USER MOD reduce.3.24.130724 H: found=0, std=0, add=851, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 852 hydrogens (5 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 10 CSP H2 : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD NoAdj-H: A 10 CSP H : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD Set 1.1: A 59 GLN : amide:sc= 0.208 K(o=0.21,f=-4.4!) USER MOD Set 1.2: A 84 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 29 LYS NZ :NH3+ -171:sc= 0.736 (180deg=0.165) USER MOD Set 2.2: A 30 TYR OH : rot 180:sc= 0.0684 USER MOD Set 3.1: A 5 HIS : no HE2:sc= 0.338 K(o=0.36,f=-1.4) USER MOD Set 3.2: A 7 TYR OH : rot 180:sc= 0.0205 USER MOD Single : A 1 MET CE :methyl -175:sc= 0 (180deg=-0.0303) USER MOD Single : A 1 MET N :NH3+ -108:sc= 0.0284 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0984) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot -170:sc= 0.0511 USER MOD Single : A 17 SER OG : rot -88:sc= 0.501 USER MOD Single : A 21 SER OG : rot -15:sc= 0.791 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl -116:sc= 0 (180deg=-0.0305) USER MOD Single : A 26 GLN : amide:sc= -2.13! C(o=-2.1!,f=-2.8!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc=-0.000191 X(o=-0.00019,f=-0.11) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -156:sc= -0.167 (180deg=-0.523) USER MOD Single : A 68 GLN : amide:sc= -0.457 K(o=-0.46,f=-1.9) USER MOD Single : A 73 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 74 LYS NZ :NH3+ 179:sc= 0.00985 (180deg=0.0098) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.0513) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 168:sc= -0.0144 (180deg=-0.166) USER MOD Single : A 106 ASN : amide:sc= -1.69 K(o=-1.7,f=-5.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.534 18.447 11.231 1.00 0.00 N ATOM 2 CA MET A 1 -8.573 17.039 10.807 1.00 0.00 C ATOM 3 C MET A 1 -7.372 16.796 9.893 1.00 0.00 C ATOM 4 O MET A 1 -7.162 17.613 8.996 1.00 0.00 O ATOM 5 CB MET A 1 -9.870 16.782 10.037 1.00 0.00 C ATOM 6 CG MET A 1 -10.257 15.303 9.973 1.00 0.00 C ATOM 7 SD MET A 1 -9.150 14.198 9.023 1.00 0.00 S ATOM 8 CE MET A 1 -9.429 14.765 7.359 1.00 0.00 C ATOM 0 H1 MET A 1 -8.262 18.500 12.233 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.839 18.964 10.656 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.474 18.874 11.104 1.00 0.00 H new ATOM 0 HA MET A 1 -8.535 16.372 11.668 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.679 17.341 10.506 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.764 17.166 9.022 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.320 14.924 10.993 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.257 15.232 9.544 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.889 14.125 6.661 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.495 14.727 7.135 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.074 15.791 7.260 1.00 0.00 H new ATOM 20 N GLU A 2 -6.574 15.777 10.201 1.00 0.00 N ATOM 21 CA GLU A 2 -5.360 15.447 9.441 1.00 0.00 C ATOM 22 C GLU A 2 -5.189 13.927 9.383 1.00 0.00 C ATOM 23 O GLU A 2 -5.084 13.280 10.423 1.00 0.00 O ATOM 24 CB GLU A 2 -4.176 16.104 10.154 1.00 0.00 C ATOM 25 CG GLU A 2 -2.832 15.819 9.481 1.00 0.00 C ATOM 26 CD GLU A 2 -1.690 16.429 10.294 1.00 0.00 C ATOM 27 OE1 GLU A 2 -1.387 15.854 11.362 1.00 0.00 O ATOM 28 OE2 GLU A 2 -1.154 17.447 9.803 1.00 0.00 O ATOM 0 H GLU A 2 -6.747 15.151 10.987 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.424 15.815 8.417 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -4.335 17.182 10.191 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -4.140 15.752 11.185 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -2.686 14.743 9.387 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.829 16.230 8.472 1.00 0.00 H new ATOM 35 N LYS A 3 -5.498 13.368 8.216 1.00 0.00 N ATOM 36 CA LYS A 3 -5.232 11.945 7.959 1.00 0.00 C ATOM 37 C LYS A 3 -4.549 11.754 6.603 1.00 0.00 C ATOM 38 O LYS A 3 -4.824 12.481 5.649 1.00 0.00 O ATOM 39 CB LYS A 3 -6.515 11.112 7.973 1.00 0.00 C ATOM 40 CG LYS A 3 -7.022 10.892 9.400 1.00 0.00 C ATOM 41 CD LYS A 3 -8.087 9.795 9.450 1.00 0.00 C ATOM 42 CE LYS A 3 -8.511 9.502 10.891 1.00 0.00 C ATOM 43 NZ LYS A 3 -9.542 8.454 10.916 1.00 0.00 N ATOM 0 H LYS A 3 -5.928 13.867 7.438 1.00 0.00 H new ATOM 0 HA LYS A 3 -4.577 11.604 8.761 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -7.283 11.615 7.386 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.330 10.148 7.498 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -6.187 10.621 10.047 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -7.437 11.822 9.788 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -8.956 10.101 8.867 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -7.699 8.886 8.990 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -7.647 9.185 11.474 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -8.894 10.410 11.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -9.821 8.265 11.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -10.372 8.771 10.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -9.163 7.584 10.490 1.00 0.00 H new ATOM 57 N LYS A 4 -3.655 10.770 6.600 1.00 0.00 N ATOM 58 CA LYS A 4 -2.886 10.369 5.412 1.00 0.00 C ATOM 59 C LYS A 4 -3.452 9.099 4.776 1.00 0.00 C ATOM 60 O LYS A 4 -3.995 8.227 5.452 1.00 0.00 O ATOM 61 CB LYS A 4 -1.412 10.158 5.765 1.00 0.00 C ATOM 62 CG LYS A 4 -0.555 11.424 5.712 1.00 0.00 C ATOM 63 CD LYS A 4 -0.867 12.438 6.814 1.00 0.00 C ATOM 64 CE LYS A 4 0.030 13.675 6.744 1.00 0.00 C ATOM 65 NZ LYS A 4 -0.222 14.445 5.517 1.00 0.00 N ATOM 0 H LYS A 4 -3.437 10.218 7.429 1.00 0.00 H new ATOM 0 HA LYS A 4 -2.968 11.179 4.687 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -1.349 9.735 6.768 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -0.990 9.421 5.081 1.00 0.00 H new ATOM 0 HG2 LYS A 4 0.496 11.141 5.780 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.694 11.903 4.743 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -1.910 12.745 6.736 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -0.747 11.961 7.787 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -0.147 14.306 7.615 1.00 0.00 H new ATOM 0 HE3 LYS A 4 1.076 13.371 6.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.271 15.359 5.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.128 13.913 4.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -1.244 14.609 5.414 1.00 0.00 H new ATOM 79 N HIS A 5 -3.314 9.029 3.455 1.00 0.00 N ATOM 80 CA HIS A 5 -3.853 7.936 2.632 1.00 0.00 C ATOM 81 C HIS A 5 -2.760 6.984 2.141 1.00 0.00 C ATOM 82 O HIS A 5 -1.761 7.382 1.545 1.00 0.00 O ATOM 83 CB HIS A 5 -4.667 8.501 1.465 1.00 0.00 C ATOM 84 CG HIS A 5 -6.045 9.018 1.880 1.00 0.00 C ATOM 85 ND1 HIS A 5 -7.205 8.586 1.391 1.00 0.00 N ATOM 86 CD2 HIS A 5 -6.310 10.067 2.752 1.00 0.00 C ATOM 87 CE1 HIS A 5 -8.127 9.365 1.949 1.00 0.00 C ATOM 88 NE2 HIS A 5 -7.623 10.269 2.783 1.00 0.00 N ATOM 0 H HIS A 5 -2.819 9.737 2.913 1.00 0.00 H new ATOM 0 HA HIS A 5 -4.516 7.344 3.264 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -4.107 9.313 1.001 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -4.791 7.726 0.709 1.00 0.00 H new ATOM 0 HD1 HIS A 5 -7.354 7.823 0.731 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -5.573 10.624 3.311 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -9.183 9.272 1.744 1.00 0.00 H new ATOM 96 N ILE A 6 -2.914 5.734 2.569 1.00 0.00 N ATOM 97 CA ILE A 6 -2.033 4.610 2.223 1.00 0.00 C ATOM 98 C ILE A 6 -2.908 3.589 1.493 1.00 0.00 C ATOM 99 O ILE A 6 -3.738 2.899 2.082 1.00 0.00 O ATOM 100 CB ILE A 6 -1.393 4.003 3.473 1.00 0.00 C ATOM 101 CG1 ILE A 6 -0.623 5.058 4.270 1.00 0.00 C ATOM 102 CG2 ILE A 6 -0.477 2.841 3.084 1.00 0.00 C ATOM 103 CD1 ILE A 6 -0.256 4.632 5.693 1.00 0.00 C ATOM 0 H ILE A 6 -3.679 5.461 3.186 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.207 4.938 1.592 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.189 3.623 4.114 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.291 5.307 3.731 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -1.222 5.967 4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -0.027 2.416 3.981 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.059 2.074 2.573 1.00 0.00 H new ATOM 0 HG23 ILE A 6 0.308 3.203 2.421 1.00 0.00 H new ATOM 0 HD11 ILE A 6 0.287 5.438 6.186 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -1.165 4.412 6.253 1.00 0.00 H new ATOM 0 HD13 ILE A 6 0.372 3.742 5.656 1.00 0.00 H new ATOM 115 N TYR A 7 -2.715 3.536 0.178 1.00 0.00 N ATOM 116 CA TYR A 7 -3.490 2.631 -0.684 1.00 0.00 C ATOM 117 C TYR A 7 -2.643 1.487 -1.243 1.00 0.00 C ATOM 118 O TYR A 7 -1.550 1.672 -1.778 1.00 0.00 O ATOM 119 CB TYR A 7 -4.187 3.381 -1.820 1.00 0.00 C ATOM 120 CG TYR A 7 -5.285 4.386 -1.464 1.00 0.00 C ATOM 121 CD1 TYR A 7 -5.899 4.460 -0.219 1.00 0.00 C ATOM 122 CD2 TYR A 7 -5.703 5.192 -2.517 1.00 0.00 C ATOM 123 CE1 TYR A 7 -6.947 5.351 -0.021 1.00 0.00 C ATOM 124 CE2 TYR A 7 -6.757 6.080 -2.330 1.00 0.00 C ATOM 125 CZ TYR A 7 -7.370 6.140 -1.084 1.00 0.00 C ATOM 126 OH TYR A 7 -8.532 6.836 -0.968 1.00 0.00 O ATOM 0 H TYR A 7 -2.031 4.106 -0.319 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.256 2.193 -0.044 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.422 3.912 -2.385 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.621 2.639 -2.490 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -5.563 3.828 0.590 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -5.211 5.129 -3.476 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.425 5.429 0.944 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -7.093 6.712 -3.139 1.00 0.00 H new ATOM 0 HH TYR A 7 -8.694 7.342 -1.792 1.00 0.00 H new ATOM 136 N LEU A 8 -3.185 0.290 -1.037 1.00 0.00 N ATOM 137 CA LEU A 8 -2.593 -0.982 -1.476 1.00 0.00 C ATOM 138 C LEU A 8 -3.275 -1.464 -2.757 1.00 0.00 C ATOM 139 O LEU A 8 -4.487 -1.344 -2.921 1.00 0.00 O ATOM 140 CB LEU A 8 -2.704 -2.058 -0.393 1.00 0.00 C ATOM 141 CG LEU A 8 -1.676 -1.913 0.730 1.00 0.00 C ATOM 142 CD1 LEU A 8 -2.060 -0.801 1.709 1.00 0.00 C ATOM 143 CD2 LEU A 8 -1.535 -3.232 1.495 1.00 0.00 C ATOM 0 H LEU A 8 -4.072 0.169 -0.548 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.535 -0.806 -1.670 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.705 -2.025 0.037 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.588 -3.038 -0.855 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.725 -1.650 0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.305 -0.729 2.492 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.121 0.148 1.176 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.027 -1.029 2.157 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.800 -3.114 2.291 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.497 -3.507 1.927 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.207 -4.016 0.812 1.00 0.00 H new ATOM 155 N PHE A 9 -2.423 -1.894 -3.685 1.00 0.00 N ATOM 156 CA PHE A 9 -2.844 -2.351 -5.017 1.00 0.00 C ATOM 157 C PHE A 9 -2.256 -3.710 -5.403 1.00 0.00 C ATOM 158 O PHE A 9 -1.084 -4.013 -5.189 1.00 0.00 O ATOM 159 CB PHE A 9 -2.488 -1.316 -6.087 1.00 0.00 C ATOM 160 CG PHE A 9 -3.335 -0.046 -5.994 1.00 0.00 C ATOM 161 CD1 PHE A 9 -2.876 1.030 -5.242 1.00 0.00 C ATOM 162 CD2 PHE A 9 -4.502 0.062 -6.742 1.00 0.00 C ATOM 163 CE1 PHE A 9 -3.569 2.234 -5.260 1.00 0.00 C ATOM 164 CE2 PHE A 9 -5.207 1.259 -6.748 1.00 0.00 C ATOM 165 CZ PHE A 9 -4.730 2.341 -6.017 1.00 0.00 C ATOM 0 H PHE A 9 -1.415 -1.937 -3.538 1.00 0.00 H new ATOM 0 HA PHE A 9 -3.926 -2.470 -4.963 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -1.435 -1.052 -5.993 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -2.618 -1.762 -7.073 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -1.982 0.930 -4.645 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -4.859 -0.781 -7.316 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -3.209 3.079 -4.691 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -6.120 1.348 -7.317 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.268 3.277 -6.037 1.00 0.00 H new HETATM 175 N CSP A 10 -3.190 -4.532 -5.874 1.00 0.00 N HETATM 176 CA CSP A 10 -2.961 -5.865 -6.450 1.00 0.00 C HETATM 177 CB CSP A 10 -2.975 -6.945 -5.366 1.00 0.00 C HETATM 178 SG CSP A 10 -4.606 -7.320 -4.627 1.00 0.00 S HETATM 179 C CSP A 10 -4.017 -6.129 -7.526 1.00 0.00 C HETATM 180 O CSP A 10 -4.985 -5.374 -7.613 1.00 0.00 O HETATM 181 P CSP A 10 -4.594 -9.440 -4.915 1.00 0.00 P