USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 756 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0677 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= -0.571 USER MOD Single : A 19 GLN : amide:sc= -1.19 K(o=-1.2,f=-2) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot 180:sc= -0.768 USER MOD Single : A 43 LYS NZ :NH3+ -156:sc= -0.0847 (180deg=-0.558) USER MOD Single : A 44 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.8!) USER MOD Single : A 46 GLN : amide:sc= -0.0703 X(o=-0.07,f=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0.053 USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.0105 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 HIS : no HD1:sc= -0.307 X(o=-0.31,f=-0.023) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 CYS SG : rot 180:sc= -0.986 USER MOD Single : A 62 GLN : amide:sc= -0.198 X(o=-0.2,f=0) USER MOD Single : A 68 ASN : amide:sc= -0.769 K(o=-0.77,f=-4.2!) USER MOD Single : A 69 ASN : amide:sc= -0.017 K(o=-0.017,f=-1.6) USER MOD Single : A 70 CYS SG : rot 16:sc= -3.78! USER MOD Single : A 71 GLN : amide:sc= -1.32 K(o=-1.3,f=-0.026) USER MOD Single : A 72 MET CE :methyl -152:sc= -1.1 (180deg=-3.34) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -130:sc= -0.0613 USER MOD Single : A 78 TYR OH : rot 30:sc= -0.284 USER MOD Single : A 79 TYR OH : rot 98:sc= 0.352 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot -120:sc= -0.928 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 167:sc= 0.689 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.229 -12.532 -14.202 1.00 0.00 N ATOM 2 CA GLY A 1 -22.812 -13.450 -13.158 1.00 0.00 C ATOM 3 C GLY A 1 -21.307 -13.621 -13.103 1.00 0.00 C ATOM 4 O GLY A 1 -20.600 -12.778 -12.551 1.00 0.00 O ATOM 0 H1 GLY A 1 -24.266 -12.450 -14.198 1.00 0.00 H new ATOM 0 H2 GLY A 1 -22.807 -11.597 -14.031 1.00 0.00 H new ATOM 0 H3 GLY A 1 -22.914 -12.891 -15.126 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.169 -13.086 -12.195 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.279 -14.421 -13.324 1.00 0.00 H new ATOM 8 N SER A 2 -20.816 -14.715 -13.676 1.00 0.00 N ATOM 9 CA SER A 2 -19.385 -14.997 -13.685 1.00 0.00 C ATOM 10 C SER A 2 -18.715 -14.369 -14.903 1.00 0.00 C ATOM 11 O SER A 2 -18.597 -14.999 -15.954 1.00 0.00 O ATOM 12 CB SER A 2 -19.141 -16.507 -13.677 1.00 0.00 C ATOM 13 OG SER A 2 -17.918 -16.823 -13.034 1.00 0.00 O ATOM 0 H SER A 2 -21.388 -15.421 -14.140 1.00 0.00 H new ATOM 0 HA SER A 2 -18.949 -14.561 -12.787 1.00 0.00 H new ATOM 0 HB2 SER A 2 -19.964 -17.009 -13.167 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.125 -16.881 -14.701 1.00 0.00 H new ATOM 0 HG SER A 2 -17.786 -17.794 -13.041 1.00 0.00 H new ATOM 19 N SER A 3 -18.279 -13.122 -14.753 1.00 0.00 N ATOM 20 CA SER A 3 -17.624 -12.406 -15.841 1.00 0.00 C ATOM 21 C SER A 3 -16.575 -11.439 -15.301 1.00 0.00 C ATOM 22 O SER A 3 -16.702 -10.924 -14.191 1.00 0.00 O ATOM 23 CB SER A 3 -18.657 -11.643 -16.672 1.00 0.00 C ATOM 24 OG SER A 3 -19.211 -10.567 -15.935 1.00 0.00 O ATOM 0 H SER A 3 -18.368 -12.587 -13.889 1.00 0.00 H new ATOM 0 HA SER A 3 -17.125 -13.138 -16.476 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.189 -11.263 -17.580 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.451 -12.322 -16.983 1.00 0.00 H new ATOM 0 HG SER A 3 -19.867 -10.094 -16.489 1.00 0.00 H new ATOM 30 N GLY A 4 -15.537 -11.196 -16.096 1.00 0.00 N ATOM 31 CA GLY A 4 -14.480 -10.292 -15.682 1.00 0.00 C ATOM 32 C GLY A 4 -13.906 -9.502 -16.841 1.00 0.00 C ATOM 33 O GLY A 4 -12.812 -9.798 -17.321 1.00 0.00 O ATOM 0 H GLY A 4 -15.410 -11.609 -17.020 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.869 -9.602 -14.933 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.683 -10.863 -15.206 1.00 0.00 H new ATOM 37 N SER A 5 -14.646 -8.495 -17.293 1.00 0.00 N ATOM 38 CA SER A 5 -14.206 -7.663 -18.407 1.00 0.00 C ATOM 39 C SER A 5 -14.135 -6.196 -17.995 1.00 0.00 C ATOM 40 O SER A 5 -13.173 -5.496 -18.312 1.00 0.00 O ATOM 41 CB SER A 5 -15.153 -7.825 -19.598 1.00 0.00 C ATOM 42 OG SER A 5 -16.429 -7.278 -19.312 1.00 0.00 O ATOM 0 H SER A 5 -15.553 -8.235 -16.905 1.00 0.00 H new ATOM 0 HA SER A 5 -13.208 -7.989 -18.699 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.730 -7.332 -20.473 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.254 -8.882 -19.846 1.00 0.00 H new ATOM 0 HG SER A 5 -17.015 -7.392 -20.089 1.00 0.00 H new ATOM 48 N SER A 6 -15.161 -5.737 -17.286 1.00 0.00 N ATOM 49 CA SER A 6 -15.219 -4.352 -16.832 1.00 0.00 C ATOM 50 C SER A 6 -15.323 -4.282 -15.312 1.00 0.00 C ATOM 51 O SER A 6 -16.079 -5.032 -14.695 1.00 0.00 O ATOM 52 CB SER A 6 -16.409 -3.633 -17.470 1.00 0.00 C ATOM 53 OG SER A 6 -17.635 -4.116 -16.949 1.00 0.00 O ATOM 0 H SER A 6 -15.964 -6.304 -17.013 1.00 0.00 H new ATOM 0 HA SER A 6 -14.298 -3.857 -17.139 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.330 -2.561 -17.289 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.388 -3.776 -18.550 1.00 0.00 H new ATOM 0 HG SER A 6 -18.380 -3.640 -17.371 1.00 0.00 H new ATOM 59 N GLY A 7 -14.557 -3.374 -14.714 1.00 0.00 N ATOM 60 CA GLY A 7 -14.578 -3.222 -13.270 1.00 0.00 C ATOM 61 C GLY A 7 -13.462 -2.329 -12.766 1.00 0.00 C ATOM 62 O GLY A 7 -12.299 -2.517 -13.121 1.00 0.00 O ATOM 0 H GLY A 7 -13.923 -2.742 -15.203 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.538 -2.806 -12.965 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.493 -4.203 -12.803 1.00 0.00 H new ATOM 66 N ALA A 8 -13.816 -1.353 -11.936 1.00 0.00 N ATOM 67 CA ALA A 8 -12.835 -0.428 -11.382 1.00 0.00 C ATOM 68 C ALA A 8 -13.074 -0.202 -9.893 1.00 0.00 C ATOM 69 O ALA A 8 -14.010 0.497 -9.504 1.00 0.00 O ATOM 70 CB ALA A 8 -12.875 0.895 -12.132 1.00 0.00 C ATOM 0 H ALA A 8 -14.775 -1.183 -11.633 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.846 -0.871 -11.501 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -12.137 1.576 -11.708 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -12.648 0.724 -13.184 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -13.868 1.334 -12.042 1.00 0.00 H new ATOM 76 N ALA A 9 -12.223 -0.798 -9.065 1.00 0.00 N ATOM 77 CA ALA A 9 -12.341 -0.659 -7.619 1.00 0.00 C ATOM 78 C ALA A 9 -11.315 0.330 -7.076 1.00 0.00 C ATOM 79 O ALA A 9 -11.545 0.981 -6.056 1.00 0.00 O ATOM 80 CB ALA A 9 -12.180 -2.014 -6.944 1.00 0.00 C ATOM 0 H ALA A 9 -11.444 -1.382 -9.371 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.334 -0.270 -7.396 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.270 -1.896 -5.864 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.955 -2.693 -7.301 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.199 -2.425 -7.183 1.00 0.00 H new ATOM 86 N PHE A 10 -10.182 0.437 -7.762 1.00 0.00 N ATOM 87 CA PHE A 10 -9.120 1.345 -7.348 1.00 0.00 C ATOM 88 C PHE A 10 -9.127 2.613 -8.197 1.00 0.00 C ATOM 89 O PHE A 10 -8.727 2.595 -9.361 1.00 0.00 O ATOM 90 CB PHE A 10 -7.759 0.654 -7.453 1.00 0.00 C ATOM 91 CG PHE A 10 -7.457 -0.255 -6.296 1.00 0.00 C ATOM 92 CD1 PHE A 10 -7.194 0.266 -5.039 1.00 0.00 C ATOM 93 CD2 PHE A 10 -7.436 -1.629 -6.465 1.00 0.00 C ATOM 94 CE1 PHE A 10 -6.915 -0.568 -3.973 1.00 0.00 C ATOM 95 CE2 PHE A 10 -7.157 -2.469 -5.403 1.00 0.00 C ATOM 96 CZ PHE A 10 -6.898 -1.937 -4.155 1.00 0.00 C ATOM 0 H PHE A 10 -9.976 -0.095 -8.608 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.298 1.624 -6.309 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -7.724 0.077 -8.377 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -6.980 1.413 -7.522 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.207 1.336 -4.891 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -7.640 -2.050 -7.438 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -6.710 -0.150 -2.999 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -7.142 -3.539 -5.549 1.00 0.00 H new ATOM 0 HZ PHE A 10 -6.682 -2.591 -3.323 1.00 0.00 H new ATOM 106 N ALA A 11 -9.584 3.712 -7.605 1.00 0.00 N ATOM 107 CA ALA A 11 -9.641 4.989 -8.305 1.00 0.00 C ATOM 108 C ALA A 11 -8.245 5.567 -8.508 1.00 0.00 C ATOM 109 O ALA A 11 -8.037 6.429 -9.363 1.00 0.00 O ATOM 110 CB ALA A 11 -10.516 5.971 -7.540 1.00 0.00 C ATOM 0 H ALA A 11 -9.920 3.743 -6.642 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.080 4.818 -9.288 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.550 6.921 -8.074 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.525 5.568 -7.453 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.101 6.129 -6.545 1.00 0.00 H new ATOM 116 N LYS A 12 -7.291 5.090 -7.716 1.00 0.00 N ATOM 117 CA LYS A 12 -5.914 5.558 -7.808 1.00 0.00 C ATOM 118 C LYS A 12 -4.939 4.474 -7.362 1.00 0.00 C ATOM 119 O LYS A 12 -4.824 4.182 -6.171 1.00 0.00 O ATOM 120 CB LYS A 12 -5.722 6.814 -6.955 1.00 0.00 C ATOM 121 CG LYS A 12 -4.638 7.743 -7.473 1.00 0.00 C ATOM 122 CD LYS A 12 -4.201 8.737 -6.411 1.00 0.00 C ATOM 123 CE LYS A 12 -2.756 9.169 -6.613 1.00 0.00 C ATOM 124 NZ LYS A 12 -2.612 10.103 -7.764 1.00 0.00 N ATOM 0 H LYS A 12 -7.447 4.378 -7.002 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.708 5.799 -8.851 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -6.665 7.359 -6.910 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -5.477 6.516 -5.936 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.779 7.156 -7.798 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -5.006 8.281 -8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.851 9.612 -6.440 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.313 8.289 -5.424 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.391 9.651 -5.706 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.134 8.290 -6.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.613 10.374 -7.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -2.936 9.634 -8.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -3.186 10.954 -7.594 1.00 0.00 H new ATOM 138 N ILE A 13 -4.239 3.881 -8.323 1.00 0.00 N ATOM 139 CA ILE A 13 -3.272 2.831 -8.027 1.00 0.00 C ATOM 140 C ILE A 13 -1.975 3.416 -7.481 1.00 0.00 C ATOM 141 O ILE A 13 -1.797 4.634 -7.445 1.00 0.00 O ATOM 142 CB ILE A 13 -2.956 1.988 -9.277 1.00 0.00 C ATOM 143 CG1 ILE A 13 -2.417 2.880 -10.397 1.00 0.00 C ATOM 144 CG2 ILE A 13 -4.198 1.240 -9.739 1.00 0.00 C ATOM 145 CD1 ILE A 13 -1.699 2.115 -11.486 1.00 0.00 C ATOM 0 H ILE A 13 -4.323 4.110 -9.313 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.725 2.189 -7.271 1.00 0.00 H new ATOM 0 HB ILE A 13 -2.190 1.257 -9.020 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -3.245 3.434 -10.839 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.734 3.614 -9.969 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.959 0.649 -10.623 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.542 0.580 -8.943 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.984 1.955 -9.982 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.344 2.811 -12.246 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.850 1.582 -11.057 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.384 1.400 -11.941 1.00 0.00 H new ATOM 157 N LEU A 14 -1.069 2.541 -7.058 1.00 0.00 N ATOM 158 CA LEU A 14 0.215 2.970 -6.515 1.00 0.00 C ATOM 159 C LEU A 14 1.204 3.277 -7.634 1.00 0.00 C ATOM 160 O LEU A 14 1.094 2.742 -8.737 1.00 0.00 O ATOM 161 CB LEU A 14 0.788 1.891 -5.594 1.00 0.00 C ATOM 162 CG LEU A 14 -0.108 1.454 -4.434 1.00 0.00 C ATOM 163 CD1 LEU A 14 0.160 0.001 -4.071 1.00 0.00 C ATOM 164 CD2 LEU A 14 0.106 2.355 -3.226 1.00 0.00 C ATOM 0 H LEU A 14 -1.200 1.530 -7.081 1.00 0.00 H new ATOM 0 HA LEU A 14 0.052 3.881 -5.939 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.022 1.014 -6.197 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.729 2.255 -5.183 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.148 1.543 -4.749 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.486 -0.293 -3.244 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.044 -0.633 -4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.203 -0.114 -3.775 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.540 2.029 -2.410 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.147 2.298 -2.909 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.136 3.384 -3.492 1.00 0.00 H new ATOM 176 N ASP A 15 2.171 4.140 -7.342 1.00 0.00 N ATOM 177 CA ASP A 15 3.182 4.517 -8.322 1.00 0.00 C ATOM 178 C ASP A 15 3.929 3.288 -8.831 1.00 0.00 C ATOM 179 O ASP A 15 4.037 2.270 -8.147 1.00 0.00 O ATOM 180 CB ASP A 15 4.170 5.513 -7.712 1.00 0.00 C ATOM 181 CG ASP A 15 3.512 6.438 -6.707 1.00 0.00 C ATOM 182 OD1 ASP A 15 2.265 6.512 -6.696 1.00 0.00 O ATOM 183 OD2 ASP A 15 4.244 7.088 -5.932 1.00 0.00 O ATOM 0 H ASP A 15 2.276 4.592 -6.434 1.00 0.00 H new ATOM 0 HA ASP A 15 2.677 4.989 -9.165 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.978 4.967 -7.225 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.621 6.107 -8.507 1.00 0.00 H new ATOM 188 N PRO A 16 4.457 3.383 -10.061 1.00 0.00 N ATOM 189 CA PRO A 16 5.203 2.288 -10.689 1.00 0.00 C ATOM 190 C PRO A 16 6.553 2.048 -10.021 1.00 0.00 C ATOM 191 O PRO A 16 7.198 1.026 -10.254 1.00 0.00 O ATOM 192 CB PRO A 16 5.396 2.770 -12.128 1.00 0.00 C ATOM 193 CG PRO A 16 5.334 4.256 -12.041 1.00 0.00 C ATOM 194 CD PRO A 16 4.367 4.566 -10.932 1.00 0.00 C ATOM 0 HA PRO A 16 4.675 1.338 -10.611 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.352 2.437 -12.532 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.618 2.379 -12.784 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.317 4.676 -11.830 1.00 0.00 H new ATOM 0 HG3 PRO A 16 4.998 4.688 -12.984 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.643 5.477 -10.402 1.00 0.00 H new ATOM 0 HD3 PRO A 16 3.355 4.711 -11.310 1.00 0.00 H new ATOM 202 N ALA A 17 6.973 2.996 -9.190 1.00 0.00 N ATOM 203 CA ALA A 17 8.245 2.886 -8.487 1.00 0.00 C ATOM 204 C ALA A 17 8.404 4.004 -7.462 1.00 0.00 C ATOM 205 O ALA A 17 8.105 5.164 -7.743 1.00 0.00 O ATOM 206 CB ALA A 17 9.400 2.908 -9.478 1.00 0.00 C ATOM 0 H ALA A 17 6.451 3.849 -8.987 1.00 0.00 H new ATOM 0 HA ALA A 17 8.256 1.935 -7.954 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.344 2.825 -8.939 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.302 2.071 -10.169 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.382 3.844 -10.037 1.00 0.00 H new ATOM 212 N TYR A 18 8.876 3.646 -6.272 1.00 0.00 N ATOM 213 CA TYR A 18 9.071 4.619 -5.204 1.00 0.00 C ATOM 214 C TYR A 18 10.551 4.762 -4.862 1.00 0.00 C ATOM 215 O TYR A 18 11.360 3.893 -5.185 1.00 0.00 O ATOM 216 CB TYR A 18 8.286 4.204 -3.958 1.00 0.00 C ATOM 217 CG TYR A 18 6.800 4.458 -4.067 1.00 0.00 C ATOM 218 CD1 TYR A 18 6.012 3.725 -4.946 1.00 0.00 C ATOM 219 CD2 TYR A 18 6.182 5.430 -3.289 1.00 0.00 C ATOM 220 CE1 TYR A 18 4.654 3.954 -5.050 1.00 0.00 C ATOM 221 CE2 TYR A 18 4.824 5.665 -3.385 1.00 0.00 C ATOM 222 CZ TYR A 18 4.065 4.924 -4.267 1.00 0.00 C ATOM 223 OH TYR A 18 2.712 5.155 -4.365 1.00 0.00 O ATOM 0 H TYR A 18 9.130 2.690 -6.024 1.00 0.00 H new ATOM 0 HA TYR A 18 8.702 5.583 -5.553 1.00 0.00 H new ATOM 0 HB2 TYR A 18 8.452 3.143 -3.771 1.00 0.00 H new ATOM 0 HB3 TYR A 18 8.676 4.745 -3.096 1.00 0.00 H new ATOM 0 HD1 TYR A 18 6.470 2.963 -5.559 1.00 0.00 H new ATOM 0 HD2 TYR A 18 6.774 6.012 -2.598 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.057 3.377 -5.741 1.00 0.00 H new ATOM 0 HE2 TYR A 18 4.359 6.424 -2.773 1.00 0.00 H new ATOM 0 HH TYR A 18 2.456 5.870 -3.745 1.00 0.00 H new ATOM 233 N GLN A 19 10.896 5.865 -4.205 1.00 0.00 N ATOM 234 CA GLN A 19 12.278 6.123 -3.819 1.00 0.00 C ATOM 235 C GLN A 19 12.348 6.739 -2.425 1.00 0.00 C ATOM 236 O GLN A 19 11.633 7.694 -2.121 1.00 0.00 O ATOM 237 CB GLN A 19 12.948 7.051 -4.833 1.00 0.00 C ATOM 238 CG GLN A 19 12.995 6.481 -6.242 1.00 0.00 C ATOM 239 CD GLN A 19 11.715 6.730 -7.015 1.00 0.00 C ATOM 240 OE1 GLN A 19 11.111 7.798 -6.910 1.00 0.00 O ATOM 241 NE2 GLN A 19 11.294 5.744 -7.798 1.00 0.00 N ATOM 0 H GLN A 19 10.238 6.594 -3.929 1.00 0.00 H new ATOM 0 HA GLN A 19 12.808 5.171 -3.803 1.00 0.00 H new ATOM 0 HB2 GLN A 19 12.414 8.001 -4.852 1.00 0.00 H new ATOM 0 HB3 GLN A 19 13.965 7.264 -4.502 1.00 0.00 H new ATOM 0 HG2 GLN A 19 13.833 6.924 -6.781 