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 15 SER OG : rot -129:sc= 0.549 USER MOD Set 1.2: A 59 GLN : amide:sc= 1.71 K(o=3,f=-5.1!) USER MOD Set 1.3: A 84 TYR OH : rot 15:sc= 0.766 USER MOD Set 2.1: A 5 HIS : no HD1:sc= 0.0363 X(o=0.068,f=0) USER MOD Set 2.2: A 7 TYR OH : rot 53:sc= 0.0315 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -112:sc= 0.254 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 159:sc= 0.121 (180deg=-0.0461) USER MOD Single : A 11 SER OG : rot 180:sc= 0.0012 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot -160:sc= 0.0326 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 73:sc= 0.286 USER MOD Single : A 22 LYS NZ :NH3+ -165:sc= -0.0183 (180deg=-0.221) USER MOD Single : A 23 MET CE :methyl -175:sc= -0.0066 (180deg=-0.0272) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 29 LYS NZ :NH3+ 169:sc=-0.00712 (180deg=-0.17) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 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 X(o=0,f=-0.0093) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -160:sc= 0 (180deg=-0.302) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ -172:sc= 0.341 (180deg=0.321) 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+ -165:sc=-0.00499 (180deg=-0.144) USER MOD Single : A 101 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0616) USER MOD Single : A 102 LYS NZ :NH3+ 167:sc= -0.023 (180deg=-0.235) USER MOD Single : A 106 ASN : amide:sc= -0.418 X(o=-0.42,f=-0.021) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.891 15.618 14.211 1.00 0.00 N ATOM 2 CA MET A 1 -6.018 16.441 13.000 1.00 0.00 C ATOM 3 C MET A 1 -5.107 15.828 11.934 1.00 0.00 C ATOM 4 O MET A 1 -4.173 15.149 12.358 1.00 0.00 O ATOM 5 CB MET A 1 -5.553 17.857 13.346 1.00 0.00 C ATOM 6 CG MET A 1 -5.959 18.901 12.305 1.00 0.00 C ATOM 7 SD MET A 1 -7.770 19.141 12.196 1.00 0.00 S ATOM 8 CE MET A 1 -7.824 20.604 11.184 1.00 0.00 C ATOM 0 H1 MET A 1 -6.786 15.117 14.386 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.126 14.925 14.081 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.671 16.228 15.024 1.00 0.00 H new ATOM 0 HA MET A 1 -7.043 16.477 12.632 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.966 18.141 14.314 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.468 17.860 13.449 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.487 19.852 12.550 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.579 18.599 11.329 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.862 20.893 11.017 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.299 21.415 11.688 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.345 20.402 10.226 1.00 0.00 H new ATOM 20 N GLU A 2 -5.456 15.965 10.657 1.00 0.00 N ATOM 21 CA GLU A 2 -4.693 15.466 9.504 1.00 0.00 C ATOM 22 C GLU A 2 -4.583 13.941 9.457 1.00 0.00 C ATOM 23 O GLU A 2 -4.428 13.283 10.485 1.00 0.00 O ATOM 24 CB GLU A 2 -3.326 16.153 9.464 1.00 0.00 C ATOM 25 CG GLU A 2 -2.394 15.754 8.319 1.00 0.00 C ATOM 26 CD GLU A 2 -2.990 16.003 6.931 1.00 0.00 C ATOM 27 OE1 GLU A 2 -2.916 17.163 6.474 1.00 0.00 O ATOM 28 OE2 GLU A 2 -3.462 15.019 6.321 1.00 0.00 O ATOM 0 H GLU A 2 -6.312 16.446 10.381 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.246 15.725 8.601 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -3.487 17.230 9.413 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -2.815 15.951 10.406 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -1.461 16.310 8.410 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.146 14.697 8.415 1.00 0.00 H new ATOM 35 N LYS A 3 -4.974 13.395 8.310 1.00 0.00 N ATOM 36 CA LYS A 3 -4.833 11.955 8.049 1.00 0.00 C ATOM 37 C LYS A 3 -4.295 11.738 6.633 1.00 0.00 C ATOM 38 O LYS A 3 -4.864 12.217 5.654 1.00 0.00 O ATOM 39 CB LYS A 3 -6.148 11.176 8.134 1.00 0.00 C ATOM 40 CG LYS A 3 -6.682 11.021 9.560 1.00 0.00 C ATOM 41 CD LYS A 3 -7.457 9.708 9.684 1.00 0.00 C ATOM 42 CE LYS A 3 -7.928 9.420 11.111 1.00 0.00 C ATOM 43 NZ LYS A 3 -9.049 10.297 11.485 1.00 0.00 N ATOM 0 H LYS A 3 -5.391 13.922 7.543 1.00 0.00 H new ATOM 0 HA LYS A 3 -4.159 11.588 8.823 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -6.899 11.682 7.527 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.002 10.186 7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.856 11.035 10.271 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -7.330 11.861 9.809 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -8.322 9.740 9.022 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.826 8.887 9.344 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -8.235 8.377 11.193 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.101 9.564 11.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -9.349 10.081 12.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -8.746 11.290 11.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -9.845 10.140 10.834 1.00 0.00 H new ATOM 57 N LYS A 4 -3.356 10.798 6.583 1.00 0.00 N ATOM 58 CA LYS A 4 -2.691 10.421 5.328 1.00 0.00 C ATOM 59 C LYS A 4 -3.204 9.103 4.745 1.00 0.00 C ATOM 60 O LYS A 4 -3.635 8.203 5.464 1.00 0.00 O ATOM 61 CB LYS A 4 -1.176 10.398 5.543 1.00 0.00 C ATOM 62 CG LYS A 4 -0.482 11.643 4.986 1.00 0.00 C ATOM 63 CD LYS A 4 -0.854 12.939 5.709 1.00 0.00 C ATOM 64 CE LYS A 4 -0.338 14.185 4.986 1.00 0.00 C ATOM 65 NZ LYS A 4 -1.095 14.434 3.750 1.00 0.00 N ATOM 0 H LYS A 4 -3.033 10.278 7.399 1.00 0.00 H new ATOM 0 HA LYS A 4 -2.937 11.176 4.581 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -0.966 10.316 6.609 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -0.759 9.511 5.067 1.00 0.00 H new ATOM 0 HG2 LYS A 4 0.597 11.502 5.046 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.732 11.744 3.930 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -1.938 13.000 5.802 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -0.448 12.916 6.720 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -0.417 15.050 5.645 1.00 0.00 H new ATOM 0 HE3 LYS A 4 0.719 14.060 4.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -0.988 15.430 3.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -0.732 13.822 2.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -2.101 14.226 3.911 1.00 0.00 H new ATOM 79 N HIS A 5 -3.133 9.039 3.419 1.00 0.00 N ATOM 80 CA HIS A 5 -3.702 7.959 2.599 1.00 0.00 C ATOM 81 C HIS A 5 -2.641 7.003 2.053 1.00 0.00 C ATOM 82 O HIS A 5 -1.762 7.351 1.265 1.00 0.00 O ATOM 83 CB HIS A 5 -4.542 8.546 1.463 1.00 0.00 C ATOM 84 CG HIS A 5 -5.848 9.156 1.979 1.00 0.00 C ATOM 85 ND1 HIS A 5 -7.006 8.514 2.098 1.00 0.00 N ATOM 86 CD2 HIS A 5 -6.064 10.500 2.262 1.00 0.00 C ATOM 87 CE1 HIS A 5 -7.891 9.457 2.412 1.00 0.00 C ATOM 88 NE2 HIS A 5 -7.355 10.668 2.530 1.00 0.00 N ATOM 0 H HIS A 5 -2.666 9.755 2.863 1.00 0.00 H new ATOM 0 HA HIS A 5 -4.342 7.366 3.252 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -3.965 9.310 0.941 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -4.767 7.765 0.737 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -5.312 11.275 2.264 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -8.943 9.258 2.557 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -7.831 11.537 2.773 1.00 0.00 H new ATOM 96 N ILE A 6 -2.775 5.767 2.526 1.00 0.00 N ATOM 97 CA ILE A 6 -1.918 4.622 2.182 1.00 0.00 C ATOM 98 C ILE A 6 -2.809 3.616 1.450 1.00 0.00 C ATOM 99 O ILE A 6 -3.683 2.982 2.039 1.00 0.00 O ATOM 100 CB ILE A 6 -1.305 4.009 3.442 1.00 0.00 C ATOM 101 CG1 ILE A 6 -0.518 5.053 4.239 1.00 0.00 C ATOM 102 CG2 ILE A 6 -0.424 2.815 3.071 1.00 0.00 C ATOM 103 CD1 ILE A 6 -0.124 4.615 5.651 1.00 0.00 C ATOM 0 H ILE A 6 -3.512 5.519 3.187 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.084 4.927 1.550 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.113 3.655 4.082 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.387 5.306 3.686 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -1.114 5.963 4.308 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.007 2.386 3.975 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.027 2.062 2.564 1.00 0.00 H new ATOM 0 HG23 ILE A 6 0.376 3.145 2.409 1.00 0.00 H new ATOM 0 HD11 ILE A 6 0.429 5.417 6.140 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -1.022 4.391 6.226 1.00 0.00 H new ATOM 0 HD13 ILE A 6 0.502 3.725 5.594 1.00 0.00 H new ATOM 115 N TYR A 7 -2.574 3.508 0.145 1.00 0.00 N ATOM 116 CA TYR A 7 -3.366 2.609 -0.708 1.00 0.00 C ATOM 117 C TYR A 7 -2.553 1.432 -1.249 1.00 0.00 C ATOM 118 O TYR A 7 -1.469 1.582 -1.810 1.00 0.00 O ATOM 119 CB TYR A 7 -4.036 3.365 -1.857 1.00 0.00 C ATOM 120 CG TYR A 7 -5.018 4.479 -1.490 1.00 0.00 C ATOM 121 CD1 TYR A 7 -5.722 4.529 -0.293 1.00 0.00 C ATOM 122 CD2 TYR A 7 -5.242 5.416 -2.493 1.00 0.00 C ATOM 123 CE1 TYR A 7 -6.655 5.538 -0.087 1.00 0.00 C ATOM 124 CE2 TYR A 7 -6.162 6.438 -2.289 1.00 0.00 C ATOM 125 CZ TYR A 7 -6.866 6.475 -1.091 1.00 0.00 C ATOM 126 OH TYR A 7 -7.877 7.379 -0.979 1.00 0.00 O ATOM 0 H TYR A 7 -1.847 4.026 -0.348 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.142 2.197 -0.064 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.252 3.799 -2.477 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.566 2.639 -2.474 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -5.545 3.788 0.473 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.703 5.350 -3.427 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.208 5.593 0.839 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -6.327 7.189 -3.047 1.00 0.00 H new ATOM 0 HH TYR A 7 -7.809 7.841 -0.117 1.00 0.00 H new ATOM 136 N LEU A 8 -3.137 0.254 -1.043 1.00 0.00 N ATOM 137 CA LEU A 8 -2.573 -1.047 -1.428 1.00 0.00 C ATOM 138 C LEU A 8 -3.298 -1.623 -2.647 1.00 0.00 C ATOM 139 O LEU A 8 -4.518 -1.532 -2.771 1.00 0.00 O ATOM 140 CB LEU A 8 -2.650 -2.061 -0.286 1.00 0.00 C ATOM 141 CG LEU A 8 -1.599 -1.867 0.809 1.00 0.00 C ATOM 142 CD1 LEU A 8 -1.997 -0.730 1.752 1.00 0.00 C ATOM 143 CD2 LEU A 8 -1.439 -3.153 1.621 1.00 0.00 C ATOM 0 H LEU A 8 -4.046 0.171 -0.589 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.526 -0.869 -1.673 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.641 -2.006 0.165 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.544 -3.064 -0.700 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.655 -1.615 0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.234 -0.612 2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.088 0.197 1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.953 -0.964 2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.688 -3.002 2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.392 -3.412 2.083 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.123 -3.962 0.963 1.00 0.00 H new ATOM 155 N PHE A 9 -2.486 -2.141 -3.565 1.00 0.00 N ATOM 156 CA PHE A 9 -2.950 -2.658 -4.860 1.00 0.00 C ATOM 157 C PHE A 9 -2.397 -4.035 -5.227 1.00 0.00 C ATOM 158 O PHE A 9 -1.221 -4.340 -5.035 1.00 0.00 O ATOM 159 CB PHE A 9 -2.602 -1.661 -5.969 1.00 0.00 C ATOM 160 CG PHE A 9 -3.362 -0.337 -5.876 1.00 0.00 C ATOM 161 CD1 PHE A 9 -2.811 0.724 -5.168 1.00 0.00 C ATOM 162 CD2 PHE A 9 -4.508 -0.153 -6.641 1.00 0.00 C ATOM 163 CE1 PHE A 9 -3.377 1.990 -5.264 1.00 0.00 C ATOM 164 CE2 PHE A 9 -5.086 1.108 -6.728 1.00 0.00 C ATOM 165 CZ PHE A 9 -4.507 2.176 -6.054 1.00 0.00 C ATOM 0 H PHE A 9 -1.477 -2.217 -3.435 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.029 -2.780 -4.761 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -1.532 -1.457 -5.937 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -2.810 -2.121 -6.935 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -1.944 0.565 -4.544 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -4.948 -0.988 -7.166 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -2.943 2.822 -4.730 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -5.980 1.257 -7.316 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.939 3.162 -6.144 1.00 0.00 H new HETATM 175 N CSP A 10 -3.341 -4.857 -5.676 1.00 0.00 N HETATM 176 CA CSP A 10 -3.130 -6.152 -6.340 1.00 0.00 C HETATM 177 CB CSP A 10 -3.218 -7.359 -5.403 1.00 0.00 C HETATM 178 SG CSP A 10 -4.908 -7.919 -4.982 1.00 0.00 S HETATM 179 C CSP A 10 -4.179 -6.269 -7.447 1.00 0.00 C HETATM 180 O CSP A 10 -5.107 -5.463 -7.489 1.00 0.00 O HETATM 181 P CSP A 10 -4.862 -10.037 -5.292 1.00 0.00 P HETATM 182 O1P CSP A 10 -6.082 -10.514 -4.604 1.00 0.00 O HETATM 183 O2P CSP A 10 -3.514 -10.532 -4.937 1.00 0.00 O HETATM 184 O3P CSP A 10 -5.082 -10.222 -6.875 1.00 0.00 O HETATM 0 HB3 CSP A 10 -2.684 -8.191 -5.862 1.00 0.00 H new HETATM 0 HB2 CSP A 10 -2.695 -7.116 -4.478 1.00 0.00 H new HETATM 0 HA CSP A 10 -2.112 -6.170 -6.730 1.00 0.00 H new ATOM 190 N SER A 11 -4.123 -7.339 -8.235 1.00 0.00 N ATOM 191 CA SER A 11 -5.030 -7.565 -9.369 1.00 0.00 C ATOM 192 C SER A 11 -6.516 -7.493 -9.015 1.00 0.00 C ATOM 193 O SER A 11 -7.326 -6.932 -9.750 1.00 0.00 O ATOM 194 CB SER A 11 -4.751 -8.938 -9.983 1.00 0.00 C ATOM 195 OG SER A 11 -3.355 -9.129 -10.227 1.00 0.00 O ATOM 0 H SER A 11 -3.440 -8.086 -8.107 1.00 0.00 H new ATOM 0 HA SER A 11 -4.830 -6.754 -10.069 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.114 -9.718 -9.314 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.302 -9.038 -10.918 1.00 0.00 H new ATOM 0 HG SER A 11 -3.210 -10.016 -10.618 1.00 0.00 H new ATOM 201 N ALA A 12 -6.891 -8.115 -7.900 1.00 0.00 N ATOM 202 CA ALA A 12 -8.291 -8.175 -7.457 1.00 0.00 C ATOM 203 C ALA A 12 -8.652 -7.287 -6.264 1.00 0.00 C ATOM 204 O ALA A 12 -9.786 -6.820 -6.169 1.00 0.00 O ATOM 205 CB ALA A 12 -8.635 -9.636 -7.163 1.00 0.00 C ATOM 0 H ALA A 12 -6.239 -8.592 -7.277 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.889 -7.769 -8.272 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.671 -9.706 -6.832 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -8.502 -10.230 -8.067 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.977 -10.014 -6.380 1.00 0.00 H new ATOM 211 N GLY A 13 -7.698 -7.078 -5.363 1.00 0.00 N ATOM 212 CA GLY A 13 -7.869 -6.315 -4.118 1.00 0.00 C ATOM 213 C GLY A 13 -8.296 -7.139 -2.902 1.00 0.00 C ATOM 214 O GLY A 13 -8.674 -6.551 -1.890 1.00 0.00 O ATOM 0 H GLY A 13 -6.753 -7.444 -5.477 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.929 -5.814 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.612 -5.536 -4.288 1.00 0.00 H new ATOM 218 N MET A 14 -8.160 -8.462 -2.954 1.00 0.00 N ATOM 219 CA MET A 14 -8.652 -9.318 -1.866 1.00 0.00 C ATOM 220 C MET A 14 -7.602 -9.883 -0.907 1.00 0.00 C ATOM 221 O MET A 14 -7.822 -9.849 0.303 1.00 0.00 O ATOM 222 CB MET A 14 -9.582 -10.420 -2.380 1.00 0.00 C ATOM 223 CG MET A 14 -8.959 -11.381 -3.394 1.00 0.00 C ATOM 224 SD MET A 14 -9.964 -12.879 -3.707 1.00 0.00 S ATOM 225 CE MET A 14 -11.377 -12.202 -4.552 1.00 0.00 C ATOM 0 H MET A 14 -7.720 -8.964 -3.725 1.00 0.00 H new ATOM 0 HA MET A 14 -9.220 -8.622 -1.248 1.00 0.00 H new ATOM 0 HB2 MET A 14 -9.939 -10.998 -1.528 1.00 0.00 H new ATOM 0 HB3 MET A 14 -10.455 -9.953 -2.836 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.808 -10.853 -4.336 1.00 0.00 H new ATOM 0 HG3 MET A 14 -7.975 -11.683 -3.037 1.00 0.00 H new ATOM 0 HE1 MET A 14 -12.071 -13.005 -4.802 1.00 0.00 H new ATOM 0 HE2 MET A 14 -11.876 -11.479 -3.906 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.051 -11.707 -5.467 1.00 0.00 H new ATOM 235 N SER A 15 -6.459 -10.343 -1.409 1.00 0.00 N ATOM 236 CA SER A 15 -5.391 -10.933 -0.590 1.00 0.00 C ATOM 237 C SER A 15 -4.851 -9.993 0.491 1.00 0.00 C ATOM 238 O SER A 15 -4.616 -10.391 1.630 1.00 0.00 O ATOM 239 CB SER A 15 -4.208 -11.364 -1.461 1.00 0.00 C ATOM 240 OG SER A 15 -3.575 -10.202 -2.001 1.00 0.00 O ATOM 0 H SER A 15 -6.241 -10.319 -2.405 1.00 0.00 H new ATOM 0 HA SER A 15 -5.856 -11.789 -0.100 1.00 0.00 H new ATOM 0 HB2 SER A 15 -3.496 -11.939 -0.869 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.551 -12.013 -2.266 1.00 0.00 H new ATOM 0 HG SER A 15 -3.477 -10.304 -2.971 1.00 0.00 H new ATOM 246 N THR A 16 -4.792 -8.714 0.133 1.00 0.00 N ATOM 247 CA THR A 16 -4.278 -7.595 0.937 1.00 0.00 C ATOM 248 C THR A 16 -5.096 -7.311 2.197 1.00 0.00 C ATOM 249 O THR A 16 -4.536 -6.835 3.185 1.00 0.00 O ATOM 250 CB THR A 16 -4.292 -6.329 0.077 1.00 0.00 C ATOM 251 OG1 THR A 16 -5.578 -6.263 -0.544 1.00 0.00 O ATOM 252 CG2 THR A 16 -3.158 -6.302 -0.949 1.00 0.00 C ATOM 0 H THR A 16 -5.121 -8.405 -0.782 1.00 0.00 H new ATOM 0 HA THR A 16 -3.275 -7.878 1.256 1.00 0.00 H new ATOM 0 HB THR A 16 -4.121 -5.452 0.701 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.534 -5.674 -1.326 1.00 0.00 H new ATOM 0 HG21 THR A 16 -3.216 -5.382 -1.531 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.199 -6.345 -0.433 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.250 -7.160 -1.615 1.00 0.00 H new ATOM 260 N SER A 17 -6.362 -7.718 2.197 1.00 0.00 N ATOM 261 CA SER A 17 -7.332 -7.452 3.270 1.00 0.00 C ATOM 262 C SER A 17 -6.807 -7.721 4.681 1.00 0.00 C ATOM 263 O SER A 17 -6.736 -6.802 5.496 1.00 0.00 O ATOM 264 CB SER A 17 -8.603 -8.267 3.019 1.00 0.00 C ATOM 265 OG SER A 17 -9.540 -8.080 4.083 1.00 0.00 O ATOM 0 H SER A 17 -6.760 -8.259 1.429 1.00 0.00 H new ATOM 0 HA SER A 17 -7.539 -6.382 3.235 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.054 -7.966 2.073 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.352 -9.324 2.930 1.00 0.00 H new ATOM 0 HG SER A 17 -10.347 -8.607 3.905 1.00 0.00 H new ATOM 271 N LEU A 18 -6.231 -8.902 4.891 1.00 0.00 N ATOM 272 CA LEU A 18 -5.674 -9.269 6.201 1.00 0.00 C ATOM 273 C LEU A 18 -4.512 -8.367 6.624 1.00 0.00 C ATOM 274 O LEU A 18 -4.477 -7.903 7.761 1.00 0.00 O ATOM 275 CB LEU A 18 -5.293 -10.751 6.232 1.00 0.00 C ATOM 276 CG LEU A 18 -4.615 -11.167 7.539 1.00 0.00 C ATOM 277 CD1 LEU A 18 -5.562 -11.105 8.739 1.00 0.00 C ATOM 278 CD2 LEU A 18 -4.040 -12.579 7.409 1.00 0.00 C ATOM 0 H LEU A 18 -6.135 -9.623 4.176 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.458 -9.108 6.941 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.189 -11.354 6.086 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.625 -10.966 5.398 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.812 -10.453 7.720 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.029 -11.410 9.639 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.927 -10.085 8.862 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.405 -11.775 8.572 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.560 -12.864 8.345 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.844 -13.280 7.185 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.306 -12.600 6.604 1.00 0.00 H new ATOM 290 N LEU A 19 -3.584 -8.117 5.704 1.00 0.00 N ATOM 291 CA LEU A 19 -2.472 -7.182 5.927 1.00 0.00 C ATOM 292 C LEU A 19 -2.973 -5.782 6.290 1.00 0.00 C ATOM 293 O LEU A 19 -2.621 -5.284 7.357 1.00 0.00 O ATOM 294 CB LEU A 19 -1.577 -7.147 4.687 1.00 0.00 C ATOM 295 CG LEU A 19 -0.368 -6.222 4.844 1.00 0.00 C ATOM 296 CD1 LEU A 19 0.644 -6.726 5.875 1.00 0.00 C ATOM 297 CD2 LEU A 19 0.327 -6.061 3.490 1.00 0.00 C ATOM 0 H LEU A 19 -3.577 -8.554 4.782 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.888 -7.535 6.777 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.228 -8.157 4.469 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.167 -6.822 3.830 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.744 -5.265 5.206 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.477 -6.026 5.939 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.162 -6.806 6.849 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.015 -7.705 5.572 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.189 -5.402 3.599 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.659 -7.036 3.133 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.371 -5.630 2.772 1.00 0.00 H new ATOM 309 N VAL A 20 -3.963 -5.292 5.550 1.00 0.00 N ATOM 310 CA VAL A 20 -4.613 -3.992 5.767 1.00 0.00 C ATOM 311 C VAL A 20 -5.217 -3.945 7.172 1.00 0.00 C ATOM 312 O VAL A 20 -4.921 -3.026 7.933 1.00 0.00 O ATOM 313 CB VAL A 20 -5.691 -3.748 4.708 1.00 0.00 C ATOM 314 CG1 VAL A 20 -6.503 -2.471 4.934 1.00 0.00 C ATOM 315 CG2 VAL A 20 -5.067 -3.634 3.315 1.00 0.00 C ATOM 0 H VAL A 20 -4.352 -5.801 4.756 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.867 -3.203 5.677 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.357 -4.607 4.789 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.246 -2.368 4.143 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.006 -2.526 5.900 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -5.836 -1.609 4.920 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.851 -3.461 2.578 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.363 -2.802 3.299 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.541 -4.558 3.075 1.00 0.00 H new ATOM 325 N SER A 21 -5.978 -4.977 7.528 1.00 0.00 N ATOM 326 CA SER A 21 -6.607 -5.103 8.850 1.00 0.00 C ATOM 327 C SER A 21 -5.593 -5.035 9.994 1.00 0.00 C ATOM 328 O SER A 21 -5.781 -4.305 10.966 1.00 0.00 O ATOM 329 CB SER A 21 -7.376 -6.422 8.942 1.00 0.00 C ATOM 330 OG SER A 21 -8.444 -6.399 7.992 1.00 0.00 O ATOM 0 H SER A 21 -6.180 -5.759 6.905 1.00 0.00 H new ATOM 0 HA SER A 21 -7.286 -4.257 8.956 1.00 0.00 H new ATOM 0 HB2 SER A 21 -6.711 -7.262 8.742 1.00 0.00 H new ATOM 0 HB3 SER A 21 -7.769 -6.560 9.949 1.00 0.00 H new ATOM 0 HG SER A 21 -8.080 -6.501 7.088 1.00 0.00 H new ATOM 336 N LYS A 22 -4.485 -5.754 9.838 1.00 0.00 N ATOM 337 CA LYS A 22 -3.372 -5.727 10.798 1.00 0.00 C ATOM 338 C LYS A 22 -2.670 -4.369 10.851 1.00 0.00 C ATOM 339 O LYS A 22 -2.395 -3.878 11.945 1.00 0.00 O ATOM 340 CB LYS A 22 -2.327 -6.806 10.509 1.00 0.00 C ATOM 341 CG LYS A 22 -2.849 -8.221 10.766 1.00 0.00 C ATOM 342 CD LYS A 22 -1.680 -9.208 10.735 1.00 0.00 C ATOM 343 CE LYS A 22 -2.073 -10.625 11.153 1.00 0.00 C ATOM 344 NZ LYS A 22 -2.512 -10.657 12.555 1.00 0.00 N ATOM 0 H LYS A 22 -4.328 -6.374 9.044 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.833 -5.924 11.766 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.006 -6.725 9.471 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.448 -6.630 11.129 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.351 -8.265 11.733 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.587 -8.491 10.011 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.264 -9.236 9.728 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.892 -8.847 11.396 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.873 -10.989 10.509 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.225 -11.296 11.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.529 -11.641 12.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.852 -10.104 13.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -3.466 -10.249 12.630 1.00 0.00 H new ATOM 358 N MET A 23 -2.461 -3.756 9.690 1.00 0.00 N ATOM 359 CA MET A 23 -1.882 -2.412 9.569 1.00 0.00 C ATOM 360 C MET A 23 -2.766 -1.373 10.263 1.00 0.00 C ATOM 361 O MET A 23 -2.275 -0.638 11.118 1.00 0.00 O ATOM 362 CB MET A 23 -1.673 -1.979 8.117 1.00 0.00 C ATOM 363 CG MET A 23 -0.562 -2.714 7.363 1.00 0.00 C ATOM 364 SD MET A 23 -0.450 -2.264 5.592 1.00 0.00 S ATOM 365 CE MET A 23 0.262 -0.634 5.645 1.00 0.00 C ATOM 0 H MET A 23 -2.690 -4.180 8.791 1.00 0.00 H new ATOM 0 HA MET A 23 -0.906 -2.466 10.052 1.00 0.00 H new ATOM 0 HB2 MET A 23 -2.609 -2.119 7.576 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.453 -0.912 8.103 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.393 -2.501 7.844 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.728 -3.788 7.446 1.00 0.00 H new ATOM 0 HE1 MET A 23 0.297 -0.219 4.638 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.347 0.009 6.281 1.00 0.00 H new ATOM 0 HE3 MET A 23 1.273 -0.691 6.049 1.00 0.00 H new ATOM 375 N ARG A 24 -4.076 -1.470 10.051 1.00 0.00 N ATOM 376 CA ARG A 24 -5.092 -0.640 10.716 1.00 0.00 C ATOM 377 C ARG A 24 -5.082 -0.828 12.234 1.00 0.00 C ATOM 378 O ARG A 24 -4.794 0.133 12.947 1.00 0.00 O ATOM 379 CB ARG A 24 -6.500 -0.905 10.180 1.00 0.00 C ATOM 380 CG ARG A 24 -6.822 -0.121 8.906 1.00 0.00 C ATOM 381 CD ARG A 24 -8.287 -0.294 8.499 1.00 0.00 C ATOM 382 NE ARG A 24 -8.709 0.704 7.505 1.00 0.00 N ATOM 383 CZ ARG A 24 -9.303 1.878 7.752 1.00 0.00 C ATOM 384 NH1 ARG A 24 -9.562 2.291 9.001 1.00 0.00 N ATOM 385 NH2 ARG A 24 -9.744 2.636 6.738 1.00 0.00 N ATOM 0 H ARG A 24 -4.476 -2.143 9.397 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.824 0.392 10.488 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.610 -1.971 9.980 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.228 -0.649 10.950 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.609 0.936 9.064 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.175 -0.459 8.096 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.433 -1.294 8.092 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.920 -0.214 9.383 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.531 0.479 6.526 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.305 1.705 9.795 