HETATM 182 O1P CSP A 10 -6.009 -9.846 -4.762 1.00 0.00 O HETATM 183 O2P CSP A 10 -3.497 -10.036 -4.119 1.00 0.00 O HETATM 184 O3P CSP A 10 -4.168 -9.584 -6.461 1.00 0.00 O HETATM 0 HB3 CSP A 10 -2.571 -7.864 -5.791 1.00 0.00 H new HETATM 0 HB2 CSP A 10 -2.299 -6.639 -4.568 1.00 0.00 H new HETATM 0 HA CSP A 10 -1.973 -5.898 -6.909 1.00 0.00 H new ATOM 190 N SER A 11 -3.887 -7.232 -8.257 1.00 0.00 N ATOM 191 CA SER A 11 -4.759 -7.571 -9.390 1.00 0.00 C ATOM 192 C SER A 11 -6.257 -7.533 -9.079 1.00 0.00 C ATOM 193 O SER A 11 -7.044 -6.897 -9.779 1.00 0.00 O ATOM 194 CB SER A 11 -4.408 -8.954 -9.942 1.00 0.00 C ATOM 195 OG SER A 11 -5.224 -9.351 -11.047 1.00 0.00 O ATOM 0 H SER A 11 -3.164 -7.929 -8.081 1.00 0.00 H new ATOM 0 HA SER A 11 -4.571 -6.791 -10.128 1.00 0.00 H new ATOM 0 HB2 SER A 11 -3.363 -8.958 -10.252 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.507 -9.691 -9.145 1.00 0.00 H new ATOM 0 HG SER A 11 -4.949 -10.240 -11.354 1.00 0.00 H new ATOM 201 N ALA A 12 -6.643 -8.116 -7.948 1.00 0.00 N ATOM 202 CA ALA A 12 -8.065 -8.232 -7.595 1.00 0.00 C ATOM 203 C ALA A 12 -8.540 -7.319 -6.462 1.00 0.00 C ATOM 204 O ALA A 12 -9.682 -6.865 -6.479 1.00 0.00 O ATOM 205 CB ALA A 12 -8.361 -9.698 -7.270 1.00 0.00 C ATOM 0 H ALA A 12 -6.002 -8.514 -7.262 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.629 -7.888 -8.462 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.413 -9.807 -7.005 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -8.141 -10.315 -8.141 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.741 -10.017 -6.432 1.00 0.00 H new ATOM 211 N GLY A 13 -7.663 -7.079 -5.492 1.00 0.00 N ATOM 212 CA GLY A 13 -7.966 -6.291 -4.287 1.00 0.00 C ATOM 213 C GLY A 13 -8.645 -7.103 -3.184 1.00 0.00 C ATOM 214 O GLY A 13 -9.468 -6.569 -2.441 1.00 0.00 O ATOM 0 H GLY A 13 -6.705 -7.429 -5.515 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.041 -5.866 -3.898 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.610 -5.455 -4.561 1.00 0.00 H new ATOM 218 N MET A 14 -8.235 -8.360 -3.034 1.00 0.00 N ATOM 219 CA MET A 14 -8.807 -9.263 -2.024 1.00 0.00 C ATOM 220 C MET A 14 -7.806 -9.832 -1.016 1.00 0.00 C ATOM 221 O MET A 14 -8.062 -9.760 0.185 1.00 0.00 O ATOM 222 CB MET A 14 -9.618 -10.400 -2.647 1.00 0.00 C ATOM 223 CG MET A 14 -8.862 -11.212 -3.701 1.00 0.00 C ATOM 224 SD MET A 14 -9.503 -12.904 -3.971 1.00 0.00 S ATOM 225 CE MET A 14 -11.121 -12.593 -4.646 1.00 0.00 C ATOM 0 H MET A 14 -7.502 -8.785 -3.602 1.00 0.00 H new ATOM 0 HA MET A 14 -9.473 -8.612 -1.458 1.00 0.00 H new ATOM 0 HB2 MET A 14 -9.946 -11.072 -1.854 1.00 0.00 H new ATOM 0 HB3 MET A 14 -10.516 -9.982 -3.103 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.893 -10.671 -4.647 1.00 0.00 H new ATOM 0 HG3 MET A 14 -7.815 -11.278 -3.406 1.00 0.00 H new ATOM 0 HE1 MET A 14 -11.617 -13.541 -4.854 1.00 0.00 H new ATOM 0 HE2 MET A 14 -11.712 -12.025 -3.928 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.026 -12.022 -5.570 1.00 0.00 H new ATOM 235 N SER A 15 -6.681 -10.367 -1.480 1.00 0.00 N ATOM 236 CA SER A 15 -5.674 -11.004 -0.619 1.00 0.00 C ATOM 237 C SER A 15 -5.024 -10.041 0.376 1.00 0.00 C ATOM 238 O SER A 15 -4.737 -10.386 1.521 1.00 0.00 O ATOM 239 CB SER A 15 -4.570 -11.636 -1.469 1.00 0.00 C ATOM 240 OG SER A 15 -5.149 -12.568 -2.385 1.00 0.00 O ATOM 0 H SER A 15 -6.435 -10.374 -2.470 1.00 0.00 H new ATOM 0 HA SER A 15 -6.211 -11.761 -0.047 1.00 0.00 H new ATOM 0 HB2 SER A 15 -4.028 -10.863 -2.014 1.00 0.00 H new ATOM 0 HB3 SER A 15 -3.847 -12.141 -0.828 1.00 0.00 H new ATOM 0 HG SER A 15 -4.443 -12.972 -2.931 1.00 0.00 H new ATOM 246 N THR A 16 -4.892 -8.790 -0.055 1.00 0.00 N ATOM 247 CA THR A 16 -4.340 -7.673 0.725 1.00 0.00 C ATOM 248 C THR A 16 -5.154 -7.276 1.958 1.00 0.00 C ATOM 249 O THR A 16 -4.565 -6.833 2.942 1.00 0.00 O ATOM 250 CB THR A 16 -4.234 -6.444 -0.181 1.00 0.00 C ATOM 251 OG1 THR A 16 -5.457 -6.343 -0.917 1.00 0.00 O ATOM 252 CG2 THR A 16 -3.014 -6.508 -1.101 1.00 0.00 C ATOM 0 H THR A 16 -5.176 -8.509 -0.994 1.00 0.00 H new ATOM 0 HA THR A 16 -3.374 -8.022 1.090 1.00 0.00 H new ATOM 0 HB THR A 16 -4.088 -5.549 0.424 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.362 -5.664 -1.617 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.981 -5.615 -1.725 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.107 -6.564 -0.499 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.083 -7.391 -1.736 1.00 0.00 H new ATOM 260 N SER A 17 -6.453 -7.565 1.979 1.00 0.00 N ATOM 261 CA SER A 17 -7.380 -7.050 2.997 1.00 0.00 C ATOM 262 C SER A 17 -7.044 -7.406 4.447 1.00 0.00 C ATOM 263 O SER A 17 -7.222 -6.585 5.346 1.00 0.00 O ATOM 264 CB SER A 17 -8.811 -7.503 2.703 1.00 0.00 C ATOM 265 OG SER A 17 -8.915 -8.916 2.892 1.00 0.00 O ATOM 0 H SER A 17 -6.900 -8.167 1.287 1.00 0.00 H new ATOM 0 HA SER A 17 -7.275 -5.968 2.920 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.509 -6.986 3.361 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.083 -7.242 1.680 1.00 0.00 H new ATOM 0 HG SER A 17 -8.677 -9.376 2.060 1.00 0.00 H new ATOM 271 N LEU A 18 -6.516 -8.608 4.661 1.00 0.00 N ATOM 272 CA LEU A 18 -6.086 -9.060 5.992 1.00 0.00 C ATOM 273 C LEU A 18 -4.849 -8.297 6.469 1.00 0.00 C ATOM 274 O LEU A 18 -4.815 -7.797 7.591 1.00 0.00 O ATOM 275 CB LEU A 18 -5.851 -10.571 6.035 1.00 0.00 C ATOM 276 CG LEU A 18 -5.342 -11.071 7.388 1.00 0.00 C ATOM 277 CD1 LEU A 18 -6.394 -10.962 8.495 1.00 0.00 C ATOM 278 CD2 LEU A 18 -4.863 -12.520 7.277 1.00 0.00 C ATOM 0 H LEU A 18 -6.372 -9.298 3.924 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.902 -8.839 6.681 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.783 -11.083 5.795 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.131 -10.841 5.263 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.509 -10.424 7.664 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.976 -11.331 9.432 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.689 -9.920 8.615 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.267 -11.558 8.227 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.504 -12.860 8.248 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.690 -13.153 6.954 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.054 -12.581 6.550 1.00 0.00 H new ATOM 290 N LEU A 19 -3.863 -8.149 5.588 1.00 0.00 N ATOM 291 CA LEU A 19 -2.664 -7.355 5.893 1.00 0.00 C ATOM 292 C LEU A 19 -3.011 -5.894 6.186 1.00 0.00 C ATOM 293 O LEU A 19 -2.509 -5.321 7.153 1.00 0.00 O ATOM 294 CB LEU A 19 -1.681 -7.453 4.725 1.00 0.00 C ATOM 295 CG LEU A 19 -0.232 -7.541 5.206 1.00 0.00 C ATOM 296 CD1 LEU A 19 0.659 -7.976 4.040 1.00 0.00 C ATOM 297 CD2 LEU A 19 0.317 -6.223 5.755 1.00 0.00 C ATOM 0 H LEU A 19 -3.865 -8.566 4.657 1.00 0.00 H new ATOM 0 HA LEU A 19 -2.202 -7.760 6.793 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.918 -8.331 4.124 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -1.797 -6.583 4.079 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.225 -8.263 6.022 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.694 -8.040 4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.334 -8.951 3.678 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.585 -7.246 3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.349 -6.364 6.076 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.280 -5.461 4.976 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.287 -5.903 6.604 1.00 0.00 H new ATOM 309 N VAL A 20 -4.013 -5.381 5.479 1.00 0.00 N ATOM 310 CA VAL A 20 -4.540 -4.019 5.651 1.00 0.00 C ATOM 311 C VAL A 20 -5.102 -3.843 7.063 1.00 0.00 C ATOM 312 O VAL A 20 -4.762 -2.877 7.744 1.00 0.00 O ATOM 313 CB VAL A 20 -5.605 -3.736 4.589 1.00 0.00 C ATOM 314 CG1 VAL A 20 -6.327 -2.398 4.759 1.00 0.00 C ATOM 315 CG2 VAL A 20 -4.975 -3.692 3.195 1.00 0.00 C ATOM 0 H VAL A 20 -4.497 -5.908 4.752 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.731 -3.300 5.522 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.323 -4.547 4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.064 -2.279 3.965 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -6.829 -2.376 5.726 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -5.603 -1.585 4.707 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.747 -3.490 2.453 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.223 -2.904 3.160 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.505 -4.651 2.978 1.00 0.00 H new ATOM 325 N SER A 21 -5.930 -4.782 7.510 1.00 0.00 N ATOM 326 CA SER A 21 -6.523 -4.689 8.852 1.00 0.00 C ATOM 327 C SER A 21 -5.517 -4.865 9.991 1.00 0.00 C ATOM 328 O SER A 21 -5.672 -4.280 11.062 1.00 0.00 O ATOM 329 CB SER A 21 -7.678 -5.680 9.018 1.00 0.00 C ATOM 330 OG SER A 21 -7.211 -7.023 8.864 1.00 0.00 O ATOM 0 H SER A 21 -6.206 -5.607 6.977 1.00 0.00 H new ATOM 0 HA SER A 21 -6.901 -3.669 8.926 1.00 0.00 H new ATOM 0 HB2 SER A 21 -8.132 -5.557 10.001 1.00 0.00 H new ATOM 0 HB3 SER A 21 -8.453 -5.471 8.281 1.00 0.00 H new ATOM 0 HG SER A 21 -6.319 -7.015 8.458 1.00 0.00 H new ATOM 336 N LYS A 22 -4.439 -5.593 9.712 1.00 0.00 N ATOM 337 CA LYS A 22 -3.303 -5.771 10.628 1.00 0.00 C ATOM 338 C LYS A 22 -2.558 -4.460 10.891 1.00 0.00 C ATOM 339 O LYS A 22 -2.266 -4.120 12.037 1.00 0.00 O ATOM 340 CB LYS A 22 -2.289 -6.772 10.070 1.00 0.00 C ATOM 341 CG LYS A 22 -2.791 -8.214 9.969 1.00 0.00 C ATOM 342 CD LYS A 22 -2.360 -9.057 11.172 1.00 0.00 C ATOM 343 CE LYS A 22 -2.787 -10.514 10.987 1.00 0.00 C ATOM 344 NZ LYS A 22 -2.247 -11.339 12.077 1.00 0.00 N ATOM 0 H LYS A 22 -4.323 -6.087 8.827 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.733 -6.140 11.559 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -1.982 -6.440 9.078 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.400 -6.756 10.701 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.879 -8.215 9.897 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -2.410 -8.667 9.054 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.278 -9.002 11.293 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -2.804 -8.655 12.083 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.875 -10.584 10.972 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -2.430 -10.887 10.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.542 -12.327 11.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.208 -11.284 12.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -2.608 -10.990 12.988 1.00 0.00 H new ATOM 358 N MET A 23 -2.326 -3.717 9.815 1.00 0.00 N ATOM 359 CA MET A 23 -1.655 -2.411 9.892 1.00 0.00 C ATOM 360 C MET A 23 -2.587 -1.239 10.210 1.00 0.00 C ATOM 361 O MET A 23 -2.110 -0.190 10.640 1.00 0.00 O ATOM 362 CB MET A 23 -0.780 -2.109 8.674 1.00 0.00 C ATOM 363 CG MET A 23 -1.466 -2.298 7.321 1.00 0.00 C ATOM 364 SD MET A 23 -0.326 -2.181 5.894 1.00 0.00 S ATOM 365 CE MET A 23 -0.029 -0.429 5.768 1.00 0.00 C ATOM 0 H MET A 23 -2.592 -3.993 8.870 1.00 0.00 H new ATOM 0 HA MET A 23 -0.993 -2.511 10.752 1.00 0.00 H new ATOM 0 HB2 MET A 23 -0.428 -1.080 8.745 1.00 0.00 H new ATOM 0 HB3 MET A 23 0.101 -2.750 8.710 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.955 -3.272 7.305 1.00 0.00 H new ATOM 0 HG3 MET A 23 -2.248 -1.547 7.212 1.00 0.00 H new ATOM 0 HE1 MET A 23 -0.420 -0.061 4.819 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.528 0.085 6.590 1.00 0.00 H new ATOM 0 HE3 MET A 23 1.043 -0.237 5.818 1.00 0.00 H new ATOM 375 N ARG A 24 -3.896 -1.459 10.119 1.00 0.00 N ATOM 376 CA ARG A 24 -4.893 -0.551 10.704 1.00 0.00 C ATOM 377 C ARG A 24 -4.901 -0.658 12.231 1.00 0.00 C ATOM 378 O ARG A 24 -4.756 0.356 12.913 1.00 0.00 O ATOM 379 CB ARG A 24 -6.331 -0.813 10.253 1.00 0.00 C ATOM 380 CG ARG A 24 -6.668 -0.366 8.829 1.00 0.00 C ATOM 381 CD ARG A 24 -8.190 -0.346 8.668 1.00 0.00 C ATOM 382 NE ARG A 24 -8.605 -0.403 7.259 1.00 0.00 N ATOM 383 CZ ARG A 24 -9.091 -1.484 6.635 1.00 0.00 C ATOM 384 NH1 ARG A 24 -9.191 -2.667 7.257 1.00 0.00 N ATOM 385 NH2 ARG A 24 -9.572 -1.389 5.388 1.00 0.00 N ATOM 0 H ARG A 24 -4.299 -2.265 9.642 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.587 0.435 10.354 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.530 -1.881 10.336 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.007 -0.308 10.943 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.255 0.624 8.636 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.220 -1.045 8.104 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.621 -1.191 9.205 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.589 0.559 9.125 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.515 