 H new ATOM 173 N THR A 12 -6.155 0.427 8.607 1.00103.83 N ATOM 174 CA THR A 12 -6.526 -0.125 9.894 1.00103.83 C ATOM 175 C THR A 12 -7.946 -0.676 9.801 1.00103.83 C ATOM 176 O THR A 12 -8.261 -1.723 10.357 1.00103.83 O ATOM 177 CB THR A 12 -6.462 0.917 11.020 1.00103.83 C ATOM 178 OG1 THR A 12 -5.163 1.500 11.092 1.00103.83 O ATOM 179 CG2 THR A 12 -6.772 0.262 12.340 1.00103.83 C ATOM 0 H THR A 12 -5.941 1.424 8.619 1.00103.83 H new ATOM 0 HA THR A 12 -5.813 -0.912 10.137 1.00103.83 H new ATOM 0 HB THR A 12 -7.195 1.695 10.806 1.00103.83 H new ATOM 0 HG1 THR A 12 -5.169 2.369 10.638 1.00103.83 H new ATOM 0 HG21 THR A 12 -6.725 1.006 13.135 1.00103.83 H new ATOM 0 HG22 THR A 12 -7.772 -0.170 12.306 1.00103.83 H new ATOM 0 HG23 THR A 12 -6.043 -0.525 12.536 1.00103.83 H new ATOM 187 N ASN A 13 -8.791 0.025 9.052 1.00 36.97 N ATOM 188 CA ASN A 13 -10.161 -0.424 8.842 1.00 36.97 C ATOM 189 C ASN A 13 -10.143 -1.748 8.082 1.00 36.97 C ATOM 190 O ASN A 13 -11.000 -2.608 8.282 1.00 36.97 O ATOM 191 CB ASN A 13 -10.978 0.626 8.086 1.00 36.97 C ATOM 192 CG ASN A 13 -11.135 1.910 8.877 1.00 36.97 C ATOM 193 OD1 ASN A 13 -11.129 1.898 10.109 1.00 36.97 O ATOM 194 ND2 ASN A 13 -11.275 3.028 8.174 1.00 36.97 N ATOM 0 H ASN A 13 -8.553 0.899 8.584 1.00 36.97 H new ATOM 0 HA ASN A 13 -10.639 -0.569 9.811 1.00 36.97 H new ATOM 0 HB2 ASN A 13 -10.493 0.845 7.135 1.00 36.97 H new ATOM 0 HB3 ASN A 13 -11.963 0.220 7.856 1.00 36.97 H new ATOM 0 HD21 ASN A 13 -11.383 3.922 8.653 1.00 36.97 H new ATOM 0 HD22 ASN A 13 -11.274 2.993 7.155 1.00 36.97 H new ATOM 201 N ASN A 14 -9.122 -1.916 7.232 1.00 84.59 N ATOM 202 CA ASN A 14 -8.946 -3.147 6.469 1.00 84.59 C ATOM 203 C ASN A 14 -7.978 -4.097 7.180 1.00 84.59 C ATOM 204 O ASN A 14 -7.685 -5.185 6.684 1.00 84.59 O ATOM 205 CB ASN A 14 -8.425 -2.829 5.067 1.00 84.59 C ATOM 206 CG ASN A 14 -9.426 -2.035 4.252 1.00 84.59 C ATOM 207 OD1 ASN A 14 -10.347 -2.599 3.661 1.00 84.59 O ATOM 208 ND2 ASN A 14 -9.254 -0.719 4.220 1.00 84.59 N ATOM 0 H ASN A 14 -8.406 -1.210 7.059 1.00 84.59 H new ATOM 0 HA ASN A 14 -9.916 -3.638 6.389 1.00 84.59 H new ATOM 0 HB2 ASN A 14 -7.495 -2.266 5.146 1.00 84.59 H new ATOM 0 HB3 ASN A 14 -8.192 -3.759 4.548 1.00 84.59 H new ATOM 0 HD21 ASN A 14 -9.899 -0.133 3.690 1.00 84.59 H new ATOM 0 HD22 ASN A 14 -8.476 -0.294 4.725 1.00 84.59 H new ATOM 215 N ILE A 15 -7.467 -3.667 8.335 1.00120.44 N ATOM 216 CA ILE A 15 -6.525 -4.443 9.099 1.00120.44 C ATOM 217 C ILE A 15 -7.212 -5.334 10.135 1.00120.44 C ATOM 218 O ILE A 15 -7.816 -4.854 11.093 1.00120.44 O ATOM 219 CB ILE A 15 -5.477 -3.482 9.757 1.00120.44 C ATOM 220 CG1 ILE A 15 -4.094 -4.044 9.610 1.00120.44 C ATOM 221 CG2 ILE A 15 -5.730 -3.157 11.228 1.00120.44 C ATOM 222 CD1 ILE A 15 -3.923 -5.387 10.274 1.00120.44 C ATOM 0 H ILE A 15 -7.703 -2.768 8.756 1.00120.44 H new ATOM 0 HA ILE A 15 -6.007 -5.123 8.423 1.00120.44 H new ATOM 0 HB ILE A 15 -5.583 -2.541 9.217 1.00120.44 H new ATOM 0 HG12 ILE A 15 -3.858 -4.138 8.550 1.00120.44 H new ATOM 0 HG13 ILE A 15 -3.377 -3.342 10.035 1.00120.44 H new ATOM 0 HG21 ILE A 15 -4.952 -2.486 11.591 1.00120.44 H new ATOM 0 HG22 ILE A 15 -6.702 -2.675 11.332 1.00120.44 H new ATOM 0 HG23 ILE A 15 -5.717 -4.078 11.811 1.00120.44 H new ATOM 0 HD11 ILE A 15 -2.901 -5.737 10.130 1.00120.44 H new ATOM 0 HD12 ILE A 15 -4.128 -5.294 11.341 1.00120.44 H new ATOM 0 HD13 ILE A 15 -4.617 -6.102 9.832 1.00120.44 H new ATOM 234 N THR A 16 -7.085 -6.637 9.949 1.00158.94 N ATOM 235 CA THR A 16 -7.647 -7.580 10.890 1.00158.94 C ATOM 236 C THR A 16 -6.649 -7.823 11.989 1.00158.94 C ATOM 237 O THR A 16 -5.451 -7.599 11.806 1.00158.94 O ATOM 238 CB THR A 16 -7.972 -8.938 10.254 1.00158.94 C ATOM 239 OG1 THR A 16 -6.790 -9.528 9.708 1.00158.94 O ATOM 240 CG2 THR A 16 -9.021 -8.801 9.184 1.00158.94 C ATOM 0 H THR A 16 -6.600 -7.060 9.158 1.00158.94 H new ATOM 0 HA THR A 16 -8.575 -7.144 11.260 1.00158.94 H new ATOM 0 HB THR A 16 -8.366 -9.587 11.036 1.00158.94 H new ATOM 0 HG1 THR A 16 -7.012 -10.394 9.307 1.00158.94 H new ATOM 0 HG21 THR A 16 -9.230 -9.780 8.752 1.00158.94 H new ATOM 0 HG22 THR A 16 -9.934 -8.394 9.619 1.00158.94 H new ATOM 0 HG23 THR A 16 -8.660 -8.130 8.405 1.00158.94 H new ATOM 248 N LEU A 17 -7.120 -8.309 13.121 1.00 50.69 N ATOM 249 CA LEU A 17 -6.220 -8.605 14.223 1.00 50.69 C ATOM 250 C LEU A 17 -5.214 -9.662 13.777 1.00 50.69 C ATOM 251 O LEU A 17 -4.040 -9.622 14.144 1.00 50.69 O ATOM 252 CB LEU A 17 -6.987 -9.090 15.457 1.00 50.69 C ATOM 253 CG LEU A 17 -6.327 -8.781 16.811 1.00 50.69 C ATOM 254 CD1 LEU A 17 -6.880 -9.699 17.890 1.00 50.69 C ATOM 255 CD2 LEU A 17 -4.807 -8.904 16.733 1.00 50.69 C ATOM 0 H LEU A 17 -8.104 -8.505 13.303 1.00 50.69 H new ATOM 0 HA LEU A 17 -5.697 -7.690 14.501 1.00 50.69 H new ATOM 0 HB2 LEU A 17 -7.980 -8.641 15.446 1.00 50.69 H new ATOM 0 HB3 LEU A 17 -7.124 -10.168 15.377 1.00 50.69 H new ATOM 0 HG LEU A 17 -6.563 -7.749 17.070 1.00 50.69 H new ATOM 0 HD11 LEU A 17 -6.404 -9.469 18.843 1.00 50.69 H new ATOM 0 HD12 LEU A 17 -7.956 -9.551 17.977 1.00 50.69 H new ATOM 0 HD13 LEU A 17 -6.677 -10.736 17.624 1.00 50.69 H new ATOM 0 HD21 LEU A 17 -4.373 -8.679 17.707 1.00 50.69 H new ATOM 0 HD22 LEU A 17 -4.539 -9.920 16.442 1.00 50.69 H new ATOM 0 HD23 LEU A 17 -4.423 -8.201 15.994 1.00 50.69 H new ATOM 267 N GLU A 18 -5.695 -10.593 12.952 1.00107.93 N ATOM 268 CA GLU A 18 -4.854 -11.652 12.413 1.00107.93 C ATOM 269 C GLU A 18 -3.857 -11.068 11.423 1.00107.93 C ATOM 270 O GLU A 18 -2.666 -11.389 11.445 1.00107.93 O ATOM 271 CB GLU A 18 -5.720 -12.704 11.719 1.00107.93 C ATOM 272 CG GLU A 18 -6.610 -13.487 12.671 1.00107.93 C ATOM 273 CD GLU A 18 -7.417 -14.564 11.968 1.00107.93 C ATOM 274 OE1 GLU A 18 -7.463 -14.555 10.719 1.00107.93 O ATOM 275 OE2 GLU A 18 -8.000 -15.418 12.667 1.00107.93 O ATOM 0 H GLU A 18 -6.667 -10.631 12.644 1.00107.93 H new ATOM 0 HA GLU A 18 -4.309 -12.124 13.231 1.00107.93 H new ATOM 0 HB2 GLU A 18 -6.345 -12.213 10.973 1.00107.93 H new ATOM 0 HB3 GLU A 18 -5.073 -13.400 11.185 1.00107.93 H new ATOM 0 HG2 GLU A 18 -5.993 -13.947 13.443 1.00107.93 H new ATOM 0 HG3 GLU A 18 -7.290 -12.800 13.174 1.00107.93 H new ATOM 282 N ASP A 19 -4.357 -10.183 10.566 1.00 35.40 N ATOM 283 CA ASP A 19 -3.526 -9.520 9.572 1.00 35.40 C ATOM 284 C ASP A 19 -2.389 -8.768 10.244 1.00 35.40 C ATOM 285 O ASP A 19 -1.245 -8.814 9.796 1.00 35.40 O ATOM 286 CB ASP A 19 -4.374 -8.552 8.749 1.00 35.40 C ATOM 287 CG ASP A 19 -5.097 -9.227 7.597 1.00 35.40 C ATOM 288 OD1 ASP A 19 -4.912 -10.448 7.408 1.00 35.40 O ATOM 289 OD2 ASP A 19 -5.851 -8.531 6.885 1.00 35.40 O ATOM 0 H ASP A 19 -5.339 -9.909 10.542 1.00 35.40 H new ATOM 0 HA ASP A 19 -3.101 -10.277 8.913 1.00 35.40 H new ATOM 0 HB2 ASP A 19 -5.106 -8.075 9.401 1.00 35.40 H new ATOM 0 HB3 ASP A 19 -3.735 -7.762 8.356 1.00 35.40 H new ATOM 294 N LEU A 20 -2.712 -8.083 11.337 1.00 45.47 N ATOM 295 CA LEU A 20 -1.715 -7.325 12.081 1.00 45.47 C ATOM 296 C LEU A 20 -0.573 -8.216 12.527 1.00 45.47 C ATOM 297 O LEU A 20 0.584 -7.833 12.442 1.00 45.47 O ATOM 298 CB LEU A 20 -2.345 -6.649 13.295 1.00 45.47 C ATOM 299 CG LEU A 20 -2.375 -5.128 13.239 1.00 45.47 C ATOM 300 CD1 LEU A 20 -2.889 -4.571 14.556 1.00 45.47 C ATOM 301 CD2 LEU A 20 -0.997 -4.561 12.900 1.00 45.47 C ATOM 0 H LEU A 20 -3.654 -8.038 11.725 1.00 45.47 H new ATOM 0 HA LEU A 20 -1.319 -6.559 11.414 1.00 45.47 H new ATOM 0 HB2 LEU A 20 -3.366 -7.014 13.407 1.00 45.47 H new ATOM 0 HB3 LEU A 20 -1.798 -6.954 14.187 1.00 45.47 H new ATOM 0 HG LEU A 20 -3.055 -4.823 12.444 1.00 45.47 H new ATOM 0 HD11 LEU A 20 -2.908 -3.482 14.508 1.00 45.47 H new ATOM 0 HD12 LEU A 20 -3.897 -4.943 14.740 1.00 45.47 H new ATOM 0 HD13 LEU A 20 -2.232 -4.887 15.366 1.00 45.47 H new ATOM 0 HD21 LEU A 20 -1.049 -3.473 12.867 1.00 45.47 H new ATOM 0 HD22 LEU A 20 -0.280 -4.867 13.662 1.00 45.47 H new ATOM 0 HD23 LEU A 20 -0.677 -4.938 11.929 1.00 45.47 H new ATOM 313 N GLU A 21 -0.905 -9.411 12.997 1.00 91.26 N ATOM 314 CA GLU A 21 0.115 -10.344 13.447 1.00 91.26 C ATOM 315 C GLU A 21 1.081 -10.658 12.316 1.00 91.26 C ATOM 316 O GLU A 21 2.250 -10.955 12.554 1.00 91.26 O ATOM 317 CB GLU A 21 -0.508 -11.631 13.967 1.00 91.26 C ATOM 318 CG GLU A 21 -1.438 -11.424 15.152 1.00 91.26 C ATOM 319 CD GLU A 21 -2.011 -12.725 15.687 1.00 91.26 C ATOM 320 OE1 GLU A 21 -1.851 -13.767 15.016 1.00 91.26 O ATOM 321 OE2 GLU A 21 -2.622 -12.700 16.775 1.00 91.26 O ATOM 0 H GLU A 21 -1.863 -9.753 13.076 1.00 91.26 H new ATOM 0 HA GLU A 21 0.661 -9.873 14.264 1.00 91.26 H new ATOM 0 HB2 GLU A 21 -1.063 -12.108 13.159 1.00 91.26 H new ATOM 0 HB3 GLU A 21 0.287 -12.318 14.256 1.00 91.26 H new ATOM 0 HG2 GLU A 21 -0.895 -10.917 15.949 1.00 91.26 H new ATOM 0 HG3 GLU A 21 -2.256 -10.767 14.855 1.00 91.26 H new ATOM 328 N GLN A 22 0.596 -10.561 11.079 1.00 87.96 N ATOM 329 CA GLN A 22 1.455 -10.810 9.932 1.00 87.96 C ATOM 330 C GLN A 22 2.403 -9.640 9.775 1.00 87.96 C ATOM 331 O GLN A 22 3.610 -9.818 9.622 1.00 87.96 O ATOM 332 CB GLN A 22 0.648 -11.029 8.653 1.00 87.96 C ATOM 333 CG GLN A 22 1.513 -11.474 7.485 1.00 87.96 C ATOM 334 CD GLN A 22 0.701 -11.987 6.311 1.00 87.96 C ATOM 335 OE1 GLN A 22 -0.505 -12.207 6.423 1.00 87.96 O ATOM 336 NE2 GLN A 22 1.363 -12.185 5.176 1.00 87.96 N ATOM 0 H GLN A 22 -0.368 -10.317 10.852 1.00 87.96 H new ATOM 0 HA GLN A 22 2.019 -11.726 10.106 1.00 87.96 H new ATOM 0 HB2 GLN A 22 -0.121 -11.779 8.837 1.00 87.96 H new ATOM 0 HB3 GLN A 22 0.135 -10.104 8.389 1.00 87.96 H new ATOM 0 HG2 GLN A 22 2.129 -10.637 7.156 1.00 87.96 H new ATOM 0 HG3 GLN A 22 2.192 -12.258 7.820 1.00 87.96 H new ATOM 0 HE21 GLN A 22 2.363 -11.989 5.128 1.00 87.96 H new ATOM 0 HE22 GLN A 22 0.871 -12.533 4.353 1.00 87.96 H new ATOM 345 N LEU A 23 1.848 -8.431 9.874 1.00 99.30 N ATOM 346 CA LEU A 23 2.640 -7.218 9.807 1.00 99.30 C ATOM 347 C LEU A 23 3.622 -7.238 10.970 1.00 99.30 C ATOM 348 O LEU A 23 4.817 -7.026 10.807 1.00 99.30 O ATOM 349 CB LEU A 23 1.714 -5.999 9.923 1.00 99.30 C ATOM 350 CG LEU A 23 0.553 -5.971 8.931 1.00 99.30 C ATOM 351 CD1 LEU A 23 -0.259 -4.689 9.080 1.00 99.30 C ATOM 352 CD2 LEU A 23 1.060 -6.141 7.500 1.00 99.30 C ATOM 0 H LEU A 23 0.848 -8.273 10.001 1.00 99.30 H new ATOM 0 HA LEU A 23 3.178 -7.159 8.861 1.00 99.30 H new ATOM 0 HB2 LEU A 23 1.309 -5.965 10.934 1.00 99.30 H new ATOM 0 HB3 LEU A 23 2.309 -5.096 9.788 1.00 99.30 H new ATOM 0 HG LEU A 23 -0.107 -6.809 9.154 1.00 99.30 H new ATOM 0 HD11 LEU A 23 -1.080 -4.693 8.363 1.00 99.30 H new ATOM 0 HD12 LEU A 23 -0.661 -4.628 10.091 1.00 99.30 H new ATOM 0 HD13 LEU A 23 0.383 -3.828 8.892 1.00 99.30 H new ATOM 0 HD21 LEU A 23 0.217 -6.118 6.810 1.00 99.30 H new ATOM 0 HD22 LEU A 23 1.748 -5.331 7.259 1.00 99.30 H new ATOM 0 HD23 LEU A 23 1.578 -7.096 7.408 1.00 99.30 H new ATOM 364 N LYS A 24 3.074 -7.551 12.141 1.00114.71 N ATOM 365 CA LYS A 24 3.840 -7.657 13.375 1.00114.71 C ATOM 366 C LYS A 24 4.926 -8.717 13.238 1.00114.71 C ATOM 367 O LYS A 24 6.051 -8.536 13.702 1.00114.71 O ATOM 368 CB LYS A 24 2.905 -8.024 14.532 1.00114.71 C ATOM 369 CG LYS A 24 1.906 -6.928 14.876 1.00114.71 C ATOM 370 CD LYS A 24 0.752 -7.456 15.715 1.00114.71 C ATOM 371 CE LYS A 24 1.231 -7.990 17.053 1.00114.71 C ATOM 372 NZ LYS A 24 0.094 -8.400 17.925 1.00114.71 N ATOM 0 H LYS A 24 2.078 -7.739 12.259 1.00114.71 H new ATOM 0 HA LYS A 24 4.312 -6.696 13.578 1.00114.71 H new ATOM 0 HB2 LYS A 24 2.361 -8.933 14.275 1.00114.71 H new ATOM 0 HB3 LYS A 24 3.503 -8.250 15.415 1.00114.71 H new ATOM 0 HG2 LYS A 24 2.414 -6.131 15.418 1.00114.71 H new ATOM 0 HG3 LYS A 24 1.516 -6.490 13.957 1.00114.71 H new ATOM 0 HD2 LYS A 24 0.027 -6.659 15.879 1.00114.71 H new ATOM 0 HD3 LYS A 24 0.238 -8.248 15.170 1.00114.71 H new ATOM 0 HE2 LYS A 24 1.889 -8.843 16.889 1.00114.71 H new ATOM 0 HE3 LYS A 24 1.820 -7.226 17.560 1.00114.71 H new ATOM 0 HZ1 LYS A 24 0.345 -8.239 18.921 1.00114.71 H new ATOM 0 HZ2 LYS A 24 -0.748 -7.838 17.685 1.00114.71 H new ATOM 0 HZ3 LYS A 24 -0.110 -9.409 17.778 1.00114.71 H new ATOM 386 N SER A 25 4.580 -9.824 12.576 1.00 75.52 N ATOM 387 CA SER A 25 5.526 -10.913 12.352 1.00 75.52 C ATOM 388 C SER A 25 6.696 -10.393 11.532 1.00 75.52 C ATOM 389 O SER A 25 7.861 -10.689 11.804 1.00 75.52 O ATOM 390 CB SER A 25 4.846 -12.083 11.630 1.00 75.52 C ATOM 391 OG SER A 25 3.944 -12.759 12.489 1.00 75.52 O ATOM 0 H SER A 25 3.651 -9.987 12.187 1.00 75.52 H new ATOM 0 HA SER A 25 5.887 -11.278 13.313 1.00 75.52 H new ATOM 0 HB2 SER A 25 4.311 -11.713 10.755 1.00 75.52 H new ATOM 0 HB3 SER A 25 5.602 -12.781 11.270 1.00 75.52 H new ATOM 0 HG SER A 25 3.272 -12.127 12.821 1.00 75.52 H new ATOM 397 N ALA A 26 6.359 -9.570 10.556 1.00 32.46 N ATOM 398 CA ALA A 26 7.340 -8.930 9.710 1.00 32.46 C ATOM 399 C ALA A 26 8.061 -7.853 10.509 1.00 32.46 C ATOM 400 O ALA A 26 9.245 -7.590 10.302 1.00 32.46 O ATOM 401 CB ALA A 26 6.662 -8.340 8.479 1.00 32.46 C ATOM 0 H ALA A 26 5.394 -9.328 10.330 1.00 32.46 H new ATOM 0 HA ALA A 26 8.071 -9.663 9.370 1.00 32.46 H new ATOM 0 HB1 ALA A 26 7.409 -7.860 7.847 1.00 32.46 H new ATOM 0 HB2 ALA A 26 6.170 -9.135 7.919 1.00 32.46 H new ATOM 0 HB3 ALA A 26 5.922 -7.603 8.790 1.00 32.46 H new ATOM 407 N CYS A 27 7.317 -7.231 11.431 1.00 54.89 N ATOM 408 CA CYS A 27 7.864 -6.179 12.270 1.00 54.89 C ATOM 409 C CYS A 27 8.606 -6.728 13.473 1.00 54.89 C ATOM 410 O CYS A 27 9.139 -5.953 14.253 1.00 54.89 O ATOM 411 CB CYS A 27 6.778 -5.237 12.772 1.00 54.89 C ATOM 412 SG CYS A 27 5.817 -4.438 11.477 1.00 54.89 S ATOM 0 H CYS A 27 6.335 -7.444 11.609 1.00 54.89 H new ATOM 0 HA CYS A 27 8.563 -5.635 11.635 1.00 54.89 H new ATOM 0 HB2 CYS A 27 6.100 -5.797 13.416 1.00 54.89 H new ATOM 0 HB3 CYS A 27 7.241 -4.467 13.389 1.00 54.89 H new ATOM 0 HG CYS A 27 5.074 -3.508 11.999 1.00 54.89 H new ATOM 418 N LYS A 28 8.658 -8.053 13.654 1.00157.95 N ATOM 419 CA LYS A 28 9.373 -8.599 14.820 1.00157.95 C ATOM 420 C LYS A 28 10.781 -8.018 14.882 1.00157.95 C ATOM 421 O LYS A 28 11.313 -7.738 15.956 1.00157.95 O ATOM 422 CB LYS A 28 9.454 -10.118 14.770 1.00157.95 C ATOM 423 CG LYS A 28 8.114 -10.791 14.946 1.00157.95 C ATOM 424 CD LYS A 28 8.275 -12.159 15.567 1.00157.95 C ATOM 425 CE LYS A 28 7.087 -13.058 15.261 1.00157.95 C ATOM 426 NZ LYS A 28 6.015 -12.933 16.287 1.00157.95 N ATOM 0 H LYS A 28 8.233 -8.745 13.037 1.00157.95 H new ATOM 0 HA LYS A 28 8.814 -8.319 15.713 1.00157.95 H new ATOM 0 HB2 LYS A 28 9.883 -10.421 13.815 1.00157.95 H new ATOM 0 HB3 LYS A 28 10.133 -10.465 15.549 1.00157.95 H new ATOM 0 HG2 LYS A 28 7.473 -10.174 15.576 1.00157.95 H new ATOM 0 HG3 LYS A 28 7.619 -10.882 13.979 1.00157.95 H new ATOM 0 HD2 LYS A 28 9.188 -12.623 15.194 1.00157.95 H new ATOM 0 HD3 LYS A 28 8.387 -12.058 16.647 1.00157.95 H new ATOM 0 HE2 LYS A 28 6.683 -12.804 14.281 1.00157.95 H new ATOM 0 HE3 LYS A 28 7.420 -14.094 15.209 1.00157.95 H new ATOM 0 HZ1 LYS A 28 5.224 -13.562 16.041 1.00157.95 H new ATOM 0 HZ2 LYS A 28 6.393 -13.200 17.218 1.00157.95 H new ATOM 0 HZ3 LYS A 28 5.678 -11.950 16.319 1.00157.95 H new ATOM 440 N GLU A 29 11.353 -7.817 13.706 1.00243.70 N ATOM 441 CA GLU A 29 12.677 -7.242 13.579 1.00243.70 C ATOM 442 C GLU A 29 12.659 -5.718 13.763 1.00243.70 C ATOM 443 O GLU A 29 13.611 -5.140 14.288 1.00243.70 O ATOM 444 CB GLU A 29 13.260 -7.592 12.207 1.00243.70 C ATOM 445 CG GLU A 29 13.311 -9.087 11.929 1.00243.70 C ATOM 446 CD GLU A 29 14.000 -9.414 10.618 1.00243.70 C ATOM 447 OE1 GLU A 29 13.360 -9.260 9.557 1.00243.70 O ATOM 448 OE2 GLU A 29 15.179 -9.827 10.653 1.00243.70 O ATOM 0 H GLU A 29 10.912 -8.048 12.816 1.00243.70 H new ATOM 0 HA GLU A 29 13.301 -7.663 14.368 1.00243.70 H new ATOM 0 HB2 GLU A 29 12.663 -7.108 11.434 1.00243.70 H new ATOM 0 HB3 GLU A 29 14.268 -7.183 12.135 1.00243.70 H new ATOM 0 HG2 GLU A 29 13.834 -9.587 12.744 1.00243.70 H new ATOM 0 HG3 GLU A 29 12.296 -9.484 11.911 1.00243.70 H new ATOM 455 N ASP A 30 11.592 -5.068 13.288 1.00108.85 N ATOM 456 CA ASP A 30 11.484 -3.607 13.359 1.00108.85 C ATOM 457 C ASP A 30 10.851 -3.095 14.657 1.00108.85 C ATOM 458 O ASP A 30 11.361 -2.160 15.274 1.00108.85 O ATOM 459 CB ASP A 30 10.679 -3.093 12.161 1.00108.85 C ATOM 460 CG ASP A 30 11.365 -3.378 10.839 1.00108.85 C ATOM 461 OD1 ASP A 30 12.597 -3.583 10.840 1.00108.85 O ATOM 462 OD2 ASP A 30 10.670 -3.392 9.800 1.00108.85 O ATOM 0 H ASP A 30 10.793 -5.528 12.852 1.00108.85 H new ATOM 0 HA ASP A 30 12.504 -3.222 13.339 1.00108.85 H new ATOM 0 HB2 ASP A 30 9.693 -3.557 12.163 1.00108.85 H new ATOM 0 HB3 ASP A 30 10.526 -2.019 12.264 1.00108.85 H new ATOM 467 N ILE A 31 9.730 -3.685 15.048 1.00355.97 N ATOM 468 CA ILE A 31 9.015 -3.266 16.243 1.00355.97 C ATOM 469 C ILE A 31 9.210 -4.255 17.398 1.00355.97 C ATOM 470 O ILE A 31 9.173 -5.467 17.190 1.00355.97 O ATOM 471 CB ILE A 31 7.514 -3.068 15.919 1.00355.97 C ATOM 472 CG1 ILE A 31 6.870 -2.118 16.929 1.00355.97 C ATOM 473 CG2 ILE A 31 6.751 -4.387 15.803 1.00355.97 C ATOM 474 CD1 ILE A 31 6.361 -2.764 18.198 1.00355.97 C ATOM 0 H ILE A 31 9.294 -4.461 14.550 1.00355.97 H new ATOM 0 HA ILE A 31 9.430 -2.313 16.571 1.00355.97 H new ATOM 0 HB ILE A 31 7.453 -2.609 14.932 1.00355.97 H new ATOM 0 HG12 ILE A 31 7.599 -1.354 17.198 1.00355.97 H new ATOM 0 HG13 ILE A 31 6.038 -1.608 16.443 1.00355.97 H new ATOM 0 HG21 ILE A 31 5.705 -4.183 15.575 1.00355.97 H new ATOM 0 HG22 ILE A 31 7.186 -4.990 15.006 1.00355.97 H new ATOM 0 HG23 ILE A 31 6.818 -4.930 16.746 1.00355.97 H new ATOM 0 HD11 ILE A 31 5.924 -2.002 18.844 1.00355.97 H new ATOM 0 HD12 ILE A 31 5.603 -3.507 17.949 1.00355.97 H new ATOM 0 HD13 ILE A 31 7.188 -3.249 18.717 1.00355.97 H new ATOM 486 N PRO A 32 9.449 -3.755 18.631 1.00153.08 N ATOM 487 CA PRO A 32 9.676 -4.617 19.791 1.00153.08 C ATOM 488 C PRO A 32 8.531 -5.583 20.067 1.00153.08 C ATOM 489 O PRO A 32 7.358 -5.216 20.000 1.00153.08 O ATOM 490 CB PRO A 32 9.831 -3.634 20.958 1.00153.08 C ATOM 491 CG PRO A 32 10.224 -2.348 20.327 1.00153.08 C ATOM 492 CD PRO A 32 9.546 -2.325 18.990 1.00153.08 C ATOM 0 HA PRO A 32 10.543 -5.258 19.631 1.00153.08 H new ATOM 0 HB2 PRO A 32 8.899 -3.532 21.515 1.00153.08 H new ATOM 0 HB3 PRO A 32 10.588 -3.975 21.664 1.00153.08 H new ATOM 0 HG2 PRO A 32 9.912 -1.501 20.938 1.00153.08 H new ATOM 0 HG3 PRO A 32 11.306 -2.281 20.218 1.00153.08 H new ATOM 0 HD2 PRO A 32 8.563 -1.857 19.046 1.00153.08 H new ATOM 0 HD3 PRO A 32 10.125 -1.765 18.256 1.00153.08 H new ATOM 500 N SER A 33 8.892 -6.819 20.399 1.00 84.70 N ATOM 501 CA SER A 33 7.914 -7.851 20.714 1.00 84.70 C ATOM 502 C SER A 33 7.114 -7.462 21.954 1.00 84.70 C ATOM 503 O SER A 33 5.931 -7.785 22.071 1.00 84.70 O ATOM 504 CB SER A 33 8.614 -9.190 20.940 1.00 84.70 C ATOM 505 OG SER A 33 7.674 -10.244 21.050 1.00 84.70 O ATOM 0 H SER A 33 9.862 -7.130 20.457 1.00 84.70 H new ATOM 0 HA SER A 33 7.229 -7.950 19.872 1.00 84.70 H new ATOM 0 HB2 SER A 33 9.296 -9.391 20.114 1.00 84.70 H new ATOM 0 HB3 SER A 33 9.217 -9.140 21.847 1.00 84.70 H new ATOM 0 HG SER A 33 8.147 -11.090 21.193 1.00 84.70 H new ATOM 511 N GLU A 34 7.770 -6.759 22.874 1.00109.83 N ATOM 512 CA GLU A 34 7.126 -6.312 24.105 1.00109.83 C ATOM 513 C GLU A 34 5.940 -5.405 23.788 1.00109.83 C ATOM 514 O GLU A 34 4.976 -5.336 24.551 1.00109.83 O ATOM 515 CB GLU A 34 8.123 -5.566 24.993 1.00109.83 C ATOM 516 CG GLU A 34 7.563 -5.214 26.358 1.00109.83 C ATOM 517 CD GLU A 34 7.451 -6.419 27.271 1.00109.83 C ATOM 518 OE1 GLU A 34 8.214 -7.388 27.071 1.00109.83 O ATOM 519 OE2 GLU A 34 6.597 -6.397 28.181 1.00109.83 O ATOM 0 H GLU A 34 8.749 -6.486 22.789 1.00109.83 H new ATOM 0 HA GLU A 34 6.767 -7.192 24.639 1.00109.83 H new ATOM 0 HB2 GLU A 34 9.015 -6.179 25.121 1.00109.83 H new ATOM 0 HB3 GLU A 34 8.435 -4.651 24.489 1.00109.83 H new ATOM 0 HG2 GLU A 34 8.202 -4.466 26.827 1.00109.83 H new ATOM 0 HG3 GLU A 34 6.579 -4.762 26.237 1.00109.83 H new ATOM 526 N LYS A 35 6.017 -4.715 22.655 1.00 73.01 N ATOM 527 CA LYS A 35 4.953 -3.819 22.234 1.00 73.01 C ATOM 528 C LYS A 35 3.996 -4.519 21.276 1.00 73.01 C ATOM 529 O LYS A 35 2.828 -4.156 21.181 1.00 73.01 O ATOM 530 CB LYS A 35 5.559 -2.594 21.554 1.00 73.01 C ATOM 531 CG LYS A 35 6.437 -1.780 22.480 1.00 73.01 C ATOM 532 CD LYS A 35 5.597 -1.008 23.480 1.00 73.01 C ATOM 533 CE LYS A 35 6.461 -0.233 24.461 1.00 73.01 C ATOM 534 NZ LYS A 35 5.639 0.556 25.419 1.00 73.01 N ATOM 0 H LYS A 35 6.808 -4.761 22.013 1.00 73.01 H new ATOM 0 HA LYS A 35 4.390 -3.512 23.115 1.00 73.01 H new ATOM 0 HB2 LYS A 35 6.147 -2.916 