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.016 3.191 9.157 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.627 2.319 5.776 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.196 3.530 6.929 1.00 0.00 H new ATOM 399 N ALA A 25 -5.030 -2.080 12.679 1.00 0.00 N ATOM 400 CA ALA A 25 -4.982 -2.405 14.113 1.00 0.00 C ATOM 401 C ALA A 25 -3.725 -1.894 14.820 1.00 0.00 C ATOM 402 O ALA A 25 -3.769 -1.466 15.972 1.00 0.00 O ATOM 403 CB ALA A 25 -5.099 -3.925 14.259 1.00 0.00 C ATOM 0 H ALA A 25 -5.020 -2.896 12.067 1.00 0.00 H new ATOM 0 HA ALA A 25 -5.813 -1.895 14.600 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.066 -4.193 15.315 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.043 -4.260 13.829 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.272 -4.405 13.737 1.00 0.00 H new ATOM 409 N GLN A 26 -2.592 -1.960 14.128 1.00 0.00 N ATOM 410 CA GLN A 26 -1.317 -1.410 14.610 1.00 0.00 C ATOM 411 C GLN A 26 -1.321 0.120 14.594 1.00 0.00 C ATOM 412 O GLN A 26 -0.873 0.737 15.560 1.00 0.00 O ATOM 413 CB GLN A 26 -0.136 -1.928 13.785 1.00 0.00 C ATOM 414 CG GLN A 26 0.132 -3.432 13.852 1.00 0.00 C ATOM 415 CD GLN A 26 0.707 -3.961 15.168 1.00 0.00 C ATOM 416 OE1 GLN A 26 1.074 -3.251 16.103 1.00 0.00 O ATOM 417 NE2 GLN A 26 0.932 -5.269 15.257 1.00 0.00 N ATOM 0 H GLN A 26 -2.526 -2.399 13.210 1.00 0.00 H new ATOM 0 HA GLN A 26 -1.201 -1.747 15.640 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.302 -1.657 12.742 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.764 -1.406 14.111 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -0.803 -3.955 13.653 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.821 -3.693 13.048 1.00 0.00 H new ATOM 0 HE21 GLN A 26 0.642 -5.889 14.501 1.00 0.00 H new ATOM 0 HE22 GLN A 26 1.395 -5.652 16.081 1.00 0.00 H new ATOM 426 N ALA A 27 -1.971 0.711 13.596 1.00 0.00 N ATOM 427 CA ALA A 27 -2.182 2.162 13.489 1.00 0.00 C ATOM 428 C ALA A 27 -3.042 2.679 14.643 1.00 0.00 C ATOM 429 O ALA A 27 -2.698 3.702 15.232 1.00 0.00 O ATOM 430 CB ALA A 27 -2.864 2.496 12.160 1.00 0.00 C ATOM 0 H ALA A 27 -2.377 0.189 12.819 1.00 0.00 H new ATOM 0 HA ALA A 27 -1.207 2.648 13.535 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.016 3.573 12.090 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.235 2.164 11.334 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.828 1.989 12.108 1.00 0.00 H new ATOM 436 N GLU A 28 -4.049 1.903 15.032 1.00 0.00 N ATOM 437 CA GLU A 28 -4.927 2.184 16.178 1.00 0.00 C ATOM 438 C GLU A 28 -4.171 2.065 17.502 1.00 0.00 C ATOM 439 O GLU A 28 -4.168 2.995 18.306 1.00 0.00 O ATOM 440 CB GLU A 28 -6.094 1.195 16.145 1.00 0.00 C ATOM 441 CG GLU A 28 -7.078 1.491 15.011 1.00 0.00 C ATOM 442 CD GLU A 28 -8.168 0.430 14.844 1.00 0.00 C ATOM 443 OE1 GLU A 28 -8.886 0.175 15.834 1.00 0.00 O ATOM 444 OE2 GLU A 28 -8.316 -0.028 13.690 1.00 0.00 O ATOM 0 H GLU A 28 -4.289 1.037 14.550 1.00 0.00 H new ATOM 0 HA GLU A 28 -5.295 3.208 16.105 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.706 0.183 16.031 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.622 1.228 17.098 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.549 2.456 15.195 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.524 1.579 14.076 1.00 0.00 H new ATOM 451 N LYS A 29 -3.366 1.011 17.607 1.00 0.00 N ATOM 452 CA LYS A 29 -2.512 0.729 18.770 1.00 0.00 C ATOM 453 C LYS A 29 -1.514 1.853 19.060 1.00 0.00 C ATOM 454 O LYS A 29 -1.146 2.073 20.213 1.00 0.00 O ATOM 455 CB LYS A 29 -1.774 -0.586 18.517 1.00 0.00 C ATOM 456 CG LYS A 29 -0.960 -1.006 19.743 1.00 0.00 C ATOM 457 CD LYS A 29 -0.138 -2.275 19.506 1.00 0.00 C ATOM 458 CE LYS A 29 0.719 -2.627 20.723 1.00 0.00 C ATOM 459 NZ LYS A 29 -0.135 -2.973 21.869 1.00 0.00 N ATOM 0 H LYS A 29 -3.283 0.309 16.871 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.148 0.653 19.652 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -2.492 -1.367 18.268 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.112 -0.476 17.658 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -0.291 -0.193 20.024 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.635 -1.168 20.583 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.807 -3.105 19.279 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.504 -2.136 18.636 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.375 -3.464 20.484 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.360 -1.784 20.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.448 -3.386 22.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.604 -2.115 22.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.854 -3.663 21.570 1.00 0.00 H new ATOM 473 N TYR A 30 -0.928 2.374 17.986 1.00 0.00 N ATOM 474 CA TYR A 30 0.084 3.439 18.047 1.00 0.00 C ATOM 475 C TYR A 30 -0.436 4.815 17.625 1.00 0.00 C ATOM 476 O TYR A 30 0.344 5.672 17.213 1.00 0.00 O ATOM 477 CB TYR A 30 1.282 3.025 17.189 1.00 0.00 C ATOM 478 CG TYR A 30 2.013 1.787 17.709 1.00 0.00 C ATOM 479 CD1 TYR A 30 2.642 1.799 18.948 1.00 0.00 C ATOM 480 CD2 TYR A 30 1.987 0.643 16.920 1.00 0.00 C ATOM 481 CE1 TYR A 30 3.246 0.638 19.418 1.00 0.00 C ATOM 482 CE2 TYR A 30 2.590 -0.521 17.383 1.00 0.00 C ATOM 483 CZ TYR A 30 3.206 -0.506 18.629 1.00 0.00 C ATOM 484 OH TYR A 30 3.668 -1.680 19.137 1.00 0.00 O ATOM 0 H TYR A 30 -1.140 2.070 17.036 1.00 0.00 H new ATOM 0 HA TYR A 30 0.376 3.553 19.091 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.940 2.833 16.172 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.985 3.856 17.138 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.662 2.702 19.540 1.00 0.00 H new ATOM 0 HD2 TYR A 30 1.502 0.658 15.955 1.00 0.00 H new ATOM 0 HE1 TYR A 30 3.738 0.625 20.379 1.00 0.00 H new ATOM 0 HE2 TYR A 30 2.580 -1.421 16.785 1.00 0.00 H new ATOM 0 HH TYR A 30 3.572 -2.387 18.466 1.00 0.00 H new ATOM 494 N GLU A 31 -1.746 5.005 17.761 1.00 0.00 N ATOM 495 CA GLU A 31 -2.521 6.199 17.397 1.00 0.00 C ATOM 496 C GLU A 31 -1.968 7.051 16.252 1.00 0.00 C ATOM 497 O GLU A 31 -1.973 8.281 16.243 1.00 0.00 O ATOM 498 CB GLU A 31 -2.858 7.020 18.643 1.00 0.00 C ATOM 499 CG GLU A 31 -1.643 7.518 19.427 1.00 0.00 C ATOM 500 CD GLU A 31 -2.106 8.379 20.605 1.00 0.00 C ATOM 501 OE1 GLU A 31 -2.394 9.572 20.363 1.00 0.00 O ATOM 502 OE2 GLU A 31 -2.218 7.807 21.710 1.00 0.00 O ATOM 0 H GLU A 31 -2.342 4.278 18.157 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.443 5.812 16.964 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -3.458 7.880 18.344 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.477 6.414 19.305 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.060 6.671 19.790 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.990 8.098 18.775 1.00 0.00 H new ATOM 509 N VAL A 32 -1.841 6.351 15.129 1.00 0.00 N ATOM 510 CA VAL A 32 -1.322 6.872 13.857 1.00 0.00 C ATOM 511 C VAL A 32 -2.517 7.265 12.986 1.00 0.00 C ATOM 512 O VAL A 32 -3.230 6.392 12.495 1.00 0.00 O ATOM 513 CB VAL A 32 -0.455 5.830 13.149 1.00 0.00 C ATOM 514 CG1 VAL A 32 0.211 6.415 11.901 1.00 0.00 C ATOM 515 CG2 VAL A 32 0.648 5.258 14.043 1.00 0.00 C ATOM 0 H VAL A 32 -2.105 5.367 15.072 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.690 7.740 14.043 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.141 5.027 12.879 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.820 5.649 11.421 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.556 6.757 11.206 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.844 7.256 12.186 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.227 4.525 13.482 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.304 6.064 14.372 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.199 4.778 14.912 1.00 0.00 H new ATOM 525 N PRO A 33 -2.714 8.556 12.734 1.00 0.00 N ATOM 526 CA PRO A 33 -3.851 9.015 11.921 1.00 0.00 C ATOM 527 C PRO A 33 -3.630 8.830 10.419 1.00 0.00 C ATOM 528 O PRO A 33 -3.235 9.725 9.673 1.00 0.00 O ATOM 529 CB PRO A 33 -4.063 10.472 12.338 1.00 0.00 C ATOM 530 CG PRO A 33 -2.666 10.938 12.758 1.00 0.00 C ATOM 531 CD PRO A 33 -2.033 9.690 13.375 1.00 0.00 C ATOM 0 HA PRO A 33 -4.745 8.419 12.101 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -4.454 11.071 11.515 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -4.776 10.554 13.159 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.091 11.297 11.904 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -2.717 11.757 13.476 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.959 9.660 13.190 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.171 9.672 14.456 1.00 0.00 H new ATOM 539 N VAL A 34 -3.939 7.606 9.998 1.00 0.00 N ATOM 540 CA VAL A 34 -3.864 7.151 8.603 1.00 0.00 C ATOM 541 C VAL A 34 -5.081 6.323 8.187 1.00 0.00 C ATOM 542 O VAL A 34 -5.810 5.764 9.006 1.00 0.00 O ATOM 543 CB VAL A 34 -2.579 6.377 8.298 1.00 0.00 C ATOM 544 CG1 VAL A 34 -1.369 7.312 8.311 1.00 0.00 C ATOM 545 CG2 VAL A 34 -2.330 5.195 9.239 1.00 0.00 C ATOM 0 H VAL A 34 -4.259 6.877 10.635 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.855 8.065 8.010 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.718 5.959 7.301 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.466 6.742 8.092 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.500 8.088 7.556 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.277 7.774 9.294 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.402 4.697 8.960 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.254 5.556 10.265 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.157 4.489 9.164 1.00 0.00 H new ATOM 555 N ILE A 35 -5.338 6.404 6.885 1.00 0.00 N ATOM 556 CA ILE A 35 -6.375 5.645 6.172 1.00 0.00 C ATOM 557 C ILE A 35 -5.660 4.657 5.246 1.00 0.00 C ATOM 558 O ILE A 35 -4.967 5.028 4.301 1.00 0.00 O ATOM 559 CB ILE A 35 -7.322 6.582 5.422 1.00 0.00 C ATOM 560 CG1 ILE A 35 -8.069 7.463 6.426 1.00 0.00 C ATOM 561 CG2 ILE A 35 -8.320 5.793 4.570 1.00 0.00 C ATOM 562 CD1 ILE A 35 -8.803 8.665 5.829 1.00 0.00 C ATOM 0 H ILE A 35 -4.812 7.023 6.268 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.006 5.093 6.868 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.732 7.208 4.753 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.793 6.845 6.957 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.355 7.826 7.166 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.980 6.486 4.048 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.779 5.189 3.841 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -8.912 5.142 5.213 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.298 9.221 6.625 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.088 9.314 5.324 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -9.547 8.318 5.112 1.00 0.00 H new ATOM 574 N ILE A 36 -5.781 3.395 5.651 1.00 0.00 N ATOM 575 CA ILE A 36 -5.184 2.267 4.921 1.00 0.00 C ATOM 576 C ILE A 36 -6.326 1.481 4.273 1.00 0.00 C ATOM 577 O ILE A 36 -7.201 0.969 4.968 1.00 0.00 O ATOM 578 CB ILE A 36 -4.341 1.400 5.859 1.00 0.00 C ATOM 579 CG1 ILE A 36 -3.354 2.262 6.648 1.00 0.00 C ATOM 580 CG2 ILE A 36 -3.602 0.329 5.054 1.00 0.00 C ATOM 581 CD1 ILE A 36 -2.892 1.628 7.961 1.00 0.00 C ATOM 0 H ILE A 36 -6.292 3.121 6.490 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.504 2.621 4.146 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.002 0.908 6.572 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.482 2.461 6.025 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.818 3.224 6.864 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.004 -0.285 5.728 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.325 -0.301 4.536 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.949 0.808 4.324 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.194 2.298 8.463 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.755 1.454 8.604 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.397 0.679 7.753 1.00 0.00 H new ATOM 593 N GLU A 37 -6.257 1.448 2.945 1.00 0.00 N ATOM 594 CA GLU A 37 -7.329 0.954 2.070 1.00 0.00 C ATOM 595 C GLU A 37 -6.757 0.227 0.851 1.00 0.00 C ATOM 596 O GLU A 37 -5.673 0.538 0.359 1.00 0.00 O ATOM 597 CB GLU A 37 -8.142 2.176 1.640 1.00 0.00 C ATOM 598 CG GLU A 37 -9.622 1.887 1.383 1.00 0.00 C ATOM 599 CD GLU A 37 -10.322 1.475 2.679 1.00 0.00 C ATOM 600 OE1 GLU A 37 -10.364 2.294 3.623 1.00 0.00 O ATOM 601 OE2 GLU A 37 -10.713 0.289 2.744 1.00 0.00 O ATOM 0 H GLU A 37 -5.437 1.770 2.430 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.954 0.233 2.597 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.062 