0.452 6.711 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -8.893 -2.759 8.228 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.565 -3.475 6.759 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.570 -0.489 4.908 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -9.940 -2.216 4.919 1.00 0.00 H new ATOM 399 N ALA A 25 -4.802 -1.891 12.721 1.00 0.00 N ATOM 400 CA ALA A 25 -4.740 -2.169 14.162 1.00 0.00 C ATOM 401 C ALA A 25 -3.448 -1.650 14.797 1.00 0.00 C ATOM 402 O ALA A 25 -3.442 -1.115 15.903 1.00 0.00 O ATOM 403 CB ALA A 25 -4.867 -3.684 14.337 1.00 0.00 C ATOM 0 H ALA A 25 -4.762 -2.726 12.137 1.00 0.00 H new ATOM 0 HA ALA A 25 -5.551 -1.648 14.671 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -4.825 -3.933 15.397 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -5.818 -4.020 13.923 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.049 -4.180 13.816 1.00 0.00 H new ATOM 409 N GLN A 26 -2.350 -1.794 14.060 1.00 0.00 N ATOM 410 CA GLN A 26 -1.052 -1.231 14.458 1.00 0.00 C ATOM 411 C GLN A 26 -1.020 0.297 14.366 1.00 0.00 C ATOM 412 O GLN A 26 -0.478 0.941 15.262 1.00 0.00 O ATOM 413 CB GLN A 26 0.084 -1.830 13.627 1.00 0.00 C ATOM 414 CG GLN A 26 0.391 -3.288 13.977 1.00 0.00 C ATOM 415 CD GLN A 26 1.183 -3.427 15.279 1.00 0.00 C ATOM 416 OE1 GLN A 26 0.766 -3.065 16.378 1.00 0.00 O ATOM 417 NE2 GLN A 26 2.374 -4.015 15.216 1.00 0.00 N ATOM 0 H GLN A 26 -2.329 -2.300 13.175 1.00 0.00 H new ATOM 0 HA GLN A 26 -0.909 -1.498 15.505 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.176 -1.765 12.570 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.984 -1.232 13.772 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -0.544 -3.841 14.064 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.955 -3.742 13.163 1.00 0.00 H new ATOM 0 HE21 GLN A 26 2.743 -4.325 14.317 1.00 0.00 H new ATOM 0 HE22 GLN A 26 2.919 -4.156 16.067 1.00 0.00 H new ATOM 426 N ALA A 27 -1.720 0.852 13.380 1.00 0.00 N ATOM 427 CA ALA A 27 -1.893 2.307 13.257 1.00 0.00 C ATOM 428 C ALA A 27 -2.620 2.882 14.474 1.00 0.00 C ATOM 429 O ALA A 27 -2.081 3.783 15.114 1.00 0.00 O ATOM 430 CB ALA A 27 -2.676 2.638 11.985 1.00 0.00 C ATOM 0 H ALA A 27 -2.182 0.315 12.646 1.00 0.00 H new ATOM 0 HA ALA A 27 -0.903 2.759 13.203 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -2.798 3.718 11.904 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.132 2.268 11.116 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.657 2.164 12.028 1.00 0.00 H new ATOM 436 N GLU A 28 -3.671 2.194 14.912 1.00 0.00 N ATOM 437 CA GLU A 28 -4.470 2.583 16.083 1.00 0.00 C ATOM 438 C GLU A 28 -3.700 2.424 17.396 1.00 0.00 C ATOM 439 O GLU A 28 -3.817 3.258 18.292 1.00 0.00 O ATOM 440 CB GLU A 28 -5.740 1.731 16.117 1.00 0.00 C ATOM 441 CG GLU A 28 -6.716 2.120 15.005 1.00 0.00 C ATOM 442 CD GLU A 28 -7.932 1.194 14.935 1.00 0.00 C ATOM 443 OE1 GLU A 28 -8.937 1.530 15.598 1.00 0.00 O ATOM 444 OE2 GLU A 28 -7.868 0.235 14.137 1.00 0.00 O ATOM 0 H GLU A 28 -4.000 1.340 14.462 1.00 0.00 H new ATOM 0 HA GLU A 28 -4.717 3.640 15.988 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.474 0.679 16.016 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.228 1.845 17.085 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.053 3.144 15.165 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.195 2.102 14.048 1.00 0.00 H new ATOM 451 N LYS A 29 -2.832 1.417 17.450 1.00 0.00 N ATOM 452 CA LYS A 29 -1.938 1.185 18.594 1.00 0.00 C ATOM 453 C LYS A 29 -0.926 2.323 18.739 1.00 0.00 C ATOM 454 O LYS A 29 -0.699 2.829 19.836 1.00 0.00 O ATOM 455 CB LYS A 29 -1.226 -0.158 18.424 1.00 0.00 C ATOM 456 CG LYS A 29 -0.365 -0.487 19.645 1.00 0.00 C ATOM 457 CD LYS A 29 0.470 -1.755 19.448 1.00 0.00 C ATOM 458 CE LYS A 29 1.416 -2.015 20.623 1.00 0.00 C ATOM 459 NZ LYS A 29 2.444 -0.967 20.694 1.00 0.00 N ATOM 0 H LYS A 29 -2.724 0.733 16.701 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.534 1.158 19.506 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.963 -0.947 18.273 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -0.601 -0.131 17.532 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.298 0.352 19.855 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.008 -0.611 20.516 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.195 -2.610 19.324 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.050 -1.666 18.530 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.850 -2.042 21.554 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.889 -2.990 20.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.165 -1.234 21.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.892 -0.856 19.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.004 -0.068 20.976 1.00 0.00 H new ATOM 473 N TYR A 30 -0.244 2.621 17.637 1.00 0.00 N ATOM 474 CA TYR A 30 0.812 3.643 17.578 1.00 0.00 C ATOM 475 C TYR A 30 0.288 5.035 17.217 1.00 0.00 C ATOM 476 O TYR A 30 1.057 5.875 16.755 1.00 0.00 O ATOM 477 CB TYR A 30 1.877 3.186 16.579 1.00 0.00 C ATOM 478 CG TYR A 30 2.672 1.972 17.065 1.00 0.00 C ATOM 479 CD1 TYR A 30 3.597 2.119 18.092 1.00 0.00 C ATOM 480 CD2 TYR A 30 2.465 0.742 16.450 1.00 0.00 C ATOM 481 CE1 TYR A 30 4.330 1.017 18.517 1.00 0.00 C ATOM 482 CE2 TYR A 30 3.183 -0.367 16.879 1.00 0.00 C ATOM 483 CZ TYR A 30 4.106 -0.212 17.907 1.00 0.00 C ATOM 484 OH TYR A 30 4.619 -1.315 18.514 1.00 0.00 O ATOM 0 H TYR A 30 -0.407 2.156 16.744 1.00 0.00 H new ATOM 0 HA TYR A 30 1.240 3.742 18.575 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.397 2.943 15.631 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.564 4.010 16.387 1.00 0.00 H new ATOM 0 HD1 TYR A 30 3.745 3.083 18.557 1.00 0.00 H new ATOM 0 HD2 TYR A 30 1.751 0.650 15.645 1.00 0.00 H new ATOM 0 HE1 TYR A 30 5.060 1.114 19.307 1.00 0.00 H new ATOM 0 HE2 TYR A 30 3.027 -1.333 16.422 1.00 0.00 H new ATOM 0 HH TYR A 30 4.393 -2.112 17.990 1.00 0.00 H new ATOM 494 N GLU A 31 -0.991 5.267 17.499 1.00 0.00 N ATOM 495 CA GLU A 31 -1.771 6.470 17.174 1.00 0.00 C ATOM 496 C GLU A 31 -1.311 7.227 15.927 1.00 0.00 C ATOM 497 O GLU A 31 -0.866 8.374 15.923 1.00 0.00 O ATOM 498 CB GLU A 31 -1.944 7.352 18.412 1.00 0.00 C ATOM 499 CG GLU A 31 -0.639 7.817 19.061 1.00 0.00 C ATOM 500 CD GLU A 31 -0.851 8.635 20.337 1.00 0.00 C ATOM 501 OE1 GLU A 31 -1.778 9.473 20.362 1.00 0.00 O ATOM 502 OE2 GLU A 31 -0.054 8.412 21.274 1.00 0.00 O ATOM 0 H GLU A 31 -1.554 4.575 17.995 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.760 6.121 16.878 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.528 8.230 18.136 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.525 6.803 19.153 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.028 6.945 19.295 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.079 8.416 18.343 1.00 0.00 H new ATOM 509 N VAL A 32 -1.460 6.522 14.810 1.00 0.00 N ATOM 510 CA VAL A 32 -1.114 7.003 13.464 1.00 0.00 C ATOM 511 C VAL A 32 -2.429 7.238 12.719 1.00 0.00 C ATOM 512 O VAL A 32 -3.076 6.278 12.305 1.00 0.00 O ATOM 513 CB VAL A 32 -0.232 5.989 12.733 1.00 0.00 C ATOM 514 CG1 VAL A 32 0.270 6.535 11.395 1.00 0.00 C ATOM 515 CG2 VAL A 32 0.997 5.559 13.538 1.00 0.00 C ATOM 0 H VAL A 32 -1.835 5.573 14.809 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.540 7.928 13.519 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.880 5.126 12.582 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.893 5.785 10.907 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.581 6.772 10.756 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.857 7.437 11.567 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.577 4.840 12.960 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.613 6.431 13.755 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.677 5.099 14.473 1.00 0.00 H new ATOM 525 N PRO A 33 -2.837 8.491 12.532 1.00 0.00 N ATOM 526 CA PRO A 33 -4.099 8.815 11.852 1.00 0.00 C ATOM 527 C PRO A 33 -4.000 8.638 10.335 1.00 0.00 C ATOM 528 O PRO A 33 -3.649 9.537 9.572 1.00 0.00 O ATOM 529 CB PRO A 33 -4.408 10.251 12.281 1.00 0.00 C ATOM 530 CG PRO A 33 -3.027 10.865 12.515 1.00 0.00 C ATOM 531 CD PRO A 33 -2.199 9.703 13.068 1.00 0.00 C ATOM 0 HA PRO A 33 -4.908 8.140 12.130 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -4.960 10.789 11.510 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -5.016 10.277 13.185 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.601 11.255 11.591 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -3.073 11.695 13.220 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.158 9.774 12.751 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.201 9.701 14.158 1.00 0.00 H new ATOM 539 N VAL A 34 -4.402 7.446 9.904 1.00 0.00 N ATOM 540 CA VAL A 34 -4.308 7.014 8.502 1.00 0.00 C ATOM 541 C VAL A 34 -5.507 6.198 8.012 1.00 0.00 C ATOM 542 O VAL A 34 -6.246 5.580 8.777 1.00 0.00 O ATOM 543 CB VAL A 34 -3.021 6.246 8.200 1.00 0.00 C ATOM 544 CG1 VAL A 34 -1.800 7.169 8.215 1.00 0.00 C ATOM 545 CG2 VAL A 34 -2.770 5.072 9.149 1.00 0.00 C ATOM 0 H VAL A 34 -4.807 6.741 10.520 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.301 7.954 7.949 1.00 0.00 H new ATOM 0 HB VAL A 34 -3.166 5.837 7.200 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.903 6.589 7.996 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.922 7.946 7.461 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.704 7.629 9.198 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.840 4.574 8.874 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.696 5.441 10.172 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.595 4.364 9.078 1.00 0.00 H new ATOM 555 N ILE A 35 -5.693 6.317 6.701 1.00 0.00 N ATOM 556 CA ILE A 35 -6.701 5.614 5.893 1.00 0.00 C ATOM 557 C ILE A 35 -5.956 4.589 5.034 1.00 0.00 C ATOM 558 O ILE A 35 -5.252 4.936 4.087 1.00 0.00 O ATOM 559 CB ILE A 35 -7.487 6.616 5.044 1.00 0.00 C ATOM 560 CG1 ILE A 35 -8.238 7.647 5.890 1.00 0.00 C ATOM 561 CG2 ILE A 35 -8.426 5.947 4.039 1.00 0.00 C ATOM 562 CD1 ILE A 35 -9.293 7.115 6.862 1.00 0.00 C ATOM 0 H ILE A 35 -5.115 6.940 6.136 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.430 5.101 6.520 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.732 7.151 4.468 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -7.504 8.213 6.464 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -8.725 8.350 5.214 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.953 6.712 3.469 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.846 5.323 3.359 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.149 5.329 4.572 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.748 7.949 7.397 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -10.062 6.578 6.306 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.822 6.439 7.576 1.00 0.00 H new ATOM 574 N ILE A 36 -6.122 3.328 5.424 1.00 0.00 N ATOM 575 CA ILE A 36 -5.478 2.202 4.732 1.00 0.00 C ATOM 576 C ILE A 36 -6.571 1.371 4.057 1.00 0.00 C ATOM 577 O ILE A 36 -7.365 0.720 4.735 1.00 0.00 O ATOM 578 CB ILE A 36 -4.631 1.352 5.682 1.00 0.00 C ATOM 579 CG1 ILE A 36 -3.684 2.218 6.516 1.00 0.00 C ATOM 580 CG2 ILE A 36 -3.822 0.334 4.877 1.00 0.00 C ATOM 581 CD1 ILE A 36 -3.161 1.533 7.780 1.00 0.00 C ATOM 0 H ILE A 36 -6.699 3.054 6.219 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.787 2.586 3.982 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.305 0.835 6.365 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.836 2.510 5.897 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.202 3.134 6.800 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.220 -0.270 5.555 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.501 -0.313 4.321 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.168 0.858 4.180 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.497 2.213 8.314 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.000 1.265 8.422 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.613 0.632 7.505 1.00 0.00 H new ATOM 593 N GLU A 37 -6.532 1.392 2.728 1.00 0.00 N ATOM 594 CA GLU A 37 -7.519 0.742 1.854 1.00 0.00 C ATOM 595 C GLU A 37 -6.860 0.005 0.685 1.00 0.00 C ATOM 596 O GLU A 37 -5.815 0.404 0.176 1.00 0.00 O ATOM 597 CB GLU A 37 -8.488 1.767 1.264 1.00 0.00 C ATOM 598 CG GLU A 37 -9.394 2.449 2.292 1.00 0.00 C ATOM 599 CD GLU A 37 -10.330 1.483 3.023 1.00 0.00 C ATOM 600 OE1 GLU A 37 -10.912 0.600 2.355 1.00 0.00 O ATOM 601 OE2 GLU A 37 -10.390 1.582 4.267 1.00 0.00 O ATOM 0 H GLU A 37 -5.796 1.872 2.210 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.049 