20.694 1.00 73.01 H new ATOM 0 HB3 LYS A 35 4.757 -1.962 21.173 1.00 73.01 H new ATOM 0 HG2 LYS A 35 7.125 -2.440 23.009 1.00 73.01 H new ATOM 0 HG3 LYS A 35 7.044 -1.087 21.897 1.00 73.01 H new ATOM 0 HD2 LYS A 35 4.942 -0.318 22.949 1.00 73.01 H new ATOM 0 HD3 LYS A 35 4.956 -1.699 24.027 1.00 73.01 H new ATOM 0 HE2 LYS A 35 7.096 -0.926 25.012 1.00 73.01 H new ATOM 0 HE3 LYS A 35 7.122 0.437 23.912 1.00 73.01 H new ATOM 0 HZ1 LYS A 35 6.265 1.070 26.071 1.00 73.01 H new ATOM 0 HZ2 LYS A 35 5.051 1.235 24.895 1.00 73.01 H new ATOM 0 HZ3 LYS A 35 5.026 -0.086 25.961 1.00 73.01 H new ATOM 548 N SER A 36 4.494 -5.535 20.582 1.00 80.12 N ATOM 549 CA SER A 36 3.682 -6.296 19.642 1.00 80.12 C ATOM 550 C SER A 36 2.479 -6.927 20.331 1.00 80.12 C ATOM 551 O SER A 36 1.423 -7.100 19.726 1.00 80.12 O ATOM 552 CB SER A 36 4.534 -7.376 18.984 1.00 80.12 C ATOM 553 OG SER A 36 3.789 -8.109 18.030 1.00 80.12 O ATOM 0 H SER A 36 5.461 -5.852 20.654 1.00 80.12 H new ATOM 0 HA SER A 36 3.309 -5.610 18.881 1.00 80.12 H new ATOM 0 HB2 SER A 36 5.397 -6.917 18.500 1.00 80.12 H new ATOM 0 HB3 SER A 36 4.919 -8.053 19.746 1.00 80.12 H new ATOM 0 HG SER A 36 4.361 -8.793 17.624 1.00 80.12 H new ATOM 559 N GLU A 37 2.650 -7.286 21.592 1.00 42.03 N ATOM 560 CA GLU A 37 1.583 -7.922 22.352 1.00 42.03 C ATOM 561 C GLU A 37 0.350 -7.027 22.462 1.00 42.03 C ATOM 562 O GLU A 37 -0.779 -7.512 22.407 1.00 42.03 O ATOM 563 CB GLU A 37 2.093 -8.296 23.742 1.00 42.03 C ATOM 564 CG GLU A 37 3.215 -9.324 23.710 1.00 42.03 C ATOM 565 CD GLU A 37 3.701 -9.707 25.095 1.00 42.03 C ATOM 566 OE1 GLU A 37 3.327 -9.021 26.071 1.00 42.03 O ATOM 567 OE2 GLU A 37 4.461 -10.692 25.203 1.00 42.03 O ATOM 0 H GLU A 37 3.516 -7.149 22.112 1.00 42.03 H new ATOM 0 HA GLU A 37 1.282 -8.824 21.818 1.00 42.03 H new ATOM 0 HB2 GLU A 37 2.446 -7.397 24.247 1.00 42.03 H new ATOM 0 HB3 GLU A 37 1.265 -8.689 24.333 1.00 42.03 H new ATOM 0 HG2 GLU A 37 2.868 -10.218 23.192 1.00 42.03 H new ATOM 0 HG3 GLU A 37 4.050 -8.926 23.134 1.00 42.03 H new ATOM 574 N GLU A 38 0.561 -5.724 22.616 1.00 75.99 N ATOM 575 CA GLU A 38 -0.558 -4.790 22.728 1.00 75.99 C ATOM 576 C GLU A 38 -1.018 -4.250 21.378 1.00 75.99 C ATOM 577 O GLU A 38 -1.933 -3.426 21.318 1.00 75.99 O ATOM 578 CB GLU A 38 -0.216 -3.630 23.659 1.00 75.99 C ATOM 579 CG GLU A 38 0.887 -2.721 23.133 1.00 75.99 C ATOM 580 CD GLU A 38 1.255 -1.616 24.110 1.00 75.99 C ATOM 581 OE1 GLU A 38 0.579 -1.492 25.154 1.00 75.99 O ATOM 582 OE2 GLU A 38 2.220 -0.875 23.830 1.00 75.99 O ATOM 0 H GLU A 38 1.484 -5.293 22.666 1.00 75.99 H new ATOM 0 HA GLU A 38 -1.385 -5.361 23.151 1.00 75.99 H new ATOM 0 HB2 GLU A 38 -1.114 -3.035 23.827 1.00 75.99 H new ATOM 0 HB3 GLU A 38 0.087 -4.031 24.626 1.00 75.99 H new ATOM 0 HG2 GLU A 38 1.772 -3.319 22.917 1.00 75.99 H new ATOM 0 HG3 GLU A 38 0.566 -2.275 22.191 1.00 75.99 H new ATOM 589 N ILE A 39 -0.401 -4.709 20.303 1.00131.16 N ATOM 590 CA ILE A 39 -0.782 -4.257 18.974 1.00131.16 C ATOM 591 C ILE A 39 -1.876 -5.147 18.401 1.00131.16 C ATOM 592 O ILE A 39 -1.634 -5.986 17.533 1.00131.16 O ATOM 593 CB ILE A 39 0.438 -4.189 18.027 1.00131.16 C ATOM 594 CG1 ILE A 39 1.401 -3.126 18.550 1.00131.16 C ATOM 595 CG2 ILE A 39 0.019 -3.867 16.594 1.00131.16 C ATOM 596 CD1 ILE A 39 2.728 -3.096 17.838 1.00131.16 C ATOM 0 H ILE A 39 0.360 -5.388 20.322 1.00131.16 H new ATOM 0 HA ILE A 39 -1.177 -3.245 19.064 1.00131.16 H new ATOM 0 HB ILE A 39 0.926 -5.163 18.008 1.00131.16 H new ATOM 0 HG12 ILE A 39 0.930 -2.147 18.459 1.00131.16 H new ATOM 0 HG13 ILE A 39 1.574 -3.299 19.612 1.00131.16 H new ATOM 0 HG21 ILE A 39 0.902 -3.827 15.957 1.00131.16 H new ATOM 0 HG22 ILE A 39 -0.657 -4.641 16.230 1.00131.16 H new ATOM 0 HG23 ILE A 39 -0.488 -2.903 16.571 1.00131.16 H new ATOM 0 HD11 ILE A 39 3.354 -2.314 18.268 1.00131.16 H new ATOM 0 HD12 ILE A 39 3.223 -4.061 17.950 1.00131.16 H new ATOM 0 HD13 ILE A 39 2.568 -2.891 16.779 1.00131.16 H new ATOM 608 N THR A 40 -3.087 -4.930 18.894 1.00160.31 N ATOM 609 CA THR A 40 -4.255 -5.680 18.444 1.00160.31 C ATOM 610 C THR A 40 -5.063 -4.895 17.398 1.00160.31 C ATOM 611 O THR A 40 -6.099 -5.360 16.922 1.00160.31 O ATOM 612 CB THR A 40 -5.165 -6.109 19.634 1.00160.31 C ATOM 613 OG1 THR A 40 -6.526 -6.254 19.206 1.00160.31 O ATOM 614 CG2 THR A 40 -5.103 -5.113 20.794 1.00160.31 C ATOM 0 H THR A 40 -3.289 -4.235 19.612 1.00160.31 H new ATOM 0 HA THR A 40 -3.881 -6.587 17.970 1.00160.31 H new ATOM 0 HB THR A 40 -4.788 -7.069 19.988 1.00160.31 H new ATOM 0 HG1 THR A 40 -6.568 -6.211 18.228 1.00160.31 H new ATOM 0 HG21 THR A 40 -5.753 -5.453 21.600 1.00160.31 H new ATOM 0 HG22 THR A 40 -4.078 -5.043 21.159 1.00160.31 H new ATOM 0 HG23 THR A 40 -5.434 -4.133 20.450 1.00160.31 H new ATOM 622 N THR A 41 -4.569 -3.713 17.039 1.00182.91 N ATOM 623 CA THR A 41 -5.205 -2.855 16.051 1.00182.91 C ATOM 624 C THR A 41 -4.180 -2.038 15.309 1.00182.91 C ATOM 625 O THR A 41 -3.163 -1.633 15.873 1.00182.91 O ATOM 626 CB THR A 41 -6.257 -1.890 16.661 1.00182.91 C ATOM 627 OG1 THR A 41 -6.359 -0.685 15.887 1.00182.91 O ATOM 628 CG2 THR A 41 -5.968 -1.518 18.116 1.00182.91 C ATOM 0 H THR A 41 -3.711 -3.324 17.429 1.00182.91 H new ATOM 0 HA THR A 41 -5.722 -3.530 15.370 1.00182.91 H new ATOM 0 HB THR A 41 -7.200 -2.436 16.638 1.00182.91 H new ATOM 0 HG1 THR A 41 -7.214 -0.246 16.077 1.00182.91 H new ATOM 0 HG21 THR A 41 -6.742 -0.842 18.479 1.00182.91 H new ATOM 0 HG22 THR A 41 -5.959 -2.420 18.727 1.00182.91 H new ATOM 0 HG23 THR A 41 -4.997 -1.026 18.180 1.00182.91 H new ATOM 636 N GLY A 42 -4.485 -1.748 14.050 1.00 66.60 N ATOM 637 CA GLY A 42 -3.599 -0.914 13.272 1.00 66.60 C ATOM 638 C GLY A 42 -3.466 0.430 13.953 1.00 66.60 C ATOM 639 O GLY A 42 -2.408 1.060 13.922 1.00 66.60 O ATOM 0 H GLY A 42 -5.320 -2.072 13.562 1.00 66.60 H new ATOM 0 HA2 GLY A 42 -2.622 -1.387 13.178 1.00 66.60 H new ATOM 0 HA3 GLY A 42 -3.990 -0.788 12.262 1.00 66.60 H new ATOM 643 N SER A 43 -4.548 0.833 14.630 1.00 41.24 N ATOM 644 CA SER A 43 -4.550 2.063 15.392 1.00 41.24 C ATOM 645 C SER A 43 -3.581 1.931 16.561 1.00 41.24 C ATOM 646 O SER A 43 -2.828 2.854 16.874 1.00 41.24 O ATOM 647 CB SER A 43 -5.961 2.384 15.895 1.00 41.24 C ATOM 648 OG SER A 43 -6.893 2.383 14.827 1.00 41.24 O ATOM 0 H SER A 43 -5.428 0.317 14.658 1.00 41.24 H new ATOM 0 HA SER A 43 -4.230 2.884 14.750 1.00 41.24 H new ATOM 0 HB2 SER A 43 -6.260 1.650 16.644 1.00 41.24 H new ATOM 0 HB3 SER A 43 -5.964 3.358 16.384 1.00 41.24 H new ATOM 0 HG SER A 43 -7.787 2.589 15.173 1.00 41.24 H new ATOM 654 N ALA A 44 -3.609 0.755 17.197 1.00 31.60 N ATOM 655 CA ALA A 44 -2.734 0.468 18.333 1.00 31.60 C ATOM 656 C ALA A 44 -1.272 0.472 17.916 1.00 31.60 C ATOM 657 O ALA A 44 -0.391 0.848 18.689 1.00 31.60 O ATOM 658 CB ALA A 44 -3.084 -0.880 18.944 1.00 31.60 C ATOM 0 H ALA A 44 -4.230 -0.013 16.942 1.00 31.60 H new ATOM 0 HA ALA A 44 -2.886 1.253 19.074 1.00 31.60 H new ATOM 0 HB1 ALA A 44 -2.424 -1.079 19.788 1.00 31.60 H new ATOM 0 HB2 ALA A 44 -4.118 -0.866 19.287 1.00 31.60 H new ATOM 0 HB3 ALA A 44 -2.961 -1.662 18.195 1.00 31.60 H new ATOM 664 N TRP A 45 -1.026 0.044 16.687 1.00 71.86 N ATOM 665 CA TRP A 45 0.321 -0.013 16.152 1.00 71.86 C ATOM 666 C TRP A 45 0.758 1.353 15.716 1.00 71.86 C ATOM 667 O TRP A 45 1.788 1.854 16.156 1.00 71.86 O ATOM 668 CB TRP A 45 0.375 -0.956 14.964 1.00 71.86 C ATOM 669 CG TRP A 45 1.757 -1.197 14.465 1.00 71.86 C ATOM 670 CD1 TRP A 45 2.908 -1.299 15.196 1.00 71.86 C ATOM 671 CD2 TRP A 45 2.129 -1.363 13.105 1.00 71.86 C ATOM 672 NE1 TRP A 45 3.971 -1.514 14.358 1.00 71.86 N ATOM 673 CE2 TRP A 45 3.517 -1.554 13.070 1.00 71.86 C ATOM 674 CE3 TRP A 45 1.415 -1.364 11.913 1.00 71.86 C ATOM 675 CZ2 TRP A 45 4.209 -1.746 11.884 1.00 71.86 C ATOM 676 CZ3 TRP A 45 2.094 -1.557 10.736 1.00 71.86 C ATOM 677 CH2 TRP A 45 3.485 -1.747 10.721 1.00 71.86 C ATOM 0 H TRP A 45 -1.749 -0.270 16.040 1.00 71.86 H new ATOM 0 HA TRP A 45 0.988 -0.378 16.933 1.00 71.86 H new ATOM 0 HB2 TRP A 45 -0.074 -1.909 15.245 1.00 71.86 H new ATOM 0 HB3 TRP A 45 -0.229 -0.545 14.155 1.00 71.86 H new ATOM 0 HD1 TRP A 45 2.970 -1.222 16.271 1.00 71.86 H new ATOM 0 HE1 TRP A 45 4.942 -1.626 14.648 1.00 71.86 H new ATOM 0 HE3 TRP A 45 0.345 -1.216 11.913 1.00 71.86 H new ATOM 0 HZ2 TRP A 45 5.279 -1.889 11.877 1.00 71.86 H new ATOM 0 HZ3 TRP A 45 1.548 -1.563 9.804 1.00 71.86 H new ATOM 0 HH2 TRP A 45 3.992 -1.896 9.779 1.00 71.86 H new ATOM 688 N PHE A 46 -0.037 1.971 14.851 1.00 81.71 N ATOM 689 CA PHE A 46 0.281 3.297 14.376 1.00 81.71 C ATOM 690 C PHE A 46 0.459 4.247 15.552 1.00 81.71 C ATOM 691 O PHE A 46 1.347 5.081 15.549 1.00 81.71 O ATOM 692 CB PHE A 46 -0.823 3.809 13.464 1.00 81.71 C ATOM 693 CG PHE A 46 -0.924 3.076 12.161 1.00 81.71 C ATOM 694 CD1 PHE A 46 0.199 2.847 11.384 1.00 81.71 C ATOM 695 CD2 PHE A 46 -2.152 2.647 11.697 1.00 81.71 C ATOM 696 CE1 PHE A 46 0.095 2.208 10.161 1.00 81.71 C ATOM 697 CE2 PHE A 46 -2.263 2.006 10.481 1.00 81.71 C ATOM 698 CZ PHE A 46 -1.142 1.790 9.709 1.00 81.71 C ATOM 0 H PHE A 46 -0.897 1.574 14.472 1.00 81.71 H new ATOM 0 HA PHE A 46 1.213 3.249 13.812 1.00 81.71 H new ATOM 0 HB2 PHE A 46 -1.777 3.734 13.987 1.00 81.71 H new ATOM 0 HB3 PHE A 46 -0.653 4.867 13.262 1.00 81.71 H new ATOM 0 HD1 PHE A 46 1.167 3.171 11.737 1.00 81.71 H new ATOM 0 HD2 PHE A 46 -3.036 2.816 12.294 1.00 81.71 H new ATOM 0 HE1 PHE A 46 0.977 2.037 9.562 1.00 81.71 H new ATOM 0 HE2 PHE A 46 -3.230 1.673 10.133 1.00 81.71 H new ATOM 0 HZ PHE A 46 -1.230 1.295 8.753 1.00 81.71 H new ATOM 708 N SER A 47 -0.379 4.092 16.571 1.00 81.62 N ATOM 709 CA SER A 47 -0.275 4.938 17.757 1.00 81.62 C ATOM 710 C SER A 47 1.047 4.700 18.465 1.00 81.62 C ATOM 711 O SER A 47 1.727 5.651 18.849 1.00 81.62 O ATOM 712 CB SER A 47 -1.451 4.698 18.706 1.00 81.62 C ATOM 713 OG SER A 47 -2.676 5.064 18.099 1.00 81.62 O ATOM 0 H SER A 47 -1.128 3.400 16.602 1.00 81.62 H new ATOM 0 HA SER A 47 -0.311 5.979 17.437 1.00 81.62 H new ATOM 0 HB2 SER A 47 -1.483 3.647 18.993 1.00 81.62 H new ATOM 0 HB3 SER A 47 -1.308 5.273 19.621 1.00 81.62 H new ATOM 0 HG SER A 47 -3.158 4.257 17.822 1.00 81.62 H new ATOM 719 N PHE A 48 1.443 3.437 18.592 1.00 49.76 N ATOM 720 CA PHE A 48 2.721 3.120 19.198 1.00 