2.941 2.412 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.702 2.590 0.733 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -10.104 2.772 0.968 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -9.720 1.094 0.642 1.00 0.00 H new ATOM 608 N ALA A 38 -7.472 -0.824 0.458 1.00 0.00 N ATOM 609 CA ALA A 38 -7.087 -1.697 -0.660 1.00 0.00 C ATOM 610 C ALA A 38 -8.008 -1.601 -1.877 1.00 0.00 C ATOM 611 O ALA A 38 -9.222 -1.445 -1.746 1.00 0.00 O ATOM 612 CB ALA A 38 -7.017 -3.146 -0.172 1.00 0.00 C ATOM 0 H ALA A 38 -8.345 -1.101 0.908 1.00 0.00 H new ATOM 0 HA ALA A 38 -6.110 -1.351 -0.998 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -6.732 -3.795 -1.000 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -6.277 -3.226 0.624 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -7.993 -3.450 0.208 1.00 0.00 H new ATOM 618 N PHE A 39 -7.385 -1.672 -3.050 1.00 0.00 N ATOM 619 CA PHE A 39 -8.044 -1.562 -4.359 1.00 0.00 C ATOM 620 C PHE A 39 -7.438 -2.481 -5.422 1.00 0.00 C ATOM 621 O PHE A 39 -6.274 -2.857 -5.299 1.00 0.00 O ATOM 622 CB PHE A 39 -7.946 -0.120 -4.860 1.00 0.00 C ATOM 623 CG PHE A 39 -8.601 0.925 -3.955 1.00 0.00 C ATOM 624 CD1 PHE A 39 -9.983 1.066 -3.969 1.00 0.00 C ATOM 625 CD2 PHE A 39 -7.813 1.739 -3.150 1.00 0.00 C ATOM 626 CE1 PHE A 39 -10.590 2.027 -3.168 1.00 0.00 C ATOM 627 CE2 PHE A 39 -8.413 2.716 -2.364 1.00 0.00 C ATOM 628 CZ PHE A 39 -9.797 2.849 -2.375 1.00 0.00 C ATOM 0 H PHE A 39 -6.377 -1.812 -3.124 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.080 -1.867 -4.209 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -6.893 0.136 -4.982 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -8.405 -0.062 -5.847 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -10.585 0.430 -4.601 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -6.740 1.613 -3.135 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -11.665 2.134 -3.162 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -7.809 3.367 -1.749 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.263 3.603 -1.758 1.00 0.00 H new ATOM 638 N PRO A 40 -8.201 -2.874 -6.438 1.00 0.00 N ATOM 639 CA PRO A 40 -7.643 -3.515 -7.638 1.00 0.00 C ATOM 640 C PRO A 40 -6.854 -2.545 -8.521 1.00 0.00 C ATOM 641 O PRO A 40 -7.120 -1.345 -8.563 1.00 0.00 O ATOM 642 CB PRO A 40 -8.816 -4.120 -8.410 1.00 0.00 C ATOM 643 CG PRO A 40 -10.054 -3.427 -7.838 1.00 0.00 C ATOM 644 CD PRO A 40 -9.661 -3.039 -6.410 1.00 0.00 C ATOM 0 HA PRO A 40 -6.927 -4.280 -7.337 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.720 -3.940 -9.481 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.867 -5.200 -8.271 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -10.323 -2.550 -8.426 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -10.918 -4.092 -7.844 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -10.155 -2.117 -6.103 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -9.956 -3.810 -5.698 1.00 0.00 H new ATOM 652 N GLU A 41 -5.949 -3.138 -9.295 1.00 0.00 N ATOM 653 CA GLU A 41 -4.964 -2.439 -10.133 1.00 0.00 C ATOM 654 C GLU A 41 -5.578 -1.553 -11.218 1.00 0.00 C ATOM 655 O GLU A 41 -5.032 -0.504 -11.557 1.00 0.00 O ATOM 656 CB GLU A 41 -3.966 -3.443 -10.711 1.00 0.00 C ATOM 657 CG GLU A 41 -4.297 -4.134 -12.035 1.00 0.00 C ATOM 658 CD GLU A 41 -5.434 -5.158 -12.032 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.589 -4.762 -11.761 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.129 -6.307 -12.418 1.00 0.00 O ATOM 0 H GLU A 41 -5.874 -4.153 -9.362 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.436 -1.743 -9.481 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.014 -2.927 -10.837 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.810 -4.221 -9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.541 -3.363 -12.765 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.395 -4.634 -12.388 1.00 0.00 H new ATOM 667 N THR A 42 -6.783 -1.897 -11.666 1.00 0.00 N ATOM 668 CA THR A 42 -7.594 -1.147 -12.636 1.00 0.00 C ATOM 669 C THR A 42 -7.882 0.296 -12.216 1.00 0.00 C ATOM 670 O THR A 42 -7.993 1.194 -13.051 1.00 0.00 O ATOM 671 CB THR A 42 -8.943 -1.831 -12.871 1.00 0.00 C ATOM 672 OG1 THR A 42 -9.612 -2.008 -11.619 1.00 0.00 O ATOM 673 CG2 THR A 42 -8.801 -3.155 -13.623 1.00 0.00 C ATOM 0 H THR A 42 -7.248 -2.748 -11.350 1.00 0.00 H new ATOM 0 HA THR A 42 -6.992 -1.131 -13.544 1.00 0.00 H new ATOM 0 HB THR A 42 -9.546 -1.185 -13.510 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.477 -2.444 -11.769 1.00 0.00 H new ATOM 0 HG21 THR A 42 -9.786 -3.600 -13.765 1.00 0.00 H new ATOM 0 HG22 THR A 42 -8.341 -2.974 -14.595 1.00 0.00 H new ATOM 0 HG23 THR A 42 -8.174 -3.836 -13.046 1.00 0.00 H new ATOM 681 N LEU A 43 -7.871 0.511 -10.904 1.00 0.00 N ATOM 682 CA LEU A 43 -8.122 1.816 -10.274 1.00 0.00 C ATOM 683 C LEU A 43 -6.854 2.524 -9.792 1.00 0.00 C ATOM 684 O LEU A 43 -6.914 3.549 -9.116 1.00 0.00 O ATOM 685 CB LEU A 43 -9.086 1.601 -9.106 1.00 0.00 C ATOM 686 CG LEU A 43 -10.450 1.051 -9.530 1.00 0.00 C ATOM 687 CD1 LEU A 43 -11.255 0.657 -8.291 1.00 0.00 C ATOM 688 CD2 LEU A 43 -11.257 2.063 -10.345 1.00 0.00 C ATOM 0 H LEU A 43 -7.684 -0.230 -10.228 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.551 2.473 -11.030 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.632 0.913 -8.393 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.231 2.548 -8.587 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.265 0.182 -10.161 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.225 0.266 -8.597 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.714 -0.108 -7.734 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.400 1.532 -7.658 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -12.216 1.625 -10.622 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.426 2.959 -9.748 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.705 2.327 -11.247 1.00 0.00 H new ATOM 700 N ALA A 44 -5.711 2.059 -10.289 1.00 0.00 N ATOM 701 CA ALA A 44 -4.382 2.595 -9.959 1.00 0.00 C ATOM 702 C ALA A 44 -4.197 4.066 -10.336 1.00 0.00 C ATOM 703 O ALA A 44 -3.788 4.848 -9.479 1.00 0.00 O ATOM 704 CB ALA A 44 -3.286 1.749 -10.609 1.00 0.00 C ATOM 0 H ALA A 44 -5.676 1.281 -10.948 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.302 2.542 -8.873 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.309 2.160 -10.354 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.354 0.724 -10.245 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.412 1.759 -11.692 1.00 0.00 H new ATOM 710 N GLY A 45 -4.616 4.441 -11.542 1.00 0.00 N ATOM 711 CA GLY A 45 -4.580 5.840 -11.995 1.00 0.00 C ATOM 712 C GLY A 45 -5.458 6.730 -11.113 1.00 0.00 C ATOM 713 O GLY A 45 -4.932 7.535 -10.345 1.00 0.00 O ATOM 0 H GLY A 45 -4.989 3.791 -12.234 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.553 6.205 -11.976 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.920 5.899 -13.029 1.00 0.00 H new ATOM 717 N GLU A 46 -6.716 6.316 -11.002 1.00 0.00 N ATOM 718 CA GLU A 46 -7.784 7.092 -10.355 1.00 0.00 C ATOM 719 C GLU A 46 -7.503 7.356 -8.874 1.00 0.00 C ATOM 720 O GLU A 46 -7.020 8.429 -8.515 1.00 0.00 O ATOM 721 CB GLU A 46 -9.100 6.347 -10.581 1.00 0.00 C ATOM 722 CG GLU A 46 -10.370 7.069 -10.127 1.00 0.00 C ATOM 723 CD GLU A 46 -10.722 6.865 -8.652 1.00 0.00 C ATOM 724 OE1 GLU A 46 -11.388 5.850 -8.353 1.00 0.00 O ATOM 725 OE2 GLU A 46 -10.374 7.716 -7.805 1.00 0.00 O ATOM 0 H GLU A 46 -7.034 5.417 -11.363 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.842 8.084 -10.802 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.192 6.128 -11.645 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.046 5.390 -10.062 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.253 8.136 -10.316 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.206 6.727 -10.738 1.00 0.00 H new ATOM 732 N LYS A 47 -7.415 6.263 -8.122 1.00 0.00 N ATOM 733 CA LYS A 47 -7.230 6.317 -6.664 1.00 0.00 C ATOM 734 C LYS A 47 -5.824 6.762 -6.258 1.00 0.00 C ATOM 735 O LYS A 47 -5.676 7.565 -5.337 1.00 0.00 O ATOM 736 CB LYS A 47 -7.533 4.966 -6.015 1.00 0.00 C ATOM 737 CG LYS A 47 -9.000 4.546 -6.118 1.00 0.00 C ATOM 738 CD LYS A 47 -9.922 5.473 -5.324 1.00 0.00 C ATOM 739 CE LYS A 47 -11.369 4.997 -5.468 1.00 0.00 C ATOM 740 NZ LYS A 47 -12.195 6.040 -4.844 1.00 0.00 N ATOM 0 H LYS A 47 -7.469 5.316 -8.498 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.937 7.065 -6.306 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.912 4.202 -6.483 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.250 5.007 -4.963 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.303 4.544 -7.165 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.111 3.525 -5.752 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.633 5.479 -4.273 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.827 6.496 -5.687 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.634 4.863 -6.517 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.516 4.035 -4.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.198 5.774 -4.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -11.928 6.142 -3.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.044 6.943 -5.336 1.00 0.00 H new ATOM 754 N GLY A 48 -4.847 6.416 -7.092 1.00 0.00 N ATOM 755 CA GLY A 48 -3.435 6.775 -6.895 1.00 0.00 C ATOM 756 C GLY A 48 -3.201 8.286 -6.854 1.00 0.00 C ATOM 757 O GLY A 48 -2.371 8.772 -6.087 1.00 0.00 O ATOM 0 H GLY A 48 -5.011 5.870 -7.938 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -3.080 6.333 -5.964 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -2.841 6.343 -7.700 1.00 0.00 H new ATOM 761 N GLN A 49 -4.067 9.023 -7.546 1.00 0.00 N ATOM 762 CA GLN A 49 -4.064 10.492 -7.582 1.00 0.00 C ATOM 763 C GLN A 49 -4.298 11.136 -6.215 1.00 0.00 C ATOM 764 O GLN A 49 -3.692 12.155 -5.890 1.00 0.00 O ATOM 765 CB GLN A 49 -5.131 10.981 -8.564 1.00 0.00 C ATOM 766 CG GLN A 49 -4.693 10.708 -10.004 1.00 0.00 C ATOM 767 CD GLN A 49 -5.805 10.995 -11.016 1.00 0.00 C ATOM 768 OE1 GLN A 49 -6.519 11.995 -10.956 1.00 0.00 O ATOM 769 NE2 GLN A 49 -5.941 10.152 -12.035 1.00 0.00 N ATOM 0 H GLN A 49 -4.809 8.611 -8.112 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.068 10.795 -7.905 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.077 10.479 -8.363 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.301 12.049 -8.425 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -3.824 11.322 -10.239 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.382 9.667 -10.095 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.352 9.321 -12.091 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.634 10.336 -12.760 1.00 0.00 H new ATOM 778 N ASN A 50 -5.044 10.431 -5.369 1.00 0.00 N ATOM 779 CA ASN A 50 -5.348 10.848 -3.993 1.00 0.00 C ATOM 780 C ASN A 50 -4.661 9.991 -2.927 1.00 0.00 C ATOM 781 O ASN A 50 -5.091 9.933 -1.776 1.00 0.00 O ATOM 782 CB ASN A 50 -6.865 10.836 -3.796 1.00 0.00 C ATOM 783 CG ASN A 50 -7.549 11.916 -4.636 1.00 0.00 C ATOM 784 OD1 ASN A 50 -7.503 13.101 -4.312 1.00 0.00 O ATOM 785 ND2 ASN A 50 -8.208 11.562 -5.736 1.00 0.00 N ATOM 0 H ASN A 50 -5.465 9.536 -5.620 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.951 11.855 -3.862 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.260 9.857 -4.068 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.097 10.992 -2.742 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -8.671 12.272 -6.304 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.251 10.581 -6.011 1.00 0.00 H new ATOM 792 N ALA A 51 -3.597 9.306 -3.338 1.00 0.00 N ATOM 793 CA ALA A 51 -2.695 8.602 -2.416 1.00 0.00 C ATOM 794 C ALA A 51 -1.473 9.463 -2.093 1.00 0.00 C ATOM 795 O ALA A 51 -1.045 10.285 -2.902 1.00 0.00 O ATOM 796 CB ALA A 51 -2.229 7.277 -3.025 1.00 0.00 C ATOM 0 H ALA A 51 -3.331 9.220 -4.319 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.247 8.403 -1.498 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.562 6.771 -2.327 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -3.094 6.644 -3.225 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.699 7.472 -3.957 1.00 0.00 H new ATOM 802 N ASP A 52 -1.023 9.325 -0.849 1.00 0.00 N ATOM 803 CA ASP A 52 0.275 9.854 -0.406 1.00 0.00 C ATOM 804 C ASP A 52 1.370 8.807 -0.620 1.00 0.00 C ATOM 805 O ASP A 52 2.511 9.179 -0.890 1.00 0.00 O ATOM 806 CB ASP A 52 0.255 10.333 1.047 1.00 0.00 C ATOM 807 CG ASP A 52 -0.692 11.498 1.342 1.00 0.00 C ATOM 808 OD1 ASP A 52 -0.287 12.667 1.164 1.00 0.00 O ATOM 809 OD2 ASP