0.027 2.483 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -7.914 2.532 0.741 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.112 1.272 0.520 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.773 2.964 3.025 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -9.991 3.209 1.789 1.00 0.00 H new ATOM 608 N ALA A 38 -7.528 -1.071 0.277 1.00 0.00 N ATOM 609 CA ALA A 38 -7.085 -1.927 -0.834 1.00 0.00 C ATOM 610 C ALA A 38 -7.988 -1.828 -2.065 1.00 0.00 C ATOM 611 O ALA A 38 -9.207 -1.717 -1.947 1.00 0.00 O ATOM 612 CB ALA A 38 -7.004 -3.380 -0.362 1.00 0.00 C ATOM 0 H ALA A 38 -8.399 -1.381 0.708 1.00 0.00 H new ATOM 0 HA ALA A 38 -6.101 -1.571 -1.138 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -6.676 -4.013 -1.187 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -6.292 -3.456 0.460 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -7.987 -3.708 -0.022 1.00 0.00 H new ATOM 618 N PHE A 39 -7.345 -1.814 -3.229 1.00 0.00 N ATOM 619 CA PHE A 39 -7.998 -1.674 -4.539 1.00 0.00 C ATOM 620 C PHE A 39 -7.346 -2.525 -5.629 1.00 0.00 C ATOM 621 O PHE A 39 -6.150 -2.797 -5.539 1.00 0.00 O ATOM 622 CB PHE A 39 -7.946 -0.213 -4.992 1.00 0.00 C ATOM 623 CG PHE A 39 -8.669 0.784 -4.084 1.00 0.00 C ATOM 624 CD1 PHE A 39 -10.050 0.913 -4.170 1.00 0.00 C ATOM 625 CD2 PHE A 39 -7.935 1.584 -3.216 1.00 0.00 C ATOM 626 CE1 PHE A 39 -10.709 1.843 -3.372 1.00 0.00 C ATOM 627 CE2 PHE A 39 -8.588 2.520 -2.425 1.00 0.00 C ATOM 628 CZ PHE A 39 -9.972 2.640 -2.505 1.00 0.00 C ATOM 0 H PHE A 39 -6.331 -1.901 -3.296 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.024 -2.017 -4.405 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -6.901 0.087 -5.073 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -8.375 -0.145 -5.992 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -10.610 0.293 -4.854 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -6.862 1.478 -3.157 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -11.783 1.944 -3.426 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -8.026 3.151 -1.752 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.480 3.363 -1.884 1.00 0.00 H new ATOM 638 N PRO A 40 -8.094 -2.941 -6.648 1.00 0.00 N ATOM 639 CA PRO A 40 -7.512 -3.533 -7.862 1.00 0.00 C ATOM 640 C PRO A 40 -6.698 -2.534 -8.687 1.00 0.00 C ATOM 641 O PRO A 40 -6.960 -1.332 -8.679 1.00 0.00 O ATOM 642 CB PRO A 40 -8.669 -4.117 -8.676 1.00 0.00 C ATOM 643 CG PRO A 40 -9.936 -3.530 -8.051 1.00 0.00 C ATOM 644 CD PRO A 40 -9.546 -3.160 -6.619 1.00 0.00 C ATOM 0 HA PRO A 40 -6.799 -4.308 -7.580 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.587 -3.845 -9.728 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.674 -5.206 -8.628 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -10.278 -2.655 -8.604 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -10.751 -4.253 -8.062 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -10.071 -2.263 -6.289 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -9.808 -3.957 -5.923 1.00 0.00 H new ATOM 652 N GLU A 41 -5.751 -3.091 -9.436 1.00 0.00 N ATOM 653 CA GLU A 41 -4.768 -2.364 -10.252 1.00 0.00 C ATOM 654 C GLU A 41 -5.386 -1.487 -11.343 1.00 0.00 C ATOM 655 O GLU A 41 -4.812 -0.475 -11.742 1.00 0.00 O ATOM 656 CB GLU A 41 -3.741 -3.331 -10.846 1.00 0.00 C ATOM 657 CG GLU A 41 -4.086 -3.998 -12.179 1.00 0.00 C ATOM 658 CD GLU A 41 -5.096 -5.145 -12.112 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.290 -4.844 -11.893 1.00 0.00 O ATOM 660 OE2 GLU A 41 -4.641 -6.271 -12.408 1.00 0.00 O ATOM 0 H GLU A 41 -5.638 -4.103 -9.498 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.268 -1.675 -9.572 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.804 -2.789 -10.974 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.557 -4.118 -10.114 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.475 -3.236 -12.854 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.165 -4.376 -12.623 1.00 0.00 H new ATOM 667 N THR A 42 -6.613 -1.815 -11.738 1.00 0.00 N ATOM 668 CA THR A 42 -7.430 -1.062 -12.701 1.00 0.00 C ATOM 669 C THR A 42 -7.723 0.371 -12.251 1.00 0.00 C ATOM 670 O THR A 42 -7.724 1.305 -13.051 1.00 0.00 O ATOM 671 CB THR A 42 -8.767 -1.769 -12.929 1.00 0.00 C ATOM 672 OG1 THR A 42 -9.405 -1.997 -11.670 1.00 0.00 O ATOM 673 CG2 THR A 42 -8.593 -3.064 -13.724 1.00 0.00 C ATOM 0 H THR A 42 -7.090 -2.645 -11.385 1.00 0.00 H new ATOM 0 HA THR A 42 -6.845 -1.018 -13.619 1.00 0.00 H new ATOM 0 HB THR A 42 -9.408 -1.126 -13.532 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.263 -2.448 -11.815 1.00 0.00 H new ATOM 0 HG21 THR A 42 -9.565 -3.537 -13.866 1.00 0.00 H new ATOM 0 HG22 THR A 42 -8.154 -2.838 -14.696 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.936 -3.741 -13.178 1.00 0.00 H new ATOM 681 N LEU A 43 -7.807 0.540 -10.935 1.00 0.00 N ATOM 682 CA LEU A 43 -8.083 1.828 -10.281 1.00 0.00 C ATOM 683 C LEU A 43 -6.820 2.524 -9.769 1.00 0.00 C ATOM 684 O LEU A 43 -6.884 3.448 -8.960 1.00 0.00 O ATOM 685 CB LEU A 43 -9.051 1.583 -9.123 1.00 0.00 C ATOM 686 CG LEU A 43 -10.411 1.046 -9.573 1.00 0.00 C ATOM 687 CD1 LEU A 43 -11.207 0.577 -8.354 1.00 0.00 C ATOM 688 CD2 LEU A 43 -11.226 2.102 -10.323 1.00 0.00 C ATOM 0 H LEU A 43 -7.683 -0.227 -10.274 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.519 2.495 -11.024 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.601 0.875 -8.427 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.199 2.516 -8.579 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.225 0.215 -10.253 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.175 0.195 -8.677 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.657 -0.213 -7.843 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.356 1.415 -7.673 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -12.184 1.677 -10.623 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.398 2.959 -9.672 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.678 2.423 -11.209 1.00 0.00 H new ATOM 700 N ALA A 44 -5.687 2.143 -10.353 1.00 0.00 N ATOM 701 CA ALA A 44 -4.372 2.703 -10.009 1.00 0.00 C ATOM 702 C ALA A 44 -4.277 4.204 -10.294 1.00 0.00 C ATOM 703 O ALA A 44 -4.061 4.960 -9.348 1.00 0.00 O ATOM 704 CB ALA A 44 -3.248 1.960 -10.735 1.00 0.00 C ATOM 0 H ALA A 44 -5.649 1.433 -11.084 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.254 2.566 -8.934 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.287 2.396 -10.461 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.264 0.908 -10.450 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.392 2.046 -11.812 1.00 0.00 H new ATOM 710 N GLY A 45 -4.686 4.607 -11.493 1.00 0.00 N ATOM 711 CA GLY A 45 -4.717 6.017 -11.906 1.00 0.00 C ATOM 712 C GLY A 45 -5.653 6.843 -11.020 1.00 0.00 C ATOM 713 O GLY A 45 -5.195 7.589 -10.157 1.00 0.00 O ATOM 0 H GLY A 45 -5.009 3.963 -12.215 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.710 6.433 -11.860 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.043 6.086 -12.944 1.00 0.00 H new ATOM 717 N GLU A 46 -6.902 6.386 -11.007 1.00 0.00 N ATOM 718 CA GLU A 46 -8.032 7.109 -10.405 1.00 0.00 C ATOM 719 C GLU A 46 -7.883 7.333 -8.899 1.00 0.00 C ATOM 720 O GLU A 46 -7.888 8.454 -8.394 1.00 0.00 O ATOM 721 CB GLU A 46 -9.301 6.311 -10.711 1.00 0.00 C ATOM 722 CG GLU A 46 -10.596 7.102 -10.514 1.00 0.00 C ATOM 723 CD GLU A 46 -10.710 8.255 -11.513 1.00 0.00 C ATOM 724 OE1 GLU A 46 -10.908 7.949 -12.709 1.00 0.00 O ATOM 725 OE2 GLU A 46 -10.599 9.408 -11.042 1.00 0.00 O ATOM 0 H GLU A 46 -7.167 5.491 -11.419 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.074 8.109 -10.837 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.256 5.958 -11.741 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.326 5.428 -10.072 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -11.451 6.435 -10.628 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.632 7.495 -9.498 1.00 0.00 H new ATOM 732 N LYS A 47 -7.646 6.243 -8.175 1.00 0.00 N ATOM 733 CA LYS A 47 -7.507 6.284 -6.712 1.00 0.00 C ATOM 734 C LYS A 47 -6.130 6.735 -6.222 1.00 0.00 C ATOM 735 O LYS A 47 -6.041 7.456 -5.229 1.00 0.00 O ATOM 736 CB LYS A 47 -7.845 4.930 -6.086 1.00 0.00 C ATOM 737 CG LYS A 47 -9.330 4.570 -6.158 1.00 0.00 C ATOM 738 CD LYS A 47 -10.195 5.521 -5.330 1.00 0.00 C ATOM 739 CE LYS A 47 -11.668 5.114 -5.406 1.00 0.00 C ATOM 740 NZ LYS A 47 -12.443 6.080 -4.615 1.00 0.00 N ATOM 0 H LYS A 47 -7.545 5.311 -8.576 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.222 7.040 -6.387 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.268 4.154 -6.588 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.532 4.935 -5.042 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.658 4.595 -7.197 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.472 3.549 -5.803 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.863 5.512 -4.292 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -10.075 6.541 -5.695 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -12.009 5.107 -6.441 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.806 4.105 -5.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.451 5.827 -4.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.115 6.063 -3.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.312 7.034 -5.007 1.00 0.00 H new ATOM 754 N GLY A 48 -5.100 6.418 -7.002 1.00 0.00 N ATOM 755 CA GLY A 48 -3.704 6.799 -6.742 1.00 0.00 C ATOM 756 C GLY A 48 -3.481 8.312 -6.686 1.00 0.00 C ATOM 757 O GLY A 48 -2.565 8.773 -6.007 1.00 0.00 O ATOM 0 H GLY A 48 -5.211 5.874 -7.858 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -3.386 6.358 -5.797 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -3.070 6.375 -7.521 1.00 0.00 H new ATOM 761 N GLN A 49 -4.410 9.066 -7.268 1.00 0.00 N ATOM 762 CA GLN A 49 -4.413 10.536 -7.250 1.00 0.00 C ATOM 763 C GLN A 49 -4.468 11.126 -5.840 1.00 0.00 C ATOM 764 O GLN A 49 -3.837 12.142 -5.552 1.00 0.00 O ATOM 765 CB GLN A 49 -5.620 11.101 -8.004 1.00 0.00 C ATOM 766 CG GLN A 49 -5.678 10.716 -9.484 1.00 0.00 C ATOM 767 CD GLN A 49 -4.530 11.234 -10.353 1.00 0.00 C ATOM 768 OE1 GLN A 49 -3.811 12.187 -10.057 1.00 0.00 O ATOM 769 NE2 GLN A 49 -4.394 10.632 -11.531 1.00 0.00 N ATOM 0 H GLN A 49 -5.200 8.669 -7.777 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.474 10.816 -7.727 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.532 10.757 -7.516 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.607 12.188 -7.924 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.701 9.629 -9.556 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -6.617 11.083 -9.899 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.992 9.842 -11.772 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.691 10.960 -12.193 1.00 0.00 H new ATOM 778 N ASN A 50 -5.154 10.402 -4.959 1.00 0.00 N ATOM 779 CA ASN A 50 -5.392 10.807 -3.567 1.00 0.00 C ATOM 780 C ASN A 50 -4.445 10.145 -2.564 1.00 0.00 C ATOM 781 O ASN A 50 -4.282 10.641 -1.451 1.00 0.00 O ATOM 782 CB ASN A 50 -6.828 10.460 -3.168 1.00 0.00 C ATOM 783 CG ASN A 50 -7.872 11.148 -4.049 1.00 0.00 C ATOM 784 OD1 ASN A 50 -7.757 12.304 -4.457 1.00 0.00 O ATOM 785 ND2 ASN A 50 -8.920 10.417 -4.417 1.00 0.00 N ATOM 0 H ASN A 50 -5.570 9.500 -5.192 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.211 11.881 -3.531 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.965 9.380 -3.226 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.991 10.747 -2.129 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.627 10.814 -5.036 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -9.017 9.459 -4.080 1.00 0.00 H new ATOM 792 N ALA A 51 -3.783 9.074 -2.993 1.00 0.00 N ATOM 793 CA ALA A 51 -2.820 8.347 -2.152 1.00 0.00 C ATOM 794 C ALA A 51 -1.550 9.172 -1.930 1.00 0.00 C ATOM 795 O ALA A 51 -1.065 9.849 -2.835 1.00 0.00 O ATOM 796 CB ALA A 51 -2.444 7.019 -2.812 1.00 0.00 C ATOM 0 H ALA A 51 -3.894 8.682 -3.928 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.293 8.161 -1.188 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.731 6.488 -2.181 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -3.339 6.410 -2.939 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.994 7.211 -3.786 1.00 0.00 H new ATOM 802 N ASP A 52 -1.119 9.170 -0.672 1.00 0.00 N ATOM 803 CA ASP A 52 0.161 9.759 -0.251 1.00 0.00 C ATOM 804 C ASP A 52 1.310 8.759 -0.396 1.00 0.00 C ATOM 805 O ASP A 52 2.464 9.166 -0.522 1.00 0.00 O ATOM 806 CB ASP A 52 0.095 10.288 1.184 1.00 0.00 C ATOM 807 CG ASP A 52 -0.855 11.479 1.325 1.00 0.00 C ATOM 808 