49.76 C ATOM 721 C PHE A 48 3.816 3.678 18.283 1.00 49.76 C ATOM 722 O PHE A 48 4.735 4.370 18.722 1.00 49.76 O ATOM 723 CB PHE A 48 2.864 1.599 19.389 1.00 49.76 C ATOM 724 CG PHE A 48 4.285 1.156 19.321 1.00 49.76 C ATOM 725 CD1 PHE A 48 5.072 1.112 20.447 1.00 49.76 C ATOM 726 CD2 PHE A 48 4.833 0.865 18.099 1.00 49.76 C ATOM 727 CE1 PHE A 48 6.408 0.775 20.354 1.00 49.76 C ATOM 728 CE2 PHE A 48 6.157 0.521 17.989 1.00 49.76 C ATOM 729 CZ PHE A 48 6.954 0.476 19.120 1.00 49.76 C ATOM 0 H PHE A 48 0.901 2.629 18.286 1.00 49.76 H new ATOM 0 HA PHE A 48 2.803 3.570 20.187 1.00 49.76 H new ATOM 0 HB2 PHE A 48 2.442 1.314 20.353 1.00 49.76 H new ATOM 0 HB3 PHE A 48 2.287 1.082 18.622 1.00 49.76 H new ATOM 0 HD1 PHE A 48 4.643 1.342 21.411 1.00 49.76 H new ATOM 0 HD2 PHE A 48 4.216 0.907 17.213 1.00 49.76 H new ATOM 0 HE1 PHE A 48 7.023 0.745 21.241 1.00 49.76 H new ATOM 0 HE2 PHE A 48 6.576 0.286 17.022 1.00 49.76 H new ATOM 0 HZ PHE A 48 7.997 0.209 19.039 1.00 49.76 H new ATOM 739 N LEU A 49 3.670 3.375 16.994 1.00 52.14 N ATOM 740 CA LEU A 49 4.595 3.835 15.967 1.00 52.14 C ATOM 741 C LEU A 49 4.731 5.359 16.049 1.00 52.14 C ATOM 742 O LEU A 49 5.835 5.902 16.049 1.00 52.14 O ATOM 743 CB LEU A 49 4.060 3.411 14.587 1.00 52.14 C ATOM 744 CG LEU A 49 4.892 2.378 13.810 1.00 52.14 C ATOM 745 CD1 LEU A 49 5.378 1.257 14.721 1.00 52.14 C ATOM 746 CD2 LEU A 49 4.070 1.804 12.665 1.00 52.14 C ATOM 0 H LEU A 49 2.906 2.803 16.635 1.00 52.14 H new ATOM 0 HA LEU A 49 5.579 3.391 16.119 1.00 52.14 H new ATOM 0 HB2 LEU A 49 3.056 3.008 14.721 1.00 52.14 H new ATOM 0 HB3 LEU A 49 3.965 4.305 13.970 1.00 52.14 H new ATOM 0 HG LEU A 49 5.769 2.885 13.407 1.00 52.14 H new ATOM 0 HD11 LEU A 49 5.963 0.544 14.140 1.00 52.14 H new ATOM 0 HD12 LEU A 49 5.999 1.675 15.513 1.00 52.14 H new ATOM 0 HD13 LEU A 49 4.520 0.749 15.162 1.00 52.14 H new ATOM 0 HD21 LEU A 49 4.667 1.073 12.119 1.00 52.14 H new ATOM 0 HD22 LEU A 49 3.179 1.320 13.064 1.00 52.14 H new ATOM 0 HD23 LEU A 49 3.775 2.608 11.990 1.00 52.14 H new ATOM 758 N GLU A 50 3.582 6.030 16.156 1.00 63.10 N ATOM 759 CA GLU A 50 3.546 7.486 16.283 1.00 63.10 C ATOM 760 C GLU A 50 4.194 7.907 17.590 1.00 63.10 C ATOM 761 O GLU A 50 4.967 8.864 17.640 1.00 63.10 O ATOM 762 CB GLU A 50 2.109 8.016 16.232 1.00 63.10 C ATOM 763 CG GLU A 50 1.482 7.988 14.847 1.00 63.10 C ATOM 764 CD GLU A 50 0.089 8.591 14.820 1.00 63.10 C ATOM 765 OE1 GLU A 50 -0.434 8.934 15.903 1.00 63.10 O ATOM 766 OE2 GLU A 50 -0.479 8.722 13.717 1.00 63.10 O ATOM 0 H GLU A 50 2.664 5.586 16.157 1.00 63.10 H new ATOM 0 HA GLU A 50 4.097 7.909 15.443 1.00 63.10 H new ATOM 0 HB2 GLU A 50 1.492 7.426 16.910 1.00 63.10 H new ATOM 0 HB3 GLU A 50 2.099 9.041 16.602 1.00 63.10 H new ATOM 0 HG2 GLU A 50 2.122 8.532 14.152 1.00 63.10 H new ATOM 0 HG3 GLU A 50 1.434 6.957 14.496 1.00 63.10 H new ATOM 773 N SER A 51 3.883 7.162 18.648 1.00 75.02 N ATOM 774 CA SER A 51 4.442 7.431 19.970 1.00 75.02 C ATOM 775 C SER A 51 5.966 7.347 19.928 1.00 75.02 C ATOM 776 O SER A 51 6.659 8.017 20.695 1.00 75.02 O ATOM 777 CB SER A 51 3.895 6.438 20.997 1.00 75.02 C ATOM 778 OG SER A 51 2.484 6.522 21.086 1.00 75.02 O ATOM 0 H SER A 51 3.246 6.366 18.615 1.00 75.02 H new ATOM 0 HA SER A 51 4.150 8.438 20.266 1.00 75.02 H new ATOM 0 HB2 SER A 51 4.185 5.425 20.718 1.00 75.02 H new ATOM 0 HB3 SER A 51 4.337 6.639 21.973 1.00 75.02 H new ATOM 0 HG SER A 51 2.078 5.883 20.464 1.00 75.02 H new ATOM 784 N HIS A 52 6.476 6.521 19.020 1.00122.90 N ATOM 785 CA HIS A 52 7.910 6.341 18.858 1.00122.90 C ATOM 786 C HIS A 52 8.381 7.027 17.581 1.00122.90 C ATOM 787 O HIS A 52 7.608 7.719 16.917 1.00122.90 O ATOM 788 CB HIS A 52 8.244 4.849 18.817 1.00122.90 C ATOM 789 CG HIS A 52 8.004 4.162 20.115 1.00122.90 C ATOM 790 ND1 HIS A 52 8.974 3.468 20.808 1.00122.90 N ATOM 791 CD2 HIS A 52 6.882 4.072 20.848 1.00122.90 C ATOM 792 CE1 HIS A 52 8.450 2.978 21.917 1.00122.90 C ATOM 793 NE2 HIS A 52 7.178 3.333 21.966 1.00122.90 N ATOM 0 H HIS A 52 5.910 5.962 18.381 1.00122.90 H new ATOM 0 HA HIS A 52 8.426 6.793 19.705 1.00122.90 H new ATOM 0 HB2 HIS A 52 7.645 4.370 18.043 1.00122.90 H new ATOM 0 HB3 HIS A 52 9.289 4.724 18.534 1.00122.90 H new ATOM 0 HD2 HIS A 52 5.922 4.502 20.602 1.00122.90 H new ATOM 0 HE1 HIS A 52 8.971 2.389 22.657 1.00122.90 H new ATOM 0 HE2 HIS A 52 6.524 3.097 22.712 1.00122.90 H new ATOM 801 N ASN A 53 9.647 6.835 17.237 1.00225.56 N ATOM 802 CA ASN A 53 10.219 7.434 16.036 1.00225.56 C ATOM 803 C ASN A 53 10.100 6.499 14.836 1.00225.56 C ATOM 804 O ASN A 53 10.979 6.475 13.973 1.00225.56 O ATOM 805 CB ASN A 53 11.688 7.799 16.279 1.00225.56 C ATOM 806 CG ASN A 53 12.568 6.578 16.478 1.00225.56 C ATOM 807 OD1 ASN A 53 12.073 5.462 16.643 1.00225.56 O ATOM 808 ND2 ASN A 53 13.878 6.783 16.460 1.00225.56 N ATOM 0 H ASN A 53 10.301 6.267 17.775 1.00225.56 H new ATOM 0 HA ASN A 53 9.656 8.340 15.811 1.00225.56 H new ATOM 0 HB2 ASN A 53 12.060 8.376 15.432 1.00225.56 H new ATOM 0 HB3 ASN A 53 11.759 8.440 17.158 1.00225.56 H new ATOM 0 HD21 ASN A 53 14.519 5.999 16.586 1.00225.56 H new ATOM 0 HD22 ASN A 53 14.245 7.724 16.320 1.00225.56 H new ATOM 815 N LYS A 54 9.024 5.719 14.786 1.00217.59 N ATOM 816 CA LYS A 54 8.827 4.781 13.690 1.00217.59 C ATOM 817 C LYS A 54 7.845 5.305 12.651 1.00217.59 C ATOM 818 O LYS A 54 7.786 4.776 11.543 1.00217.59 O ATOM 819 CB LYS A 54 8.286 3.457 14.212 1.00217.59 C ATOM 820 CG LYS A 54 9.088 2.860 15.356 1.00217.59 C ATOM 821 CD LYS A 54 10.509 2.532 14.930 1.00217.59 C ATOM 822 CE LYS A 54 10.533 1.509 13.802 1.00217.59 C ATOM 823 NZ LYS A 54 11.577 0.468 14.013 1.00217.59 N ATOM 0 H LYS A 54 8.282 5.719 15.486 1.00217.59 H new ATOM 0 HA LYS A 54 9.803 4.647 13.224 1.00217.59 H new ATOM 0 HB2 LYS A 54 7.258 3.603 14.543 1.00217.59 H new ATOM 0 HB3 LYS A 54 8.258 2.741 13.391 1.00217.59 H new ATOM 0 HG2 LYS A 54 9.110 3.561 16.190 1.00217.59 H new ATOM 0 HG3 LYS A 54 8.596 1.955 15.713 1.00217.59 H new ATOM 0 HD2 LYS A 54 11.012 3.443 14.607 1.00217.59 H new ATOM 0 HD3 LYS A 54 11.066 2.146 15.784 1.00217.59 H new ATOM 0 HE2 LYS A 54 9.556 1.032 13.725 1.00217.59 H new ATOM 0 HE3 LYS A 54 10.715 2.018 12.855 1.00217.59 H new ATOM 0 HZ1 LYS A 54 11.954 0.163 13.093 1.00217.59 H new ATOM 0 HZ2 LYS A 54 12.348 0.861 14.590 1.00217.59 H new ATOM 0 HZ3 LYS A 54 11.159 -0.348 14.504 1.00217.59 H new ATOM 837 N LEU A 55 7.055 6.321 12.992 1.00 97.75 N ATOM 838 CA LEU A 55 6.082 6.826 12.029 1.00 97.75 C ATOM 839 C LEU A 55 5.624 8.253 12.294 1.00 97.75 C ATOM 840 O LEU A 55 4.837 8.525 13.202 1.00 97.75 O ATOM 841 CB LEU A 55 4.871 5.909 11.997 1.00 97.75 C ATOM 842 CG LEU A 55 3.751 6.338 11.050 1.00 97.75 C ATOM 843 CD1 LEU A 55 3.029 5.124 10.483 1.00 97.75 C ATOM 844 CD2 LEU A 55 2.778 7.248 11.784 1.00 97.75 C ATOM 0 H LEU A 55 7.067 6.796 13.895 1.00 97.75 H new ATOM 0 HA LEU A 55 6.593 6.840 11.066 1.00 97.75 H new ATOM 0 HB2 LEU A 55 5.200 4.909 11.714 1.00 97.75 H new ATOM 0 HB3 LEU A 55 4.464 5.837 13.006 1.00 97.75 H new ATOM 0 HG LEU A 55 4.187 6.887 10.215 1.00 97.75 H new ATOM 0 HD11 LEU A 55 2.236 5.453 9.812 1.00 97.75 H new ATOM 0 HD12 LEU A 55 3.737 4.504 9.932 1.00 97.75 H new ATOM 0 HD13 LEU A 55 2.597 4.544 11.298 1.00 97.75 H new ATOM 0 HD21 LEU A 55 1.981 7.552 11.105 1.00 97.75 H new ATOM 0 HD22 LEU A 55 2.349 6.714 12.632 1.00 97.75 H new ATOM 0 HD23 LEU A 55 3.306 8.132 12.142 1.00 97.75 H new ATOM 856 N ASP A 56 6.085 9.134 11.428 1.00109.16 N ATOM 857 CA ASP A 56 5.713 10.541 11.453 1.00109.16 C ATOM 858 C ASP A 56 4.393 10.729 10.710 1.00109.16 C ATOM 859 O ASP A 56 3.806 9.763 10.229 1.00109.16 O ATOM 860 CB ASP A 56 6.807 11.408 10.823 1.00109.16 C ATOM 861 CG ASP A 56 8.113 11.344 11.593 1.00109.16 C ATOM 862 OD1 ASP A 56 8.102 10.864 12.747 1.00109.16 O ATOM 863 OD2 ASP A 56 9.149 11.773 11.042 1.00109.16 O ATOM 0 H ASP A 56 6.735 8.894 10.679 1.00109.16 H new ATOM 0 HA ASP A 56 5.594 10.855 12.490 1.00109.16 H new ATOM 0 HB2 ASP A 56 6.978 11.083 9.797 1.00109.16 H new ATOM 0 HB3 ASP A 56 6.466 12.442 10.778 1.00109.16 H new ATOM 868 N LYS A 57 3.953 11.970 10.579 1.00 65.03 N ATOM 869 CA LYS A 57 2.720 12.267 9.848 1.00 65.03 C ATOM 870 C LYS A 57 2.923 12.064 8.339 1.00 65.03 C ATOM 871 O LYS A 57 1.957 11.965 7.586 1.00 65.03 O ATOM 872 CB LYS A 57 2.223 13.692 10.156 1.00 65.03 C ATOM 873 CG LYS A 57 2.925 14.788 9.373 1.00 65.03 C ATOM 874 CD LYS A 57 4.409 14.788 9.657 1.00 65.03 C ATOM 875 CE LYS A 57 5.131 15.890 8.899 1.00 65.03 C ATOM 876 NZ LYS A 57 6.225 16.498 9.708 1.00 65.03 N ATOM 0 H LYS A 57 4.425 12.788 10.965 1.00 65.03 H new ATOM 0 HA LYS A 57 1.951 11.571 10.182 1.00 65.03 H new ATOM 0 HB2 LYS A 57 1.154 13.743 9.949 1.00 65.03 H new ATOM 0 HB3 LYS A 57 2.351 13.885 11.221 1.00 65.03 H new ATOM 0 HG2 LYS A 57 2.755 14.644 8.306 1.00 65.03 H new ATOM 0 HG3 LYS A 57 2.500 15.757 9.636 1.00 65.03 H new ATOM 0 HD2 LYS A 57 4.574 14.915 10.727 1.00 65.03 H new ATOM 0 HD3 LYS A 57 4.831 13.821 9.382 1.00 65.03 H new ATOM 0 HE2 LYS A 57 5.545 15.484 7.976 1.00 65.03 H new ATOM 0 HE3 LYS A 57 4.417 16.663 8.615 1.00 65.03 H new ATOM 0 HZ1 LYS A 57 6.692 17.245 9.155 1.00 65.03 H new ATOM 0 HZ2 LYS A 57 5.827 16.908 10.577 1.00 65.03 H new ATOM 0 HZ3 LYS A 57 6.920 15.766 9.957 1.00 65.03 H new ATOM 890 N ASP A 58 4.185 12.009 7.905 1.00165.72 N ATOM 891 CA ASP A 58 4.501 11.823 6.495 1.00165.72 C ATOM 892 C ASP A 58 5.473 10.656 6.271 1.00165.72 C ATOM 893 O ASP A 58 5.666 10.223 5.136 1.00165.72 O ATOM 894 CB ASP A 58 5.095 13.109 5.916 1.00165.72 C ATOM 895 CG ASP A 58 5.235 13.051 4.407 1.00165.72 C ATOM 896 OD1 ASP A 58 4.253 13.374 3.708 1.00165.72 O ATOM 897 OD2 ASP A 58 6.326 12.679 3.926 1.00165.72 O ATOM 0 H ASP A 58 5.000 12.091 8.512 1.00165.72 H new ATOM 0 HA ASP A 58 3.570 11.582 5.982 1.00165.72 H new ATOM 0 HB2 ASP A 58 4.461 13.953 6.187 1.00165.72 H new ATOM 0 HB3 ASP A 58 6.073 13.288 6.363 1.00165.72 H new ATOM 902 N ASN A 59 6.093 10.147 7.342 1.00 98.89 N ATOM 903 CA ASN A 59 7.040 9.035 7.202 1.00 98.89 C ATOM 904 C ASN A 59 6.350 7.689 7.334 1.00 98.89 C ATOM 905 O ASN A 59 6.142 7.179 8.436 1.00 98.89 O ATOM 906 CB ASN A 59 8.169 9.143 8.230 1.00 98.89 C ATOM 907 CG ASN A 59 9.180 