1.00 0.00 H new ATOM 0 HG3 GLN A 19 13.181 5.408 -6.190 1.00 0.00 H new ATOM 0 HE21 GLN A 19 11.826 4.875 -7.855 1.00 0.00 H new ATOM 0 HE22 GLN A 19 10.439 5.855 -8.343 1.00 0.00 H new ATOM 250 N VAL A 20 13.213 6.185 -1.582 1.00 0.00 N ATOM 251 CA VAL A 20 13.377 6.680 -0.220 1.00 0.00 C ATOM 252 C VAL A 20 14.822 6.541 0.245 1.00 0.00 C ATOM 253 O VAL A 20 15.561 5.684 -0.239 1.00 0.00 O ATOM 254 CB VAL A 20 12.458 5.931 0.764 1.00 0.00 C ATOM 255 CG1 VAL A 20 13.045 4.572 1.114 1.00 0.00 C ATOM 256 CG2 VAL A 20 12.230 6.762 2.017 1.00 0.00 C ATOM 0 H VAL A 20 13.811 5.393 -1.818 1.00 0.00 H new ATOM 0 HA VAL A 20 13.102 7.735 -0.231 1.00 0.00 H new ATOM 0 HB VAL A 20 11.493 5.770 0.283 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.382 4.058 1.810 1.00 0.00 H new ATOM 0 HG12 VAL A 20 13.151 3.977 0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 20 14.023 4.706 1.576 1.00 0.00 H new ATOM 0 HG21 VAL A 20 11.579 6.218 2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 20 13.186 6.956 2.504 1.00 0.00 H new ATOM 0 HG23 VAL A 20 11.762 7.708 1.746 1.00 0.00 H new ATOM 266 N ASP A 21 15.218 7.389 1.188 1.00 0.00 N ATOM 267 CA ASP A 21 16.575 7.360 1.721 1.00 0.00 C ATOM 268 C ASP A 21 16.739 6.226 2.729 1.00 0.00 C ATOM 269 O ASP A 21 15.805 5.887 3.456 1.00 0.00 O ATOM 270 CB ASP A 21 16.916 8.697 2.379 1.00 0.00 C ATOM 271 CG ASP A 21 16.130 8.933 3.654 1.00 0.00 C ATOM 272 OD1 ASP A 21 14.984 9.423 3.563 1.00 0.00 O ATOM 273 OD2 ASP A 21 16.659 8.626 4.742 1.00 0.00 O ATOM 0 H ASP A 21 14.619 8.105 1.599 1.00 0.00 H new ATOM 0 HA ASP A 21 17.261 7.187 0.892 1.00 0.00 H new ATOM 0 HB2 ASP A 21 17.982 8.727 2.602 1.00 0.00 H new ATOM 0 HB3 ASP A 21 16.715 9.506 1.677 1.00 0.00 H new ATOM 278 N LYS A 22 17.932 5.643 2.766 1.00 0.00 N ATOM 279 CA LYS A 22 18.220 4.548 3.685 1.00 0.00 C ATOM 280 C LYS A 22 17.660 4.840 5.073 1.00 0.00 C ATOM 281 O LYS A 22 17.576 5.995 5.488 1.00 0.00 O ATOM 282 CB LYS A 22 19.730 4.311 3.772 1.00 0.00 C ATOM 283 CG LYS A 22 20.101 2.970 4.379 1.00 0.00 C ATOM 284 CD LYS A 22 20.292 3.072 5.883 1.00 0.00 C ATOM 285 CE LYS A 22 21.588 3.787 6.234 1.00 0.00 C ATOM 286 NZ LYS A 22 21.908 3.675 7.683 1.00 0.00 N ATOM 0 H LYS A 22 18.715 5.910 2.170 1.00 0.00 H new ATOM 0 HA LYS A 22 17.739 3.649 3.300 1.00 0.00 H new ATOM 0 HB2 LYS A 22 20.158 4.379 2.772 1.00 0.00 H new ATOM 0 HB3 LYS A 22 20.180 5.106 4.366 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.320 2.242 4.159 1.00 0.00 H new ATOM 0 HG3 LYS A 22 21.018 2.603 3.919 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.450 3.607 6.322 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.297 2.073 6.319 1.00 0.00 H new ATOM 0 HE2 LYS A 22 22.405 3.366 5.648 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.508 4.839 5.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.798 4.175 7.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 21.140 4.099 8.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.010 2.672 7.940 1.00 0.00 H new ATOM 300 N GLY A 23 17.279 3.785 5.787 1.00 0.00 N ATOM 301 CA GLY A 23 16.733 3.950 7.121 1.00 0.00 C ATOM 302 C GLY A 23 15.775 5.121 7.215 1.00 0.00 C ATOM 303 O GLY A 23 15.726 5.812 8.232 1.00 0.00 O ATOM 0 H GLY A 23 17.339 2.819 5.465 1.00 0.00 H new ATOM 0 HA2 GLY A 23 16.215 3.037 7.414 1.00 0.00 H new ATOM 0 HA3 GLY A 23 17.549 4.095 7.829 1.00 0.00 H new ATOM 307 N GLY A 24 15.012 5.346 6.150 1.00 0.00 N ATOM 308 CA GLY A 24 14.062 6.443 6.136 1.00 0.00 C ATOM 309 C GLY A 24 12.628 5.971 6.266 1.00 0.00 C ATOM 310 O GLY A 24 12.343 5.025 7.001 1.00 0.00 O ATOM 0 H GLY A 24 15.035 4.788 5.296 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.291 7.128 6.952 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.174 7.004 5.208 1.00 0.00 H new ATOM 314 N ARG A 25 11.722 6.631 5.552 1.00 0.00 N ATOM 315 CA ARG A 25 10.309 6.275 5.594 1.00 0.00 C ATOM 316 C ARG A 25 9.658 6.473 4.228 1.00 0.00 C ATOM 317 O ARG A 25 9.715 7.560 3.653 1.00 0.00 O ATOM 318 CB ARG A 25 9.580 7.114 6.644 1.00 0.00 C ATOM 319 CG ARG A 25 8.176 6.620 6.952 1.00 0.00 C ATOM 320 CD ARG A 25 7.282 7.750 7.439 1.00 0.00 C ATOM 321 NE ARG A 25 7.761 8.325 8.693 1.00 0.00 N ATOM 322 CZ ARG A 25 7.279 9.445 9.218 1.00 0.00 C ATOM 323 NH1 ARG A 25 6.311 10.108 8.602 1.00 0.00 N ATOM 324 NH2 ARG A 25 7.767 9.905 10.364 1.00 0.00 N ATOM 0 H ARG A 25 11.941 7.415 4.938 1.00 0.00 H new ATOM 0 HA ARG A 25 10.234 5.222 5.865 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.165 7.117 7.564 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.525 8.146 6.298 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.743 6.171 6.058 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.222 5.839 7.710 1.00 0.00 H new ATOM 0 HD2 ARG A 25 7.235 8.529 6.678 1.00 0.00 H new ATOM 0 HD3 ARG A 25 6.267 7.376 7.576 1.00 0.00 H new ATOM 0 HE ARG A 25 8.506 7.840 9.193 1.00 0.00 H new ATOM 0 HH11 ARG A 25 5.934 9.758 7.721 1.00 0.00 H new ATOM 0 HH12 ARG A 25 5.943 10.968 9.009 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.512 9.398 10.841 1.00 0.00 H new ATOM 0 HH22 ARG A 25 7.397 10.766 10.767 1.00 0.00 H new ATOM 338 N VAL A 26 9.040 5.414 3.713 1.00 0.00 N ATOM 339 CA VAL A 26 8.378 5.471 2.416 1.00 0.00 C ATOM 340 C VAL A 26 6.895 5.790 2.569 1.00 0.00 C ATOM 341 O VAL A 26 6.355 5.764 3.675 1.00 0.00 O ATOM 342 CB VAL A 26 8.529 4.144 1.649 1.00 0.00 C ATOM 343 CG1 VAL A 26 9.931 4.017 1.072 1.00 0.00 C ATOM 344 CG2 VAL A 26 8.210 2.966 2.557 1.00 0.00 C ATOM 0 H VAL A 26 8.984 4.506 4.175 1.00 0.00 H new ATOM 0 HA VAL A 26 8.862 6.267 1.849 1.00 0.00 H new ATOM 0 HB VAL A 26 7.819 4.140 0.822 1.00 0.00 H new ATOM 0 HG11 VAL A 26 10.019 3.073 0.534 1.00 0.00 H new ATOM 0 HG12 VAL A 26 10.119 4.844 0.387 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.661 4.042 1.881 1.00 0.00 H new ATOM 0 HG21 VAL A 26 8.322 2.036 1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.894 2.965 3.405 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.185 3.052 2.918 1.00 0.00 H new ATOM 354 N ARG A 27 6.242 6.092 1.451 1.00 0.00 N ATOM 355 CA ARG A 27 4.821 6.417 1.461 1.00 0.00 C ATOM 356 C ARG A 27 4.063 5.573 0.441 1.00 0.00 C ATOM 357 O ARG A 27 4.482 5.446 -0.709 1.00 0.00 O ATOM 358 CB ARG A 27 4.614 7.903 1.163 1.00 0.00 C ATOM 359 CG ARG A 27 3.154 8.329 1.170 1.00 0.00 C ATOM 360 CD ARG A 27 3.015 9.842 1.222 1.00 0.00 C ATOM 361 NE ARG A 27 1.718 10.290 0.723 1.00 0.00 N ATOM 362 CZ ARG A 27 1.371 10.253 -0.559 1.00 0.00 C ATOM 363 NH1 ARG A 27 2.221 9.792 -1.466 1.00 0.00 N ATOM 364 NH2 ARG A 27 0.172 10.679 -0.935 1.00 0.00 N ATOM 0 H ARG A 27 6.674 6.118 0.528 1.00 0.00 H new ATOM 0 HA ARG A 27 4.430 6.194 2.454 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.159 8.492 1.901 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.046 8.133 0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.658 7.948 0.277 1.00 0.00 H new ATOM 0 HG3 ARG A 27 2.649 7.887 2.029 1.00 0.00 H new ATOM 0 HD2 ARG A 27 3.146 10.183 2.249 1.00 0.00 H new ATOM 0 HD3 ARG A 27 3.808 10.299 0.631 1.00 0.00 H new ATOM 0 HE ARG A 27 1.041 10.651 1.395 1.00 0.00 H new ATOM 0 HH11 ARG A 27 3.144 9.465 -1.180 1.00 0.00 H new ATOM 0 HH12 ARG A 27 1.952 9.765 -2.450 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -0.484 11.035 -0.240 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -0.094 10.650 -1.919 1.00 0.00 H new ATOM 378 N PHE A 28 2.945 4.997 0.872 1.00 0.00 N ATOM 379 CA PHE A 28 2.129 4.163 -0.003 1.00 0.00 C ATOM 380 C PHE A 28 0.643 4.382 0.267 1.00 0.00 C ATOM 381 O PHE A 28 0.116 3.949 1.292 1.00 0.00 O ATOM 382 CB PHE A 28 2.481 2.687 0.190 1.00 0.00 C ATOM 383 CG PHE A 28 3.886 2.347 -0.219 1.00 0.00 C ATOM 384 CD1 PHE A 28 4.317 2.571 -1.517 1.00 0.00 C ATOM 385 CD2 PHE A 28 4.775 1.803 0.694 1.00 0.00 C ATOM 386 CE1 PHE A 28 5.609 2.260 -1.896 1.00 0.00 C ATOM 387 CE2 PHE A 28 6.068 1.491 0.320 1.00 0.00 C ATOM 388 CZ PHE A 28 6.486 1.718 -0.977 1.00 0.00 C ATOM 0 H PHE A 28 2.584 5.093 1.821 1.00 0.00 H new ATOM 0 HA PHE A 28 2.339 4.448 -1.034 1.00 0.00 H new ATOM 0 HB2 PHE A 28 2.342 2.423 