OD1 ASP A 52 -0.502 12.559 0.804 1.00 0.00 O ATOM 809 OD2 ASP A 52 -1.861 11.303 2.047 1.00 0.00 O ATOM 0 H ASP A 52 -1.649 8.757 0.096 1.00 0.00 H new ATOM 0 HA ASP A 52 0.355 10.603 -0.913 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -0.230 9.487 1.849 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.094 10.584 1.505 1.00 0.00 H new ATOM 814 N VAL A 53 0.987 7.471 -0.329 1.00 0.00 N ATOM 815 CA VAL A 53 1.866 6.383 -0.781 1.00 0.00 C ATOM 816 C VAL A 53 1.011 5.238 -1.328 1.00 0.00 C ATOM 817 O VAL A 53 -0.090 4.959 -0.856 1.00 0.00 O ATOM 818 CB VAL A 53 2.831 5.944 0.322 1.00 0.00 C ATOM 819 CG1 VAL A 53 2.128 5.308 1.523 1.00 0.00 C ATOM 820 CG2 VAL A 53 3.905 5.000 -0.226 1.00 0.00 C ATOM 0 H VAL A 53 0.097 7.143 0.045 1.00 0.00 H new ATOM 0 HA VAL A 53 2.501 6.740 -1.592 1.00 0.00 H new ATOM 0 HB VAL A 53 3.307 6.856 0.682 1.00 0.00 H new ATOM 0 HG11 VAL A 53 2.870 5.020 2.268 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.434 6.026 1.961 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.579 4.425 1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.576 4.705 0.581 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.430 4.113 -0.646 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.474 5.509 -1.004 1.00 0.00 H new ATOM 830 N VAL A 54 1.529 4.669 -2.412 1.00 0.00 N ATOM 831 CA VAL A 54 0.969 3.487 -3.083 1.00 0.00 C ATOM 832 C VAL A 54 1.919 2.318 -2.816 1.00 0.00 C ATOM 833 O VAL A 54 3.133 2.404 -2.997 1.00 0.00 O ATOM 834 CB VAL A 54 0.854 3.770 -4.582 1.00 0.00 C ATOM 835 CG1 VAL A 54 0.375 2.565 -5.393 1.00 0.00 C ATOM 836 CG2 VAL A 54 -0.105 4.928 -4.870 1.00 0.00 C ATOM 0 H VAL A 54 2.372 5.022 -2.865 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.026 3.246 -2.709 1.00 0.00 H new ATOM 0 HB VAL A 54 1.869 4.024 -4.889 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.316 2.836 -6.447 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.077 1.741 -5.269 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.610 2.258 -5.042 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.159 5.097 -5.945 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.097 4.682 -4.491 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.257 5.831 -4.378 1.00 0.00 H new ATOM 846 N LEU A 55 1.310 1.254 -2.299 1.00 0.00 N ATOM 847 CA LEU A 55 2.016 0.000 -1.997 1.00 0.00 C ATOM 848 C LEU A 55 1.496 -1.153 -2.857 1.00 0.00 C ATOM 849 O LEU A 55 0.315 -1.494 -2.855 1.00 0.00 O ATOM 850 CB LEU A 55 1.885 -0.346 -0.511 1.00 0.00 C ATOM 851 CG LEU A 55 2.641 0.631 0.392 1.00 0.00 C ATOM 852 CD1 LEU A 55 2.211 0.396 1.842 1.00 0.00 C ATOM 853 CD2 LEU A 55 4.159 0.472 0.285 1.00 0.00 C ATOM 0 H LEU A 55 0.315 1.231 -2.076 1.00 0.00 H new ATOM 0 HA LEU A 55 3.070 0.148 -2.233 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.831 -0.348 -0.234 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.261 -1.355 -0.343 1.00 0.00 H new ATOM 0 HG LEU A 55 2.396 1.642 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.743 1.087 2.496 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.138 0.563 1.935 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.445 -0.629 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.647 1.188 0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.440 -0.540 0.576 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.472 0.654 -0.743 1.00 0.00 H new ATOM 865 N LEU A 56 2.444 -1.742 -3.581 1.00 0.00 N ATOM 866 CA LEU A 56 2.173 -2.817 -4.548 1.00 0.00 C ATOM 867 C LEU A 56 2.497 -4.198 -3.973 1.00 0.00 C ATOM 868 O LEU A 56 3.468 -4.388 -3.243 1.00 0.00 O ATOM 869 CB LEU A 56 3.027 -2.659 -5.808 1.00 0.00 C ATOM 870 CG LEU A 56 2.880 -1.306 -6.507 1.00 0.00 C ATOM 871 CD1 LEU A 56 3.944 -1.185 -7.600 1.00 0.00 C ATOM 872 CD2 LEU A 56 1.500 -1.119 -7.141 1.00 0.00 C ATOM 0 H LEU A 56 3.430 -1.490 -3.517 1.00 0.00 H new ATOM 0 HA LEU A 56 1.111 -2.741 -4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.074 -2.805 -5.543 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.763 -3.448 -6.512 1.00 0.00 H new ATOM 0 HG LEU A 56 3.005 -0.534 -5.748 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.843 -0.222 -8.101 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.935 -1.259 -7.153 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.813 -1.987 -8.326 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.450 -0.143 -7.623 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.332 -1.899 -7.883 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.733 -1.182 -6.369 1.00 0.00 H new ATOM 884 N GLY A 57 1.634 -5.140 -4.343 1.00 0.00 N ATOM 885 CA GLY A 57 1.850 -6.577 -4.117 1.00 0.00 C ATOM 886 C GLY A 57 3.080 -7.066 -4.886 1.00 0.00 C ATOM 887 O GLY A 57 3.257 -6.649 -6.029 1.00 0.00 O ATOM 0 H GLY A 57 0.754 -4.931 -4.814 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.981 -6.767 -3.052 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.970 -7.137 -4.434 1.00 0.00 H new ATOM 891 N PRO A 58 3.858 -7.999 -4.345 1.00 0.00 N ATOM 892 CA PRO A 58 5.035 -8.539 -5.040 1.00 0.00 C ATOM 893 C PRO A 58 4.724 -9.207 -6.381 1.00 0.00 C ATOM 894 O PRO A 58 5.529 -9.167 -7.308 1.00 0.00 O ATOM 895 CB PRO A 58 5.697 -9.507 -4.057 1.00 0.00 C ATOM 896 CG PRO A 58 4.606 -9.834 -3.036 1.00 0.00 C ATOM 897 CD PRO A 58 3.759 -8.561 -2.990 1.00 0.00 C ATOM 0 HA PRO A 58 5.701 -7.722 -5.318 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.048 -10.406 -4.563 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.564 -9.053 -3.578 1.00 0.00 H new ATOM 0 HG2 PRO A 58 4.015 -10.697 -3.344 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.029 -10.069 -2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 58 2.725 -8.783 -2.728 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.135 -7.862 -2.243 1.00 0.00 H new ATOM 905 N GLN A 59 3.490 -9.681 -6.528 1.00 0.00 N ATOM 906 CA GLN A 59 2.953 -10.255 -7.770 1.00 0.00 C ATOM 907 C GLN A 59 2.777 -9.249 -8.909 1.00 0.00 C ATOM 908 O GLN A 59 2.960 -9.602 -10.073 1.00 0.00 O ATOM 909 CB GLN A 59 1.639 -11.002 -7.535 1.00 0.00 C ATOM 910 CG GLN A 59 0.574 -10.244 -6.739 1.00 0.00 C ATOM 911 CD GLN A 59 0.655 -10.482 -5.229 1.00 0.00 C ATOM 912 OE1 GLN A 59 1.703 -10.747 -4.644 1.00 0.00 O ATOM 913 NE2 GLN A 59 -0.464 -10.302 -4.533 1.00 0.00 N ATOM 0 H GLN A 59 2.811 -9.679 -5.767 1.00 0.00 H new ATOM 0 HA GLN A 59 3.720 -10.960 -8.090 1.00 0.00 H new ATOM 0 HB2 GLN A 59 1.218 -11.271 -8.504 1.00 0.00 H new ATOM 0 HB3 GLN A 59 1.861 -11.933 -7.014 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.675 -9.177 -6.936 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.413 -10.541 -7.093 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.335 -10.082 -5.016 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.451 -10.384 -3.516 1.00 0.00 H new ATOM 922 N ILE A 60 2.542 -7.986 -8.566 1.00 0.00 N ATOM 923 CA ILE A 60 2.454 -6.914 -9.568 1.00 0.00 C ATOM 924 C ILE A 60 3.607 -5.914 -9.446 1.00 0.00 C ATOM 925 O ILE A 60 3.575 -4.813 -9.989 1.00 0.00 O ATOM 926 CB ILE A 60 1.102 -6.197 -9.563 1.00 0.00 C ATOM 927 CG1 ILE A 60 0.810 -5.471 -8.248 1.00 0.00 C ATOM 928 CG2 ILE A 60 -0.014 -7.181 -9.920 1.00 0.00 C ATOM 929 CD1 ILE A 60 -0.127 -4.281 -8.462 1.00 0.00 C ATOM 0 H ILE A 60 2.408 -7.674 -7.604 1.00 0.00 H new ATOM 0 HA ILE A 60 2.543 -7.410 -10.534 1.00 0.00 H new ATOM 0 HB ILE A 60 1.147 -5.418 -10.324 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.361 -6.166 -7.539 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.745 -5.125 -7.807 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.972 -6.662 -9.914 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.169 -7.594 -10.912 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.034 -7.989 -9.189 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.313 -3.788 -7.508 1.00 0.00 H new ATOM 0 HD12 ILE A 60 0.334 -3.574 -9.151 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.071 -4.632 -8.880 1.00 0.00 H new ATOM 941 N ALA A 61 4.714 -6.398 -8.891 1.00 0.00 N ATOM 942 CA ALA A 61 5.934 -5.603 -8.687 1.00 0.00 C ATOM 943 C ALA A 61 6.664 -5.264 -9.988 1.00 0.00 C ATOM 944 O ALA A 61 7.278 -4.204 -10.106 1.00 0.00 O ATOM 945 CB ALA A 61 6.899 -6.367 -7.778 1.00 0.00 C ATOM 0 H ALA A 61 4.797 -7.361 -8.565 1.00 0.00 H new ATOM 0 HA ALA A 61 5.615 -4.664 -8.234 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.803 -5.776 -7.628 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.423 -6.552 -6.815 1.00 0.00 H new ATOM 0 HB3 ALA A 61 7.160 -7.318 -8.242 1.00 0.00 H new ATOM 951 N TYR A 62 6.518 -6.148 -10.970 1.00 0.00 N ATOM 952 CA TYR A 62 7.036 -5.925 -12.328 1.00 0.00 C ATOM 953 C TYR A 62 6.412 -4.702 -13.004 1.00 0.00 C ATOM 954 O TYR A 62 7.059 -4.074 -13.841 1.00 0.00 O ATOM 955 CB TYR A 62 6.859 -7.184 -13.179 1.00 0.00 C ATOM 956 CG TYR A 62 5.427 -7.476 -13.631 1.00 0.00 C ATOM 957 CD1 TYR A 62 4.494 -7.984 -12.734 1.00 0.00 C ATOM 958 CD2 TYR A 62 5.101 -7.230 -14.960 1.00 0.00 C ATOM 959 CE1 TYR A 62 3.197 -8.230 -13.169 1.00 0.00 C ATOM 960 CE2 TYR A 62 3.809 -7.491 -15.403 1.00 0.00 C ATOM 961 CZ TYR A 62 2.875 -7.980 -14.497 1.00 0.00 C ATOM 962 OH TYR A 62 1.614 -8.228 -14.940 1.00 0.00 O ATOM 0 H TYR A 62 6.038 -7.041 -10.853 1.00 0.00 H new ATOM 0 HA TYR A 62 8.101 -5.712 -12.237 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.490 -7.096 -14.063 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.224 -8.040 -12.611 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.774 -8.185 -11.711 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.843 -6.840 -15.641 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.452 -8.609 -12.486 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.536 -7.317 -16.433 1.00 0.00 H new ATOM 0 HH TYR A 62 1.551 -8.000 -15.891 1.00 0.00 H new ATOM 972 N MET A 63 5.216 -4.318 -12.569 1.00 0.00 N ATOM 973 CA MET A 63 4.527 -3.122 -13.076 1.00 0.00 C ATOM 974 C MET A 63 4.878 -1.827 -12.340 1.00 0.00 C ATOM 975 O MET A 63 4.349 -0.778 -12.706 1.00 0.00 O ATOM 976 CB MET A 63 3.014 -3.342 -13.016 1.00 0.00 C ATOM 977 CG MET A 63 2.513 -4.289 -14.107 1.00 0.00 C ATOM 978 SD MET A 63 0.732 -4.119 -14.495 1.00 0.00 S ATOM 979 CE MET A 63 -0.049 -4.569 -12.959 1.00 0.00 C ATOM 0 H MET A 63 4.692 -4.823 -11.855 1.00 0.00 H new ATOM 0 HA MET A 63 4.872 -2.990 -14.102 1.00 0.00 H new ATOM 0 HB2 MET A 63 2.748 -3.746 -12.039 1.00 0.00 H new ATOM 0 HB3 MET A 63 2.507 -2.382 -13.113 1.00 0.00 H new ATOM 0 HG2 MET A 63 3.089 -4.114 -15.016 1.00 0.00 H new ATOM 0 HG3 MET A 63 2.709 -5.316 -13.798 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.063 -4.917 -13.155 1.00 0.00 H new ATOM 0 HE2 MET A 63 0.522 -5.364 -12.480 1.00 0.00 H new ATOM 0 HE3 MET A 63 -0.084 -3.701 -12.301 1.00 0.00 H new ATOM 989 N LEU A 64 5.852 -1.832 -11.434 1.00 0.00 N ATOM 990 CA LEU A 64 6.342 -0.607 -10.785 1.00 0.00 C ATOM 991 C LEU A 64 6.703 0.510 -11.766 1.00 0.00 C ATOM 992 O LEU A 64 6.137 1.589 -11.599 1.00 0.00 O ATOM 993 CB LEU A 64 7.460 -0.969 -9.806 1.00 0.00 C ATOM 994 CG LEU A 64 8.083 0.270 -9.161 1.00 0.00 C ATOM 995 CD1 LEU A 64 7.195 0.882 -8.075 1.00 0.00 C ATOM 996 CD2 LEU A 64 9.465 -0.038 -8.584 1.00 0.00 C ATOM 0 H LEU A 64 6.327 -2.681 -11.126 1.00 0.00 H new ATOM 0 HA LEU A 64 5.524 -0.168 -10.214 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.063 -1.621 -9.028 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.232 -1.532 -10.330 1.00 0.00 H new ATOM 0 HG LEU A 64 8.183 1.005 -9.960 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.688 1.758 -7.653 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.240 1.177 -8.510 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.024 0.147 -7.288 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.880 0.863 -8.133 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.377 -0.816 -7.826 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.124 -0.381 -9.381 1.00 0.00 H new ATOM 1008 N PRO A 65 7.429 0.282 -12.858 1.00 0.00 N ATOM 1009 CA PRO A 65 7.683 1.326 -13.862 1.00 0.00 C ATOM 1010 C PRO A 65 6.438 1.827 -14.597 1.00 0.00 C ATOM 1011 O PRO A 65 6.355 3.016 -14.902 1.00 0.00 O ATOM 1012 CB PRO A 65 8.686 0.728 -14.851 1.00 0.00 C ATOM 1013 CG PRO A 65 8.533 -0.783 -14.671 1.00 0.00 C ATOM 1014 CD PRO A 65 8.208 -0.921 -13.182 1.00 0.00 C ATOM 0 HA PRO A 65 8.062 2.212 -13.353 1.00 0.00 H new ATOM 0 HB2 PRO A 65 8.466 1.032 -15.874 1.00 0.00 H new ATOM 0 HB3 PRO A 65 9.703 1.054 -14.633 1.00 0.00 H new ATOM 0 HG2 PRO A 65 7.737 -1.185 -15.297 1.00 0.00 H new ATOM 0 HG3 PRO A 65 9.446 -1.316 -14.936 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.637 -1.828 -12.984 1.00 0.00 H new ATOM 0 HD3 PRO A 65 9.116 -0.978 -12.582 1.00 0.00 H new ATOM 1022 N GLU A 66 5.437 0.965 -14.740 1.00 0.00 N ATOM 1023 CA GLU A 66 4.190 1.283 -15.450 1.00 0.00 C ATOM 1024 C GLU A 66 3.193 2.057 -14.583 1.00 0.00 C ATOM 1025 O GLU A 66 2.584 3.035 -15.014 1.00 0.00 O ATOM 1026 CB GLU A 66 3.574 -0.027 -15.948 1.00 0.00 C ATOM 1027 CG GLU A 66 2.625 0.161 -17.133 1.00 0.00 C ATOM 1028 CD GLU A 66 3.343 0.668 -18.385 1.00 0.00 C ATOM 1029 OE1 GLU A 66 4.096 -0.135 -18.977 1.00 0.00 O ATOM 1030 OE2 GLU A 66 3.162 1.856 -18.726 1.00 0.00 O ATOM 0 H GLU A 66 5.462 0.017 -14.366 1.00 0.00 H new ATOM 0 HA GLU A 66 4.427 1.939 -16.288 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.373 -0.709 -16.237 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.032 -0.500 -15.129 1.00 0.00 H new ATOM 0 HG2 GLU A 66 2.137 -0.787 -17.357 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.841 0.866 -16.858 1.00 0.00 H new ATOM 1037 N ILE A 67 3.149 1.707 -13.301 1.00 0.00 N ATOM 1038 CA ILE A 67 2.377 2.404 -12.262 1.00 0.00 C ATOM 1039 C ILE A 67 2.942 3.813 -12.064 1.00 0.00 C ATOM 1040 O ILE A 67 2.194 4.775 -11.900 1.00 0.00 O ATOM 1041 CB ILE A 67 2.412 1.586 -10.970 1.00 0.00 C ATOM 1042 CG1 ILE A 67 1.748 0.216 -11.124 1.00 0.00 C ATOM 1043 CG2 ILE A 67 1.846 2.325 -9.756 1.00 0.00 C ATOM 1044 CD1 ILE A 67 0.265 0.179 -11.500 1.00 0.00 C ATOM 0 H ILE A 67 3.665 0.905 -12.939 1.00 0.00 H new ATOM 0 HA ILE A 67 1.335 2.505 -12.566 1.00 0.00 H new ATOM 0 HB ILE A 67 3.473 1.429 -10.775 1.00 0.00 H new ATOM 0 HG12 ILE A 67 2.300 -0.340 -11.882 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.868 -0.322 -10.184 1.00 0.00 H new ATOM 0 HG21 ILE A 67 1.905 1.681 -8.878 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.424 3.232 -9.580 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.805 2.589 -9.943 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.066 -0.857 -11.573 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -0.317 0.693 -10.735 1.00 0.00 H new ATOM 0 HD13 ILE A 67 0.121 0.675 -12.460 1.00 0.00 H new ATOM 1056 N GLN A 68 4.269 3.907 -12.087 1.00 0.00 N ATOM 1057 CA GLN A 68 4.967 5.197 -12.001 1.00 0.00 C ATOM 1058 C GLN A 68 4.880 6.029 -13.281 1.00 0.00 C ATOM 1059 O GLN A 68 4.980 7.254 -13.231 1.00 0.00 O ATOM 1060 CB GLN A 68 6.435 4.988 -11.625 1.00 0.00 C ATOM 1061 CG GLN A 68 6.567 4.730 -10.123 1.00 0.00 C ATOM 1062 CD GLN A 68 6.268 5.987 -9.305 1.00 0.00 C ATOM 1063 OE1 GLN A 68 5.133 6.383 -9.044 1.00 0.00 O ATOM 1064 NE2 GLN A 68 7.314 6.643 -8.810 1.00 0.00 N ATOM 0 H GLN A 68 4.890 3.102 -12.165 1.00 0.00 H new ATOM 0 HA GLN A 68 4.454 5.761 -11.222 1.00 0.00 H new ATOM 0 HB2 GLN A 68 6.844 4.146 -12.183 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.017 5.867 -11.902 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.884 3.933 -9.829 1.00 0.00 H new ATOM 0 HG3 GLN A 68 7.576 4.383 -9.901 1.00 0.00 H new ATOM 0 HE21 GLN A 68 8.261 6.325 -9.019 1.00 0.00 H new ATOM 0 HE22 GLN A 68 7.170 7.464 -8.222 1.00 0.00 H new ATOM 1073 N ARG A 69 4.692 5.374 -14.424 1.00 0.00 N ATOM 1074 CA ARG A 69 4.390 6.072 -15.682 1.00 0.00 C ATOM 1075 C ARG A 69 3.031 6.766 -15.580 1.00 0.00 C ATOM 1076 O ARG A 69 2.858 7.877 -16.078 1.00 0.00 O ATOM 1077 CB ARG A 69 4.402 5.071 -16.840 1.00 0.00 C ATOM 1078 CG ARG A 69 4.384 5.787 -18.192 1.00 0.00 C ATOM 1079 CD ARG A 69 4.179 4.817 -19.358 1.00 0.00 C ATOM 1080 NE ARG A 69 3.965 5.598 -20.585 1.00 0.00 N ATOM 1081 CZ ARG A 69 4.690 5.532 -21.710 1.00 0.00 C ATOM 1082 NH1 ARG A 69 5.736 4.704 -21.837 1.00 0.00 N ATOM 1083 NH2 ARG A 69 4.390 6.338 -22.738 1.00 0.00 N ATOM 0 H ARG A 69 4.743 4.359 -14.510 1.00 0.00 H new ATOM 0 HA ARG A 69 5.150 6.831 -15.869 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.289 4.442 -16.771 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.537 4.412 -16.763 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.587 6.531 -18.196 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.323 6.324 -18.329 1.00 0.00 H new ATOM 0 HD2 ARG A 69 5.049 4.169 -19.469 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.322 4.171 -19.167 1.00 0.00 H new ATOM 0 HE ARG A 69 3.186 6.257 -20.579 1.00 0.00 H new ATOM 0 HH11 ARG A 69 6.003 4.097 -21.062 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.265 4.681 -22.709 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.614 6.996 -22.661 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.937 6.294 -23.598 1.00 0.00 H new ATOM 1097 N LEU A 70 2.081 6.081 -14.949 1.00 0.00 N ATOM 1098 CA LEU A 70 0.743 6.604 -14.639 1.00 0.00 C ATOM 1099 C LEU A 70 0.788 7.759 -13.637 1.00 0.00 C ATOM 1100 O LEU A 70 0.223 8.823 -13.884 1.00 0.00 O ATOM 1101 CB LEU A 70 -0.110 5.474 -14.058 1.00 0.00 C ATOM 1102 CG LEU A 70 -0.629 4.497 -15.115 1.00 0.00 C ATOM 1103 CD1 LEU A 70 -1.109 3.213 -14.434 1.00 0.00 C ATOM 1104 CD2 LEU A 70 -1.807 5.098 -15.884 1.00 0.00 C ATOM 0 H LEU A 70 2.219 5.122 -14.629 1.00 0.00 H new ATOM 0 HA LEU A 70 0.313 6.985 -15.565 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.480 4.924 -13.325 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.958 5.906 -13.526 1.00 0.00 H new ATOM 0 HG LEU A 70 0.186 4.286 -15.808 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.479 2.518 -15.188 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.280 2.756 -13.894 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.911 3.450 -13.735 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.157 4.384 -16.629 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.616 5.325 -15.190 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.488 6.014 -16.381 1.00 0.00 H new ATOM 1116 N LEU A 71 1.436 7.516 -12.501 1.00 0.00 N ATOM 1117 CA LEU A 71 1.486 8.442 -11.359 1.00 0.00 C ATOM 1118 C LEU A 71 2.928 8.739 -10.941 1.00 0.00 C ATOM 1119 O LEU A 71 3.344 8.354 -9.849 1.00 0.00 O ATOM 1120 CB LEU A 71 0.702 7.821 -10.202 1.00 0.00 C ATOM 1121 CG LEU A 71 -0.771 7.586 -10.541 1.00 0.00 C ATOM 1122 CD1 LEU A 71 -1.207 6.208 -10.036 1.00 0.00 C ATOM 1123 CD2 LEU A 71 -1.672 8.668 -9.940 1.00 0.00 C ATOM 0 H LEU A 71 1.954 6.653 -12.339 1.00 0.00 H new ATOM 0 HA LEU A 71 1.039 9.394 -11.646 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.162 6.872 -9.926 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.770 8.474 -9.332 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.874 7.632 -11.625 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.257 6.046 -10.280 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.601 5.437 -10.512 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.074 6.158 -8.955 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.710 8.465 -10.204 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.566 8.668 -8.855 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.382 9.643 -10.333 1.00 0.00 H new ATOM 1135 N PRO A 72 3.659 9.563 -11.686 1.00 0.00 N ATOM 1136 CA PRO A 72 5.074 9.836 -11.396 1.00 0.00 C ATOM 1137 C PRO A 72 5.342 10.701 -10.162 1.00 0.00 C ATOM 1138 O PRO A 72 6.374 10.565 -9.508 1.00 0.00 O ATOM 1139 CB PRO A 72 5.611 10.503 -12.664 1.00 0.00 C ATOM 1140 CG PRO A 72 4.385 11.174 -13.286 1.00 0.00 C ATOM 1141 CD PRO A 72 3.232 10.236 -12.921 1.00 0.00 C ATOM 0 HA PRO A 72 5.575 8.901 -11.144 1.00 0.00 H new ATOM 0 HB2 PRO A 72 6.388 11.231 -12.432 1.00 0.00 H new ATOM 0 HB3 PRO A 72 6.051 9.772 -13.342 1.00 0.00 H new ATOM 0 HG2 PRO A 72 4.229 12.175 -12.884 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.490 11.277 -14.366 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.307 10.791 -12.767 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.043 9.516 -13.717 1.00 0.00 H new ATOM 1149 N ASN A 73 4.325 11.469 -9.779 1.00 0.00 N ATOM 1150 CA ASN A 73 4.424 12.404 -8.650 1.00 0.00 C ATOM 1151 C ASN A 73 4.120 11.777 -7.288 1.00 0.00 C ATOM 1152 O ASN A 73 4.195 12.442 -6.255 1.00 0.00 O ATOM 1153 CB ASN A 73 3.498 13.601 -8.871 1.00 0.00 C ATOM 1154 CG ASN A 73 3.943 14.526 -10.006 1.00 0.00 C ATOM 1155 OD1 ASN A 73 4.633 14.158 -10.954 1.00 0.00 O ATOM 1156 ND2 ASN A 73 3.468 15.768 -9.978 1.00 0.00 N ATOM 0 H ASN A 73 3.413 11.465 -10.236 1.00 0.00 H new ATOM 0 HA ASN A 73 5.467 12.719 -8.623 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.493 13.236 -9.085 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.438 14.177 -7.948 1.00 0.00 H new ATOM 0 HD21 ASN A 73 3.677 16.411 -10.742 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.895 16.077 -9.193 1.00 0.00 H new ATOM 1163 N LYS A 74 3.794 10.488 -7.294 1.00 0.00 N ATOM 1164 CA LYS A 74 3.438 9.742 -6.079 1.00 0.00 C ATOM 1165 C LYS A 74 4.527 8.727 -5.727 1.00 0.00 C ATOM 1166 O LYS A 74 5.076 8.103 -6.634 1.00 0.00 O ATOM 1167 CB LYS A 74 2.106 9.019 -6.289 1.00 0.00 C ATOM 1168 CG LYS A 74 0.904 9.931 -6.542 1.00 0.00 C ATOM 1169 CD LYS A 74 0.609 10.873 -5.373 1.00 0.00 C ATOM 1170 CE LYS A 74 -0.658 11.695 -5.616 1.00 0.00 C ATOM 1171 NZ LYS A 74 -0.844 12.613 -4.483 1.00 0.00 N ATOM 0 H LYS A 74 3.768 9.924 -8.143 1.00 0.00 H new ATOM 0 HA LYS A 74 3.344 10.448 -5.254 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.210 8.338 -7.134 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.900 8.408 -5.410 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.086 10.522 -7.440 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.025 9.317 -6.737 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.496 10.293 -4.457 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.455 11.544 -5.223 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.573 12.255 -6.547 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.522 11.038 -5.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -1.693 13.192 -4.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -0.957 12.064 -3.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.013 13.233 -4.399 1.00 0.00 H new ATOM 1185 N PRO A 75 4.932 8.641 -4.463 1.00 0.00 N ATOM 1186 CA PRO A 75 5.874 7.610 -4.006 1.00 0.00 C ATOM 1187 C PRO A 75 5.195 6.240 -3.974 1.00 0.00 C ATOM 1188 O PRO A 75 4.118 6.048 -3.411 1.00 0.00 O ATOM 1189 CB PRO A 75 6.343 8.060 -2.621 1.00 0.00 C ATOM 1190 CG PRO A 75 5.199 8.945 -2.122 1.00 0.00 C ATOM 1191 CD PRO A 75 4.647 9.603 -3.388 1.00 0.00 C ATOM 0 HA PRO A 75 6.725 7.501 -4.678 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.510 7.210 -1.959 1.00 0.00 H new ATOM 0 HB3 PRO A 75 7.282 8.611 -2.675 1.00 0.00 H new ATOM 0 HG2 PRO A 75 4.434 8.357 -1.614 1.00 0.00 H new ATOM 0 HG3 PRO A 75 5.554 9.690 -1.410 1.00 0.00 H new ATOM 0 HD2 PRO A 75 3.577 9.794 -3.301 1.00 0.00 H new ATOM 0 HD3 PRO A 75 5.128 10.563 -3.578 1.00 0.00 H new ATOM 1199 N VAL A 76 5.757 5.383 -4.823 1.00 0.00 N ATOM 1200 CA VAL A 76 5.221 4.032 -5.045 1.00 0.00 C ATOM 1201 C VAL A 76 6.331 3.020 -4.756 1.00 0.00 C ATOM 1202 O VAL A 76 7.337 2.970 -5.462 1.00 0.00 O ATOM 1203 CB VAL A 76 4.700 3.910 -6.479 1.00 0.00 C ATOM 1204 CG1 VAL A 76 4.109 2.524 -6.744 1.00 0.00 C ATOM 1205 CG2 VAL A 76 3.630 4.948 -6.819 1.00 0.00 C ATOM 0 H VAL A 76 6.588 5.597 -5.374 1.00 0.00 H new ATOM 0 HA VAL A 76 4.383 3.833 -4.377 1.00 0.00 H new ATOM 0 HB VAL A 76 5.571 4.082 -7.111 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.749 2.472 -7.771 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.877 1.766 -6.590 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.280 2.345 -6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.302 4.808 -7.849 1.00 0.00 H new ATOM 0 HG22 VAL A 76 2.780 4.827 -6.148 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.045 5.949 -6.703 1.00 0.00 H new ATOM 1215 N GLU A 77 6.018 2.181 -3.773 1.00 0.00 N ATOM 1216 CA GLU A 77 6.897 1.105 -3.295 1.00 0.00 C ATOM 1217 C GLU A 77 6.196 -0.255 -3.324 1.00 0.00 C ATOM 1218 O GLU A 77 4.972 -0.370 -3.371 1.00 0.00 O ATOM 1219 CB GLU A 77 7.365 1.399 -1.868 1.00 0.00 C ATOM 1220 CG GLU A 77 8.331 2.579 -1.748 1.00 0.00 C ATOM 1221 CD GLU A 77 9.647 2.355 -2.496 1.00 0.00 C ATOM 1222 OE1 GLU A 77 10.381 1.422 -2.102 1.00 0.00 O ATOM 1223 OE2 GLU A 77 9.924 3.165 -3.406 1.00 0.00 O ATOM 0 H GLU A 77 5.130 2.226 -3.273 1.00 0.00 H new ATOM 0 HA GLU A 77 7.754 1.064 -3.967 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.492 1.596 -1.246 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.848 0.508 -1.467 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.848 3.477 -2.134 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.545 2.760 -0.695 1.00 0.00 H new