10.208 7.867 1.00 98.89 C ATOM 908 OD1 ASN A 59 8.731 11.455 7.819 1.00 98.89 O flip ATOM 909 ND2 ASN A 59 10.352 9.914 7.632 1.00 98.89 N flip ATOM 0 H ASN A 59 5.960 10.479 8.297 1.00 98.89 H new ATOM 0 HA ASN A 59 7.465 9.103 6.201 1.00 98.89 H new ATOM 0 HB2 ASN A 59 7.745 9.367 9.209 1.00 98.89 H new ATOM 0 HB3 ASN A 59 8.674 8.180 8.314 1.00 98.89 H new ATOM 0 HD21 ASN A 59 10.653 8.941 7.681 1.00 98.89 H new ATOM 0 HD22 ASN A 59 11.022 10.644 7.388 1.00 98.89 H new ATOM 916 N LEU A 60 6.026 7.111 6.187 1.00196.24 N ATOM 917 CA LEU A 60 5.385 5.806 6.126 1.00196.24 C ATOM 918 C LEU A 60 6.299 4.784 5.443 1.00196.24 C ATOM 919 O LEU A 60 5.863 3.683 5.112 1.00196.24 O ATOM 920 CB LEU A 60 4.065 5.904 5.357 1.00196.24 C ATOM 921 CG LEU A 60 4.098 6.831 4.139 1.00196.24 C ATOM 922 CD1 LEU A 60 3.133 6.351 3.066 1.00196.24 C ATOM 923 CD2 LEU A 60 3.770 8.255 4.560 1.00196.24 C ATOM 0 H LEU A 60 6.200 7.532 5.274 1.00196.24 H new ATOM 0 HA LEU A 60 5.188 5.476 7.146 1.00196.24 H new ATOM 0 HB2 LEU A 60 3.778 4.905 5.028 1.00196.24 H new ATOM 0 HB3 LEU A 60 3.289 6.251 6.039 1.00196.24 H new ATOM 0 HG LEU A 60 5.103 6.813 3.716 1.00196.24 H new ATOM 0 HD11 LEU A 60 3.175 7.026 2.211 1.00196.24 H new ATOM 0 HD12 LEU A 60 3.412 5.346 2.749 1.00196.24 H new ATOM 0 HD13 LEU A 60 2.120 6.337 3.468 1.00196.24 H new ATOM 0 HD21 LEU A 60 3.796 8.908 3.687 1.00196.24 H new ATOM 0 HD22 LEU A 60 2.775 8.283 5.005 1.00196.24 H new ATOM 0 HD23 LEU A 60 4.504 8.597 5.290 1.00196.24 H new ATOM 935 N SER A 61 7.562 5.156 5.210 1.00 66.14 N ATOM 936 CA SER A 61 8.501 4.263 4.542 1.00 66.14 C ATOM 937 C SER A 61 8.650 2.934 5.278 1.00 66.14 C ATOM 938 O SER A 61 8.701 1.875 4.652 1.00 66.14 O ATOM 939 CB SER A 61 9.866 4.937 4.394 1.00 66.14 C ATOM 940 OG SER A 61 9.755 6.160 3.689 1.00 66.14 O ATOM 0 H SER A 61 7.951 6.062 5.473 1.00 66.14 H new ATOM 0 HA SER A 61 8.095 4.049 3.553 1.00 66.14 H new ATOM 0 HB2 SER A 61 10.294 5.119 5.380 1.00 66.14 H new ATOM 0 HB3 SER A 61 10.549 4.271 3.868 1.00 66.14 H new ATOM 0 HG SER A 61 10.640 6.573 3.609 1.00 66.14 H new ATOM 946 N TYR A 62 8.721 2.986 6.602 1.00 59.69 N ATOM 947 CA TYR A 62 8.861 1.772 7.393 1.00 59.69 C ATOM 948 C TYR A 62 7.573 0.951 7.371 1.00 59.69 C ATOM 949 O TYR A 62 7.622 -0.265 7.269 1.00 59.69 O ATOM 950 CB TYR A 62 9.284 2.120 8.837 1.00 59.69 C ATOM 951 CG TYR A 62 8.784 1.158 9.906 1.00 59.69 C ATOM 952 CD1 TYR A 62 9.053 -0.206 9.843 1.00 59.69 C ATOM 953 CD2 TYR A 62 8.022 1.624 10.960 1.00 59.69 C ATOM 954 CE1 TYR A 62 8.574 -1.068 10.811 1.00 59.69 C ATOM 955 CE2 TYR A 62 7.540 0.771 11.928 1.00 59.69 C ATOM 956 CZ TYR A 62 7.818 -0.575 11.850 1.00 59.69 C ATOM 957 OH TYR A 62 7.341 -1.430 12.815 1.00 59.69 O ATOM 0 H TYR A 62 8.684 3.848 7.146 1.00 59.69 H new ATOM 0 HA TYR A 62 9.644 1.158 6.949 1.00 59.69 H new ATOM 0 HB2 TYR A 62 10.373 2.155 8.882 1.00 59.69 H new ATOM 0 HB3 TYR A 62 8.923 3.121 9.074 1.00 59.69 H new ATOM 0 HD1 TYR A 62 9.644 -0.596 9.027 1.00 59.69 H new ATOM 0 HD2 TYR A 62 7.800 2.679 11.026 1.00 59.69 H new ATOM 0 HE1 TYR A 62 8.792 -2.124 10.752 1.00 59.69 H new ATOM 0 HE2 TYR A 62 6.947 1.156 12.744 1.00 59.69 H new ATOM 0 HH TYR A 62 7.115 -2.291 12.406 1.00 59.69 H new ATOM 967 N ILE A 63 6.434 1.618 7.493 1.00 95.89 N ATOM 968 CA ILE A 63 5.154 0.923 7.514 1.00 95.89 C ATOM 969 C ILE A 63 4.821 0.389 6.141 1.00 95.89 C ATOM 970 O ILE A 63 4.475 -0.781 5.977 1.00 95.89 O ATOM 971 CB ILE A 63 4.017 1.829 8.053 1.00 95.89 C ATOM 972 CG1 ILE A 63 3.441 2.778 6.992 1.00 95.89 C ATOM 973 CG2 ILE A 63 4.513 2.649 9.237 1.00 95.89 C ATOM 974 CD1 ILE A 63 2.223 3.518 7.483 1.00 95.89 C ATOM 0 H ILE A 63 6.369 2.632 7.578 1.00 95.89 H new ATOM 0 HA ILE A 63 5.243 0.080 8.200 1.00 95.89 H new ATOM 0 HB ILE A 63 3.215 1.158 8.360 1.00 95.89 H new ATOM 0 HG12 ILE A 63 4.206 3.497 6.698 1.00 95.89 H new ATOM 0 HG13 ILE A 63 3.181 2.207 6.101 1.00 95.89 H new ATOM 0 HG21 ILE A 63 3.705 3.281 9.606 1.00 95.89 H new ATOM 0 HG22 ILE A 63 4.841 1.979 10.032 1.00 95.89 H new ATOM 0 HG23 ILE A 63 5.348 3.275 8.922 1.00 95.89 H new ATOM 0 HD11 ILE A 63 1.855 4.175 6.695 1.00 95.89 H new ATOM 0 HD12 ILE A 63 1.446 2.802 7.751 1.00 95.89 H new ATOM 0 HD13 ILE A 63 2.486 4.112 8.358 1.00 95.89 H new ATOM 986 N GLU A 64 4.978 1.248 5.148 1.00 77.41 N ATOM 987 CA GLU A 64 4.746 0.867 3.763 1.00 77.41 C ATOM 988 C GLU A 64 5.557 -0.389 3.453 1.00 77.41 C ATOM 989 O GLU A 64 5.151 -1.231 2.656 1.00 77.41 O ATOM 990 CB GLU A 64 5.153 2.012 2.834 1.00 77.41 C ATOM 991 CG GLU A 64 4.791 1.789 1.376 1.00 77.41 C ATOM 992 CD GLU A 64 5.284 2.908 0.479 1.00 77.41 C ATOM 993 OE1 GLU A 64 6.171 3.675 0.916 1.00 77.41 O ATOM 994 OE2 GLU A 64 4.776 3.028 -0.655 1.00 77.41 O ATOM 0 H GLU A 64 5.266 2.218 5.275 1.00 77.41 H new ATOM 0 HA GLU A 64 3.688 0.659 3.606 1.00 77.41 H new ATOM 0 HB2 GLU A 64 4.678 2.931 3.178 1.00 77.41 H new ATOM 0 HB3 GLU A 64 6.230 2.162 2.911 1.00 77.41 H new ATOM 0 HG2 GLU A 64 5.216 0.844 1.040 1.00 77.41 H new ATOM 0 HG3 GLU A 64 3.708 1.703 1.283 1.00 77.41 H new ATOM 1001 N HIS A 65 6.695 -0.521 4.139 1.00 68.54 N ATOM 1002 CA HIS A 65 7.539 -1.689 3.982 1.00 68.54 C ATOM 1003 C HIS A 65 6.853 -2.892 4.599 1.00 68.54 C ATOM 1004 O HIS A 65 6.831 -3.966 4.013 1.00 68.54 O ATOM 1005 CB HIS A 65 8.912 -1.440 4.617 1.00 68.54 C ATOM 1006 CG HIS A 65 9.767 -2.660 4.752 1.00 68.54 C ATOM 1007 ND1 HIS A 65 10.578 -3.137 3.747 1.00 68.54 N ATOM 1008 CD2 HIS A 65 9.922 -3.504 5.796 1.00 68.54 C ATOM 1009 CE1 HIS A 65 11.198 -4.225 4.168 1.00 68.54 C ATOM 1010 NE2 HIS A 65 10.817 -4.468 5.409 1.00 68.54 N ATOM 0 H HIS A 65 7.045 0.168 4.804 1.00 68.54 H new ATOM 0 HA HIS A 65 7.698 -1.888 2.922 1.00 68.54 H new ATOM 0 HB2 HIS A 65 9.446 -0.703 4.018 1.00 68.54 H new ATOM 0 HB3 HIS A 65 8.767 -1.003 5.605 1.00 68.54 H new ATOM 0 HD2 HIS A 65 9.432 -3.433 6.756 1.00 68.54 H new ATOM 0 HE1 HIS A 65 11.897 -4.815 3.595 1.00 68.54 H new ATOM 0 HE2 HIS A 65 11.137 -5.246 5.986 1.00 68.54 H new ATOM 1018 N ILE A 66 6.282 -2.691 5.783 1.00 44.28 N ATOM 1019 CA ILE A 66 5.578 -3.753 6.485 1.00 44.28 C ATOM 1020 C ILE A 66 4.454 -4.283 5.619 1.00 44.28 C ATOM 1021 O ILE A 66 4.331 -5.486 5.395 1.00 44.28 O ATOM 1022 CB ILE A 66 5.008 -3.235 7.821 1.00 44.28 C ATOM 1023 CG1 ILE A 66 6.148 -2.667 8.664 1.00 44.28 C ATOM 1024 CG2 ILE A 66 4.251 -4.325 8.571 1.00 44.28 C ATOM 1025 CD1 ILE A 66 7.312 -3.599 8.843 1.00 44.28 C ATOM 0 H ILE A 66 6.295 -1.798 6.276 1.00 44.28 H new ATOM 0 HA ILE A 66 6.283 -4.557 6.696 1.00 44.28 H new ATOM 0 HB ILE A 66 4.287 -2.444 7.614 1.00 44.28 H new ATOM 0 HG12 ILE A 66 6.503 -1.747 8.200 1.00 44.28 H new ATOM 0 HG13 ILE A 66 5.759 -2.399 9.646 1.00 44.28 H new ATOM 0 HG21 ILE A 66 3.865 -3.921 9.507 1.00 44.28 H new ATOM 0 HG22 ILE A 66 3.422 -4.679 7.959 1.00 44.28 H new ATOM 0 HG23 ILE A 66 4.925 -5.155 8.784 1.00 44.28 H new ATOM 0 HD11 ILE A 66 8.075 -3.116 9.454 1.00 44.28 H new ATOM 0 HD12 ILE A 66 6.976 -4.511 9.337 1.00 44.28 H new ATOM 0 HD13 ILE A 66 7.732 -3.848 7.868 1.00 44.28 H new ATOM 1037 N PHE A 67 3.656 -3.361 5.112 1.00103.95 N ATOM 1038 CA PHE A 67 2.559 -3.715 4.240 1.00103.95 C ATOM 1039 C PHE A 67 3.098 -4.350 2.955 1.00103.95 C ATOM 1040 O PHE A 67 2.448 -5.206 2.355 1.00103.95 O ATOM 1041 CB PHE A 67 1.726 -2.477 3.933 1.00103.95 C ATOM 1042 CG PHE A 67 1.253 -1.802 5.183 1.00103.95 C ATOM 1043 CD1 PHE A 67 0.560 -2.520 6.141 1.00103.95 C ATOM 1044 CD2 PHE A 67 1.520 -0.464 5.414 1.00103.95 C ATOM 1045 CE1 PHE A 67 0.138 -1.917 7.308 1.00103.95 C ATOM 1046 CE2 PHE A 67 1.105 0.146 6.584 1.00103.95 C ATOM 1047 CZ PHE A 67 0.411 -0.586 7.530 1.00103.95 C ATOM 0 H PHE A 67 3.750 -2.361 5.291 1.00103.95 H new ATOM 0 HA PHE A 67 1.919 -4.444 4.736 1.00103.95 H new ATOM 0 HB2 PHE A 67 2.318 -1.777 3.344 1.00103.95 H new ATOM 0 HB3 PHE A 67 0.867 -2.759 3.324 1.00103.95 H new ATOM 0 HD1 PHE A 67 0.347 -3.565 5.973 1.00103.95 H new ATOM 0 HD2 PHE A 67 2.058 0.110 4.674 1.00103.95 H new ATOM 0 HE1 PHE A 67 -0.406 -2.488 8.046 1.00103.95 H new ATOM 0 HE2 PHE A 67 1.322 1.190 6.758 1.00103.95 H new ATOM 0 HZ PHE A 67 0.083 -0.113 8.444 1.00103.95 H new ATOM 1057 N GLU A 68 4.299 -3.917 2.535 1.00 76.40 N ATOM 1058 CA GLU A 68 4.921 -4.445 1.320 1.00 76.40 C ATOM 1059 C GLU A 68 5.471 -5.842 1.542 1.00 76.40 C ATOM 1060 O GLU A 68 5.187 -6.759 0.773 1.00 76.40 O ATOM 1061 CB GLU A 68 6.040 -3.517 0.842 1.00 76.40 C ATOM 1062 CG GLU A 68 6.723 -3.998 -0.430 1.00 76.40 C ATOM 1063 CD GLU A 68 7.889 -3.117 -0.843 1.00 76.40 C ATOM 1064 OE1 GLU A 68 8.199 -2.155 -0.110 1.00 76.40 O ATOM 1065 OE2 GLU A 68 8.492 -3.392 -1.902 1.00 76.40 O ATOM 0 H GLU A 68 4.851 -3.208 3.018 1.00 76.40 H new ATOM 0 HA GLU A 68 4.149 -4.499 0.553 1.00 76.40 H new ATOM 0 HB2 GLU A 68 5.628 -2.522 0.671 1.00 76.40 H new ATOM 0 HB3 GLU A 68 6.785 -3.422 1.632 1.00 76.40 H new ATOM 0 HG2 GLU A 68 7.079 -5.018 -0.282 1.00 76.40 H new ATOM 0 HG3 GLU A 68 5.993 -4.029 -1.239 1.00 76.40 H new ATOM 1072 N ILE A 69 6.256 -6.006 2.599 1.00 33.63 N ATOM 1073 CA ILE A 69 6.825 -7.303 2.905 1.00 33.63 C ATOM 1074 C ILE A 69 5.723 -8.290 3.254 1.00 33.63 C ATOM 1075 O ILE A 69 5.817 -9.482 2.962 1.00 33.63 O ATOM 1076 CB ILE A 69 7.845 -7.220 4.038 1.00 33.63 C ATOM 1077 CG1 ILE A 69 7.196 -6.748 5.340 1.00 33.63 C ATOM 1078 CG2 ILE A 69 9.001 -6.312 3.635 1.00 33.63 C ATOM 1079 CD1 ILE A 69 8.190 -6.579 6.462 1.00 33.63 C ATOM 0 H ILE A 69 6.509 -5.263 3.250 1.00 33.63 H new ATOM 0 HA ILE A 69 7.350 -7.654 2.017 1.00 33.63 H new ATOM 0 HB ILE A 69 8.238 -8.220 4.221 1.00 33.63 H new ATOM 0 HG12 ILE A 69 6.689 -5.799 5.164 1.00 33.63 H new ATOM 0 HG13 ILE A 69 6.434 -7.466 5.642 1.00 33.63 H new ATOM 0 HG21 ILE A 69 9.723 -6.259 4.450 1.00 33.63 H new ATOM 0 HG22 ILE A 69 9.486 -6.714 2.745 1.00 33.63 H new ATOM 0 HG23 ILE A 69 8.621 -5.313 3.421 1.00 33.63 H new ATOM 0 HD11 ILE A 69 7.672 -6.243 7.360 1.00 33.63 H new ATOM 0 HD12 ILE A 69 8.679 -7.532 6.661 1.00 33.63 H new ATOM 0 HD13 ILE A 69 8.938 -5.840 6.177 1.00 33.63 H new ATOM 1091 N SER A 70 4.652 -7.765 3.836 1.00 80.34 N ATOM 1092 CA SER A 70 3.495 -8.571 4.179 1.00 80.34 C ATOM 1093 C SER A 70 2.712 -8.832 2.893 1.00 80.34 C ATOM 