1.238 1.00 0.00 H new ATOM 0 HB3 PHE A 28 1.786 2.077 -0.387 1.00 0.00 H new ATOM 0 HD1 PHE A 28 3.635 2.993 -2.240 1.00 0.00 H new ATOM 0 HD2 PHE A 28 4.454 1.621 1.709 1.00 0.00 H new ATOM 0 HE1 PHE A 28 5.933 2.441 -2.910 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.752 1.070 1.042 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.496 1.472 -1.271 1.00 0.00 H new ATOM 398 N VAL A 29 -0.027 5.059 -0.660 1.00 0.00 N ATOM 399 CA VAL A 29 -1.452 5.337 -0.524 1.00 0.00 C ATOM 400 C VAL A 29 -2.201 5.009 -1.810 1.00 0.00 C ATOM 401 O VAL A 29 -1.631 5.045 -2.901 1.00 0.00 O ATOM 402 CB VAL A 29 -1.704 6.811 -0.158 1.00 0.00 C ATOM 403 CG1 VAL A 29 -1.006 7.734 -1.146 1.00 0.00 C ATOM 404 CG2 VAL A 29 -3.197 7.100 -0.109 1.00 0.00 C ATOM 0 H VAL A 29 0.394 5.425 -1.514 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.823 4.702 0.281 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.288 6.997 0.832 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -1.196 8.772 -0.871 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.067 7.544 -1.126 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.389 7.549 -2.150 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.357 8.146 0.151 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.639 6.897 -1.084 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.666 6.464 0.641 1.00 0.00 H new ATOM 414 N VAL A 30 -3.484 4.688 -1.676 1.00 0.00 N ATOM 415 CA VAL A 30 -4.314 4.355 -2.828 1.00 0.00 C ATOM 416 C VAL A 30 -5.722 4.919 -2.673 1.00 0.00 C ATOM 417 O VAL A 30 -6.145 5.262 -1.570 1.00 0.00 O ATOM 418 CB VAL A 30 -4.402 2.831 -3.033 1.00 0.00 C ATOM 419 CG1 VAL A 30 -3.062 2.275 -3.488 1.00 0.00 C ATOM 420 CG2 VAL A 30 -4.867 2.148 -1.756 1.00 0.00 C ATOM 0 H VAL A 30 -3.971 4.651 -0.781 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.841 4.805 -3.701 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.135 2.628 -3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.144 1.197 -3.628 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.775 2.742 -4.430 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.305 2.487 -2.733 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.924 1.072 -1.919 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.160 2.357 -0.953 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.851 2.525 -1.479 1.00 0.00 H new ATOM 430 N GLU A 31 -6.443 5.010 -3.786 1.00 0.00 N ATOM 431 CA GLU A 31 -7.804 5.533 -3.773 1.00 0.00 C ATOM 432 C GLU A 31 -8.813 4.432 -4.086 1.00 0.00 C ATOM 433 O GLU A 31 -8.581 3.591 -4.956 1.00 0.00 O ATOM 434 CB GLU A 31 -7.946 6.672 -4.784 1.00 0.00 C ATOM 435 CG GLU A 31 -9.029 7.675 -4.423 1.00 0.00 C ATOM 436 CD GLU A 31 -9.072 8.855 -5.374 1.00 0.00 C ATOM 437 OE1 GLU A 31 -8.153 9.700 -5.313 1.00 0.00 O ATOM 438 OE2 GLU A 31 -10.023 8.935 -6.179 1.00 0.00 O ATOM 0 H GLU A 31 -6.108 4.729 -4.707 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.009 5.916 -2.773 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.993 7.194 -4.867 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.165 6.251 -5.765 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -9.998 7.175 -4.426 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -8.860 8.037 -3.409 1.00 0.00 H new ATOM 445 N LEU A 32 -9.932 4.442 -3.371 1.00 0.00 N ATOM 446 CA LEU A 32 -10.977 3.444 -3.571 1.00 0.00 C ATOM 447 C LEU A 32 -12.255 4.092 -4.094 1.00 0.00 C ATOM 448 O LEU A 32 -12.839 4.953 -3.438 1.00 0.00 O ATOM 449 CB LEU A 32 -11.264 2.708 -2.261 1.00 0.00 C ATOM 450 CG LEU A 32 -10.055 2.083 -1.563 1.00 0.00 C ATOM 451 CD1 LEU A 32 -10.382 1.764 -0.113 1.00 0.00 C ATOM 452 CD2 LEU A 32 -9.603 0.830 -2.298 1.00 0.00 C ATOM 0 H LEU A 32 -10.139 5.130 -2.647 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.624 2.728 -4.313 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.736 3.407 -1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.990 1.920 -2.462 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.238 2.804 -1.580 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.510 1.320 0.367 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.656 2.681 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.215 1.062 -0.074 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.742 0.399 -1.787 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.416 0.104 -2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.327 1.088 -3.320 1.00 0.00 H new ATOM 464 N ALA A 33 -12.685 3.669 -5.278 1.00 0.00 N ATOM 465 CA ALA A 33 -13.896 4.204 -5.887 1.00 0.00 C ATOM 466 C ALA A 33 -15.045 4.239 -4.886 1.00 0.00 C ATOM 467 O ALA A 33 -15.978 5.030 -5.024 1.00 0.00 O ATOM 468 CB ALA A 33 -14.281 3.381 -7.107 1.00 0.00 C ATOM 0 H ALA A 33 -12.212 2.957 -5.835 1.00 0.00 H new ATOM 0 HA ALA A 33 -13.693 5.227 -6.202 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.187 3.792 -7.552 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -13.472 3.412 -7.837 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -14.460 2.348 -6.808 1.00 0.00 H new ATOM 474 N ASP A 34 -14.971 3.376 -3.878 1.00 0.00 N ATOM 475 CA ASP A 34 -16.006 3.309 -2.852 1.00 0.00 C ATOM 476 C ASP A 34 -15.435 2.786 -1.538 1.00 0.00 C ATOM 477 O ASP A 34 -14.564 1.916 -1.514 1.00 0.00 O ATOM 478 CB ASP A 34 -17.156 2.412 -3.316 1.00 0.00 C ATOM 479 CG ASP A 34 -18.036 3.088 -4.348 1.00 0.00 C ATOM 480 OD1 ASP A 34 -19.013 3.757 -3.949 1.00 0.00 O ATOM 481 OD2 ASP A 34 -17.749 2.948 -5.555 1.00 0.00 O ATOM 0 H ASP A 34 -14.206 2.714 -3.750 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.386 4.317 -2.687 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.749 1.492 -3.736 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.762 2.129 -2.455 1.00 0.00 H new ATOM 486 N PRO A 35 -15.935 3.328 -0.418 1.00 0.00 N ATOM 487 CA PRO A 35 -15.488 2.931 0.921 1.00 0.00 C ATOM 488 C PRO A 35 -15.936 1.520 1.287 1.00 0.00 C ATOM 489 O PRO A 35 -15.310 0.854 2.112 1.00 0.00 O ATOM 490 CB PRO A 35 -16.158 3.959 1.837 1.00 0.00 C ATOM 491 CG PRO A 35 -17.358 4.415 1.082 1.00 0.00 C ATOM 492 CD PRO A 35 -16.975 4.369 -0.372 1.00 0.00 C ATOM 0 HA PRO A 35 -14.401 2.913 1.000 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -16.437 3.515 2.793 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -15.488 4.791 2.055 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -18.213 3.769 1.281 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -17.645 5.424 1.378 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -17.826 4.115 -1.004 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.597 5.331 -0.718 1.00 0.00 H new ATOM 500 N LYS A 36 -17.022 1.070 0.669 1.00 0.00 N ATOM 501 CA LYS A 36 -17.553 -0.263 0.927 1.00 0.00 C ATOM 502 C LYS A 36 -16.500 -1.331 0.652 1.00 0.00 C ATOM 503 O LYS A 36 -16.421 -2.337 1.359 1.00 0.00 O ATOM 504 CB LYS A 36 -18.791 -0.518 0.064 1.00 0.00 C ATOM 505 CG LYS A 36 -19.953 0.407 0.380 1.00 0.00 C ATOM 506 CD LYS A 36 -21.279 -0.195 -0.055 1.00 0.00 C ATOM 507 CE LYS A 36 -22.452 0.479 0.640 1.00 0.00 C ATOM 508 NZ LYS A 36 -22.744 -0.141 1.963 1.00 0.00 N ATOM 0 H LYS A 36 -17.552 1.610 -0.015 1.00 0.00 H new ATOM 0 HA LYS A 36 -17.834 -0.317 1.979 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.522 -0.404 -0.986 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -19.112 -1.551 0.200 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -19.978 0.609 1.451 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -19.805 1.363 -0.121 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -21.388 -0.095 -1.135 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -21.286 -1.262 0.169 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -22.234 1.538 0.776 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -23.336 0.414 0.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -23.550 0.346 2.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -22.977 -1.146 1.