A 52 -1.767 11.225 1.919 1.00 0.00 O ATOM 0 H ASP A 52 -1.544 8.844 -0.115 1.00 0.00 H new ATOM 0 HA ASP A 52 0.491 10.731 -1.016 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -0.020 9.493 1.685 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.266 10.629 1.328 1.00 0.00 H new ATOM 814 N VAL A 53 1.020 7.525 -0.557 1.00 0.00 N ATOM 815 CA VAL A 53 1.850 6.429 -1.081 1.00 0.00 C ATOM 816 C VAL A 53 0.970 5.318 -1.659 1.00 0.00 C ATOM 817 O VAL A 53 -0.117 5.016 -1.170 1.00 0.00 O ATOM 818 CB VAL A 53 2.843 5.912 -0.040 1.00 0.00 C ATOM 819 CG1 VAL A 53 2.157 5.291 1.178 1.00 0.00 C ATOM 820 CG2 VAL A 53 3.831 4.922 -0.665 1.00 0.00 C ATOM 0 H VAL A 53 0.145 7.208 -0.138 1.00 0.00 H new ATOM 0 HA VAL A 53 2.456 6.824 -1.897 1.00 0.00 H new ATOM 0 HB VAL A 53 3.395 6.782 0.316 1.00 0.00 H new ATOM 0 HG11 VAL A 53 2.912 4.942 1.882 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.528 6.038 1.661 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.542 4.450 0.859 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.526 4.570 0.098 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.284 4.074 -1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.387 5.417 -1.461 1.00 0.00 H new ATOM 830 N VAL A 54 1.475 4.783 -2.767 1.00 0.00 N ATOM 831 CA VAL A 54 0.927 3.614 -3.471 1.00 0.00 C ATOM 832 C VAL A 54 1.872 2.438 -3.213 1.00 0.00 C ATOM 833 O VAL A 54 3.072 2.490 -3.480 1.00 0.00 O ATOM 834 CB VAL A 54 0.837 3.909 -4.970 1.00 0.00 C ATOM 835 CG1 VAL A 54 0.315 2.717 -5.774 1.00 0.00 C ATOM 836 CG2 VAL A 54 -0.077 5.105 -5.242 1.00 0.00 C ATOM 0 H VAL A 54 2.307 5.161 -3.220 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.075 3.378 -3.113 1.00 0.00 H new ATOM 0 HB VAL A 54 1.856 4.129 -5.290 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.271 2.982 -6.830 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.984 1.867 -5.640 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.683 2.452 -5.425 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.122 5.292 -6.315 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.078 4.890 -4.869 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.317 5.987 -4.737 1.00 0.00 H new ATOM 846 N LEU A 55 1.274 1.400 -2.637 1.00 0.00 N ATOM 847 CA LEU A 55 1.971 0.146 -2.316 1.00 0.00 C ATOM 848 C LEU A 55 1.412 -1.045 -3.097 1.00 0.00 C ATOM 849 O LEU A 55 0.210 -1.299 -3.147 1.00 0.00 O ATOM 850 CB LEU A 55 1.893 -0.100 -0.808 1.00 0.00 C ATOM 851 CG LEU A 55 2.797 0.882 -0.061 1.00 0.00 C ATOM 852 CD1 LEU A 55 2.282 1.043 1.370 1.00 0.00 C ATOM 853 CD2 LEU A 55 4.260 0.433 -0.036 1.00 0.00 C ATOM 0 H LEU A 55 0.288 1.399 -2.376 1.00 0.00 H new ATOM 0 HA LEU A 55 3.014 0.247 -2.617 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.864 0.012 -0.467 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.193 -1.124 -0.584 1.00 0.00 H new ATOM 0 HG LEU A 55 2.765 1.833 -0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.921 1.742 1.910 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.262 1.426 1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.296 0.076 1.873 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.856 1.166 0.507 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.335 -0.535 0.460 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.632 0.347 -1.057 1.00 0.00 H new ATOM 865 N LEU A 56 2.356 -1.727 -3.740 1.00 0.00 N ATOM 866 CA LEU A 56 2.093 -2.855 -4.645 1.00 0.00 C ATOM 867 C LEU A 56 2.453 -4.207 -4.028 1.00 0.00 C ATOM 868 O LEU A 56 3.437 -4.355 -3.306 1.00 0.00 O ATOM 869 CB LEU A 56 2.916 -2.716 -5.927 1.00 0.00 C ATOM 870 CG LEU A 56 2.752 -1.376 -6.647 1.00 0.00 C ATOM 871 CD1 LEU A 56 3.773 -1.264 -7.782 1.00 0.00 C ATOM 872 CD2 LEU A 56 1.351 -1.201 -7.239 1.00 0.00 C ATOM 0 H LEU A 56 3.348 -1.510 -3.648 1.00 0.00 H new ATOM 0 HA LEU A 56 1.023 -2.826 -4.849 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.969 -2.856 -5.684 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.637 -3.518 -6.611 1.00 0.00 H new ATOM 0 HG LEU A 56 2.912 -0.596 -5.902 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.649 -0.307 -8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.781 -1.330 -7.372 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.617 -2.075 -8.493 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.285 -0.235 -7.739 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.158 -1.996 -7.959 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.610 -1.247 -6.441 1.00 0.00 H new ATOM 884 N GLY A 57 1.589 -5.170 -4.341 1.00 0.00 N ATOM 885 CA GLY A 57 1.801 -6.603 -4.096 1.00 0.00 C ATOM 886 C GLY A 57 3.006 -7.126 -4.880 1.00 0.00 C ATOM 887 O GLY A 57 3.102 -6.818 -6.067 1.00 0.00 O ATOM 0 H GLY A 57 0.693 -4.973 -4.786 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.955 -6.774 -3.031 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.908 -7.159 -4.382 1.00 0.00 H new ATOM 891 N PRO A 58 3.863 -7.954 -4.288 1.00 0.00 N ATOM 892 CA PRO A 58 5.032 -8.525 -4.972 1.00 0.00 C ATOM 893 C PRO A 58 4.721 -9.172 -6.322 1.00 0.00 C ATOM 894 O PRO A 58 5.458 -9.012 -7.294 1.00 0.00 O ATOM 895 CB PRO A 58 5.620 -9.553 -4.003 1.00 0.00 C ATOM 896 CG PRO A 58 5.188 -9.042 -2.626 1.00 0.00 C ATOM 897 CD PRO A 58 3.852 -8.339 -2.869 1.00 0.00 C ATOM 0 HA PRO A 58 5.729 -7.724 -5.217 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.234 -10.554 -4.198 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.705 -9.608 -4.087 1.00 0.00 H new ATOM 0 HG2 PRO A 58 5.080 -9.862 -1.916 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.926 -8.356 -2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 58 3.014 -9.001 -2.648 1.00 0.00 H new ATOM 0 HD3 PRO A 58 3.746 -7.465 -2.226 1.00 0.00 H new ATOM 905 N GLN A 59 3.548 -9.792 -6.416 1.00 0.00 N ATOM 906 CA GLN A 59 2.992 -10.413 -7.628 1.00 0.00 C ATOM 907 C GLN A 59 2.783 -9.464 -8.808 1.00 0.00 C ATOM 908 O GLN A 59 3.024 -9.850 -9.951 1.00 0.00 O ATOM 909 CB GLN A 59 1.689 -11.155 -7.322 1.00 0.00 C ATOM 910 CG GLN A 59 0.610 -10.367 -6.576 1.00 0.00 C ATOM 911 CD GLN A 59 0.728 -10.422 -5.051 1.00 0.00 C ATOM 912 OE1 GLN A 59 1.799 -10.440 -4.448 1.00 0.00 O ATOM 913 NE2 GLN A 59 -0.411 -10.402 -4.364 1.00 0.00 N ATOM 0 H GLN A 59 2.925 -9.883 -5.614 1.00 0.00 H new ATOM 0 HA GLN A 59 3.761 -11.117 -7.946 1.00 0.00 H new ATOM 0 HB2 GLN A 59 1.266 -11.503 -8.264 1.00 0.00 H new ATOM 0 HB3 GLN A 59 1.931 -12.041 -6.735 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.653 -9.325 -6.894 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.368 -10.749 -6.867 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.304 -10.387 -4.857 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.392 -10.402 -3.344 1.00 0.00 H new ATOM 922 N ILE A 60 2.493 -8.197 -8.523 1.00 0.00 N ATOM 923 CA ILE A 60 2.334 -7.184 -9.577 1.00 0.00 C ATOM 924 C ILE A 60 3.457 -6.144 -9.569 1.00 0.00 C ATOM 925 O ILE A 60 3.413 -5.150 -10.292 1.00 0.00 O ATOM 926 CB ILE A 60 0.967 -6.499 -9.559 1.00 0.00 C ATOM 927 CG1 ILE A 60 0.694 -5.728 -8.266 1.00 0.00 C ATOM 928 CG2 ILE A 60 -0.132 -7.522 -9.852 1.00 0.00 C ATOM 929 CD1 ILE A 60 -0.279 -4.567 -8.489 1.00 0.00 C ATOM 0 H ILE A 60 2.363 -7.843 -7.576 1.00 0.00 H new ATOM 0 HA ILE A 60 2.400 -7.742 -10.511 1.00 0.00 H new ATOM 0 HB ILE A 60 0.971 -5.746 -10.347 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.284 -6.407 -7.518 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.633 -5.344 -7.867 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -1.103 -7.027 -9.838 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.035 -7.964 -10.834 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.112 -8.304 -9.093 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.446 -4.046 -7.546 1.00 0.00 H new ATOM 0 HD12 ILE A 60 0.142 -3.874 -9.217 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.227 -4.954 -8.863 1.00 0.00 H new ATOM 941 N ALA A 61 4.568 -6.516 -8.939 1.00 0.00 N ATOM 942 CA ALA A 61 5.770 -5.675 -8.833 1.00 0.00 C ATOM 943 C ALA A 61 6.426 -5.385 -10.184 1.00 0.00 C ATOM 944 O ALA A 61 6.991 -4.310 -10.375 1.00 0.00 O ATOM 945 CB ALA A 61 6.789 -6.371 -7.926 1.00 0.00 C ATOM 0 H ALA A 61 4.666 -7.421 -8.480 1.00 0.00 H new ATOM 0 HA ALA A 61 5.453 -4.718 -8.418 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.683 -5.753 -7.842 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.355 -6.517 -6.937 1.00 0.00 H new ATOM 0 HB3 ALA A 61 7.055 -7.338 -8.352 1.00 0.00 H new ATOM 951 N TYR A 62 6.257 -6.300 -11.134 1.00 0.00 N ATOM 952 CA TYR A 62 6.723 -6.092 -12.513 1.00 0.00 C ATOM 953 C TYR A 62 6.065 -4.892 -13.198 1.00 0.00 C ATOM 954 O TYR A 62 6.682 -4.280 -14.070 1.00 0.00 O ATOM 955 CB TYR A 62 6.566 -7.368 -13.341 1.00 0.00 C ATOM 956 CG TYR A 62 5.129 -7.737 -13.716 1.00 0.00 C ATOM 957 CD1 TYR A 62 4.295 -8.336 -12.780 1.00 0.00 C ATOM 958 CD2 TYR A 62 4.683 -7.412 -14.992 1.00 0.00 C ATOM 959 CE1 TYR A 62 2.967 -8.580 -13.114 1.00 0.00 C ATOM 960 CE2 TYR A 62 3.364 -7.681 -15.339 1.00 0.00 C ATOM 961 CZ TYR A 62 2.523 -8.249 -14.390 1.00 0.00 C ATOM 962 OH TYR A 62 1.249 -8.557 -14.754 1.00 0.00 O ATOM 0 H TYR A 62 5.799 -7.198 -10.979 1.00 0.00 H new ATOM 0 HA TYR A 62 7.784 -5.852 -12.449 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.146 -7.259 -14.258 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.002 -8.197 -12.784 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.673 -8.609 -11.806 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.353 -6.956 -15.705 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.292 -9.019 -12.395 1.00 0.00 H new ATOM 0 HE2 TYR A 62 2.999 -7.452 -16.329 1.00 0.00 H new ATOM 0 HH TYR A 62 1.091 -8.260 -15.674 1.00 0.00 H new ATOM 972 N MET A 63 4.882 -4.497 -12.738 1.00 0.00 N ATOM 973 CA MET A 63 4.181 -3.297 -13.219 1.00 0.00 C ATOM 974 C MET A 63 4.550 -2.003 -12.492 1.00 0.00 C ATOM 975 O MET A 63 4.023 -0.944 -12.831 1.00 0.00 O ATOM 976 CB MET A 63 2.671 -3.523 -13.121 1.00 0.00 C ATOM 977 CG MET A 63 2.137 -4.358 -14.286 1.00 0.00 C ATOM 978 SD MET A 63 0.325 -4.242 -14.519 1.00 0.00 S ATOM 979 CE MET A 63 -0.296 -5.006 -13.037 1.00 0.00 C ATOM 0 H MET A 63 4.372 -5.002 -12.013 1.00 0.00 H new ATOM 0 HA MET A 63 4.502 -3.157 -14.251 1.00 0.00 H new ATOM 0 HB2 MET A 63 2.440 -4.024 -12.181 1.00 0.00 H new ATOM 0 HB3 MET A 63 2.161 -2.560 -13.102 1.00 0.00 H new ATOM 0 HG2 MET A 63 2.632 -4.040 -15.204 1.00 0.00 H new ATOM 0 HG3 MET A 63 2.406 -5.402 -14.124 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.327 -5.322 -13.195 1.00 0.00 H new ATOM 0 HE2 MET A 63 0.316 -5.874 -12.791 1.00 0.00 H new ATOM 0 HE3 MET A 63 -0.258 -4.291 -12.215 1.00 0.00 H new ATOM 989 N LEU A 64 5.541 -2.040 -11.607 1.00 0.00 N ATOM 990 CA LEU A 64 6.100 -0.832 -10.982 1.00 0.00 C ATOM 991 C LEU A 64 6.489 0.238 -12.003 1.00 0.00 C ATOM 992 O LEU A 64 5.827 1.273 -11.933 1.00 0.00 O ATOM 993 CB LEU A 64 7.221 -1.213 -10.012 1.00 0.00 C ATOM 994 CG LEU A 64 7.891 0.036 -9.436 1.00 0.00 C ATOM 995 CD1 LEU A 64 7.061 0.652 -8.309 1.00 0.00 C ATOM 996 CD2 LEU A 64 9.323 -0.237 -8.970 1.00 0.00 C ATOM 0 H LEU A 64 5.984 -2.905 -11.298 1.00 0.00 H new ATOM 0 HA LEU A 64 5.319 -0.354 -10.391 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.816 -1.820 -9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.962 -1.823 -10.528 1.00 0.00 H new ATOM 0 HG LEU A 64 7.946 0.760 -10.249 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.569 1.537 -7.925 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.080 0.934 -8.692 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.942 -0.075 -7.506 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.756 0.679 -8.569 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.314 -1.003 -8.195 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.921 -0.582 -9.814 1.00 0.00 H new ATOM 1008 N PRO A 65 7.273 -0.014 -13.048 1.00 0.00 N ATOM 1009 CA PRO A 65 7.590 1.007 -14.056 1.00 0.00 C ATOM 1010 C PRO A 65 6.363 1.624 -14.729 1.00 0.00 C ATOM 1011 O PRO A 65 6.277 2.849 -14.806 1.00 0.00 O ATOM 1012 CB PRO A 65 8.493 0.331 -15.090 1.00 0.00 C ATOM 1013 CG PRO A 65 8.286 -1.169 -14.866 1.00 0.00 C ATOM 1014 CD PRO A 65 7.961 -1.270 -13.373 1.00 0.00 C ATOM 0 HA PRO A 65 8.080 1.847 -13.564 1.00 0.00 H new ATOM 0 HB2 PRO A 65 8.220 0.621 -16.104 1.00 0.00 H new ATOM 0 HB3 PRO A 65 9.537 0.612 -14.948 1.00 0.00 H new ATOM 0 HG2 PRO A 65 7.474 -1.557 -15.480 1.00 0.00 H new ATOM 0 HG3 PRO A 65 9.179 -1.739 -15.121 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.328 -2.132 -13.164 1.00 0.00 H new ATOM 0 HD3 PRO A 65 8.867 -1.389 -12.779 1.00 0.00 H new ATOM 1022 N GLU A 66 5.329 0.812 -14.936 1.00 0.00 N ATOM 1023 CA GLU A 66 4.106 1.230 -15.636 1.00 0.00 C ATOM 1024 C GLU A 66 3.238 2.151 -14.775 1.00 0.00 C ATOM 1025 O GLU A 66 2.890 3.267 -15.160 1.00 0.00 O ATOM 1026 CB GLU A 66 3.328 -0.026 -16.032 1.00 0.00 C ATOM 1027 CG GLU A 66 2.322 0.201 -17.163 1.00 0.00 C ATOM 1028 CD GLU A 66 3.020 0.432 -18.504 1.00 0.00 C ATOM 1029 OE1 GLU A 66 3.403 -0.588 -19.119 1.00 0.00 O ATOM 1030 OE2 GLU A 66 3.171 1.614 -18.882 1.00 0.00 O ATOM 0 H GLU A 66 5.311 -0.159 -14.624 1.00 0.00 H new ATOM 0 HA GLU A 66 4.383 1.802 -16.522 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.034 -0.799 -16.336 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.798 -0.405 -15.158 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.661 -0.662 -17.241 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.696 1.061 -16.926 1.00 0.00 H new ATOM 1037 N ILE A 67 3.070 1.759 -13.517 1.00 0.00 N ATOM 1038 CA ILE A 67 2.296 2.501 -12.511 1.00 0.00 C ATOM 1039 C ILE A 67 3.045 3.755 -12.054 1.00 0.00 C ATOM 1040 O ILE A 67 2.442 4.811 -11.872 1.00 0.00 O ATOM 1041 CB ILE A 67 1.907 1.532 -11.392 1.00 0.00 C ATOM 1042 CG1 ILE A 67 0.902 0.546 -11.992 1.00 0.00 C ATOM 1043 CG2 ILE A 67 1.327 2.264 -10.181 1.00 0.00 C ATOM 1044 CD1 ILE A 67 0.460 -0.627 -11.114 1.00 0.00 C ATOM 0 H ILE A 67 3.475 0.897 -13.153 1.00 0.00 H new ATOM 0 HA ILE A 67 1.368 2.889 -12.932 1.00 0.00 H new ATOM 0 HB ILE A 67 2.786 1.006 -11.019 1.00 0.00 H new ATOM 0 HG12 ILE A 67 0.012 1.105 -12.281 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.334 0.139 -12.906 1.00 0.00 H new ATOM 0 HG21 ILE A 67 1.064 1.540 -9.410 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.068 2.960 -9.788 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.435 2.814 -10.481 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.251 -1.244 -11.663 1.00 0.00 H new ATOM 0 HD12 ILE A 67 1.329 -1.227 -10.844 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.013 -0.246 -10.209 1.00 0.00 H new ATOM 1056 N GLN A 68 4.368 3.650 -11.964 1.00 0.00 N ATOM 1057 CA GLN A 68 5.273 4.781 -11.711 1.00 0.00 C ATOM 1058 C GLN A 68 5.119 5.843 -12.803 1.00 0.00 C ATOM 1059 O GLN A 68 5.033 7.035 -12.513 1.00 0.00 O ATOM 1060 CB GLN A 68 6.712 4.262 -11.738 1.00 0.00 C ATOM 1061 CG GLN A 68 7.694 5.228 -11.072 1.00 0.00 C ATOM 1062 CD GLN A 68 7.971 4.798 -9.629 1.00 0.00 C ATOM 1063 OE1 GLN A 68 8.504 3.726 -9.349 1.00 0.00 O ATOM 1064 NE2 GLN A 68 7.674 5.661 -8.662 1.00 0.00 N ATOM 0 H GLN A 68 4.857 2.761 -12.066 1.00 0.00 H new ATOM 0 HA GLN A 68 5.033 5.225 -10.745 1.00 0.00 H new ATOM 0 HB2 GLN A 68 6.757 3.297 -11.233 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.016 4.095 -12.771 1.00 0.00 H new ATOM 0 HG2 GLN A 68 8.627 5.254 -11.636 1.00 0.00 H new ATOM 0 HG3 GLN A 68 7.285 6.238 -11.085 1.00 0.00 H new ATOM 0 HE21 GLN A 68 7.232 6.551 -8.891 1.00 0.00 H new ATOM 0 HE22 GLN A 68 7.888 5.433 -7.691 1.00 0.00 H new ATOM 1073 N ARG A 69 5.003 5.380 -14.045 1.00 0.00 N ATOM 1074 CA ARG A 69 4.838 6.221 -15.240 1.00 0.00 C ATOM 1075 C ARG A 69 3.496 6.956 -15.211 1.00 0.00 C ATOM 1076 O ARG A 69 3.392 8.090 -15.677 1.00 0.00 O ATOM 1077 CB ARG A 69 4.967 5.270 -16.431 1.00 0.00 C ATOM 1078 CG ARG A 69 5.238 5.971 -17.763 1.00 0.00 C ATOM 1079 CD ARG A 69 3.963 6.425 -18.477 1.00 0.00 C ATOM 1080 NE ARG A 69 4.358 7.255 -19.625 1.00 0.00 N ATOM 1081 CZ ARG A 69 3.658 7.451 -20.751 1.00 0.00 C ATOM 1082 NH1 ARG A 69 2.470 6.868 -20.960 1.00 0.00 N ATOM 1083 NH2 ARG A 69 4.163 8.244 -21.706 1.00 0.00 N ATOM 0 H ARG A 69 5.021 4.383 -14.260 1.00 0.00 H new ATOM 0 HA ARG A 69 5.589 7.009 -15.298 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.774 4.564 -16.233 1.00 0.00 H new ATOM 0 HB3 ARG A 69 4.049 4.688 -16.519 1.00 0.00 H new ATOM 0 HG2 ARG A 69 5.876 6.837 -17.587 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.791 5.295 -18.416 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.385 5.563 -18.810 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.327 6.992 -17.798 1.00 0.00 H new ATOM 0 HE ARG A 69 5.258 7.731 -19.557 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.072 6.253 -20.250 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.964 7.039 -21.829 1.00 0.00 H new ATOM 0 HH21 ARG A 69 5.070 8.690 -21.571 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.640 8.401 -22.568 1.00 0.00 H new ATOM 1097 N LEU A 70 2.465 6.238 -14.774 1.00 0.00 N ATOM 1098 CA LEU A 70 1.108 6.750 -14.535 1.00 0.00 C ATOM 1099 C LEU A 70 1.066 7.808 -13.431 1.00 0.00 C ATOM 1100 O LEU A 70 0.334 8.793 -13.525 1.00 0.00 O ATOM 1101 CB LEU A 70 0.218 5.580 -14.113 1.00 0.00 C ATOM 1102 CG LEU A 70 -0.281 4.733 -15.285 1.00 0.00 C ATOM 1103 CD1 LEU A 70 -0.887 3.420 -14.782 1.00 0.00 C ATOM 1104 CD2 LEU A 70 -1.378 5.457 -16.069 1.00 0.00 C ATOM 0 H LEU A 70 2.550 5.243 -14.567 1.00 0.00 H new ATOM 0 HA LEU A 70 0.761 7.216 -15.457 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.774 4.942 -13.426 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.641 5.968 -13.565 1.00 0.00 H new ATOM 0 HG LEU A 70 0.582 4.547 -15.924 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.236 2.832 -15.631 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.131 2.856 -14.236 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.726 3.636 -14.121 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.711 4.828 -16.895 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.220 5.665 -15.409 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.986 6.395 -16.462 1.00 0.00 H new ATOM 1116 N LEU A 71 1.788 7.527 -12.350 1.00 0.00 N ATOM 1117 CA LEU A 71 1.841 8.358 -11.139 1.00 0.00 C ATOM 1118 C LEU A 71 3.275 8.777 -10.806 1.00 0.00 C ATOM 1119 O LEU A 71 3.827 8.369 -9.786 1.00 0.00 O ATOM 1120 CB LEU A 71 1.236 7.564 -9.980 1.00 0.00 C ATOM 1121 CG LEU A 71 -0.170 7.029 -10.261 1.00 0.00 C ATOM 1122 CD1 LEU A 71 -0.473 5.871 -9.307 1.00 0.00 C ATOM 1123 CD2 LEU A 71 -1.244 8.114 -10.153 1.00 0.00 C ATOM 0 H LEU A 71 2.371 6.692 -12.285 1.00 0.00 H new ATOM 0 HA LEU A 71 1.272 9.272 -11.309 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.892 6.726 -9.745 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.202 8.200 -9.096 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.192 6.674 -11.291 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.474 5.488 -9.506 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.256 5.075 -9.458 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.417 6.224 -8.277 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.222 7.680 -10.362 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.240 8.531 -9.146 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.036 8.905 -10.874 1.00 0.00 H new ATOM 1135 N PRO A 72 3.857 9.700 -11.567 1.00 0.00 N ATOM 1136 CA PRO A 72 5.233 10.150 -11.312 1.00 0.00 C ATOM 1137 C PRO A 72 5.378 11.161 -10.173 1.00 0.00 C ATOM 1138 O PRO A 72 6.468 11.301 -9.620 1.00 0.00 O ATOM 1139 CB PRO A 72 5.705 10.720 -12.651 1.00 0.00 C ATOM 1140 CG PRO A 72 4.419 11.256 -13.284 1.00 0.00 C ATOM 1141 CD PRO A 72 3.352 10.258 -12.829 1.00 0.00 C ATOM 0 HA PRO A 72 5.843 9.317 -10.964 1.00 0.00 H new ATOM 0 HB2 PRO A 72 6.444 11.509 -12.513 1.00 0.00 H new ATOM 0 HB3 PRO A 72 6.169 9.954 -13.272 1.00 0.00 H new ATOM 0 HG2 PRO A 72 4.195 12.266 -12.942 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.493 11.296 -14.371 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.390 10.749 -12.685 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.202 9.476 -13.573 1.00 0.00 H new ATOM 1149 N ASN A 73 4.250 11.682 -9.704 1.00 0.00 N ATOM 1150 CA ASN A 73 4.240 12.589 -8.546 1.00 0.00 C ATOM 1151 C ASN A 73 3.799 11.927 -7.239 1.00 0.00 C ATOM 1152 O ASN A 73 3.358 12.585 -6.297 1.00 0.00 O ATOM 1153 CB ASN A 73 3.380 13.824 -8.823 1.00 0.00 C ATOM 1154 CG ASN A 73 4.067 14.757 -9.821 1.00 0.00 C ATOM 1155 OD1 ASN A 73 5.077 15.391 -9.517 1.00 0.00 O ATOM 1156 ND2 ASN A 73 3.499 14.980 -11.003 1.00 0.00 N ATOM 0 H ASN A 73 3.329 11.497 -10.102 1.00 0.00 H new ATOM 0 HA ASN A 73 5.279 12.887 -8.406 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.411 13.516 -9.215 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.192 14.357 -7.891 1.00 0.00 H new ATOM 0 HD21 ASN A 73 3.901 15.667 -11.641 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.661 14.464 -11.272 1.00 0.00 H new ATOM 1163 N LYS A 74 3.835 10.598 -7.226 1.00 0.00 N ATOM 1164 CA LYS A 74 3.443 9.796 -6.059 1.00 0.00 C ATOM 1165 C LYS A 74 4.511 8.725 -5.830 1.00 0.00 C ATOM 1166 O LYS A 74 4.987 8.147 -6.805 1.00 0.00 O ATOM 1167 CB LYS A 74 2.104 9.101 -6.319 1.00 0.00 C ATOM 1168 CG LYS A 74 0.927 10.023 -6.644 1.00 0.00 C ATOM 1169 CD LYS A 74 0.590 10.992 -5.510 1.00 0.00 C ATOM 1170 CE LYS A 74 -0.639 11.835 -5.856 1.00 0.00 C ATOM 1171 NZ LYS A 74 -0.941 12.711 -4.716 1.00 0.00 N ATOM 0 H LYS A 74 4.137 10.040 -8.024 1.00 0.00 H new ATOM 0 HA LYS A 74 3.347 10.446 -5.189 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.233 8.403 -7.146 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.846 8.510 -5.440 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.158 10.593 -7.544 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.050 9.416 -6.868 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.406 10.433 -4.592 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.442 11.645 -5.320 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.451 12.429 -6.750 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.491 11.191 -6.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -1.849 13.191 -4.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -1.001 12.142 -3.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.187 13.420 -4.614 1.00 0.00 H new ATOM 1185 N PRO A 75 4.979 8.552 -4.597 1.00 0.00 N ATOM 1186 CA PRO A 75 5.906 7.462 -4.261 1.00 0.00 C ATOM 1187 C PRO A 75 5.174 6.120 -4.324 1.00 0.00 C ATOM 1188 O PRO A 75 4.056 5.954 -3.839 1.00 0.00 O ATOM 1189 CB PRO A 75 6.445 7.787 -2.867 1.00 0.00 C ATOM 1190 CG PRO A 75 5.347 8.663 -2.259 1.00 0.00 C ATOM 1191 CD PRO A 75 4.779 9.444 -3.446 1.00 0.00 C ATOM 0 HA PRO A 75 6.735 7.378 -4.964 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.610 6.884 -2.279 1.00 0.00 H new ATOM 0 HB3 PRO A 75 7.398 8.314 -2.917 1.00 0.00 H new ATOM 0 HG2 PRO A 75 4.578 8.059 -1.777 1.00 0.00 H new ATOM 0 HG3 PRO A 75 5.749 9.333 -1.499 1.00 0.00 H new ATOM 0 HD2 PRO A 75 3.724 9.676 -3.301 1.00 0.00 H new ATOM 0 HD3 PRO A 75 5.298 10.393 -3.583 1.00 0.00 H new ATOM 1199 N VAL A 76 5.697 5.359 -5.281 1.00 0.00 N ATOM 1200 CA VAL A 76 5.157 4.029 -5.599 1.00 0.00 C ATOM 1201 C VAL A 76 6.240 2.997 -5.278 1.00 0.00 C ATOM 1202 O VAL A 76 7.270 2.926 -5.945 1.00 0.00 O ATOM 1203 CB VAL A 76 4.722 3.945 -7.063 1.00 0.00 C ATOM 1204 CG1 VAL A 76 4.033 2.608 -7.342 1.00 0.00 C ATOM 1205 CG2 VAL A 76 3.769 5.064 -7.484 1.00 0.00 C ATOM 0 H VAL A 76 6.495 5.635 -5.853 1.00 0.00 H new ATOM 0 HA VAL A 76 4.267 3.832 -5.001 1.00 0.00 H new ATOM 0 HB VAL A 76 5.639 4.046 -7.643 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.730 2.566 -8.388 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.724 1.792 -7.131 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.153 2.512 -6.706 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.503 4.940 -8.534 1.00 0.00 H new ATOM 0 HG22 VAL A 76 2.867 5.022 -6.874 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.257 6.029 -7.345 1.00 0.00 H new ATOM 1215 N GLU A 77 5.905 2.209 -4.260 1.00 0.00 N ATOM 1216 CA GLU A 77 6.776 1.167 -3.696 1.00 0.00 C ATOM 1217 C GLU A 77 6.069 -0.189 -3.668 1.00 0.00 C ATOM 1218 O GLU A 77 4.845 -0.310 -3.694 1.00 0.00 O ATOM 1219 CB GLU A 77 7.173 1.544 -2.266 1.00 0.00 C ATOM 1220 CG GLU A 77 8.179 2.689 -2.145 1.00 0.00 C ATOM 1221 CD GLU A 77 9.628 2.258 -2.378 1.00 0.00 C ATOM 1222 OE1 GLU A 77 10.289 1.933 -1.367 1.00 0.00 O ATOM 1223 OE2 GLU A 77 10.089 2.383 -3.533 1.00 0.00 O ATOM 0 H GLU A 77 5.002 2.274 -3.790 1.00 0.00 H new ATOM 0 HA GLU A 77 7.660 1.091 -4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.272 1.815 -1.716 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.591 0.663 -1.779 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.920 3.467 -2.864 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.095 3.132 -1.152 1.00 0.00 H new ATOM 1230 N VAL A 78 6.911 -1.219 -3.704 1.00 0.00 N