1094 O SER A 70 2.712 -7.998 1.989 1.00 80.34 O ATOM 1095 CB SER A 70 2.613 -7.841 5.196 1.00 80.34 C ATOM 1096 OG SER A 70 1.877 -6.800 4.578 1.00 80.34 O ATOM 0 H SER A 70 4.564 -6.779 4.080 1.00 80.34 H new ATOM 0 HA SER A 70 3.813 -9.511 4.631 1.00 80.34 H new ATOM 0 HB2 SER A 70 1.927 -8.549 5.662 1.00 80.34 H new ATOM 0 HB3 SER A 70 3.234 -7.429 5.991 1.00 80.34 H new ATOM 0 HG SER A 70 0.931 -6.877 4.824 1.00 80.34 H new ATOM 1102 N ARG A 71 2.081 -9.993 2.791 1.00144.05 N ATOM 1103 CA ARG A 71 1.344 -10.342 1.581 1.00144.05 C ATOM 1104 C ARG A 71 -0.070 -9.768 1.560 1.00144.05 C ATOM 1105 O ARG A 71 -1.051 -10.502 1.435 1.00144.05 O ATOM 1106 CB ARG A 71 1.311 -11.858 1.399 1.00144.05 C ATOM 1107 CG ARG A 71 2.627 -12.425 0.899 1.00144.05 C ATOM 1108 CD ARG A 71 3.022 -11.811 -0.436 1.00144.05 C ATOM 1109 NE ARG A 71 4.014 -12.622 -1.141 1.00144.05 N ATOM 1110 CZ ARG A 71 3.722 -13.740 -1.808 1.00144.05 C ATOM 1111 NH1 ARG A 71 2.471 -14.186 -1.868 1.00144.05 N ATOM 1112 NH2 ARG A 71 4.686 -14.416 -2.417 1.00144.05 N ATOM 0 H ARG A 71 2.063 -10.704 3.522 1.00144.05 H new ATOM 0 HA ARG A 71 1.876 -9.889 0.745 1.00144.05 H new ATOM 0 HB2 ARG A 71 1.058 -12.327 2.350 1.00144.05 H new ATOM 0 HB3 ARG A 71 0.520 -12.117 0.695 1.00144.05 H new ATOM 0 HG2 ARG A 71 3.409 -12.236 1.634 1.00144.05 H new ATOM 0 HG3 ARG A 71 2.543 -13.507 0.794 1.00144.05 H new ATOM 0 HD2 ARG A 71 2.135 -11.700 -1.060 1.00144.05 H new ATOM 0 HD3 ARG A 71 3.423 -10.811 -0.270 1.00144.05 H new ATOM 0 HE ARG A 71 4.986 -12.315 -1.122 1.00144.05 H new ATOM 0 HH11 ARG A 71 1.723 -13.672 -1.401 1.00144.05 H new ATOM 0 HH12 ARG A 71 2.259 -15.042 -2.381 1.00144.05 H new ATOM 0 HH21 ARG A 71 5.649 -14.081 -2.375 1.00144.05 H new ATOM 0 HH22 ARG A 71 4.465 -15.271 -2.928 1.00144.05 H new ATOM 1126 N ARG A 72 -0.170 -8.448 1.664 1.00183.66 N ATOM 1127 CA ARG A 72 -1.461 -7.782 1.634 1.00183.66 C ATOM 1128 C ARG A 72 -1.366 -6.436 0.916 1.00183.66 C ATOM 1129 O ARG A 72 -1.368 -5.383 1.552 1.00183.66 O ATOM 1130 CB ARG A 72 -1.984 -7.594 3.047 1.00183.66 C ATOM 1131 CG ARG A 72 -2.907 -8.712 3.485 1.00183.66 C ATOM 1132 CD ARG A 72 -3.760 -8.282 4.655 1.00183.66 C ATOM 1133 NE ARG A 72 -2.951 -7.683 5.708 1.00183.66 N ATOM 1134 CZ ARG A 72 -2.196 -8.381 6.555 1.00183.66 C ATOM 1135 NH1 ARG A 72 -2.167 -9.708 6.501 1.00183.66 N ATOM 1136 NH2 ARG A 72 -1.477 -7.751 7.469 1.00183.66 N ATOM 0 H ARG A 72 0.628 -7.821 1.770 1.00183.66 H new ATOM 0 HA ARG A 72 -2.158 -8.410 1.080 1.00183.66 H new ATOM 0 HB2 ARG A 72 -1.142 -7.533 3.736 1.00183.66 H new ATOM 0 HB3 ARG A 72 -2.516 -6.645 3.109 1.00183.66 H new ATOM 0 HG2 ARG A 72 -3.546 -9.007 2.653 1.00183.66 H new ATOM 0 HG3 ARG A 72 -2.319 -9.587 3.761 1.00183.66 H new ATOM 0 HD2 ARG A 72 -4.510 -7.566 4.318 1.00183.66 H new ATOM 0 HD3 ARG A 72 -4.298 -9.143 5.052 1.00183.66 H new ATOM 0 HE ARG A 72 -2.963 -6.667 5.803 1.00183.66 H new ATOM 0 HH11 ARG A 72 -2.726 -10.202 5.806 1.00183.66 H new ATOM 0 HH12 ARG A 72 -1.585 -10.232 7.154 1.00183.66 H new ATOM 0 HH21 ARG A 72 -1.501 -6.733 7.524 1.00183.66 H new ATOM 0 HH22 ARG A 72 -0.898 -8.283 8.119 1.00183.66 H new ATOM 1150 N PRO A 73 -1.275 -6.451 -0.429 1.00130.67 N ATOM 1151 CA PRO A 73 -1.170 -5.224 -1.223 1.00130.67 C ATOM 1152 C PRO A 73 -2.367 -4.288 -1.054 1.00130.67 C ATOM 1153 O PRO A 73 -2.303 -3.125 -1.445 1.00130.67 O ATOM 1154 CB PRO A 73 -1.090 -5.728 -2.670 1.00130.67 C ATOM 1155 CG PRO A 73 -0.662 -7.150 -2.565 1.00130.67 C ATOM 1156 CD PRO A 73 -1.252 -7.656 -1.282 1.00130.67 C ATOM 0 HA PRO A 73 -0.310 -4.631 -0.912 1.00130.67 H new ATOM 0 HB2 PRO A 73 -2.055 -5.643 -3.170 1.00130.67 H new ATOM 0 HB3 PRO A 73 -0.377 -5.144 -3.252 1.00130.67 H new ATOM 0 HG2 PRO A 73 -1.019 -7.730 -3.416 1.00130.67 H new ATOM 0 HG3 PRO A 73 0.425 -7.232 -2.556 1.00130.67 H new ATOM 0 HD2 PRO A 73 -2.252 -8.064 -1.431 1.00130.67 H new ATOM 0 HD3 PRO A 73 -0.646 -8.449 -0.844 1.00130.67 H new ATOM 1164 N ASP A 74 -3.463 -4.787 -0.482 1.00 56.92 N ATOM 1165 CA ASP A 74 -4.652 -3.959 -0.300 1.00 56.92 C ATOM 1166 C ASP A 74 -4.386 -2.821 0.677 1.00 56.92 C ATOM 1167 O ASP A 74 -4.739 -1.674 0.407 1.00 56.92 O ATOM 1168 CB ASP A 74 -5.823 -4.813 0.191 1.00 56.92 C ATOM 1169 CG ASP A 74 -6.280 -5.827 -0.842 1.00 56.92 C ATOM 1170 OD1 ASP A 74 -5.847 -5.723 -2.011 1.00 56.92 O ATOM 1171 OD2 ASP A 74 -7.068 -6.726 -0.483 1.00 56.92 O ATOM 0 H ASP A 74 -3.551 -5.745 -0.142 1.00 56.92 H new ATOM 0 HA ASP A 74 -4.910 -3.523 -1.265 1.00 56.92 H new ATOM 0 HB2 ASP A 74 -5.530 -5.335 1.102 1.00 56.92 H new ATOM 0 HB3 ASP A 74 -6.658 -4.163 0.451 1.00 56.92 H new ATOM 1176 N LEU A 75 -3.741 -3.125 1.798 1.00 72.53 N ATOM 1177 CA LEU A 75 -3.416 -2.093 2.776 1.00 72.53 C ATOM 1178 C LEU A 75 -2.331 -1.184 2.218 1.00 72.53 C ATOM 1179 O LEU A 75 -2.428 0.040 2.301 1.00 72.53 O ATOM 1180 CB LEU A 75 -2.941 -2.714 4.087 1.00 72.53 C ATOM 1181 CG LEU A 75 -4.012 -3.407 4.936 1.00 72.53 C ATOM 1182 CD1 LEU A 75 -4.696 -4.509 4.142 1.00 72.53 C ATOM 1183 CD2 LEU A 75 -3.356 -3.983 6.178 1.00 72.53 C ATOM 0 H LEU A 75 -3.436 -4.065 2.050 1.00 72.53 H new ATOM 0 HA LEU A 75 -4.316 -1.512 2.976 1.00 72.53 H new ATOM 0 HB2 LEU A 75 -2.162 -3.441 3.859 1.00 72.53 H new ATOM 0 HB3 LEU A 75 -2.480 -1.931 4.689 1.00 72.53 H new ATOM 0 HG LEU A 75 -4.772 -2.680 5.224 1.00 72.53 H new ATOM 0 HD11 LEU A 75 -5.453 -4.989 4.763 1.00 72.53 H new ATOM 0 HD12 LEU A 75 -5.169 -4.081 3.258 1.00 72.53 H new ATOM 0 HD13 LEU A 75 -3.957 -5.249 3.835 1.00 72.53 H new ATOM 0 HD21 LEU A 75 -4.109 -4.479 6.790 1.00 72.53 H new ATOM 0 HD22 LEU A 75 -2.593 -4.705 5.885 1.00 72.53 H new ATOM 0 HD23 LEU A 75 -2.894 -3.179 6.751 1.00 72.53 H new ATOM 1195 N LEU A 76 -1.299 -1.793 1.631 1.00 57.08 N ATOM 1196 CA LEU A 76 -0.199 -1.038 1.039 1.00 57.08 C ATOM 1197 C LEU A 76 -0.718 -0.063 -0.004 1.00 57.08 C ATOM 1198 O LEU A 76 -0.298 1.090 -0.058 1.00 57.08 O ATOM 1199 CB LEU A 76 0.810 -1.975 0.381 1.00 57.08 C ATOM 1200 CG LEU A 76 2.070 -1.281 -0.150 1.00 57.08 C ATOM 1201 CD1 LEU A 76 3.253 -1.566 0.748 1.00 57.08 C ATOM 1202 CD2 LEU A 76 2.373 -1.708 -1.580 1.00 57.08 C ATOM 0 H LEU A 76 -1.204 -2.806 1.554 1.00 57.08 H new ATOM 0 HA LEU A 76 0.290 -0.486 1.842 1.00 57.08 H new ATOM 0 HB2 LEU A 76 1.106 -2.735 1.104 1.00 57.08 H new ATOM 0 HB3 LEU A 76 0.321 -2.493 -0.444 1.00 57.08 H new ATOM 0 HG LEU A 76 1.884 -0.207 -0.151 1.00 57.08 H new ATOM 0 HD11 LEU A 76 4.137 -1.065 0.355 1.00 57.08 H new ATOM 0 HD12 LEU A 76 3.044 -1.198 1.753 1.00 57.08 H new ATOM 0 HD13 LEU A 76 3.431 -2.641 0.785 1.00 57.08 H new ATOM 0 HD21 LEU A 76 3.272 -1.199 -1.929 1.00 57.08 H new ATOM 0 HD22 LEU A 76 2.531 -2.786 -1.612 1.00 57.08 H new ATOM 0 HD23 LEU A 76 1.534 -1.445 -2.224 1.00 57.08 H new ATOM 1214 N THR A 77 -1.643 -0.541 -0.831 1.00 38.46 N ATOM 1215 CA THR A 77 -2.235 0.266 -1.876 1.00 38.46 C ATOM 1216 C THR A 77 -2.850 1.539 -1.310 1.00 38.46 C ATOM 1217 O THR A 77 -2.703 2.608 -1.891 1.00 38.46 O ATOM 1218 CB THR A 77 -3.308 -0.541 -2.635 1.00 38.46 C ATOM 1219 OG1 THR A 77 -2.697 -1.623 -3.347 1.00 38.46 O ATOM 1220 CG2 THR A 77 -4.086 0.329 -3.607 1.00 38.46 C ATOM 0 H THR A 77 -1.998 -1.496 -0.790 1.00 38.46 H new ATOM 0 HA THR A 77 -1.441 0.548 -2.568 1.00 38.46 H new ATOM 0 HB THR A 77 -4.007 -0.931 -1.896 1.00 38.46 H new ATOM 0 HG1 THR A 77 -2.810 -2.454 -2.839 1.00 38.46 H new ATOM 0 HG21 THR A 77 -4.832 -0.277 -4.121 1.00 38.46 H new ATOM 0 HG22 THR A 77 -4.584 1.130 -3.060 1.00 38.46 H new ATOM 0 HG23 THR A 77 -3.402 0.760 -4.338 1.00 38.46 H new ATOM 1228 N MET A 78 -3.542 1.426 -0.185 1.00 70.15 N ATOM 1229 CA MET A 78 -4.161 2.594 0.417 1.00 70.15 C ATOM 1230 C MET A 78 -3.086 3.578 0.846 1.00 70.15 C ATOM 1231 O MET A 78 -3.241 4.789 0.697 1.00 70.15 O ATOM 1232 CB MET A 78 -5.045 2.187 1.595 1.00 70.15 C ATOM 1233 CG MET A 78 -6.138 1.209 1.190 1.00 70.15 C ATOM 1234 SD MET A 78 -7.451 1.063 2.417 1.00 70.15 S ATOM 1235 CE MET A 78 -8.455 2.487 2.002 1.00 70.15 C ATOM 0 H MET A 78 -3.687 0.552 0.321 1.00 70.15 H new ATOM 0 HA MET A 78 -4.801 3.081 -0.319 1.00 70.15 H new ATOM 0 HB2 MET A 78 -4.427 1.735 2.371 1.00 70.15 H new ATOM 0 HB3 MET A 78 -5.500 3.077 2.028 1.00 70.15 H new ATOM 0 HG2 MET A 78 -6.570 1.529 0.242 1.00 70.15 H new ATOM 0 HG3 MET A 78 -5.695 0.227 1.023 1.00 70.15 H new ATOM 0 HE1 MET A 78 -9.357 2.488 2.615 1.00 70.15 H new ATOM 0 HE2 MET A 78 -7.888 3.399 2.190 1.00 70.15 H new ATOM 0 HE3 MET A 78 -8.732 2.442 0.949 1.00 70.15 H new ATOM 1245 N VAL A 79 -1.981 3.037 1.344 1.00 44.32 N ATOM 1246 CA VAL A 79 -0.853 3.850 1.766 1.00 44.32 C ATOM 1247 C VAL A 79 -0.170 4.454 0.546 1.00 44.32 C ATOM 1248 O VAL A 79 0.127 5.648 0.503 1.00 44.32 O ATOM 1249 CB VAL A 79 0.171 3.003 2.551 1.00 44.32 C ATOM 1250 CG1 VAL A 79 1.223 3.888 3.195 1.00 44.32 C ATOM 1251 CG2 VAL A 79 -0.529 2.137 3.590 1.00 44.32 C ATOM 0 H VAL A 79 -1.844 2.033 1.465 1.00 44.32 H new ATOM 0 HA VAL A 79 -1.227 4.642 2.415 1.00 44.32 H new ATOM 0 HB VAL A 79 0.677 2.341 1.848 1.00 44.32 H new ATOM 0 HG11 VAL A 79 1.934 3.269 3.743 1.00 44.32 H new ATOM 0 HG12 VAL A 79 1.750 4.448 2.422 1.00 44.32 H new ATOM 0 HG13 VAL A 79 0.742 4.583 3.883 1.00 44.32 H new ATOM 0 HG21 VAL A 79 0.211 1.548 4.132 1.00 44.32 H new ATOM 0 HG22 VAL A 79 -1.069 2.774 4.290 1.00 44.32 H new ATOM 0 HG23 VAL A 79 -1.231 1.468 3.093 1.00 44.32 H new ATOM 1261 N VAL A 80 0.055 3.607 -0.450 1.00 90.77 N ATOM 1262 CA VAL A 80 0.682 4.017 -1.698 1.00 90.77 C ATOM 1263 C VAL A 80 -0.194 5.023 -2.441 1.00 90.77 C ATOM 1264 O VAL A 80 0.279 6.069 -2.884 1.00 90.77 O ATOM 1265 CB VAL A 80 0.919 2.787 -2.610 1.00 90.77 C ATOM 1266 CG1 VAL A 80 1.508 3.207 -3.954 1.00 90.77 C ATOM 1267 CG2 VAL A 80 1.813 1.762 -1.914 1.00 90.77 C ATOM 0 H VAL A 80 -0.192 2.618 -0.415 1.00 90.77 H new ATOM 0 HA VAL A 80 1.636 4.484 -1.454 1.00 90.77 H new ATOM 0 HB VAL A 80 -0.046 2.318 -2.803 1.00 90.77 H new ATOM 0 HG11 VAL A 80 1.664 2.325 -4.574 1.00 90.77 H new ATOM 0 HG12 VAL A 80 0.820 3.887 -4.456 1.00 90.77 H new ATOM 0 HG13 VAL A 80 2.461 3.710 -3.792 1.00 90.77 H new ATOM 0 HG21 VAL A 80 1.966 0.907 -2.572 1.00 90.77 H new ATOM 0 HG22 VAL A 80 2.775 2.218 -1.681 1.00 90.77 H new ATOM 0 