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -21.909 -0.057 2.578 1.00 0.00 H new ATOM 522 N LEU A 37 -15.691 -1.106 -0.377 1.00 0.00 N ATOM 523 CA LEU A 37 -14.640 -2.049 -0.745 1.00 0.00 C ATOM 524 C LEU A 37 -13.589 -2.151 0.356 1.00 0.00 C ATOM 525 O LEU A 37 -13.275 -1.163 1.019 1.00 0.00 O ATOM 526 CB LEU A 37 -13.980 -1.622 -2.057 1.00 0.00 C ATOM 527 CG LEU A 37 -14.881 -1.625 -3.293 1.00 0.00 C ATOM 528 CD1 LEU A 37 -14.299 -0.734 -4.380 1.00 0.00 C ATOM 529 CD2 LEU A 37 -15.072 -3.044 -3.810 1.00 0.00 C ATOM 0 H LEU A 37 -15.742 -0.279 -0.972 1.00 0.00 H new ATOM 0 HA LEU A 37 -15.097 -3.030 -0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -13.577 -0.617 -1.928 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -13.134 -2.283 -2.247 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.856 -1.228 -3.010 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -14.953 -0.749 -5.252 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.214 0.287 -4.007 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -13.312 -1.101 -4.661 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -15.716 -3.027 -4.690 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -14.104 -3.467 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.534 -3.655 -3.034 1.00 0.00 H new ATOM 541 N GLU A 38 -13.049 -3.351 0.543 1.00 0.00 N ATOM 542 CA GLU A 38 -12.032 -3.580 1.563 1.00 0.00 C ATOM 543 C GLU A 38 -10.631 -3.435 0.976 1.00 0.00 C ATOM 544 O GLU A 38 -10.450 -3.460 -0.241 1.00 0.00 O ATOM 545 CB GLU A 38 -12.199 -4.971 2.177 1.00 0.00 C ATOM 546 CG GLU A 38 -13.142 -5.001 3.369 1.00 0.00 C ATOM 547 CD GLU A 38 -14.592 -5.176 2.961 1.00 0.00 C ATOM 548 OE1 GLU A 38 -15.040 -4.461 2.040 1.00 0.00 O ATOM 549 OE2 GLU A 38 -15.278 -6.028 3.563 1.00 0.00 O ATOM 0 H GLU A 38 -13.298 -4.179 0.002 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.160 -2.829 2.343 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.571 -5.654 1.413 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.222 -5.341 2.488 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -12.855 -5.815 4.034 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.037 -4.075 3.934 1.00 0.00 H new ATOM 556 N VAL A 39 -9.642 -3.284 1.852 1.00 0.00 N ATOM 557 CA VAL A 39 -8.257 -3.137 1.422 1.00 0.00 C ATOM 558 C VAL A 39 -7.329 -4.024 2.244 1.00 0.00 C ATOM 559 O VAL A 39 -7.500 -4.168 3.455 1.00 0.00 O ATOM 560 CB VAL A 39 -7.786 -1.674 1.538 1.00 0.00 C ATOM 561 CG1 VAL A 39 -8.567 -0.785 0.582 1.00 0.00 C ATOM 562 CG2 VAL A 39 -7.925 -1.182 2.970 1.00 0.00 C ATOM 0 H VAL A 39 -9.775 -3.260 2.863 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.216 -3.443 0.377 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.732 -1.626 1.262 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.221 0.244 0.678 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.412 -1.126 -0.441 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.629 -0.835 0.824 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.588 -0.147 3.034 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.969 -1.243 3.276 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.317 -1.803 3.629 1.00 0.00 H new ATOM 572 N LYS A 40 -6.344 -4.618 1.578 1.00 0.00 N ATOM 573 CA LYS A 40 -5.386 -5.491 2.246 1.00 0.00 C ATOM 574 C LYS A 40 -3.983 -5.292 1.681 1.00 0.00 C ATOM 575 O LYS A 40 -3.765 -5.423 0.477 1.00 0.00 O ATOM 576 CB LYS A 40 -5.806 -6.954 2.094 1.00 0.00 C ATOM 577 CG LYS A 40 -7.014 -7.331 2.934 1.00 0.00 C ATOM 578 CD LYS A 40 -7.476 -8.749 2.641 1.00 0.00 C ATOM 579 CE LYS A 40 -8.824 -9.039 3.283 1.00 0.00 C ATOM 580 NZ LYS A 40 -8.699 -9.292 4.745 1.00 0.00 N ATOM 0 H LYS A 40 -6.188 -4.510 0.576 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.372 -5.232 3.305 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.027 -7.153 1.045 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.968 -7.594 2.370 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -6.766 -7.239 3.991 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.828 -6.634 2.736 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -7.546 -8.895 1.563 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -6.735 -9.458 3.011 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.494 -8.196 3.116 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.276 -9.906 2.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.639 -9.486 5.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.080 -10.112 4.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -8.291 -8.455 5.208 1.00 0.00 H new ATOM 594 N TRP A 41 -3.037 -4.976 2.558 1.00 0.00 N ATOM 595 CA TRP A 41 -1.654 -4.761 2.146 1.00 0.00 C ATOM 596 C TRP A 41 -0.832 -6.034 2.313 1.00 0.00 C ATOM 597 O TRP A 41 -0.900 -6.697 3.349 1.00 0.00 O ATOM 598 CB TRP A 41 -1.029 -3.625 2.958 1.00 0.00 C ATOM 599 CG TRP A 41 -1.653 -2.289 2.688 1.00 0.00 C ATOM 600 CD1 TRP A 41 -2.844 -1.828 3.171 1.00 0.00 C ATOM 601 CD2 TRP A 41 -1.118 -1.244 1.869 1.00 0.00 C ATOM 602 NE1 TRP A 41 -3.081 -0.558 2.702 1.00 0.00 N ATOM 603 CE2 TRP A 41 -2.037 -0.177 1.902 1.00 0.00 C ATOM 604 CE3 TRP A 41 0.049 -1.104 1.113 1.00 0.00 C ATOM 605 CZ2 TRP A 41 -1.824 1.010 1.207 1.00 0.00 C ATOM 606 CZ3 TRP A 41 0.259 0.075 0.423 1.00 0.00 C ATOM 607 CH2 TRP A 41 -0.674 1.120 0.475 1.00 0.00 C ATOM 0 H TRP A 41 -3.202 -4.863 3.558 1.00 0.00 H new ATOM 0 HA TRP A 41 -1.654 -4.487 1.091 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -1.121 -3.853 4.020 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.037 -3.572 2.735 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.503 -2.380 3.825 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -3.902 0.009 2.915 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.774 -1.903 1.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.542 1.816 1.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.157 0.193 -0.166 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -0.481 2.030 -0.074 1.00 0.00 H new ATOM 618 N TYR A 42 -0.056 -6.370 1.289 1.00 0.00 N ATOM 619 CA TYR A 42 0.778 -7.566 1.322 1.00 0.00 C ATOM 620 C TYR A 42 2.211 -7.242 0.911 1.00 0.00 C ATOM 621 O TYR A 42 2.448 -6.375 0.070 1.00 0.00 O ATOM 622 CB TYR A 42 0.202 -8.641 0.400 1.00 0.00 C ATOM 623 CG TYR A 42 -1.179 -9.108 0.802 1.00 0.00 C ATOM 624 CD1 TYR A 42 -2.315 -8.441 0.361 1.00 0.00 C ATOM 625 CD2 TYR A 42 -1.348 -10.216 1.623 1.00 0.00 C ATOM 626 CE1 TYR A 42 -3.579 -8.863 0.727 1.00 0.00 C ATOM 627 CE2 TYR A 42 -2.607 -10.646 1.993 1.00 0.00 C ATOM 628 CZ TYR A 42 -3.720 -9.966 1.543 1.00 0.00 C ATOM 629 OH TYR A 42 -4.976 -10.391 1.908 1.00 0.00 O ATOM 0 H TYR A 42 0.013 -5.831 0.426 1.00 0.00 H new ATOM 0 HA TYR A 42 0.789 -7.942 2.345 1.00 0.00 H new ATOM 0 HB2 TYR A 42 0.163 -8.252 -0.617 1.00 0.00 H new ATOM 0 HB3 TYR A 42 0.877 -9.497 0.388 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -2.208 -7.578 -0.279 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.479 -10.750 1.978 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -4.452 -8.332 0.376 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -2.720 -11.510 2.631 1.00 0.00 H new ATOM 0 HH TYR A 42 -4.900 -11.181 2.483 1.00 0.00 H new ATOM 639 N LYS A 43 3.165 -7.946 1.511 1.00 0.00 N ATOM 640 CA LYS A 43 4.576 -7.738 1.208 1.00 0.00 C ATOM 641 C LYS A 43 5.273 -9.064 0.919 1.00 0.00 C ATOM 642 O LYS A 43 5.562 -9.835 1.833 1.00 0.00 O ATOM 643 CB LYS A 43 5.270 -7.028 2.373 1.00 0.00 C ATOM 644 CG LYS A 43 6.776 -6.922 2.211 1.00 0.00 C ATOM 645 CD LYS A 43 7.433 -6.354 3.457 1.00 0.00 C ATOM 646 CE LYS A 43 8.930 -6.623 3.471 1.00 0.00 C ATOM 647 NZ LYS A 43 9.230 -8.080 3.529 1.00 0.00 N ATOM 0 H LYS A 43 2.986 -8.666 2.211 1.00 0.00 H new ATOM 0 HA LYS A 43 4.642 -7.112 0.318 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.853 -6.026 2.477 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.049 -7.563 3.297 1.00 0.00 H new ATOM 0 HG2 LYS A 43 7.190 -7.907 1.998 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.007 -6.287 1.356 1.00 0.00 H new ATOM 0 HD2 LYS A 43 7.255 -5.280 3.506 1.00 0.00 H new ATOM 0 HD3 LYS A 43 6.975 -6.793 4.343 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.385 -6.194 2.578 1.00 0.00 H new ATOM 0 HE3 LYS A 43 9.381 -6.125 4.