ATOM 1231 CA VAL A 78 6.493 -2.623 -3.590 1.00 0.00 C ATOM 1232 C VAL A 78 6.705 -3.080 -2.145 1.00 0.00 C ATOM 1233 O VAL A 78 7.748 -2.830 -1.541 1.00 0.00 O ATOM 1234 CB VAL A 78 7.302 -3.481 -4.565 1.00 0.00 C ATOM 1235 CG1 VAL A 78 6.941 -4.965 -4.482 1.00 0.00 C ATOM 1236 CG2 VAL A 78 7.122 -3.024 -6.015 1.00 0.00 C ATOM 0 H VAL A 78 7.919 -1.105 -3.815 1.00 0.00 H new ATOM 0 HA VAL A 78 5.438 -2.730 -3.844 1.00 0.00 H new ATOM 0 HB VAL A 78 8.341 -3.350 -4.264 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.545 -5.527 -5.195 1.00 0.00 H new ATOM 0 HG12 VAL A 78 7.136 -5.331 -3.474 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.885 -5.096 -4.718 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.714 -3.660 -6.673 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.070 -3.095 -6.291 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.454 -1.991 -6.115 1.00 0.00 H new ATOM 1246 N ILE A 79 5.716 -3.794 -1.616 1.00 0.00 N ATOM 1247 CA ILE A 79 5.794 -4.428 -0.293 1.00 0.00 C ATOM 1248 C ILE A 79 6.768 -5.603 -0.398 1.00 0.00 C ATOM 1249 O ILE A 79 6.638 -6.448 -1.283 1.00 0.00 O ATOM 1250 CB ILE A 79 4.418 -4.916 0.163 1.00 0.00 C ATOM 1251 CG1 ILE A 79 3.409 -3.765 0.201 1.00 0.00 C ATOM 1252 CG2 ILE A 79 4.509 -5.569 1.544 1.00 0.00 C ATOM 1253 CD1 ILE A 79 1.967 -4.237 0.003 1.00 0.00 C ATOM 0 H ILE A 79 4.829 -3.953 -2.093 1.00 0.00 H new ATOM 0 HA ILE A 79 6.142 -3.706 0.446 1.00 0.00 H new ATOM 0 HB ILE A 79 4.073 -5.656 -0.560 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.490 -3.248 1.157 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.660 -3.042 -0.575 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.520 -5.910 1.851 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.189 -6.420 1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.883 -4.843 2.266 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.295 -3.379 0.039 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.875 -4.729 -0.965 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.702 -4.939 0.794 1.00 0.00 H new ATOM 1265 N ASP A 80 7.719 -5.625 0.532 1.00 0.00 N ATOM 1266 CA ASP A 80 8.677 -6.733 0.672 1.00 0.00 C ATOM 1267 C ASP A 80 7.959 -8.072 0.853 1.00 0.00 C ATOM 1268 O ASP A 80 7.102 -8.251 1.715 1.00 0.00 O ATOM 1269 CB ASP A 80 9.632 -6.471 1.838 1.00 0.00 C ATOM 1270 CG ASP A 80 10.506 -7.692 2.133 1.00 0.00 C ATOM 1271 OD1 ASP A 80 11.308 -8.066 1.251 1.00 0.00 O ATOM 1272 OD2 ASP A 80 10.174 -8.387 3.118 1.00 0.00 O ATOM 0 H ASP A 80 7.852 -4.878 1.213 1.00 0.00 H new ATOM 0 HA ASP A 80 9.258 -6.791 -0.248 1.00 0.00 H new ATOM 0 HB2 ASP A 80 10.267 -5.616 1.605 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.059 -6.209 2.727 1.00 0.00 H new ATOM 1277 N SER A 81 8.350 -8.990 -0.027 1.00 0.00 N ATOM 1278 CA SER A 81 7.773 -10.339 -0.120 1.00 0.00 C ATOM 1279 C SER A 81 7.782 -11.135 1.187 1.00 0.00 C ATOM 1280 O SER A 81 6.812 -11.824 1.503 1.00 0.00 O ATOM 1281 CB SER A 81 8.477 -11.146 -1.213 1.00 0.00 C ATOM 1282 OG SER A 81 9.881 -11.211 -0.953 1.00 0.00 O ATOM 0 H SER A 81 9.089 -8.820 -0.709 1.00 0.00 H new ATOM 0 HA SER A 81 6.724 -10.180 -0.368 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.061 -12.153 -1.257 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.301 -10.686 -2.185 1.00 0.00 H new ATOM 0 HG SER A 81 10.320 -11.731 -1.658 1.00 0.00 H new ATOM 1288 N LEU A 82 8.817 -10.936 1.999 1.00 0.00 N ATOM 1289 CA LEU A 82 8.997 -11.599 3.298 1.00 0.00 C ATOM 1290 C LEU A 82 8.078 -11.011 4.369 1.00 0.00 C ATOM 1291 O LEU A 82 7.377 -11.761 5.047 1.00 0.00 O ATOM 1292 CB LEU A 82 10.486 -11.514 3.642 1.00 0.00 C ATOM 1293 CG LEU A 82 10.820 -12.004 5.053 1.00 0.00 C ATOM 1294 CD1 LEU A 82 10.578 -13.506 5.215 1.00 0.00 C ATOM 1295 CD2 LEU A 82 12.269 -11.691 5.432 1.00 0.00 C ATOM 0 H LEU A 82 9.576 -10.294 1.771 1.00 0.00 H new ATOM 0 HA LEU A 82 8.704 -12.648 3.249 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.051 -12.103 2.919 1.00 0.00 H new ATOM 0 HB3 LEU A 82 10.815 -10.480 3.538 1.00 0.00 H new ATOM 0 HG LEU A 82 10.148 -11.466 5.722 1.00 0.00 H new ATOM 0 HD11 LEU A 82 10.829 -13.807 6.232 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.529 -13.729 5.019 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.203 -14.053 4.510 1.00 0.00 H new ATOM 0 HD21 LEU A 82 12.468 -12.054 6.440 1.00 0.00 H new ATOM 0 HD22 LEU A 82 12.943 -12.182 4.730 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.430 -10.614 5.396 1.00 0.00 H new ATOM 1307 N LEU A 83 8.027 -9.687 4.487 1.00 0.00 N ATOM 1308 CA LEU A 83 7.096 -8.950 5.355 1.00 0.00 C ATOM 1309 C LEU A 83 5.637 -9.280 5.031 1.00 0.00 C ATOM 1310 O LEU A 83 4.810 -9.412 5.932 1.00 0.00 O ATOM 1311 CB LEU A 83 7.269 -7.436 5.211 1.00 0.00 C ATOM 1312 CG LEU A 83 8.587 -6.892 5.765 1.00 0.00 C ATOM 1313 CD1 LEU A 83 8.642 -5.378 5.555 1.00 0.00 C ATOM 1314 CD2 LEU A 83 8.763 -7.198 7.254 1.00 0.00 C ATOM 0 H LEU A 83 8.651 -9.071 3.966 1.00 0.00 H new ATOM 0 HA LEU A 83 7.332 -9.260 6.373 1.00 0.00 H new ATOM 0 HB2 LEU A 83 7.198 -7.174 4.155 1.00 0.00 H new ATOM 0 HB3 LEU A 83 6.443 -6.939 5.720 1.00 0.00 H new ATOM 0 HG LEU A 83 9.396 -7.386 5.226 1.00 0.00 H new ATOM 0 HD11 LEU A 83 9.581 -4.990 5.950 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.577 -5.156 4.490 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.808 -4.908 6.076 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.713 -6.791 7.599 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.948 -6.744 7.818 1.00 0.00 H new ATOM 0 HD23 LEU A 83 8.753 -8.277 7.407 1.00 0.00 H new ATOM 1326 N TYR A 84 5.376 -9.413 3.734 1.00 0.00 N ATOM 1327 CA TYR A 84 4.093 -9.820 3.142 1.00 0.00 C ATOM 1328 C TYR A 84 3.723 -11.250 3.541 1.00 0.00 C ATOM 1329 O TYR A 84 2.597 -11.489 3.972 1.00 0.00 O ATOM 1330 CB TYR A 84 4.188 -9.685 1.621 1.00 0.00 C ATOM 1331 CG TYR A 84 2.856 -9.812 0.880 1.00 0.00 C ATOM 1332 CD1 TYR A 84 2.056 -8.684 0.728 1.00 0.00 C ATOM 1333 CD2 TYR A 84 2.525 -11.020 0.279 1.00 0.00 C ATOM 1334 CE1 TYR A 84 0.905 -8.762 -0.048 1.00 0.00 C ATOM 1335 CE2 TYR A 84 1.379 -11.104 -0.506 1.00 0.00 C ATOM 1336 CZ TYR A 84 0.585 -9.972 -0.651 1.00 0.00 C ATOM 1337 OH TYR A 84 -0.477 -10.024 -1.500 1.00 0.00 O ATOM 0 H TYR A 84 6.087 -9.232 3.025 1.00 0.00 H new ATOM 0 HA TYR A 84 3.303 -9.171 3.519 1.00 0.00 H new ATOM 0 HB2 TYR A 84 4.629 -8.717 1.383 1.00 0.00 H new ATOM 0 HB3 TYR A 84 4.871 -10.447 1.245 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.327 -7.756 1.209 1.00 0.00 H new ATOM 0 HD2 TYR A 84 3.153 -11.888 0.420 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.271 -7.898 -0.180 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.112 -12.030 -0.993 1.00 0.00 H new ATOM 0 HH TYR A 84 -0.739 -9.114 -1.752 1.00 0.00 H new ATOM 1347 N GLY A 85 4.691 -12.160 3.481 1.00 0.00 N ATOM 1348 CA GLY A 85 4.557 -13.557 3.921 1.00 0.00 C ATOM 1349 C GLY A 85 4.276 -13.666 5.421 1.00 0.00 C ATOM 1350 O GLY A 85 3.365 -14.371 5.852 1.00 0.00 O ATOM 0 H GLY A 85 5.619 -11.946 3.116 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.750 -14.035 3.366 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.472 -14.100 3.684 1.00 0.00 H new ATOM 1354 N LYS A 86 5.031 -12.888 6.191 1.00 0.00 N ATOM 1355 CA LYS A 86 4.914 -12.769 7.651 1.00 0.00 C ATOM 1356 C LYS A 86 3.628 -12.078 8.107 1.00 0.00 C ATOM 1357 O LYS A 86 3.223 -12.211 9.261 1.00 0.00 O ATOM 1358 CB LYS A 86 6.073 -11.918 8.176 1.00 0.00 C ATOM 1359 CG LYS A 86 7.426 -12.631 8.233 1.00 0.00 C ATOM 1360 CD LYS A 86 8.566 -11.685 8.618 1.00 0.00 C ATOM 1361 CE LYS A 86 8.406 -11.055 10.003 1.00 0.00 C ATOM 1362 NZ LYS A 86 9.599 -10.275 10.364 1.00 0.00 N ATOM 0 H LYS A 86 5.770 -12.299 5.807 1.00 0.00 H new ATOM 0 HA LYS A 86 4.918 -13.788 8.038 1.00 0.00 H new ATOM 0 HB2 LYS A 86 6.171 -11.035 7.544 1.00 0.00 H new ATOM 0 HB3 LYS A 86 5.822 -11.567 9.177 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.374 -13.446 8.955 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.640 -13.078 7.262 1.00 0.00 H new ATOM 0 HD2 LYS A 86 9.507 -12.234 8.585 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.634 -10.891 7.874 1.00 0.00 H new ATOM 0 HE2 LYS A 86 7.527 -10.410 10.015 1.00 0.00 H new ATOM 0 HE3 LYS A 86 8.238 -11.836 10.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 9.468 -9.857 11.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 10.431 -10.898 10.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 9.743 -9.517 9.666 1.00 0.00 H new ATOM 1376 N VAL A 87 3.024 -11.334 7.184 1.00 0.00 N ATOM 1377 CA VAL A 87 1.997 -10.306 7.408 1.00 0.00 C ATOM 1378 C VAL A 87 2.259 -9.459 8.656 1.00 0.00 C ATOM 1379 O VAL A 87 1.416 -9.261 9.529 1.00 0.00 O ATOM 1380 CB VAL A 87 0.545 -10.783 7.335 1.00 0.00 C ATOM 1381 CG1 VAL A 87 0.103 -10.926 5.877 1.00 0.00 C ATOM 1382 CG2 VAL A 87 0.275 -12.093 8.078 1.00 0.00 C ATOM 0 H VAL A 87 3.249 -11.435 6.194 1.00 0.00 H new ATOM 0 HA VAL A 87 2.109 -9.659 6.538 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.038 -10.014 7.841 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -0.932 -11.266 5.842 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.185 -9.962 5.376 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.741 -11.652 5.373 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.777 -12.359 7.976 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.892 -12.885 7.655 1.00 0.00 H new ATOM 0 HG23 VAL A 87 0.517 -11.969 9.134 1.00 0.00 H new ATOM 1392 N ASP A 88 3.429 -8.829 8.589 1.00 0.00 N ATOM 1393 CA ASP A 88 3.968 -7.956 9.642 1.00 0.00 C ATOM 1394 C ASP A 88 3.497 -6.524 9.382 1.00 0.00 C ATOM 1395 O ASP A 88 4.088 -5.732 8.649 1.00 0.00 O ATOM 1396 CB ASP A 88 5.495 -8.064 9.666 1.00 0.00 C ATOM 1397 CG ASP A 88 6.147 -7.424 10.892 1.00 0.00 C ATOM 1398 OD1 ASP A 88 5.655 -6.364 11.337 1.00 0.00 O ATOM 1399 OD2 ASP A 88 7.167 -8.010 11.317 1.00 0.00 O ATOM 0 H ASP A 88 4.048 -8.910 7.783 1.00 0.00 H new ATOM 0 HA ASP A 88 3.604 -8.262 10.623 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.775 -9.117 9.627 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.896 -7.594 8.768 1.00 0.00 H new ATOM 1404 N GLY A 89 2.313 -6.291 9.941 1.00 0.00 N ATOM 1405 CA GLY A 89 1.562 -5.037 9.791 1.00 0.00 C ATOM 1406 C GLY A 89 2.368 -3.789 10.157 1.00 0.00 C ATOM 1407 O GLY A 89 2.410 -2.834 9.381 1.00 0.00 O ATOM 0 H GLY A 89 1.835 -6.979 10.523 1.00 0.00 H new ATOM 0 HA2 GLY A 89 1.222 -4.949 8.759 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.671 -5.080 10.418 1.00 0.00 H new ATOM 1411 N LEU A 90 3.184 -3.918 11.199 1.00 0.00 N ATOM 1412 CA LEU A 90 3.962 -2.796 11.744 1.00 0.00 C ATOM 1413 C LEU A 90 5.141 -2.428 10.841 1.00 0.00 C ATOM 1414 O LEU A 90 5.349 -1.251 10.549 1.00 0.00 O ATOM 1415 CB LEU A 90 4.423 -3.166 13.155 1.00 0.00 C ATOM 1416 CG LEU A 90 5.178 -2.022 13.835 1.00 0.00 C ATOM 1417 CD1 LEU A 90 4.307 -0.783 14.052 1.00 0.00 C ATOM 1418 CD2 LEU A 90 5.755 -2.492 15.173 1.00 0.00 C ATOM 0 H LEU A 90 3.329 -4.799 11.693 1.00 0.00 H new ATOM 0 HA LEU A 90 3.332 -1.908 11.789 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.557 -3.437 13.759 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.066 -4.045 13.107 1.00 0.00 H new ATOM 0 HG LEU A 90 5.986 -1.734 13.162 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.896 -0.005 14.538 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.947 -0.418 13.090 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.457 -1.042 14.683 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.290 -1.669 15.648 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.944 -2.821 15.823 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.442 -3.321 15.002 1.00 0.00 H new ATOM 1430 N GLY A 91 5.859 -3.447 10.376 1.00 0.00 N ATOM 1431 CA GLY A 91 6.987 -3.343 9.439 1.00 0.00 C ATOM 1432 C GLY A 91 6.603 -2.582 8.168 1.00 0.00 C ATOM 1433 O GLY A 91 7.110 -1.492 7.914 1.00 0.00 O ATOM 0 H GLY A 91 5.667 -4.411 10.650 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.820 -2.837 9.928 1.00 0.00 H new ATOM 0 HA3 GLY A 91 7.332 -4.342 9.174 1.00 0.00 H new ATOM 1437 N VAL A 92 5.498 -3.029 7.577 1.00 0.00 N ATOM 1438 CA VAL A 92 4.946 -2.456 6.340 1.00 0.00 C ATOM 1439 C VAL A 92 4.416 -1.043 6.589 1.00 0.00 C ATOM 1440 O VAL A 92 4.730 -0.129 5.828 1.00 0.00 O ATOM 1441 CB VAL A 92 3.861 -3.366 5.762 1.00 0.00 C ATOM 1442 CG1 VAL A 92 3.303 -2.840 4.438 1.00 0.00 C ATOM 1443 CG2 VAL A 92 4.384 -4.775 5.473 1.00 0.00 C ATOM 0 H VAL A 92 4.950 -3.808 