HG23 VAL A 80 1.336 1.430 -0.992 1.00 90.77 H new ATOM 1277 N ASP A 81 -1.468 4.688 -2.578 1.00 37.97 N ATOM 1278 CA ASP A 81 -2.415 5.544 -3.272 1.00 37.97 C ATOM 1279 C ASP A 81 -2.512 6.896 -2.586 1.00 37.97 C ATOM 1280 O ASP A 81 -2.630 7.929 -3.245 1.00 37.97 O ATOM 1281 CB ASP A 81 -3.789 4.874 -3.335 1.00 37.97 C ATOM 1282 CG ASP A 81 -3.801 3.651 -4.233 1.00 37.97 C ATOM 1283 OD1 ASP A 81 -2.809 3.438 -4.964 1.00 37.97 O ATOM 1284 OD2 ASP A 81 -4.802 2.906 -4.205 1.00 37.97 O ATOM 0 H ASP A 81 -1.871 3.824 -2.215 1.00 37.97 H new ATOM 0 HA ASP A 81 -2.059 5.701 -4.290 1.00 37.97 H new ATOM 0 HB2 ASP A 81 -4.095 4.585 -2.329 1.00 37.97 H new ATOM 0 HB3 ASP A 81 -4.524 5.593 -3.697 1.00 37.97 H new ATOM 1289 N TYR A 82 -2.445 6.887 -1.259 1.00130.70 N ATOM 1290 CA TYR A 82 -2.507 8.119 -0.499 1.00130.70 C ATOM 1291 C TYR A 82 -1.316 9.012 -0.829 1.00130.70 C ATOM 1292 O TYR A 82 -1.461 10.223 -1.002 1.00130.70 O ATOM 1293 CB TYR A 82 -2.526 7.789 0.994 1.00130.70 C ATOM 1294 CG TYR A 82 -2.087 8.922 1.897 1.00130.70 C ATOM 1295 CD1 TYR A 82 -0.736 9.190 2.077 1.00130.70 C ATOM 1296 CD2 TYR A 82 -3.004 9.712 2.561 1.00130.70 C ATOM 1297 CE1 TYR A 82 -0.316 10.213 2.893 1.00130.70 C ATOM 1298 CE2 TYR A 82 -2.585 10.733 3.380 1.00130.70 C ATOM 1299 CZ TYR A 82 -1.244 10.984 3.543 1.00130.70 C ATOM 1300 OH TYR A 82 -0.832 12.008 4.361 1.00130.70 O ATOM 0 H TYR A 82 -2.348 6.043 -0.695 1.00130.70 H new ATOM 0 HA TYR A 82 -3.417 8.658 -0.763 1.00130.70 H new ATOM 0 HB2 TYR A 82 -3.536 7.490 1.273 1.00130.70 H new ATOM 0 HB3 TYR A 82 -1.879 6.930 1.171 1.00130.70 H new ATOM 0 HD1 TYR A 82 -0.002 8.584 1.567 1.00130.70 H new ATOM 0 HD2 TYR A 82 -4.060 9.526 2.436 1.00130.70 H new ATOM 0 HE1 TYR A 82 0.738 10.408 3.021 1.00130.70 H new ATOM 0 HE2 TYR A 82 -3.313 11.340 3.898 1.00130.70 H new ATOM 0 HH TYR A 82 -1.590 12.598 4.553 1.00130.70 H new ATOM 1310 N ARG A 83 -0.133 8.407 -0.890 1.00265.02 N ATOM 1311 CA ARG A 83 1.093 9.146 -1.173 1.00265.02 C ATOM 1312 C ARG A 83 0.904 10.034 -2.387 1.00265.02 C ATOM 1313 O ARG A 83 1.215 11.209 -2.348 1.00265.02 O ATOM 1314 CB ARG A 83 2.249 8.147 -1.387 1.00265.02 C ATOM 1315 CG ARG A 83 3.485 8.713 -2.094 1.00265.02 C ATOM 1316 CD ARG A 83 3.708 8.022 -3.433 1.00265.02 C ATOM 1317 NE ARG A 83 5.129 7.910 -3.767 1.00265.02 N ATOM 1318 CZ ARG A 83 5.882 8.927 -4.195 1.00265.02 C ATOM 1319 NH1 ARG A 83 5.363 10.140 -4.338 1.00265.02 N ATOM 1320 NH2 ARG A 83 7.162 8.726 -4.476 1.00265.02 N ATOM 0 H ARG A 83 0.002 7.406 -0.747 1.00265.02 H new ATOM 0 HA ARG A 83 1.337 9.790 -0.328 1.00265.02 H new ATOM 0 HB2 ARG A 83 2.554 7.757 -0.416 1.00265.02 H new ATOM 0 HB3 ARG A 83 1.875 7.303 -1.966 1.00265.02 H new ATOM 0 HG2 ARG A 83 3.361 9.785 -2.249 1.00265.02 H new ATOM 0 HG3 ARG A 83 4.363 8.582 -1.462 1.00265.02 H new ATOM 0 HD2 ARG A 83 3.263 7.027 -3.405 1.00265.02 H new ATOM 0 HD3 ARG A 83 3.195 8.579 -4.217 1.00265.02 H new ATOM 0 HE ARG A 83 5.572 6.997 -3.666 1.00265.02 H new ATOM 0 HH11 ARG A 83 4.380 10.303 -4.120 1.00265.02 H new ATOM 0 HH12 ARG A 83 5.947 10.909 -4.666 1.00265.02 H new ATOM 0 HH21 ARG A 83 7.569 7.797 -4.365 1.00265.02 H new ATOM 0 HH22 ARG A 83 7.740 9.500 -4.803 1.00265.02 H new ATOM 1334 N THR A 84 0.378 9.462 -3.444 1.00259.68 N ATOM 1335 CA THR A 84 0.134 10.198 -4.657 1.00259.68 C ATOM 1336 C THR A 84 -1.065 11.141 -4.544 1.00259.68 C ATOM 1337 O THR A 84 -1.038 12.256 -5.066 1.00259.68 O ATOM 1338 CB THR A 84 -0.108 9.227 -5.815 1.00259.68 C ATOM 1339 OG1 THR A 84 1.009 8.342 -5.962 1.00259.68 O ATOM 1340 CG2 THR A 84 -0.332 9.991 -7.096 1.00259.68 C ATOM 0 H THR A 84 0.109 8.479 -3.486 1.00259.68 H new ATOM 0 HA THR A 84 1.020 10.805 -4.840 1.00259.68 H new ATOM 0 HB THR A 84 -0.998 8.637 -5.595 1.00259.68 H new ATOM 0 HG1 THR A 84 0.842 7.725 -6.705 1.00259.68 H new ATOM 0 HG21 THR A 84 -0.503 9.290 -7.913 1.00259.68 H new ATOM 0 HG22 THR A 84 -1.202 10.639 -6.986 1.00259.68 H new ATOM 0 HG23 THR A 84 0.547 10.597 -7.316 1.00259.68 H new ATOM 1348 N ARG A 85 -2.133 10.669 -3.915 1.00220.68 N ATOM 1349 CA ARG A 85 -3.355 11.460 -3.805 1.00220.68 C ATOM 1350 C ARG A 85 -3.139 12.728 -2.985 1.00220.68 C ATOM 1351 O ARG A 85 -3.514 13.819 -3.410 1.00220.68 O ATOM 1352 CB ARG A 85 -4.488 10.604 -3.213 1.00220.68 C ATOM 1353 CG ARG A 85 -4.617 10.650 -1.698 1.00220.68 C ATOM 1354 CD ARG A 85 -5.642 9.648 -1.233 1.00220.68 C ATOM 1355 NE ARG A 85 -5.903 9.745 0.202 1.00220.68 N ATOM 1356 CZ ARG A 85 -6.743 10.624 0.751 1.00220.68 C ATOM 1357 NH1 ARG A 85 -7.406 11.493 -0.005 1.00220.68 N ATOM 1358 NH2 ARG A 85 -6.917 10.635 2.064 1.00220.68 N ATOM 0 H ARG A 85 -2.180 9.750 -3.476 1.00220.68 H new ATOM 0 HA ARG A 85 -3.642 11.776 -4.808 1.00220.68 H new ATOM 0 HB2 ARG A 85 -5.432 10.928 -3.651 1.00220.68 H new ATOM 0 HB3 ARG A 85 -4.335 9.568 -3.516 1.00220.68 H new ATOM 0 HG2 ARG A 85 -3.653 10.436 -1.237 1.00220.68 H new ATOM 0 HG3 ARG A 85 -4.907 11.652 -1.381 1.00220.68 H new ATOM 0 HD2 ARG A 85 -6.572 9.803 -1.780 1.00220.68 H new ATOM 0 HD3 ARG A 85 -5.296 8.642 -1.470 1.00220.68 H new ATOM 0 HE ARG A 85 -5.412 9.101 0.822 1.00220.68 H new ATOM 0 HH11 ARG A 85 -7.275 11.493 -1.017 1.00220.68 H new ATOM 0 HH12 ARG A 85 -8.046 12.160 0.426 1.00220.68 H new ATOM 0 HH21 ARG A 85 -6.410 9.973 2.651 1.00220.68 H new ATOM 0 HH22 ARG A 85 -7.558 11.305 2.488 1.00220.68 H new ATOM 1372 N VAL A 86 -2.523 12.582 -1.822 1.00 63.58 N ATOM 1373 CA VAL A 86 -2.254 13.730 -0.975 1.00 63.58 C ATOM 1374 C VAL A 86 -1.161 14.578 -1.623 1.00 63.58 C ATOM 1375 O VAL A 86 -1.130 15.798 -1.472 1.00 63.58 O ATOM 1376 CB VAL A 86 -1.876 13.303 0.465 1.00 63.58 C ATOM 1377 CG1 VAL A 86 -1.438 14.498 1.308 1.00 63.58 C ATOM 1378 CG2 VAL A 86 -3.068 12.614 1.110 1.00 63.58 C ATOM 0 H VAL A 86 -2.203 11.689 -1.447 1.00 63.58 H new ATOM 0 HA VAL A 86 -3.160 14.329 -0.884 1.00 63.58 H new ATOM 0 HB VAL A 86 -1.033 12.614 0.412 1.00 63.58 H new ATOM 0 HG11 VAL A 86 -1.181 14.160 2.312 1.00 63.58 H new ATOM 0 HG12 VAL A 86 -0.568 14.968 0.849 1.00 63.58 H new ATOM 0 HG13 VAL A 86 -2.252 15.220 1.366 1.00 63.58 H new ATOM 0 HG21 VAL A 86 -2.808 12.311 2.124 1.00 63.58 H new ATOM 0 HG22 VAL A 86 -3.913 13.302 1.142 1.00 63.58 H new ATOM 0 HG23 VAL A 86 -3.339 11.734 0.527 1.00 63.58 H new ATOM 1583 N LEU A 99 18.134 22.667 -1.897 1.00281.45 N ATOM 1584 CA LEU A 99 18.861 23.877 -1.547 1.00281.45 C ATOM 1585 C LEU A 99 18.469 24.353 -0.147 1.00281.45 C ATOM 1586 O LEU A 99 17.298 24.288 0.228 1.00281.45 O ATOM 1587 CB LEU A 99 18.565 24.955 -2.590 1.00281.45 C ATOM 1588 CG LEU A 99 18.662 24.482 -4.044 1.00281.45 C ATOM 1589 CD1 LEU A 99 18.524 25.656 -4.998 1.00281.45 C ATOM 1590 CD2 LEU A 99 19.970 23.739 -4.290 1.00281.45 C ATOM 0 HA LEU A 99 19.931 23.669 -1.538 1.00281.45 H new ATOM 0 HB2 LEU A 99 17.562 25.345 -2.415 1.00281.45 H new ATOM 0 HB3 LEU A 99 19.259 25.783 -2.444 1.00281.45 H new ATOM 0 HG LEU A 99 17.841 23.789 -4.230 1.00281.45 H new ATOM 0 HD11 LEU A 99 18.596 25.300 -6.026 1.00281.45 H new ATOM 0 HD12 LEU A 99 17.557 26.136 -4.847 1.00281.45 H new ATOM 0 HD13 LEU A 99 19.320 26.376 -4.807 1.00281.45 H new ATOM 0 HD21 LEU A 99 20.014 23.414 -5.329 1.00281.45 H new ATOM 0 HD22 LEU A 99 20.810 24.402 -4.081 1.00281.45 H new ATOM 0 HD23 LEU A 99 20.023 22.869 -3.635 1.00281.45 H new ATOM 1602 N THR A 100 19.453 24.799 0.636 1.00235.89 N ATOM 1603 CA THR A 100 19.190 25.247 2.004 1.00235.89 C ATOM 1604 C THR A 100 18.969 26.760 2.117 1.00235.89 C ATOM 1605 O THR A 100 17.830 27.227 2.095 1.00235.89 O ATOM 1606 CB THR A 100 20.318 24.814 2.958 1.00235.89 C ATOM 1607 OG1 THR A 100 21.551 25.446 2.594 1.00235.89 O ATOM 1608 CG2 THR A 100 20.490 23.312 2.931 1.00235.89 C ATOM 0 H THR A 100 20.430 24.859 0.350 1.00235.89 H new ATOM 0 HA THR A 100 18.258 24.763 2.297 1.00235.89 H new ATOM 0 HB THR A 100 20.044 25.121 3.968 1.00235.89 H new ATOM 0 HG1 THR A 100 22.258 25.163 3.210 1.00235.89 H new ATOM 0 HG21 THR A 100 21.292 23.025 3.612 1.00235.89 H new ATOM 0 HG22 THR A 100 19.561 22.834 3.242 1.00235.89 H new ATOM 0 HG23 THR A 100 20.741 22.993 1.920 1.00235.89 H new ATOM 1616 N ARG A 101 20.054 27.525 2.260 1.00326.00 N ATOM 1617 CA ARG A 101 19.955 28.977 2.400 1.00326.00 C ATOM 1618 C ARG A 101 20.006 29.645 1.038 1.00326.00 C ATOM 1619 O ARG A 101 21.027 30.212 0.644 1.00326.00 O ATOM 1620 CB ARG A 101 21.081 29.517 3.298 1.00326.00 C ATOM 1621 CG ARG A 101 21.561 28.543 4.377 1.00326.00 C ATOM 1622 CD ARG A 101 20.403 27.836 5.068 1.00326.00 C ATOM 1623 NE ARG A 101 20.669 27.595 6.485 1.00326.00 N ATOM 1624 CZ ARG A 101 19.836 26.947 7.300 1.00326.00 C ATOM 1625 NH1 ARG A 101 18.677 26.481 6.849 1.00326.00 N ATOM 1626 NH2 ARG A 101 20.165 26.765 8.573 1.00326.00 N ATOM 0 H ARG A 101 21.007 27.163 2.282 1.00326.00 H new ATOM 0 HA ARG A 101 18.999 29.209 2.869 1.00326.00 H new ATOM 0 HB2 ARG A 101 21.929 29.789 2.670 1.00326.00 H new ATOM 0 HB3 ARG A 101 20.736 30.431 3.781 1.00326.00 H new ATOM 0 HG2 ARG A 101 22.221 27.801 3.927 1.00326.00 H new ATOM 0 HG3 ARG A 101 22.148 29.085 5.118 1.00326.00 H new ATOM 0 HD2 ARG A 101 19.500 28.438 4.967 1.00326.00 H new ATOM 0 HD3 ARG A 101 20.210 26.886 4.570 1.00326.00 H new ATOM 0 HE ARG A 101 21.545 27.944 6.874 1.00326.00 H new ATOM 0 HH11 ARG A 101 18.418 26.618 5.872 1.00326.00 H new ATOM 0 HH12 ARG A 101 18.046 25.986 7.480 1.00326.00 H new ATOM 0 HH21 ARG A 101 21.053 27.121 8.926 1.00326.00 H new ATOM 0 HH22 ARG A 101 19.529 26.270 9.198 1.00326.00 H new ATOM 1640 N ILE A 102 18.902 29.552 0.314 1.00164.55 N ATOM 1641 CA ILE A 102 18.810 30.117 -1.018 1.00164.55 C ATOM 1642 C ILE A 102 17.501 30.886 -1.183 1.00164.55 C ATOM 1643 O ILE A 102 16.641 30.505 -1.973 1.00164.55 O ATOM 1644 CB ILE A 102 18.892 29.004 -2.086 1.00164.55 C ATOM 1645 CG1 ILE A 102 20.180 28.192 -1.916 1.00164.55 C ATOM 1646 CG2 ILE A 102 18.810 29.584 -3.494 1.00164.55 C ATOM 1647 CD1 ILE A 102 20.170 27.260 -0.724 1.00164.55 C ATOM 0 H ILE A 102 18.052 29.086 0.632 1.00164.55 H new ATOM 0 HA ILE A 102 19.647 30.802 -1.153 1.00164.55 H new ATOM 0 HB ILE A 102 18.039 28.340 -1.945 1.00164.55 H new ATOM 0 HG12 ILE A 102 20.350 27.607 -2.820 1.00164.55 H new ATOM 0 HG13 ILE A 102 21.020 28.880 -1.819 1.00164.55 H new ATOM 0 HG21 ILE A 102 18.870 28.777 -4.224 1.00164.55 H new ATOM 0 HG22 ILE A 102 17.865 30.113 -3.615 1.00164.55 H new ATOM 0 HG23 ILE A 102 19.636 30.277 -3.651 1.00164.55 H new ATOM 0 HD11 ILE A 102 21.117 26.722 -0.675 1.00164.55 H new ATOM 0 HD12 ILE A 102 20.033 27.839 0.189 1.00164.55 H new ATOM 0 HD13 ILE A 102 19.353 26.546 -0.827 1.00164.55 H new ATOM 1659 N PRO A 103 17.330 31.993 -0.442 1.00 72.69 N ATOM 1660 CA PRO A 103 16.121 32.813 -0.514 1.00 72.69 C ATOM 1661 C PRO A 103 15.684 33.087 -1.955 1.00 72.69 C ATOM 1662 O PRO A 103 14.498 33.276 -2.227 1.00 72.69 O ATOM 1663 CB PRO A 103 16.524 34.117 0.192 1.00 72.69 C ATOM 1664 CG PRO A 103 17.988 34.001 0.474 1.00 72.69 C ATOM 1665 CD PRO A 103 18.284 32.535 0.527 1.00 72.69 C ATOM 0 HA PRO A 103 15.267 32.316 -0.054 1.00 72.69 H new ATOM 0 HB2 PRO A 103 16.316 34.982 -0.438 1.00 72.69 H new ATOM 0 HB3 PRO A 103 15.959 34.251 1.114 1.00 72.69 H new ATOM 0 HG2 PRO A 103 18.575 34.489 -0.304 1.00 72.69 H new ATOM 0 HG3 PRO A 103 18.243 34.485 1.417 1.00 72.69 H new ATOM 0 HD2 PRO A 103 19.315 32.317 0.249 1.00 72.69 H new ATOM 0 HD3 PRO A 103 18.129 32.124 1.525 1.00 72.69 H new ATOM 1673 N SER A 104 16.646 33.089 -2.875 1.00159.85 N ATOM 1674 CA SER A 104 16.353 33.320 -4.285 1.00159.85 C ATOM 1675 C SER A 104 15.460 32.214 -4.843 1.00159.85 C ATOM 1676 O SER A 104 14.587 32.463 -5.673 1.00159.85 O ATOM 1677 CB SER A 104 17.652 33.394 -5.092 1.00159.85 C ATOM 1678 OG SER A 104 18.497 34.422 -4.608 1.00159.85 O ATOM 0 H SER A 104 17.633 32.933 -2.669 1.00159.85 H new ATOM 0 HA SER A 104 15.824 34.269 -4.369 1.00159.85 H new ATOM 0 HB2 SER A 104 18.171 32.437 -5.039 1.00159.85 H new ATOM 0 HB3 SER A 104 17.421 33.573 -6.142 1.00159.85 H new ATOM 0 HG SER A 104 19.320 34.446 -5.140 1.00159.85 H new ATOM 1684 N ALA A 105 15.692 30.989 -4.377 1.00293.58 N ATOM 1685 CA ALA A 105 14.920 29.833 -4.820 1.00293.58 C ATOM 1686 C ALA A 105 14.055 29.293 -3.690 1.00293.58 C ATOM 1687 O ALA A 105 12.835 29.186 -3.815 1.00293.58 O ATOM 1688 CB ALA A 105 15.853 28.745 -5.321 1.00293.58 C ATOM 0 H ALA A 105 16.413 30.772 -3.689 1.00293.58 H new ATOM 0 HA ALA A 105 14.267 30.150 -5.633 1.00293.58 H new ATOM 0 HB1 ALA A 105 15.267 27.886 -5.649 1.00293.58 H new ATOM 0 HB2 ALA A 105 16.440 29.125 -6.157 1.00293.58 H new ATOM 0 HB3 ALA A 105 16.523 28.441 -4.516 1.00293.58 H new ATOM 1694 N LYS A 106 14.706 28.960 -2.585 1.00328.40 N ATOM 1695 CA LYS A 106 14.024 28.434 -1.414 1.00328.40 C ATOM 1696 C LYS A 106 13.380 29.564 -0.624 1.00328.40 C ATOM 1697 O LYS A 106 13.969 30.631 -0.463 1.00328.40 O ATOM 1698 CB LYS A 106 15.026 27.690 -0.533 1.00328.40 C ATOM 1699 CG LYS A 106 15.696 26.520 -1.231 1.00328.40 C ATOM 1700 CD LYS A 106 14.727 25.369 -1.442 1.00328.40 C ATOM 1701 CE LYS A 106 14.390 24.677 -0.130 1.00328.40 C ATOM 1702 NZ LYS A 106 13.066 25.105 0.402 1.00328.40 N ATOM 0 H LYS A 106 15.716 29.047 -2.476 1.00328.40 H new ATOM 0 HA LYS A 106 13.242 27.746 -1.737 1.00328.40 H new ATOM 0 HB2 LYS A 106 15.792 28.389 -0.198 1.00328.40 H new ATOM 0 HB3 LYS A 106 14.514 27.326 0.358 1.00328.40 H new ATOM 0 HG2 LYS A 106 16.090 26.846 -2.193 1.00328.40 H new ATOM 0 HG3 LYS A 106 16.545 26.179 -0.638 1.00328.40 H new ATOM 0 HD2 LYS A 106 13.813 25.742 -1.903 1.00328.40 H new ATOM 0 HD3 LYS A 106 15.162 24.648 -2.134 1.00328.40 H new ATOM 0 HE2 LYS A 106 14.389 23.597 -0.279 1.00328.40 H new ATOM 0 HE3 LYS A 106 15.164 24.896 0.605 1.00328.40 H new ATOM 0 HZ1 LYS A 106 13.107 25.151 1.440 1.00328.40 H new ATOM 0 HZ2 LYS A 106 12.827 26.043 0.023 1.00328.40 H new ATOM 0 HZ3 LYS A 106 12.338 24.420 0.115 1.00328.40 H new ATOM 1716 N LYS A 107 12.170 29.330 -0.133 1.00281.61 N ATOM 1717 CA LYS A 107 11.467 30.346 0.633 1.00281.61 C ATOM 1718 C LYS A 107 11.653 30.149 2.126 1.00281.61 C ATOM 1719 O LYS A 107 11.312 29.106 2.684 1.00281.61 O ATOM 1720 CB LYS A 107 9.981 30.360 0.286 1.00281.61 C ATOM 1721 CG LYS A 107 9.695 30.883 -1.111 1.00281.61 C ATOM 1722 CD LYS A 107 8.209 31.119 -1.318 1.00281.61 C ATOM 1723 CE LYS A 107 7.671 32.181 -0.367 1.00281.61 C ATOM 1724 NZ LYS A 107 6.699 31.611 0.606 1.00281.61 N ATOM 0 H LYS A 107 11.660 28.454 -0.251 1.00281.61 H new ATOM 0 HA LYS A 107 11.899 31.310 0.363 1.00281.61 H new ATOM 0 HB2 LYS A 107 9.584 29.349 0.376 1.00281.61 H new ATOM 0 HB3 LYS A 107 9.451 30.976 1.013 1.00281.61 H new ATOM 0 HG2 LYS A 107 10.239 31.814 -1.272 1.00281.61 H new ATOM 0 HG3 LYS A 107 10.059 30.169 -1.850 1.00281.61 H new ATOM 0 HD2 LYS A 107 8.029 31.428 -2.348 1.00281.61 H new ATOM 0 HD3 LYS A 107 7.667 30.186 -1.166 1.00281.61 H new ATOM 0 HE2 LYS A 107 8.500 32.639 0.173 1.00281.61 H new ATOM 0 HE3 LYS A 107 7.189 32.972 -0.941 1.00281.61 H new ATOM 0 HZ1 LYS A 107 6.356 32.364 1.236 1.00281.61 H new ATOM 0 HZ2 LYS A 107 5.896 31.197 0.092 1.00281.61 H new ATOM 0 HZ3 LYS A 107 7.166 30.873 1.171 1.00281.61 H new ATOM 1738 N TYR A 108 12.185 31.180 2.760 1.00309.62 N ATOM 1739 CA TYR A 108 12.422 31.180 4.193 1.00309.62 C ATOM 1740 C TYR A 108 11.118 31.046 4.967 1.00309.62 C ATOM 1741 O TYR A 108 10.033 31.283 4.433 1.00309.62 O ATOM 1742 CB TYR A 108 13.132 32.484 4.592 1.00309.62 C ATOM 1743 CG TYR A 108 12.432 33.776 4.159 1.00309.62 C ATOM 1744 CD1 TYR A 108 11.208 33.774 3.481 1.00309.62 C ATOM 1745 CD2 TYR A 108 13.007 35.011 4.443 1.00309.62 C ATOM 1746 CE1 TYR A 108 10.589 34.949 3.110 1.00309.62 C ATOM 1747 CE2 TYR A 108 12.391 36.191 4.072 1.00309.62 C ATOM 1748 CZ TYR A 108 11.182 36.156 3.408 1.00309.62 C ATOM 1749 OH TYR A 108 10.573 37.331 3.035 1.00309.62 O ATOM 0 H TYR A 108 12.465 32.043 2.294 1.00309.62 H new ATOM 0 HA TYR A 108 13.050 30.324 4.439 1.00309.62 H new ATOM 0 HB2 TYR A 108 13.245 32.498 5.676 1.00309.62 H new ATOM 0 HB3 TYR A 108 14.136 32.475 4.167 1.00309.62 H new ATOM 0 HD1 TYR A 108 10.738 32.831 3.243 1.00309.62 H new ATOM 0 HD2 TYR A 108 13.953 35.048 4.963 1.00309.62 H new ATOM 0 HE1 TYR A 108 9.644 34.923 2.588 1.00309.62 H new ATOM 0 HE2 TYR A 108 12.855 37.139 4.301 1.00309.62 H new ATOM 0 HH TYR A 108 11.123 38.090 3.322 1.00309.62 H new ATOM 1759 N LYS A 109 11.217 30.682 6.239 1.00276.51 N ATOM 1760 CA LYS A 109 10.026 30.562 7.066 1.00276.51 C ATOM 1761 C LYS A 109 9.870 31.775 7.973 1.00276.51 C ATOM 1762 O LYS A 109 9.033 31.783 8.877 1.00276.51 O ATOM 1763 CB LYS A 109 10.034 29.268 7.875 1.00276.51 C ATOM 1764 CG LYS A 109 10.460 28.058 7.056 1.00276.51 C ATOM 1765 CD LYS A 109 9.699 26.806 7.466 1.00276.51 C ATOM 1766 CE LYS A 109 8.389 26.680 6.702 1.00276.51 C ATOM 1767 NZ LYS A 109 7.442 25.741 7.365 1.00276.51 N ATOM 0 H LYS A 109 12.094 30.468 6.713 1.00276.51 H new ATOM 0 HA LYS A 109 9.164 30.525 6.400 1.00276.51 H new ATOM 0 HB2 LYS A 109 10.708 29.381 8.724 1.00276.51 H new ATOM 0 HB3 LYS A 109 9.037 29.093 8.280 1.00276.51 H new ATOM 0 HG2 LYS A 109 10.291 28.257 5.998 1.00276.51 H new ATOM 0 HG3 LYS A 109 11.530 27.891 7.182 1.00276.51 H new ATOM 0 HD2 LYS A 109 10.316 25.926 7.282 1.00276.51 H new ATOM 0 HD3 LYS A 109 9.497 26.835 8.537 1.00276.51 H new ATOM 0 HE2 LYS A 109 7.924 27.662 6.616 1.00276.51 H new ATOM 0 HE3 LYS A 109 8.593 26.334 5.689 1.00276.51 H new ATOM 0 HZ1 LYS A 109 6.563 25.685 6.811 1.00276.51 H new ATOM 0 HZ2 LYS A 109 7.874 24.797 7.425 1.00276.51 H new ATOM 0 HZ3 LYS A 109 7.226 26.084 8.323 1.00276.51 H new ATOM 1781 N ASP A 110 10.635 32.832 7.684 1.00203.92 N ATOM 1782 CA ASP A 110 10.529 34.076 8.428 1.00203.92 C ATOM 1783 C ASP A 110 9.109 34.609 8.265 1.00203.92 C ATOM 1784 O ASP A 110 8.538 35.206 9.178 1.00203.92 O ATOM 1785 CB ASP A 110 11.545 35.095 7.906 1.00203.92 C ATOM 1786 CG ASP A 110 12.979 34.650 8.130 1.00203.92 C ATOM 1787 OD1 ASP A 110 13.205 33.799 9.015 1.00203.92 O ATOM 1788 OD2 ASP A 110 13.875 35.154 7.421 1.00203.92 O ATOM 0 H ASP A 110 11.332 32.844 6.939 1.00203.92 H new ATOM 0 HA ASP A 110 10.742 33.901 9.483 1.00203.92 H new ATOM 0 HB2 ASP A 110 11.380 35.256 6.841 1.00203.92 H new ATOM 0 HB3 ASP A 110 11.383 36.052 8.402 1.00203.92 H new ATOM 1793 N ILE A 111 8.535 34.328 7.091 1.00 50.97 N ATOM 1794 CA ILE A 111 7.178 34.702 6.782 1.00 50.97 C ATOM 1795 C ILE A 111 6.264 33.587 7.295 1.00 50.97 C ATOM 1796 O ILE A 111 6.502 32.411 7.020 1.00 50.97 O ATOM 1797 CB ILE A 111 7.033 34.948 5.246 1.00 50.97 C ATOM 1798 CG1 ILE A 111 7.552 36.347 4.886 1.00 50.97 C ATOM 1799 CG2 ILE A 111 5.594 34.786 4.770 1.00 50.97 C ATOM 1800 CD1 ILE A 111 8.925 36.666 5.447 1.00 50.97 C ATOM 0 H ILE A 111 9.011 33.834 6.336 1.00 50.97 H new ATOM 0 HA ILE A 111 6.895 35.635 7.269 1.00 50.97 H new ATOM 0 HB ILE A 111 7.632 34.192 4.737 1.00 50.97 H new ATOM 0 HG12 ILE A 111 7.585 36.442 3.801 1.00 50.97 H new ATOM 0 HG13 ILE A 111 6.842 37.090 5.249 1.00 50.97 H new ATOM 0 HG21 ILE A 111 5.543 34.967 3.696 1.00 50.97 H new ATOM 0 HG22 ILE A 111 5.252 33.774 4.984 1.00 50.97 H new ATOM 0 HG23 ILE A 111 4.956 35.502 5.289 1.00 50.97 H new ATOM 0 HD11 ILE A 111 9.216 37.672 5.146 1.00 50.97 H new ATOM 0 HD12 ILE A 111 8.896 36.607 6.535 1.00 50.97 H new ATOM 0 HD13 ILE A 111 9.650 35.948 5.064 1.00 50.97 H new ATOM 1812 N ILE A 112 5.251 33.948 8.072 1.00108.96 N ATOM 1813 CA ILE A 112 4.358 32.951 8.644 1.00108.96 C ATOM 1814 C ILE A 112 3.208 32.615 7.708 1.00108.96 C ATOM 1815 O ILE A 112 2.299 33.418 7.508 1.00108.96 O ATOM 1816 CB ILE A 112 3.780 33.431 9.995 1.00108.96 C ATOM 1817 CG1 ILE A 112 4.904 33.868 10.941 1.00108.96 C ATOM 1818 CG2 ILE A 112 2.941 32.333 10.641 1.00108.96 C ATOM 1819 CD1 ILE A 112 5.983 32.822 11.136 1.00108.96 C ATOM 0 H ILE A 112 5.029 34.913 8.318 1.00108.96 H new ATOM 0 HA ILE A 112 4.957 32.054 8.800 1.00108.96 H new ATOM 0 HB ILE A 112 3.138 34.290 9.803 1.00108.96 H new ATOM 0 HG12 ILE A 112 5.360 34.778 10.552 1.00108.96 H new ATOM 0 HG13 ILE A 112 4.473 34.117 11.911 1.00108.96 H new ATOM 0 HG21 ILE A 112 2.543 32.690 11.591 1.00108.96 H new ATOM 0 HG22 ILE A 112 2.117 32.068 9.979 1.00108.96 H new ATOM 0 HG23 ILE A 112 3.563 31.455 10.816 1.00108.96 H new ATOM 0 HD11 ILE A 112 6.742 33.205 11.818 1.00108.96 H new ATOM 0 HD12 ILE A 112 5.542 31.918 11.555 1.00108.96 H new ATOM 0 HD13 ILE A 112 6.442 32.590 10.175 1.00108.96 H new