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 10.176 -8.224 3.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 8.522 -8.557 4.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 9.202 -8.479 2.569 1.00 0.00 H new ATOM 661 N ASN A 44 5.540 -9.321 -0.357 1.00 0.00 N ATOM 662 CA ASN A 44 6.204 -10.554 -0.765 1.00 0.00 C ATOM 663 C ASN A 44 5.310 -11.764 -0.509 1.00 0.00 C ATOM 664 O ASN A 44 5.769 -12.795 -0.021 1.00 0.00 O ATOM 665 CB ASN A 44 7.528 -10.717 -0.016 1.00 0.00 C ATOM 666 CG ASN A 44 8.512 -11.595 -0.765 1.00 0.00 C ATOM 667 OD1 ASN A 44 8.442 -11.723 -1.988 1.00 0.00 O ATOM 668 ND2 ASN A 44 9.435 -12.208 -0.033 1.00 0.00 N ATOM 0 H ASN A 44 5.307 -8.693 -1.126 1.00 0.00 H new ATOM 0 HA ASN A 44 6.404 -10.492 -1.835 1.00 0.00 H new ATOM 0 HB2 ASN A 44 7.973 -9.735 0.148 1.00 0.00 H new ATOM 0 HB3 ASN A 44 7.336 -11.148 0.967 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.123 -12.813 -0.482 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.456 -12.074 0.978 1.00 0.00 H new ATOM 675 N GLY A 45 4.030 -11.628 -0.843 1.00 0.00 N ATOM 676 CA GLY A 45 3.092 -12.717 -0.642 1.00 0.00 C ATOM 677 C GLY A 45 2.806 -12.973 0.825 1.00 0.00 C ATOM 678 O GLY A 45 2.621 -14.118 1.236 1.00 0.00 O ATOM 0 H GLY A 45 3.626 -10.784 -1.249 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.159 -12.488 -1.156 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.491 -13.625 -1.095 1.00 0.00 H new ATOM 682 N GLN A 46 2.771 -11.905 1.614 1.00 0.00 N ATOM 683 CA GLN A 46 2.508 -12.020 3.044 1.00 0.00 C ATOM 684 C GLN A 46 1.826 -10.763 3.575 1.00 0.00 C ATOM 685 O GLN A 46 2.397 -9.674 3.539 1.00 0.00 O ATOM 686 CB GLN A 46 3.811 -12.268 3.805 1.00 0.00 C ATOM 687 CG GLN A 46 4.462 -13.603 3.480 1.00 0.00 C ATOM 688 CD GLN A 46 5.764 -13.815 4.227 1.00 0.00 C ATOM 689 OE1 GLN A 46 6.802 -14.088 3.623 1.00 0.00 O ATOM 690 NE2 GLN A 46 5.716 -13.690 5.548 1.00 0.00 N ATOM 0 H GLN A 46 2.921 -10.950 1.288 1.00 0.00 H new ATOM 0 HA GLN A 46 1.839 -12.867 3.198 1.00 0.00 H new ATOM 0 HB2 GLN A 46 4.513 -11.466 3.577 1.00 0.00 H new ATOM 0 HB3 GLN A 46 3.611 -12.222 4.876 1.00 0.00 H new ATOM 0 HG2 GLN A 46 3.771 -14.409 3.726 1.00 0.00 H new ATOM 0 HG3 GLN A 46 4.649 -13.660 2.408 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.834 -13.463 6.007 1.00 0.00 H new ATOM 0 HE22 GLN A 46 6.561 -13.821 6.104 1.00 0.00 H new ATOM 699 N GLU A 47 0.601 -10.924 4.066 1.00 0.00 N ATOM 700 CA GLU A 47 -0.159 -9.801 4.603 1.00 0.00 C ATOM 701 C GLU A 47 0.704 -8.958 5.538 1.00 0.00 C ATOM 702 O GLU A 47 1.646 -9.460 6.152 1.00 0.00 O ATOM 703 CB GLU A 47 -1.397 -10.304 5.349 1.00 0.00 C ATOM 704 CG GLU A 47 -2.106 -9.224 6.148 1.00 0.00 C ATOM 705 CD GLU A 47 -1.567 -9.095 7.560 1.00 0.00 C ATOM 706 OE1 GLU A 47 -0.400 -9.476 7.786 1.00 0.00 O ATOM 707 OE2 GLU A 47 -2.312 -8.613 8.438 1.00 0.00 O ATOM 0 H GLU A 47 0.114 -11.820 4.103 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.476 -9.177 3.767 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -2.096 -10.730 4.630 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -1.103 -11.109 6.023 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.001 -8.269 5.634 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.172 -9.448 6.189 1.00 0.00 H new ATOM 714 N ILE A 48 0.375 -7.674 5.640 1.00 0.00 N ATOM 715 CA ILE A 48 1.119 -6.762 6.499 1.00 0.00 C ATOM 716 C ILE A 48 0.322 -6.415 7.753 1.00 0.00 C ATOM 717 O ILE A 48 -0.855 -6.065 7.675 1.00 0.00 O ATOM 718 CB ILE A 48 1.482 -5.461 5.759 1.00 0.00 C ATOM 719 CG1 ILE A 48 2.316 -5.773 4.515 1.00 0.00 C ATOM 720 CG2 ILE A 48 2.235 -4.517 6.685 1.00 0.00 C ATOM 721 CD1 ILE A 48 2.519 -4.578 3.609 1.00 0.00 C ATOM 0 H ILE A 48 -0.401 -7.243 5.139 1.00 0.00 H new ATOM 0 HA ILE A 48 2.037 -7.276 6.785 1.00 0.00 H new ATOM 0 HB ILE A 48 0.561 -4.971 5.443 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.289 -6.153 4.826 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.829 -6.568 3.951 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.485 -3.602 6.147 1.00 0.00 H new ATOM 0 HG22 ILE A 48 1.609 -4.274 7.544 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.151 -4.998 7.028 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.119 -4.872 2.748 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.551 -4.211 3.269 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.034 -3.789 4.157 1.00 0.00 H new ATOM 733 N ARG A 49 0.973 -6.513 8.907 1.00 0.00 N ATOM 734 CA ARG A 49 0.326 -6.209 10.177 1.00 0.00 C ATOM 735 C ARG A 49 0.654 -4.789 10.629 1.00 0.00 C ATOM 736 O ARG A 49 1.765 -4.293 10.441 1.00 0.00 O ATOM 737 CB ARG A 49 0.763 -7.210 11.249 1.00 0.00 C ATOM 738 CG ARG A 49 2.220 -7.069 11.657 1.00 0.00 C ATOM 739 CD ARG A 49 2.383 -6.098 12.816 1.00 0.00 C ATOM 740 NE ARG A 49 2.294 -6.770 14.109 1.00 0.00 N ATOM 741 CZ ARG A 49 3.270 -7.510 14.621 1.00 0.00 C ATOM 742 NH1 ARG A 49 4.403 -7.673 13.953 1.00 0.00 N ATOM 743 NH2 ARG A 49 3.114 -8.090 15.805 1.00 0.00 N ATOM 0 H ARG A 49 1.948 -6.801 8.989 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.752 -6.287 10.034 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.134 -7.083 12.130 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.594 -8.222 10.880 1.00 0.00 H new ATOM 0 HG2 ARG A 49 2.616 -8.044 11.940 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.805 -6.722 10.805 1.00 0.00 H new ATOM 0 HD2 ARG A 49 3.346 -5.595 12.735 1.00 0.00 H new ATOM 0 HD3 ARG A 49 1.615 -5.327 12.754 1.00 0.00 H new ATOM 0 HE ARG A 49 1.435 -6.665 14.649 1.00 0.00 H new ATOM 0 HH11 ARG A 49 4.527 -7.229 13.043 1.00 0.00 H new ATOM 0 HH12 ARG A 49 5.151 -8.242 14.349 1.00 0.00 H new ATOM 0 HH21 ARG A 49 2.244 -7.967 16.322 1.00 0.00 H new ATOM 0 HH22 ARG A 49 3.865 -8.658 16.197 1.00 0.00 H new ATOM 757 N PRO A 50 -0.335 -4.118 11.237 1.00 0.00 N ATOM 758 CA PRO A 50 -0.176 -2.746 11.728 1.00 0.00 C ATOM 759 C PRO A 50 0.754 -2.666 12.934 1.00 0.00 C ATOM 760 O PRO A 50 0.478 -3.250 13.982 1.00 0.00 O ATOM 761 CB PRO A 50 -1.599 -2.342 12.122 1.00 0.00 C ATOM 762 CG PRO A 50 -2.288 -3.628 12.421 1.00 0.00 C ATOM 763 CD PRO A 50 -1.685 -4.647 11.494 1.00 0.00 C ATOM 0 HA PRO A 50 0.274 -2.095 10.979 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.597 -1.682 12.990 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.096 -1.805 11.314 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -2.144 -3.915 13.463 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.363 -3.542 12.260 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.649 -5.635 11.952 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -2.261 -4.743 10.574 1.00 0.00 H new ATOM 771 N SER A 51 1.855 -1.938 12.780 1.00 0.00 N ATOM 772 CA SER A 51 2.827 -1.784 13.856 1.00 0.00 C ATOM 773 C SER A 51 3.577 -0.462 13.725 1.00 0.00 C ATOM 774 O SER A 51 3.321 0.325 12.813 1.00 0.00 O ATOM 775 CB SER A 51 3.818 -2.949 13.846 1.00 0.00 C ATOM 776 OG SER A 51 4.515 -3.036 15.078 1.00 0.00 O ATOM 0 H SER A 51 2.096 -1.445 11.920 1.00 0.00 H new ATOM 0 HA SER A 51 2.288 -1.783 14.803 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.286 -3.882 13.659 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.529 -2.819 13.030 1.00 0.00 H new ATOM 0 HG SER A 51 5.141 -3.789 15.047 1.00 0.00 H new ATOM 782 N THR A 52 4.507 -0.223 14.645 1.00 0.00 N ATOM 783 CA THR A 52 5.295 1.004 14.635 1.00 0.00 C ATOM 784 C THR A 52 6.006 1.189 13.300 1.00 0.00 C ATOM 785 O THR A 52 6.447 2.290 12.967 1.00 0.00 O ATOM 786 CB THR A 52 6.340 1.009 15.766 1.00 0.00 C ATOM 787 OG1 THR A 52 7.272 2.078 15.567 1.00 0.00 O ATOM 788 CG2 THR A 52 7.086 -0.317 15.820 1.00 0.00 C ATOM 0 H THR A 52 4.733 -0.863 15.406 1.00 0.00 H new ATOM 0 HA THR A 52 4.599 1.829 14.790 1.00 0.00 H new ATOM 0 HB THR A 52 5.818 1.153 16.712 1.00 0.00 H new ATOM 0 HG1 THR A 52 7.932 2.075 16.291 1.00 0.00 H new ATOM 0 HG21 THR A 52 7.819 -0.290 16.627 1.00 0.00 H new ATOM 0 HG22 THR A 52 6.378 -1.126 16.000 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.596 -0.486 14.872 1.00 0.00 H new ATOM 796 N LYS A 53 6.114 0.107 12.537 1.00 0.00 N ATOM 797 CA LYS A 53 6.770 0.150 11.235 1.00 0.00 C ATOM 798 C LYS A 53 5.773 0.497 10.134 1.00 0.00 C ATOM 799 O LYS A 53 6.065 1.304 9.251 1.00 0.00 O ATOM 800 CB LYS A 53 7.434 -1.195 10.931 1.00 0.00 C ATOM 801 CG LYS A 53 8.452 -1.130 9.806 1.00 0.00 C ATOM 802 CD LYS A 53 9.370 -2.340 9.814 1.00 0.00 C ATOM 803 CE LYS A 53 10.076 -2.514 8.478 1.00 0.00 C ATOM 804 NZ LYS A 53 10.410 -3.940 8.209 1.00 0.00 N ATOM 0 H LYS A 53 5.755 -0.812 12.798 1.00 0.00 H new ATOM 0 HA LYS A 53 7.534 0.927 11.267 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.925 -1.561 11.833 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.663 -1.921 10.671 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.934 -1.071 8.849 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.046 -0.221 9.903 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.111 -2.231 10.606 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.791 -3.236 10.040 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.440 -2.133 7.679 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.989 -1.919 8.