7.943 1.00 0.00 H new ATOM 0 HA VAL A 92 5.747 -2.385 5.604 1.00 0.00 H new ATOM 0 HB VAL A 92 3.085 -3.386 6.527 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.536 -3.522 4.070 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.867 -1.853 4.593 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.108 -2.770 3.706 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.579 -5.385 5.064 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.199 -4.720 4.752 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.747 -5.225 6.397 1.00 0.00 H new ATOM 1453 N LEU A 93 3.759 -0.839 7.726 1.00 0.00 N ATOM 1454 CA LEU A 93 3.228 0.472 8.127 1.00 0.00 C ATOM 1455 C LEU A 93 4.350 1.508 8.236 1.00 0.00 C ATOM 1456 O LEU A 93 4.251 2.612 7.704 1.00 0.00 O ATOM 1457 CB LEU A 93 2.547 0.389 9.495 1.00 0.00 C ATOM 1458 CG LEU A 93 1.201 1.109 9.594 1.00 0.00 C ATOM 1459 CD1 LEU A 93 0.690 0.971 11.028 1.00 0.00 C ATOM 1460 CD2 LEU A 93 1.255 2.597 9.238 1.00 0.00 C ATOM 0 H LEU A 93 3.576 -1.579 8.404 1.00 0.00 H new ATOM 0 HA LEU A 93 2.511 0.770 7.362 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.399 -0.661 9.747 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.220 0.805 10.245 1.00 0.00 H new ATOM 0 HG LEU A 93 0.540 0.641 8.865 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.270 1.478 11.122 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.569 -0.085 11.271 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.407 1.421 11.715 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.260 3.030 9.334 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.940 3.108 9.914 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.604 2.713 8.212 1.00 0.00 H new ATOM 1472 N LYS A 94 5.444 1.107 8.878 1.00 0.00 N ATOM 1473 CA LYS A 94 6.641 1.941 9.054 1.00 0.00 C ATOM 1474 C LYS A 94 7.282 2.339 7.723 1.00 0.00 C ATOM 1475 O LYS A 94 7.603 3.510 7.527 1.00 0.00 O ATOM 1476 CB LYS A 94 7.681 1.200 9.896 1.00 0.00 C ATOM 1477 CG LYS A 94 7.419 1.393 11.392 1.00 0.00 C ATOM 1478 CD LYS A 94 8.293 0.472 12.245 1.00 0.00 C ATOM 1479 CE LYS A 94 8.429 0.952 13.692 1.00 0.00 C ATOM 1480 NZ LYS A 94 9.310 2.127 13.744 1.00 0.00 N ATOM 0 H LYS A 94 5.530 0.182 9.298 1.00 0.00 H new ATOM 0 HA LYS A 94 6.314 2.850 9.558 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.659 0.137 9.654 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.679 1.563 9.649 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.611 2.431 11.664 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.368 1.197 11.605 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.868 -0.532 12.239 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.284 0.402 11.796 1.00 0.00 H new ATOM 0 HE2 LYS A 94 7.448 1.203 14.096 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.835 0.154 14.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.605 2.297 14.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.150 1.957 13.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.799 2.960 13.387 1.00 0.00 H new ATOM 1494 N ALA A 95 7.343 1.377 6.806 1.00 0.00 N ATOM 1495 CA ALA A 95 7.877 1.586 5.452 1.00 0.00 C ATOM 1496 C ALA A 95 7.006 2.552 4.647 1.00 0.00 C ATOM 1497 O ALA A 95 7.482 3.591 4.189 1.00 0.00 O ATOM 1498 CB ALA A 95 7.961 0.219 4.771 1.00 0.00 C ATOM 0 H ALA A 95 7.023 0.424 6.977 1.00 0.00 H new ATOM 0 HA ALA A 95 8.866 2.041 5.509 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.355 0.339 3.762 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.622 -0.432 5.343 1.00 0.00 H new ATOM 0 HB3 ALA A 95 6.967 -0.225 4.722 1.00 0.00 H new ATOM 1504 N ALA A 96 5.698 2.390 4.824 1.00 0.00 N ATOM 1505 CA ALA A 96 4.667 3.245 4.216 1.00 0.00 C ATOM 1506 C ALA A 96 4.749 4.693 4.707 1.00 0.00 C ATOM 1507 O ALA A 96 4.855 5.622 3.910 1.00 0.00 O ATOM 1508 CB ALA A 96 3.295 2.659 4.552 1.00 0.00 C ATOM 0 H ALA A 96 5.311 1.647 5.405 1.00 0.00 H new ATOM 0 HA ALA A 96 4.828 3.266 3.138 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.516 3.280 4.109 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.224 1.647 4.152 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.166 2.632 5.634 1.00 0.00 H new ATOM 1514 N VAL A 97 4.943 4.860 6.013 1.00 0.00 N ATOM 1515 CA VAL A 97 5.039 6.175 6.661 1.00 0.00 C ATOM 1516 C VAL A 97 6.345 6.884 6.298 1.00 0.00 C ATOM 1517 O VAL A 97 6.407 8.107 6.182 1.00 0.00 O ATOM 1518 CB VAL A 97 4.812 5.919 8.152 1.00 0.00 C ATOM 1519 CG1 VAL A 97 6.049 5.994 9.049 1.00 0.00 C ATOM 1520 CG2 VAL A 97 3.733 6.869 8.673 1.00 0.00 C ATOM 0 H VAL A 97 5.040 4.080 6.663 1.00 0.00 H new ATOM 0 HA VAL A 97 4.285 6.881 6.312 1.00 0.00 H new ATOM 0 HB VAL A 97 4.499 4.877 8.211 1.00 0.00 H new ATOM 0 HG11 VAL A 97 5.762 5.795 10.082 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.779 5.252 8.726 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.489 6.989 8.980 1.00 0.00 H new ATOM 0 HG21 VAL A 97 3.570 6.687 9.735 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.054 7.900 8.526 1.00 0.00 H new ATOM 0 HG23 VAL A 97 2.804 6.698 8.129 1.00 0.00 H new ATOM 1530 N ALA A 98 7.372 6.061 6.101 1.00 0.00 N ATOM 1531 CA ALA A 98 8.714 6.488 5.683 1.00 0.00 C ATOM 1532 C ALA A 98 8.672 7.014 4.247 1.00 0.00 C ATOM 1533 O ALA A 98 9.301 8.022 3.933 1.00 0.00 O ATOM 1534 CB ALA A 98 9.647 5.278 5.756 1.00 0.00 C ATOM 0 H ALA A 98 7.297 5.052 6.230 1.00 0.00 H new ATOM 0 HA ALA A 98 9.071 7.284 6.337 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.650 5.573 5.449 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.676 4.902 6.779 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.280 4.495 5.092 1.00 0.00 H new ATOM 1540 N ALA A 99 7.849 6.374 3.419 1.00 0.00 N ATOM 1541 CA ALA A 99 7.593 6.774 2.029 1.00 0.00 C ATOM 1542 C ALA A 99 6.754 8.050 1.923 1.00 0.00 C ATOM 1543 O ALA A 99 7.059 8.912 1.101 1.00 0.00 O ATOM 1544 CB ALA A 99 6.905 5.601 1.329 1.00 0.00 C ATOM 0 H ALA A 99 7.327 5.543 3.698 1.00 0.00 H new ATOM 0 HA ALA A 99 8.541 7.011 1.546 1.00 0.00 H new ATOM 0 HB1 ALA A 99 6.700 5.866 0.292 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.556 4.727 1.359 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.968 5.373 1.837 1.00 0.00 H new ATOM 1550 N ILE A 100 5.807 8.224 2.841 1.00 0.00 N ATOM 1551 CA ILE A 100 5.035 9.466 3.000 1.00 0.00 C ATOM 1552 C ILE A 100 5.984 10.611 3.360 1.00 0.00 C ATOM 1553 O ILE A 100 5.778 11.746 2.932 1.00 0.00 O ATOM 1554 CB ILE A 100 3.947 9.264 4.056 1.00 0.00 C ATOM 1555 CG1 ILE A 100 2.911 8.235 3.597 1.00 0.00 C ATOM 1556 CG2 ILE A 100 3.248 10.583 4.393 1.00 0.00 C ATOM 1557 CD1 ILE A 100 2.000 7.719 4.712 1.00 0.00 C ATOM 0 H ILE A 100 5.546 7.498 3.509 1.00 0.00 H new ATOM 0 HA ILE A 100 4.539 9.727 2.065 1.00 0.00 H new ATOM 0 HB ILE A 100 4.439 8.889 4.953 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.294 8.681 2.817 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.431 7.389 3.148 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.480 10.406 5.146 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.979 11.294 4.780 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.787 10.990 3.493 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.296 6.995 4.301 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.604 7.241 5.483 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.449 8.553 5.147 1.00 0.00 H new ATOM 1569 N LYS A 101 6.897 10.318 4.281 1.00 0.00 N ATOM 1570 CA LYS A 101 7.982 11.226 4.682 1.00 0.00 C ATOM 1571 C LYS A 101 9.009 11.519 3.587 1.00 0.00 C ATOM 1572 O LYS A 101 9.544 12.627 3.581 1.00 0.00 O ATOM 1573 CB LYS A 101 8.731 10.680 5.899 1.00 0.00 C ATOM 1574 CG LYS A 101 8.018 10.951 7.224 1.00 0.00 C ATOM 1575 CD LYS A 101 8.938 10.816 8.438 1.00 0.00 C ATOM 1576 CE LYS A 101 10.068 11.846 8.504 1.00 0.00 C ATOM 1577 NZ LYS A 101 9.546 13.217 8.595 1.00 0.00 N ATOM 0 H LYS A 101 6.909 9.429 4.782 1.00 0.00 H new ATOM 0 HA LYS A 101 7.475 12.163 4.913 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.866 9.605 5.781 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.726 11.124 5.933 1.00 0.00 H new ATOM 0 HG2 LYS A 101 7.597 11.956 7.204 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.183 10.258 7.329 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.336 10.899 9.343 1.00 0.00 H new ATOM 0 HD3 LYS A 101 9.375 9.817 8.436 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.700 11.639 9.368 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.697 11.754 7.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 10.330 13.876 8.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.078 13.470 7.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.860 13.276 9.374 1.00 0.00 H new ATOM 1591 N LYS A 102 9.344 10.539 2.752 1.00 0.00 N ATOM 1592 CA LYS A 102 10.218 10.729 1.586 1.00 0.00 C ATOM 1593 C LYS A 102 9.553 11.675 0.585 1.00 0.00 C ATOM 1594 O LYS A 102 10.209 12.528 -0.013 1.00 0.00 O ATOM 1595 CB LYS A 102 10.509 9.350 0.992 1.00 0.00 C ATOM 1596 CG LYS A 102 11.560 9.453 -0.116 1.00 0.00 C ATOM 1597 CD LYS A 102 12.019 8.049 -0.514 1.00 0.00 C ATOM 1598 CE LYS A 102 13.049 8.080 -1.645 1.00 0.00 C ATOM 1599 NZ LYS A 102 14.256 8.801 -1.213 1.00 0.00 N ATOM 0 H LYS A 102 9.016 9.580 2.862 1.00 0.00 H new ATOM 0 HA LYS A 102 11.163 11.193 1.867 1.00 0.00 H new ATOM 0 HB2 LYS A 102 10.862 8.678 1.774 1.00 0.00 H new ATOM 0 HB3 LYS A 102 9.591 8.919 0.592 1.00 0.00 H new ATOM 0 HG2 LYS A 102 11.143 9.970 -0.980 1.00 0.00 H new ATOM 0 HG3 LYS A 102 12.410 10.042 0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.449 7.549 0.354 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.156 7.461 -0.826 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.309 7.063 -1.938 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.622 8.565 -2.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.024 8.631 -1.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 14.054 9.820 -1.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.545 8.463 -0.273 1.00 0.00 H new ATOM 1613 N ALA A 103 8.256 11.441 0.406 1.00 0.00 N ATOM 1614 CA ALA A 103 7.296 12.425 -0.118 1.00 0.00 C ATOM 1615 C ALA A 103 7.255 13.589 0.875 1.00 0.00 C ATOM 1616 O ALA A 103 7.559 13.401 2.052 1.00 0.00 O ATOM 1617 CB ALA A 103 5.895 11.820 -0.228 1.00 0.00 C ATOM 0 H ALA A 103 7.827 10.542 0.625 1.00 0.00 H new ATOM 0 HA ALA A 103 7.605 12.749 -1.112 1.00 0.00 H new ATOM 0 HB1 ALA A 103 5.205 12.568 -0.618 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.920 10.964 -0.902 1.00 0.00 H new ATOM 0 HB3 ALA A 103 5.560 11.496 0.757 1.00 0.00 H new ATOM 1623 N ALA A 104 6.897 14.793 0.436 1.00 0.00 N ATOM 1624 CA ALA A 104 7.150 16.041 1.169 1.00 0.00 C ATOM 1625 C ALA A 104 8.623 16.387 1.390 1.00 0.00 C ATOM 1626 O ALA A 104 8.927 17.563 1.585 1.00 0.00 O ATOM 1627 CB ALA A 104 6.412 16.063 2.510 1.00 0.00 C ATOM 0 H ALA A 104 6.416 14.936 -0.452 1.00 0.00 H new ATOM 0 HA ALA A 104 6.758 16.813 0.507 1.00 0.00 H new ATOM 0 HB1 ALA A 104 6.622 17.000 3.025 1.00 0.00 H new ATOM 0 HB2 ALA A 104 5.339 15.976 2.336 1.00 0.00 H new ATOM 0 HB3 ALA A 104 6.749 15.228 3.124 1.00 0.00 H new ATOM 1633 N ALA A 105 9.454 15.360 1.544 1.00 0.00 N ATOM 1634 CA ALA A 105 10.922 15.281 1.507 1.00 0.00 C ATOM 1635 C ALA A 105 11.543 14.759 2.805 1.00 0.00 C ATOM 1636 O ALA A 105 11.185 15.154 3.913 1.00 0.00 O ATOM 1637 CB ALA A 105 11.647 16.560 1.085 1.00 0.00 C ATOM 0 H ALA A 105 9.064 14.434 1.722 1.00 0.00 H new ATOM 0 HA ALA A 105 11.080 14.551 0.713 1.00 0.00 H new ATOM 0 HB1 ALA A 105 12.723 16.388 1.093 1.00 0.00 H new ATOM 0 HB2 ALA A 105 11.332 16.842 0.080 1.00 0.00 H new ATOM 0 HB3 ALA A 105 11.403 17.363 1.781 1.00 0.00 H new ATOM 1643 N ASN A 106 12.396 13.760 2.601 1.00 0.00 N ATOM 1644 CA ASN A 106 13.253 13.114 3.606 1.00 0.00 C ATOM 1645 C ASN A 106 14.378 12.406 2.850 1.00 0.00 C ATOM 1646 O ASN A 106 14.203 12.122 1.645 1.00 0.00 O ATOM 1647 CB ASN A 106 12.480 12.068 4.412 1.00 0.00 C ATOM 1648 CG ASN A 106 12.930 11.923 5.867 1.00 0.00 C ATOM 1649 OD1 ASN A 106 12.964 10.839 6.448 1.00 0.00 O ATOM 1650 ND2 ASN A 106 12.993 13.033 6.597 1.00 0.00 N ATOM 1651 OXT ASN A 106 15.383 12.080 3.520 1.00 0.00 O ATOM 0 H ASN A 106 12.520 13.350 1.675 1.00 0.00 H new ATOM 0 HA ASN A 106 13.628 13.867 4.299 1.00 0.00 H new ATOM 0 HB2 ASN A 106 11.421 12.327 4.397 1.00 0.00 H new ATOM 0 HB3 ASN A 106 12.579 11.102 3.917 1.00 0.00 H new ATOM 0 HD21 ASN A 106 13.067 12.972 7.612 1.00 0.00 H new ATOM 0 HD22 ASN A 106 12.967 13.945 6.141 1.00 0.00 H new TER 1658 ASN A 106