ATOM 1230 N VAL A 78 7.027 -1.293 -3.346 1.00 0.00 N ATOM 1231 CA VAL A 78 6.576 -2.692 -3.313 1.00 0.00 C ATOM 1232 C VAL A 78 6.710 -3.236 -1.890 1.00 0.00 C ATOM 1233 O VAL A 78 7.695 -2.994 -1.194 1.00 0.00 O ATOM 1234 CB VAL A 78 7.387 -3.523 -4.310 1.00 0.00 C ATOM 1235 CG1 VAL A 78 6.975 -4.996 -4.318 1.00 0.00 C ATOM 1236 CG2 VAL A 78 7.253 -3.001 -5.742 1.00 0.00 C ATOM 0 H VAL A 78 8.041 -1.192 -3.388 1.00 0.00 H new ATOM 0 HA VAL A 78 5.527 -2.752 -3.604 1.00 0.00 H new ATOM 0 HB VAL A 78 8.419 -3.431 -3.973 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.581 -5.540 -5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 78 7.126 -5.422 -3.326 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.923 -5.078 -4.591 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.846 -3.623 -6.413 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.207 -3.035 -6.045 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.611 -1.972 -5.789 1.00 0.00 H new ATOM 1246 N ILE A 79 5.695 -3.986 -1.471 1.00 0.00 N ATOM 1247 CA ILE A 79 5.678 -4.718 -0.197 1.00 0.00 C ATOM 1248 C ILE A 79 6.639 -5.903 -0.321 1.00 0.00 C ATOM 1249 O ILE A 79 6.511 -6.731 -1.221 1.00 0.00 O ATOM 1250 CB ILE A 79 4.265 -5.206 0.133 1.00 0.00 C ATOM 1251 CG1 ILE A 79 3.282 -4.034 0.173 1.00 0.00 C ATOM 1252 CG2 ILE A 79 4.234 -5.948 1.470 1.00 0.00 C ATOM 1253 CD1 ILE A 79 1.838 -4.443 -0.124 1.00 0.00 C ATOM 0 H ILE A 79 4.841 -4.108 -2.015 1.00 0.00 H new ATOM 0 HA ILE A 79 5.992 -4.060 0.613 1.00 0.00 H new ATOM 0 HB ILE A 79 3.965 -5.896 -0.655 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.325 -3.567 1.157 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.595 -3.282 -0.551 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.217 -6.282 1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.897 -6.812 1.422 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.565 -5.280 2.265 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.194 -3.564 -0.079 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.782 -4.883 -1.119 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.507 -5.173 0.615 1.00 0.00 H new ATOM 1265 N ASP A 80 7.553 -5.966 0.643 1.00 0.00 N ATOM 1266 CA ASP A 80 8.524 -7.063 0.775 1.00 0.00 C ATOM 1267 C ASP A 80 7.830 -8.409 0.989 1.00 0.00 C ATOM 1268 O ASP A 80 6.920 -8.569 1.801 1.00 0.00 O ATOM 1269 CB ASP A 80 9.490 -6.760 1.922 1.00 0.00 C ATOM 1270 CG ASP A 80 10.483 -7.894 2.188 1.00 0.00 C ATOM 1271 OD1 ASP A 80 11.157 -8.323 1.227 1.00 0.00 O ATOM 1272 OD2 ASP A 80 10.381 -8.471 3.292 1.00 0.00 O ATOM 0 H ASP A 80 7.646 -5.252 1.365 1.00 0.00 H new ATOM 0 HA ASP A 80 9.086 -7.137 -0.156 1.00 0.00 H new ATOM 0 HB2 ASP A 80 10.042 -5.848 1.693 1.00 0.00 H new ATOM 0 HB3 ASP A 80 8.918 -6.566 2.829 1.00 0.00 H new ATOM 1277 N SER A 81 8.293 -9.362 0.186 1.00 0.00 N ATOM 1278 CA SER A 81 7.760 -10.731 0.134 1.00 0.00 C ATOM 1279 C SER A 81 7.807 -11.466 1.475 1.00 0.00 C ATOM 1280 O SER A 81 6.905 -12.233 1.809 1.00 0.00 O ATOM 1281 CB SER A 81 8.509 -11.565 -0.908 1.00 0.00 C ATOM 1282 OG SER A 81 8.291 -10.998 -2.202 1.00 0.00 O ATOM 0 H SER A 81 9.065 -9.207 -0.462 1.00 0.00 H new ATOM 0 HA SER A 81 6.711 -10.619 -0.141 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.575 -11.584 -0.680 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.160 -12.597 -0.886 1.00 0.00 H new ATOM 0 HG SER A 81 8.769 -11.526 -2.875 1.00 0.00 H new ATOM 1288 N LEU A 82 8.838 -11.196 2.270 1.00 0.00 N ATOM 1289 CA LEU A 82 9.031 -11.814 3.591 1.00 0.00 C ATOM 1290 C LEU A 82 8.119 -11.207 4.660 1.00 0.00 C ATOM 1291 O LEU A 82 7.600 -11.929 5.510 1.00 0.00 O ATOM 1292 CB LEU A 82 10.497 -11.657 3.996 1.00 0.00 C ATOM 1293 CG LEU A 82 11.217 -12.956 4.369 1.00 0.00 C ATOM 1294 CD1 LEU A 82 10.599 -13.643 5.588 1.00 0.00 C ATOM 1295 CD2 LEU A 82 11.315 -13.933 3.196 1.00 0.00 C ATOM 0 H LEU A 82 9.574 -10.536 2.019 1.00 0.00 H new ATOM 0 HA LEU A 82 8.765 -12.868 3.516 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.035 -11.186 3.173 1.00 0.00 H new ATOM 0 HB3 LEU A 82 10.551 -10.975 4.844 1.00 0.00 H new ATOM 0 HG LEU A 82 12.230 -12.656 4.636 1.00 0.00 H new ATOM 0 HD11 LEU A 82 11.149 -14.558 5.807 1.00 0.00 H new ATOM 0 HD12 LEU A 82 10.650 -12.974 6.447 1.00 0.00 H new ATOM 0 HD13 LEU A 82 9.557 -13.887 5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 82 11.834 -14.836 3.517 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.313 -14.193 2.854 1.00 0.00 H new ATOM 0 HD23 LEU A 82 11.867 -13.467 2.380 1.00 0.00 H new ATOM 1307 N LEU A 83 7.915 -9.894 4.614 1.00 0.00 N ATOM 1308 CA LEU A 83 6.931 -9.200 5.456 1.00 0.00 C ATOM 1309 C LEU A 83 5.503 -9.682 5.189 1.00 0.00 C ATOM 1310 O LEU A 83 4.706 -9.832 6.114 1.00 0.00 O ATOM 1311 CB LEU A 83 6.942 -7.686 5.237 1.00 0.00 C ATOM 1312 CG LEU A 83 8.199 -6.988 5.759 1.00 0.00 C ATOM 1313 CD1 LEU A 83 8.132 -5.502 5.397 1.00 0.00 C ATOM 1314 CD2 LEU A 83 8.353 -7.128 7.275 1.00 0.00 C ATOM 0 H LEU A 83 8.428 -9.272 3.989 1.00 0.00 H new ATOM 0 HA LEU A 83 7.225 -9.433 6.479 1.00 0.00 H new ATOM 0 HB2 LEU A 83 6.843 -7.483 4.171 1.00 0.00 H new ATOM 0 HB3 LEU A 83 6.069 -7.253 5.726 1.00 0.00 H new ATOM 0 HG LEU A 83 9.061 -7.465 5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 83 9.025 -4.997 5.766 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.075 -5.394 4.314 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.248 -5.056 5.853 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.260 -6.616 7.597 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.490 -6.684 7.771 1.00 0.00 H new ATOM 0 HD23 LEU A 83 8.419 -8.184 7.538 1.00 0.00 H new ATOM 1326 N TYR A 84 5.236 -9.935 3.911 1.00 0.00 N ATOM 1327 CA TYR A 84 3.973 -10.483 3.393 1.00 0.00 C ATOM 1328 C TYR A 84 3.755 -11.921 3.866 1.00 0.00 C ATOM 1329 O TYR A 84 2.657 -12.259 4.305 1.00 0.00 O ATOM 1330 CB TYR A 84 3.996 -10.424 1.865 1.00 0.00 C ATOM 1331 CG TYR A 84 2.635 -10.612 1.191 1.00 0.00 C ATOM 1332 CD1 TYR A 84 2.180 -11.890 0.890 1.00 0.00 C ATOM 1333 CD2 TYR A 84 1.934 -9.485 0.780 1.00 0.00 C ATOM 1334 CE1 TYR A 84 1.004 -12.046 0.164 1.00 0.00 C ATOM 1335 CE2 TYR A 84 0.755 -9.632 0.057 1.00 0.00 C ATOM 1336 CZ TYR A 84 0.308 -10.914 -0.245 1.00 0.00 C ATOM 1337 OH TYR A 84 -0.800 -11.066 -1.017 1.00 0.00 O ATOM 0 H TYR A 84 5.917 -9.759 3.173 1.00 0.00 H new ATOM 0 HA TYR A 84 3.146 -9.884 3.775 1.00 0.00 H new ATOM 0 HB2 TYR A 84 4.406 -9.461 1.560 1.00 0.00 H new ATOM 0 HB3 TYR A 84 4.676 -11.192 1.497 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.736 -12.756 1.218 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.303 -8.499 1.021 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.637 -13.032 -0.079 1.00 0.00 H new ATOM 0 HE2 TYR A 84 0.196 -8.766 -0.264 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.179 -10.186 -1.222 1.00 0.00 H new ATOM 1347 N GLY A 85 4.823 -12.715 3.857 1.00 0.00 N ATOM 1348 CA GLY A 85 4.839 -14.114 4.307 1.00 0.00 C ATOM 1349 C GLY A 85 4.502 -14.255 5.793 1.00 0.00 C ATOM 1350 O GLY A 85 3.766 -15.155 6.193 1.00 0.00 O ATOM 0 H GLY A 85 5.734 -12.396 3.526 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.124 -14.690 3.719 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.824 -14.542 4.119 1.00 0.00 H new ATOM 1354 N LYS A 86 5.083 -13.365 6.593 1.00 0.00 N ATOM 1355 CA LYS A 86 4.830 -13.301 8.041 1.00 0.00 C ATOM 1356 C LYS A 86 3.476 -12.678 8.382 1.00 0.00 C ATOM 1357 O LYS A 86 2.896 -12.977 9.425 1.00 0.00 O ATOM 1358 CB LYS A 86 5.906 -12.454 8.723 1.00 0.00 C ATOM 1359 CG LYS A 86 7.322 -13.027 8.633 1.00 0.00 C ATOM 1360 CD LYS A 86 8.309 -12.226 9.486 1.00 0.00 C ATOM 1361 CE LYS A 86 8.560 -10.808 8.970 1.00 0.00 C ATOM 1362 NZ LYS A 86 9.369 -10.059 9.942 1.00 0.00 N ATOM 0 H LYS A 86 5.745 -12.664 6.261 1.00 0.00 H new ATOM 0 HA LYS A 86 4.842 -14.332 8.395 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.902 -11.459 8.278 1.00 0.00 H new ATOM 0 HB3 LYS A 86 5.643 -12.334 9.774 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.316 -14.066 8.962 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.651 -13.023 7.594 1.00 0.00 H new ATOM 0 HD2 LYS A 86 7.931 -12.170 10.507 1.00 0.00 H new ATOM 0 HD3 LYS A 86 9.258 -12.761 9.527 1.00 0.00 H new ATOM 0 HE2 LYS A 86 9.073 -10.847 8.009 1.00 0.00 H new ATOM 0 HE3 LYS A 86 7.611 -10.298 8.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 9.536 -9.096 9.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.863 -10.010 10.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.281 -10.541 10.079 1.00 0.00 H new ATOM 1376 N VAL A 87 3.017 -11.799 7.495 1.00 0.00 N ATOM 1377 CA VAL A 87 1.883 -10.876 7.657 1.00 0.00 C ATOM 1378 C VAL A 87 2.164 -9.987 8.870 1.00 0.00 C ATOM 1379 O VAL A 87 1.569 -10.121 9.938 1.00 0.00 O ATOM 1380 CB VAL A 87 0.529 -11.583 7.750 1.00 0.00 C ATOM 1381 CG1 VAL A 87 -0.632 -10.591 7.668 1.00 0.00 C ATOM 1382 CG2 VAL A 87 0.326 -12.626 6.650 1.00 0.00 C ATOM 0 H VAL A 87 3.454 -11.701 6.578 1.00 0.00 H new ATOM 0 HA VAL A 87 1.799 -10.263 6.760 1.00 0.00 H new ATOM 0 HB VAL A 87 0.537 -12.081 8.719 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.577 -11.130 7.737 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -0.560 -9.878 8.489 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.588 -10.057 6.719 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.651 -13.094 6.768 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.381 -12.142 5.675 1.00 0.00 H new ATOM 0 HG23 VAL A 87 1.103 -13.387 6.722 1.00 0.00 H new ATOM 1392 N ASP A 88 3.145 -9.113 8.663 1.00 0.00 N ATOM 1393 CA ASP A 88 3.631 -8.168 9.677 1.00 0.00 C ATOM 1394 C ASP A 88 3.255 -6.734 9.300 1.00 0.00 C ATOM 1395 O ASP A 88 3.861 -6.065 8.464 1.00 0.00 O ATOM 1396 CB ASP A 88 5.142 -8.328 9.860 1.00 0.00 C ATOM 1397 CG ASP A 88 5.630 -7.551 11.084 1.00 0.00 C ATOM 1398 OD1 ASP A 88 5.314 -8.001 12.207 1.00 0.00 O ATOM 1399 OD2 ASP A 88 6.238 -6.477 10.887 1.00 0.00 O ATOM 0 H ASP A 88 3.636 -9.036 7.772 1.00 0.00 H new ATOM 0 HA ASP A 88 3.152 -8.389 10.631 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.389 -9.384 9.973 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.660 -7.973 8.969 1.00 0.00 H new ATOM 1404 N GLY A 89 2.176 -6.318 9.957 1.00 0.00 N ATOM 1405 CA GLY A 89 1.521 -5.021 9.735 1.00 0.00 C ATOM 1406 C GLY A 89 2.429 -3.817 9.992 1.00 0.00 C ATOM 1407 O GLY A 89 2.518 -2.922 9.153 1.00 0.00 O ATOM 0 H GLY A 89 1.719 -6.881 10.675 1.00 0.00 H new ATOM 0 HA2 GLY A 89 1.160 -4.979 8.708 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.648 -4.950 10.383 1.00 0.00 H new ATOM 1411 N LEU A 90 3.191 -3.880 11.081 1.00 0.00 N ATOM 1412 CA LEU A 90 4.069 -2.777 11.497 1.00 0.00 C ATOM 1413 C LEU A 90 5.183 -2.503 10.484 1.00 0.00 C ATOM 1414 O LEU A 90 5.446 -1.346 10.159 1.00 0.00 O ATOM 1415 CB LEU A 90 4.656 -3.097 12.873 1.00 0.00 C ATOM 1416 CG LEU A 90 5.593 -2.004 13.390 1.00 0.00 C ATOM 1417 CD1 LEU A 90 4.890 -0.661 13.602 1.00 0.00 C ATOM 1418 CD2 LEU A 90 6.264 -2.447 14.691 1.00 0.00 C ATOM 0 H LEU A 90 3.221 -4.690 11.700 1.00 0.00 H new ATOM 0 HA LEU A 90 3.470 -1.868 11.550 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.843 -3.238 13.585 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.200 -4.040 12.820 1.00 0.00 H new ATOM 0 HG LEU A 90 6.346 -1.853 12.616 1.00 0.00 H new ATOM 0 HD11 LEU A 90 5.608 0.072 13.969 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.471 -0.316 12.657 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.089 -0.781 14.331 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.927 -1.658 15.045 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.502 -2.646 15.444 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.842 -3.354 14.512 1.00 0.00 H new ATOM 1430 N GLY A 91 5.795 -3.570 9.980 1.00 0.00 N ATOM 1431 CA GLY A 91 6.890 -3.522 8.999 1.00 0.00 C ATOM 1432 C GLY A 91 6.509 -2.768 7.724 1.00 0.00 C ATOM 1433 O GLY A 91 7.208 -1.845 7.307 1.00 0.00 O ATOM 0 H GLY A 91 5.541 -4.521 10.246 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.758 -3.044 9.453 1.00 0.00 H new ATOM 0 HA3 GLY A 91 7.185 -4.539 8.740 1.00 0.00 H new ATOM 1437 N VAL A 92 5.289 -3.033 7.264 1.00 0.00 N ATOM 1438 CA VAL A 92 4.719 -2.411 6.060 1.00 0.00 C ATOM 1439 C VAL A 92 4.243 -0.986 6.352 1.00 0.00 C ATOM 1440 O VAL A 92 4.486 -0.076 5.559 1.00 0.00 O ATOM 1441 CB VAL A 92 3.583 -3.276 5.510 1.00 0.00 C ATOM 1442 CG1 VAL A 92 3.040 -2.749 4.181 1.00 0.00 C ATOM 1443 CG2 VAL A 92 4.003 -4.729 5.275 1.00 0.00 C ATOM 0 H VAL A 92 4.657 -3.692 7.718 1.00 0.00 H new ATOM 0 HA VAL A 92 5.497 -2.344 5.300 1.00 0.00 H new ATOM 0 HB VAL A 92 2.814 -3.230 6.281 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.236 -3.398 3.833 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.656 -1.738 4.320 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.840 -2.735 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.156 -5.294 4.885 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.822 -4.759 4.556 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.330 -5.170 6.217 1.00 0.00 H new ATOM 1453 N LEU A 93 3.669 -0.772 7.532 1.00 0.00 N ATOM 1454 CA LEU A 93 3.218 0.549 7.994 1.00 0.00 C ATOM 1455 C LEU A 93 4.387 1.527 8.132 1.00 0.00 C ATOM 1456 O LEU A 93 4.308 2.685 7.724 1.00 0.00 O ATOM 1457 CB LEU A 93 2.521 0.385 9.347 1.00 0.00 C ATOM 1458 CG LEU A 93 1.779 1.647 9.795 1.00 0.00 C ATOM 1459 CD1 LEU A 93 0.443 1.815 9.070 1.00 0.00 C ATOM 1460 CD2 LEU A 93 1.568 1.633 11.311 1.00 0.00 C ATOM 0 H LEU A 93 3.499 -1.517 8.208 1.00 0.00 H new ATOM 0 HA LEU A 93 2.529 0.959 7.255 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.815 -0.443 9.288 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.262 0.119 10.101 1.00 0.00 H new ATOM 0 HG LEU A 93 2.401 2.502 9.531 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.049 2.723 9.419 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.618 1.887 7.997 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.194 0.955 9.277 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.039 2.537 11.613 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.979 0.758 11.588 1.00 0.00 H new ATOM 0 HD23 LEU A 93 2.535 1.594 11.813 1.00 0.00 H new ATOM 1472 N LYS A 94 5.510 1.018 8.631 1.00 0.00 N ATOM 1473 CA LYS A 94 6.765 1.763 8.809 1.00 0.00 C ATOM 1474 C LYS A 94 7.347 2.199 7.464 1.00 0.00 C ATOM 1475 O LYS A 94 7.759 3.350 7.325 1.00 0.00 O ATOM 1476 CB LYS A 94 7.735 0.852 9.566 1.00 0.00 C ATOM 1477 CG LYS A 94 9.070 1.516 9.905 1.00 0.00 C ATOM 1478 CD LYS A 94 9.983 0.552 10.668 1.00 0.00 C ATOM 1479 CE LYS A 94 9.798 0.589 12.186 1.00 0.00 C ATOM 1480 NZ LYS A 94 10.417 1.813 12.714 1.00 0.00 N ATOM 0 H LYS A 94 5.580 0.046 8.934 1.00 0.00 H new ATOM 0 HA LYS A 94 6.585 2.677 9.375 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.261 0.520 10.489 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.925 -0.038 8.967 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.562 1.840 8.988 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.894 2.409 10.505 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.799 -0.463 10.315 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.021 0.788 10.433 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.737 0.565 12.437 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.253 -0.290 12.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.874 1.606 13.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.129 2.161 12.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.686 2.540 12.851 1.00 0.00 H new ATOM 1494 N ALA A 95 7.326 1.293 6.491 1.00 0.00 N ATOM 1495 CA ALA A 95 7.794 1.566 5.124 1.00 0.00 C ATOM 1496 C ALA A 95 6.926 2.603 4.407 1.00 0.00 C ATOM 1497 O ALA A 95 7.431 3.581 3.856 1.00 0.00 O ATOM 1498 CB ALA A 95 7.784 0.247 4.348 1.00 0.00 C ATOM 0 H ALA A 95 6.983 0.342 6.623 1.00 0.00 H new ATOM 0 HA ALA A 95 8.800 1.983 5.176 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.128 0.422 3.329 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.446 -0.468 4.837 1.00 0.00 H new ATOM 0 HB3 ALA A 95 6.771 -0.154 4.325 1.00 0.00 H new ATOM 1504 N ALA A 96 5.630 2.521 4.695 1.00 0.00 N ATOM 1505 CA ALA A 96 4.621 3.456 4.177 1.00 0.00 C ATOM 1506 C ALA A 96 4.785 4.865 4.750 1.00 0.00 C ATOM 1507 O ALA A 96 4.924 5.836 4.008 1.00 0.00 O ATOM 1508 CB ALA A 96 3.230 2.913 4.513 1.00 0.00 C ATOM 0 H ALA A 96 5.241 1.798 5.300 1.00 0.00 H new ATOM 0 HA ALA A 96 4.752 3.536 3.098 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.471 3.597 4.134 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.100 1.935 4.050 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.127 2.820 5.594 1.00 0.00 H new ATOM 1514 N VAL A 97 5.016 4.943 6.058 1.00 0.00 N ATOM 1515 CA VAL A 97 5.158 6.220 6.773 1.00 0.00 C ATOM 1516 C VAL A 97 6.483 6.916 6.456 1.00 0.00 C ATOM 1517 O VAL A 97 6.587 8.140 6.512 1.00 0.00 O ATOM 1518 CB VAL A 97 4.916 5.924 8.255 1.00 0.00 C ATOM 1519 CG1 VAL A 97 6.166 5.657 9.096 1.00 0.00 C ATOM 1520 CG2 VAL A 97 4.081 7.042 8.883 1.00 0.00 C ATOM 0 H VAL A 97 5.111 4.124 6.658 1.00 0.00 H new ATOM 0 HA VAL A 97 4.421 6.952 6.442 1.00 0.00 H new ATOM 0 HB VAL A 97 4.374 4.978 8.265 1.00 0.00 H new ATOM 0 HG11 VAL A 97 5.875 5.460 10.128 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.695 4.792 8.696 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.819 6.529 9.064 1.00 0.00 H new ATOM 0 HG21 VAL A 97 3.914 6.823 9.938 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.612 7.989 8.789 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.122 7.111 8.370 1.00 0.00 H new ATOM 1530 N ALA A 98 7.478 6.102 6.115 1.00 0.00 N ATOM 1531 CA ALA A 98 8.807 6.570 5.691 1.00 0.00 C ATOM 1532 C ALA A 98 8.737 7.282 4.339 1.00 0.00 C ATOM 1533 O ALA A 98 9.337 8.342 4.163 1.00 0.00 O ATOM 1534 CB ALA A 98 9.742 5.363 5.587 1.00 0.00 C ATOM 0 H ALA A 98 7.390 5.086 6.123 1.00 0.00 H new ATOM 0 HA ALA A 98 9.182 7.281 6.427 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.732 5.695 5.273 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.814 4.874 6.559 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.347 4.659 4.855 1.00 0.00 H new ATOM 1540 N ALA A 99 7.908 6.745 3.448 1.00 0.00 N ATOM 1541 CA ALA A 99 7.645 7.328 2.124 1.00 0.00 C ATOM 1542 C ALA A 99 6.746 8.565 2.182 1.00 0.00 C ATOM 1543 O ALA A 99 6.956 9.513 1.426 1.00 0.00 O ATOM 1544 CB ALA A 99 7.005 6.251 1.246 1.00 0.00 C ATOM 0 H ALA A 99 7.391 5.883 3.622 1.00 0.00 H new ATOM 0 HA ALA A 99 8.594 7.663 1.706 1.00 0.00 H new ATOM 0 HB1 ALA A 99 6.801 6.662 0.257 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.686 5.405 1.154 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.072 5.918 1.701 1.00 0.00 H new ATOM 1550 N ILE A 100 5.868 8.616 3.179 1.00 0.00 N ATOM 1551 CA ILE A 100 5.055 9.807 3.464 1.00 0.00 C ATOM 1552 C ILE A 100 5.962 10.912 4.011 1.00 0.00 C ATOM 1553 O ILE A 100 5.818 12.076 3.642 1.00 0.00 O ATOM 1554 CB ILE A 100 3.924 9.466 4.437 1.00 0.00 C ATOM 1555 CG1 ILE A 100 2.979 8.425 3.833 1.00 0.00 C ATOM 1556 CG2 ILE A 100 3.124 10.721 4.796 1.00 0.00 C ATOM 1557 CD1 ILE A 100 2.052 7.750 4.846 1.00 0.00 C ATOM 0 H ILE A 100 5.696 7.837 3.815 1.00 0.00 H new ATOM 0 HA ILE A 100 4.588 10.164 2.546 1.00 0.00 H new ATOM 0 HB ILE A 100 4.378 9.056 5.339 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.371 8.905 3.066 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.573 7.658 3.335 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.325 10.457 5.489 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.784 11.451 5.264 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.693 11.149 3.891 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.417 7.028 4.333 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.649 7.237 5.600 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.429 8.504 5.327 1.00 0.00 H new ATOM 1569 N LYS A 101 6.879 10.543 4.901 1.00 0.00 N ATOM 1570 CA LYS A 101 7.892 11.473 5.422 1.00 0.00 C ATOM 1571 C LYS A 101 8.752 12.094 4.319 1.00 0.00 C ATOM 1572 O LYS A 101 8.995 13.299 4.360 1.00 0.00 O ATOM 1573 CB LYS A 101 8.828 10.804 6.431 1.00 0.00 C ATOM 1574 CG LYS A 101 8.259 10.755 7.850 1.00 0.00 C ATOM 1575 CD LYS A 101 9.347 10.551 8.906 1.00 0.00 C ATOM 1576 CE LYS A 101 10.232 11.788 9.073 1.00 0.00 C ATOM 1577 NZ LYS A 101 11.231 11.573 10.130 1.00 0.00 N ATOM 0 H LYS A 101 6.946 9.600 5.283 1.00 0.00 H new ATOM 0 HA LYS A 101 7.318 12.259 5.914 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.042 9.788 6.098 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.776 11.341 6.446 1.00 0.00 H new ATOM 0 HG2 LYS A 101 7.725 11.682 8.057 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.532 9.946 7.920 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.882 10.308 9.861 1.00 0.00 H new ATOM 0 HD3 LYS A 101 9.966 9.699 8.627 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.734 12.012 8.132 1.00 0.00 H new ATOM 0 HE3 LYS A 101 9.615 12.652 9.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 11.821 12.424 10.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 10.748 11.382 11.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 11.832 10.762 9.880 1.00 0.00 H new ATOM 1591 N LYS A 102 9.108 11.295 3.317 1.00 0.00 N ATOM 1592 CA LYS A 102 9.878 11.749 2.150 1.00 0.00 C ATOM 1593 C LYS A 102 9.071 12.748 1.317 1.00 0.00 C ATOM 1594 O LYS A 102 9.529 13.850 1.019 1.00 0.00 O ATOM 1595 CB LYS A 102 10.272 10.510 1.344 1.00 0.00 C ATOM 1596 CG LYS A 102 11.192 10.916 0.191 1.00 0.00 C ATOM 1597 CD LYS A 102 11.645 9.685 -0.597 1.00 0.00 C ATOM 1598 CE LYS A 102 12.519 10.074 -1.792 1.00 0.00 C ATOM 1599 NZ LYS A 102 13.766 10.706 -1.339 1.00 0.00 N ATOM 0 H LYS A 102 8.870 10.304 3.287 1.00 0.00 H new ATOM 0 HA LYS A 102 10.778 12.278 2.464 1.00 0.00 H new ATOM 0 HB2 LYS A 102 10.777 9.790 1.989 1.00 0.00 H new ATOM 0 HB3 LYS A 102 9.380 10.019 0.955 1.00 0.00 H new ATOM 0 HG2 LYS A 102 10.670 11.607 -0.472 1.00 0.00 H new ATOM 0 HG3 LYS A 102 12.062 11.445 0.582 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.201 9.016 0.059 1.00 0.00 H new ATOM 0 HD3 LYS A 102 10.772 9.134 -0.947 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.749 9.188 -2.385 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.973 10.759 -2.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.429 10.777 -2.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.560 11.658 -0.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.193 10.131 -0.585 1.00 0.00 H new ATOM 1613 N ALA A 103 7.834 12.343 1.043 1.00 0.00 N ATOM 1614 CA ALA A 103 6.844 13.142 0.307 1.00 0.00 C ATOM 1615 C ALA A 103 6.573 14.493 0.972 1.00 0.00 C ATOM 1616 O ALA A 103 6.306 15.477 0.285 1.00 0.00 O ATOM 1617 CB ALA A 103 5.530 12.373 0.158 1.00 0.00 C ATOM 0 H ALA A 103 7.479 11.431 1.330 1.00 0.00 H new ATOM 0 HA ALA A 103 7.270 13.334 -0.678 1.00 0.00 H new ATOM 0 HB1 ALA A 103 4.812 12.983 -0.390 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.710 11.447 -0.388 1.00 0.00 H new ATOM 0 HB3 ALA A 103 5.131 12.141 1.145 1.00 0.00 H new ATOM 1623 N ALA A 104 6.562 14.495 2.303 1.00 0.00 N ATOM 1624 CA ALA A 104 6.458 15.709 3.127 1.00 0.00 C ATOM 1625 C ALA A 104 7.727 16.552 2.990 1.00 0.00 C ATOM 1626 O ALA A 104 7.686 17.559 2.284 1.00 0.00 O ATOM 1627 CB ALA A 104 6.193 15.283 4.572 1.00 0.00 C ATOM 0 H ALA A 104 6.626 13.639 2.855 1.00 0.00 H new ATOM 0 HA ALA A 104 5.632 16.337 2.792 1.00 0.00 H new ATOM 0 HB1 ALA A 104 6.112 16.168 5.203 1.00 0.00 H new ATOM 0 HB2 ALA A 104 5.263 14.717 4.620 1.00 0.00 H new ATOM 0 HB3 ALA A 104 7.015 14.660 4.924 1.00 0.00 H new ATOM 1633 N ALA A 105 8.831 16.129 3.599 1.00 0.00 N ATOM 1634 CA ALA A 105 10.139 16.786 3.473 1.00 0.00 C ATOM 1635 C ALA A 105 11.256 15.925 4.066 1.00 0.00 C ATOM 1636 O ALA A 105 11.497 15.926 5.272 1.00 0.00 O ATOM 1637 CB ALA A 105 10.118 18.158 4.152 1.00 0.00 C ATOM 0 H ALA A 105 8.848 15.308 4.204 1.00 0.00 H new ATOM 0 HA ALA A 105 10.341 16.918 2.410 1.00 0.00 H new ATOM 0 HB1 ALA A 105 11.095 18.630 4.049 1.00 0.00 H new ATOM 0 HB2 ALA A 105 9.361 18.785 3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 105 9.883 18.037 5.210 1.00 0.00 H new ATOM 1643 N ASN A 106 11.767 15.049 3.206 1.00 0.00 N ATOM 1644 CA ASN A 106 12.978 14.242 3.414 1.00 0.00 C ATOM 1645 C ASN A 106 13.604 13.850 2.074 1.00 0.00 C ATOM 1646 O ASN A 106 12.981 14.111 1.021 1.00 0.00 O ATOM 1647 CB ASN A 106 12.704 12.958 4.200 1.00 0.00 C ATOM 1648 CG ASN A 106 12.404 13.149 5.688 1.00 0.00 C ATOM 1649 OD1 ASN A 106 11.284 13.047 6.186 1.00 0.00 O ATOM 1650 ND2 ASN A 106 13.459 13.270 6.487 1.00 0.00 N ATOM 1651 OXT ASN A 106 14.630 13.137 2.075 1.00 0.00 O ATOM 0 H ASN A 106 11.332 14.870 2.301 1.00 0.00 H new ATOM 0 HA ASN A 106 13.658 14.868 3.991 1.00 0.00 H new ATOM 0 HB2 ASN A 106 11.860 12.444 3.740 1.00 0.00 H new ATOM 0 HB3 ASN A 106 13.569 12.301 4.103 1.00 0.00 H new ATOM 0 HD21 ASN A 106 13.334 13.277 7.499 1.00 0.00 H new ATOM 0 HD22 ASN A 106 14.394 13.355 6.088 1.00 0.00 H new TER 1658 ASN A 106