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.890 -4.017 7.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.037 -4.297 8.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.536 -4.504 8.191 1.00 0.00 H new ATOM 818 N TYR A 54 4.596 -0.115 10.194 1.00 0.00 N ATOM 819 CA TYR A 54 3.556 0.129 9.202 1.00 0.00 C ATOM 820 C TYR A 54 2.497 1.084 9.746 1.00 0.00 C ATOM 821 O TYR A 54 1.771 0.753 10.684 1.00 0.00 O ATOM 822 CB TYR A 54 2.903 -1.188 8.782 1.00 0.00 C ATOM 823 CG TYR A 54 3.868 -2.170 8.156 1.00 0.00 C ATOM 824 CD1 TYR A 54 4.389 -1.948 6.886 1.00 0.00 C ATOM 825 CD2 TYR A 54 4.259 -3.318 8.833 1.00 0.00 C ATOM 826 CE1 TYR A 54 5.270 -2.842 6.310 1.00 0.00 C ATOM 827 CE2 TYR A 54 5.141 -4.217 8.265 1.00 0.00 C ATOM 828 CZ TYR A 54 5.644 -3.975 7.003 1.00 0.00 C ATOM 829 OH TYR A 54 6.521 -4.868 6.433 1.00 0.00 O ATOM 0 H TYR A 54 4.338 -0.784 10.919 1.00 0.00 H new ATOM 0 HA TYR A 54 4.022 0.590 8.331 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.443 -1.650 9.655 1.00 0.00 H new ATOM 0 HB3 TYR A 54 2.102 -0.977 8.074 1.00 0.00 H new ATOM 0 HD1 TYR A 54 4.100 -1.062 6.341 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.867 -3.511 9.821 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.664 -2.655 5.322 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.435 -5.104 8.806 1.00 0.00 H new ATOM 0 HH TYR A 54 6.681 -5.610 7.053 1.00 0.00 H new ATOM 839 N ILE A 55 2.415 2.268 9.149 1.00 0.00 N ATOM 840 CA ILE A 55 1.445 3.270 9.571 1.00 0.00 C ATOM 841 C ILE A 55 0.204 3.242 8.685 1.00 0.00 C ATOM 842 O ILE A 55 0.232 3.706 7.545 1.00 0.00 O ATOM 843 CB ILE A 55 2.049 4.686 9.544 1.00 0.00 C ATOM 844 CG1 ILE A 55 3.507 4.651 10.006 1.00 0.00 C ATOM 845 CG2 ILE A 55 1.234 5.628 10.418 1.00 0.00 C ATOM 846 CD1 ILE A 55 3.672 4.254 11.456 1.00 0.00 C ATOM 0 H ILE A 55 3.009 2.557 8.372 1.00 0.00 H new ATOM 0 HA ILE A 55 1.163 3.024 10.595 1.00 0.00 H new ATOM 0 HB ILE A 55 2.020 5.057 8.519 1.00 0.00 H new ATOM 0 HG12 ILE A 55 4.061 3.951 9.381 1.00 0.00 H new ATOM 0 HG13 ILE A 55 3.951 5.635 9.854 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.674 6.625 10.388 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.210 5.673 10.048 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.233 5.262 11.445 1.00 0.00 H new ATOM 0 HD11 ILE A 55 4.731 4.250 11.714 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.146 4.967 12.091 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.258 3.258 11.610 1.00 0.00 H new ATOM 858 N PHE A 56 -0.884 2.697 9.217 1.00 0.00 N ATOM 859 CA PHE A 56 -2.137 2.609 8.475 1.00 0.00 C ATOM 860 C PHE A 56 -3.026 3.814 8.765 1.00 0.00 C ATOM 861 O PHE A 56 -3.422 4.045 9.906 1.00 0.00 O ATOM 862 CB PHE A 56 -2.876 1.317 8.832 1.00 0.00 C ATOM 863 CG PHE A 56 -2.213 0.080 8.296 1.00 0.00 C ATOM 864 CD1 PHE A 56 -1.076 -0.430 8.902 1.00 0.00 C ATOM 865 CD2 PHE A 56 -2.728 -0.573 7.188 1.00 0.00 C ATOM 866 CE1 PHE A 56 -0.464 -1.569 8.412 1.00 0.00 C ATOM 867 CE2 PHE A 56 -2.120 -1.712 6.694 1.00 0.00 C ATOM 868 CZ PHE A 56 -0.987 -2.210 7.306 1.00 0.00 C ATOM 0 H PHE A 56 -0.924 2.309 10.160 1.00 0.00 H new ATOM 0 HA PHE A 56 -1.901 2.602 7.411 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -2.951 1.239 9.917 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -3.894 1.371 8.445 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.663 0.068 9.767 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -3.614 -0.188 6.705 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.422 -1.957 8.893 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -2.531 -2.212 5.830 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.511 -3.099 6.921 1.00 0.00 H new ATOM 878 N GLU A 57 -3.336 4.578 7.721 1.00 0.00 N ATOM 879 CA GLU A 57 -4.178 5.760 7.864 1.00 0.00 C ATOM 880 C GLU A 57 -5.349 5.715 6.887 1.00 0.00 C ATOM 881 O GLU A 57 -5.315 4.989 5.893 1.00 0.00 O ATOM 882 CB GLU A 57 -3.355 7.029 7.634 1.00 0.00 C ATOM 883 CG GLU A 57 -2.643 7.528 8.880 1.00 0.00 C ATOM 884 CD GLU A 57 -1.723 6.484 9.483 1.00 0.00 C ATOM 885 OE1 GLU A 57 -1.031 5.787 8.713 1.00 0.00 O ATOM 886 OE2 GLU A 57 -1.696 6.366 10.726 1.00 0.00 O ATOM 0 H GLU A 57 -3.017 4.399 6.769 1.00 0.00 H new ATOM 0 HA GLU A 57 -4.575 5.772 8.879 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -2.616 6.836 6.856 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -4.012 7.815 7.262 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -2.064 8.417 8.632 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -3.383 7.827 9.622 1.00 0.00 H new ATOM 893 N HIS A 58 -6.385 6.496 7.177 1.00 0.00 N ATOM 894 CA HIS A 58 -7.567 6.546 6.325 1.00 0.00 C ATOM 895 C HIS A 58 -8.105 7.971 6.225 1.00 0.00 C ATOM 896 O HIS A 58 -8.481 8.575 7.229 1.00 0.00 O ATOM 897 CB HIS A 58 -8.652 5.616 6.867 1.00 0.00 C ATOM 898 CG HIS A 58 -9.920 5.645 6.069 1.00 0.00 C ATOM 899 ND1 HIS A 58 -11.143 5.271 6.585 1.00 0.00 N ATOM 900 CD2 HIS A 58 -10.150 6.008 4.786 1.00 0.00 C ATOM 901 CE1 HIS A 58 -12.070 5.402 5.653 1.00 0.00 C ATOM 902 NE2 HIS A 58 -11.493 5.848 4.552 1.00 0.00 N ATOM 0 H HIS A 58 -6.429 7.103 7.996 1.00 0.00 H new ATOM 0 HA HIS A 58 -7.280 6.214 5.327 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -8.268 4.596 6.887 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -8.875 5.893 7.898 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -9.414 6.358 4.078 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -13.121 5.182 5.771 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -11.968 6.042 3.671 1.00 0.00 H new ATOM 911 N LYS A 59 -8.137 8.501 5.007 1.00 0.00 N ATOM 912 CA LYS A 59 -8.629 9.854 4.775 1.00 0.00 C ATOM 913 C LYS A 59 -9.593 9.887 3.593 1.00 0.00 C ATOM 914 O LYS A 59 -9.187 10.116 2.455 1.00 0.00 O ATOM 915 CB LYS A 59 -7.459 10.807 4.519 1.00 0.00 C ATOM 916 CG LYS A 59 -6.454 10.855 5.657 1.00 0.00 C ATOM 917 CD LYS A 59 -5.378 11.899 5.407 1.00 0.00 C ATOM 918 CE LYS A 59 -4.688 12.308 6.699 1.00 0.00 C ATOM 919 NZ LYS A 59 -5.465 13.339 7.440 1.00 0.00 N ATOM 0 H LYS A 59 -7.828 8.014 4.165 1.00 0.00 H new ATOM 0 HA LYS A 59 -9.165 10.177 5.668 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.947 10.503 3.606 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.849 11.810 4.347 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -6.970 11.080 6.590 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.991 9.875 5.776 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.640 11.503 4.709 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -5.823 12.776 4.937 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.553 11.431 7.332 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.694 12.695 6.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.962 13.591 8.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -5.573 14.186 6.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.404 12.961 7.678 1.00 0.00 H new ATOM 933 N GLY A 60 -10.872 9.658 3.872 1.00 0.00 N ATOM 934 CA GLY A 60 -11.874 9.667 2.822 1.00 0.00 C ATOM 935 C GLY A 60 -11.503 8.768 1.659 1.00 0.00 C ATOM 936 O GLY A 60 -10.671 9.130 0.827 1.00 0.00 O ATOM 0 H GLY A 60 -11.233 9.466 4.807 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.831 9.346 3.234 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.008 10.687 2.461 1.00 0.00 H new ATOM 940 N CYS A 61 -12.120 7.593 1.603 1.00 0.00 N ATOM 941 CA CYS A 61 -11.848 6.638 0.534 1.00 0.00 C ATOM 942 C CYS A 61 -10.383 6.692 0.116 1.00 0.00 C ATOM 943 O CYS A 61 -10.066 6.683 -1.073 1.00 0.00 O ATOM 944 CB CYS A 61 -12.746 6.921 -0.672 1.00 0.00 C ATOM 945 SG CYS A 61 -14.514 6.921 -0.292 1.00 0.00 S ATOM 0 H CYS A 61 -12.811 7.279 2.284 1.00 0.00 H new ATOM 0 HA CYS A 61 -12.063 5.638 0.911 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -12.476 7.889 -1.093 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -12.550 6.173 -1.441 1.00 0.00 H new ATOM 0 HG CYS A 61 -15.190 7.172 -1.374 1.00 0.00 H new ATOM 951 N GLN A 62 -9.493 6.749 1.102 1.00 0.00 N ATOM 952 CA GLN A 62 -8.061 6.807 0.836 1.00 0.00 C ATOM 953 C GLN A 62 -7.274 6.104 1.937 1.00 0.00 C ATOM 954 O GLN A 62 -7.288 6.530 3.092 1.00 0.00 O ATOM 955 CB GLN A 62 -7.602 8.261 0.713 1.00 0.00 C ATOM 956 CG GLN A 62 -6.326 8.430 -0.096 1.00 0.00 C ATOM 957 CD GLN A 62 -5.830 9.862 -0.110 1.00 0.00 C ATOM 958 OE1 GLN A 62 -5.608 10.444 -1.172 1.00 0.00 O ATOM 959 NE2 GLN A 62 -5.653 10.439 1.073 1.00 0.00 N ATOM 0 H GLN A 62 -9.739 6.756 2.092 1.00 0.00 H new ATOM 0 HA GLN A 62 -7.871 6.293 -0.106 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -8.396 8.846 0.249 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -7.446 8.670 1.711 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -5.550 7.785 0.317 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -6.503 8.101 -1.120 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.849 9.919 1.928 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.321 11.402 1.126 1.00 0.00 H new ATOM 968 N ARG A 63 -6.588 5.026 1.572 1.00 0.00 N ATOM 969 CA ARG A 63 -5.796 4.264 2.529 1.00 0.00 C ATOM 970 C ARG A 63 -4.306 4.532 2.338 1.00 0.00 C ATOM 971 O ARG A 63 -3.748 4.259 1.275 1.00 0.00 O ATOM 972 CB ARG A 63 -6.079 2.768 2.381 1.00 0.00 C ATOM 973 CG ARG A 63 -7.543 2.404 2.566 1.00 0.00 C ATOM 974 CD ARG A 63 -7.874 2.152 4.029 1.00 0.00 C ATOM 975 NE ARG A 63 -9.293 1.870 4.229 1.00 0.00 N ATOM 976 CZ ARG A 63 -9.817 1.531 5.401 1.00 0.00 C ATOM 977 NH1 ARG A 63 -9.043 1.433 6.473 1.00 0.00 N ATOM 978 NH2 ARG A 63 -11.118 1.290 5.503 1.00 0.00 N ATOM 0 H ARG A 63 -6.565 4.661 0.620 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.079 4.583 3.532 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.754 2.441 1.393 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.482 2.220 3.110 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.170 3.209 2.183 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.774 1.514 1.981 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.283 1.313 4.395 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.591 3.023 4.620 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.916 1.937 3.424 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.043 1.618 6.398 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.448 1.172 7.372 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -11.717 1.365 4.681 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.519 1.030 6.404 1.00 0.00 H new ATOM 992 N ILE A 64 -3.669 5.067 3.374 1.00 0.00 N ATOM 993 CA ILE A 64 -2.244 5.371 3.320 1.00 0.00 C ATOM 994 C ILE A 64 -1.434 4.351 4.112 1.00 0.00 C ATOM 995 O ILE A 64 -1.931 3.755 5.068 1.00 0.00 O ATOM 996 CB ILE A 64 -1.948 6.781 3.865 1.00 0.00 C ATOM 997 CG1 ILE A 64 -2.712 7.834 3.060 1.00 0.00 C ATOM 998 CG2 ILE A 64 -0.453 7.060 3.829 1.00 0.00 C ATOM 999 CD1 ILE A 64 -3.091 9.055 3.868 1.00 0.00 C ATOM 0 H ILE A 64 -4.117 5.299 4.261 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.952 5.327 2.271 1.00 0.00 H new ATOM 0 HB ILE A 64 -2.282 6.831 4.901 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.102 8.145 2.212 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.617 7.382 2.653 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.260 8.060 4.217 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.069 6.326 4.442 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.095 6.994 2.801 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.630 9.759 3.233 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.728 8.757 4.701 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -2.189 9.531 4.253 1.00 0.00 H new ATOM 1011 N LEU A 65 -0.183 4.156 3.709 1.00 0.00 N ATOM 1012 CA LEU A 65 0.699 3.209 4.383 1.00 0.00 C ATOM 1013 C LEU A 65 2.143 3.699 4.361 1.00 0.00 C ATOM 1014 O LEU A 65 2.674 4.050 3.307 1.00 0.00 O ATOM 1015 CB LEU A 65 0.604 1.834 3.719 1.00 0.00 C ATOM 1016 CG LEU A 65 1.362 0.701 4.412 1.00 0.00 C ATOM 1017 CD1 LEU A 65 2.851 1.008 4.463 1.00 0.00 C ATOM 1018 CD2 LEU A 65 0.815 0.472 5.814 1.00 0.00 C ATOM 0 H LEU A 65 0.243 4.641 2.919 1.00 0.00 H new ATOM 0 HA LEU A 65 0.379 3.127 5.422 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.448 1.555 3.655 1.00 0.00 H new ATOM 0 HB3 LEU A 65 0.973 1.920 2.697 1.00 0.00 H new ATOM 0 HG LEU A 65 1.219 -0.212 3.834 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.374 0.191 4.960 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.234 1.121 3.449 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.013 1.932 5.017 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.366 -0.338 6.292 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.927 1.383 6.402 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.240 0.206 5.754 1.00 0.00 H new ATOM 1030 N PHE A 66 2.773 3.719 5.531 1.00 0.00 N ATOM 1031 CA PHE A 66 4.157 4.165 5.646 1.00 0.00 C ATOM 1032 C PHE A 66 5.030 3.074 6.259 1.00 0.00 C ATOM 1033 O PHE A 66 4.624 2.397 7.204 1.00 0.00 O ATOM 1034 CB PHE A 66 4.237 5.436 6.494 1.00 0.00 C ATOM 1035 CG PHE A 66 3.502 6.602 5.897 1.00 0.00 C ATOM 1036 CD1 PHE A 66 4.139 7.461 5.015 1.00 0.00 C ATOM 1037 CD2 PHE A 66 2.175 6.839 6.217 1.00 0.00 C ATOM 1038 CE1 PHE A 66 3.466 8.535 4.465 1.00 0.00 C ATOM 1039 CE2 PHE A 66 1.497 7.912 5.669 1.00 0.00 C ATOM 1040 CZ PHE A 66 2.143 8.760 4.792 1.00 0.00 C ATOM 0 H PHE A 66 2.348 3.432 6.412 1.00 0.00 H new ATOM 0 HA PHE A 66 4.528 4.382 4.644 1.00 0.00 H new ATOM 0 HB2 PHE A 66 3.831 5.229 7.484 1.00 0.00 H new ATOM 0 HB3 PHE A 66 5.284 5.707 6.630 1.00 0.00 H new ATOM 0 HD1 PHE A 66 5.173 7.289 4.755 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.665 6.178 6.902 1.00 0.00 H new ATOM 0 HE1 PHE A 66 3.974 9.198 3.780 1.00 0.00 H new ATOM 0 HE2 PHE A 66 0.463 8.087 5.927 1.00 0.00 H new ATOM 0 HZ PHE A 66 1.615 9.598 4.362 1.00 0.00 H new ATOM 1050 N ILE A 67 6.232 2.911 5.716 1.00 0.00 N ATOM 1051 CA ILE A 67 7.162 1.904 6.209 1.00 0.00 C ATOM 1052 C ILE A 67 8.474 2.540 6.658 1.00 0.00 C ATOM 1053 O ILE A 67 9.210 3.103 5.849 1.00 0.00 O ATOM 1054 CB ILE A 67 7.462 0.840 5.137 1.00 0.00 C ATOM 1055 CG1 ILE A 67 6.172 0.135 4.713 1.00 0.00 C ATOM 1056 CG2 ILE A 67 8.475 -0.168 5.659 1.00 0.00 C ATOM 1057 CD1 ILE A 67 6.338 -0.749 3.496 1.00 0.00 C ATOM 0 H ILE A 67 6.584 3.464 4.934 1.00 0.00 H new ATOM 0 HA ILE A 67 6.682 1.423 7.062 1.00 0.00 H new ATOM 0 HB ILE A 67 7.888 1.335 4.264 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.808 -0.469 5.544 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.409 0.885 4.506 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.676 -0.913 4.890 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.401 0.347 5.917 1.00 0.00 H new ATOM 0 HG23 ILE A 67 8.075 -0.660 6.545 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.384 -1.216 3.253 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.672 -0.146 2.652 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.078 -1.522 3.706 1.00 0.00 H new ATOM 1069 N ASN A 68 8.759 2.444 7.952 1.00 0.00 N ATOM 1070 CA ASN A 68 9.983 3.010 8.509 1.00 0.00 C ATOM 1071 C ASN A 68 11.125 2.000 8.450 1.00 0.00 C ATOM 1072 O ASN A 68 10.904 0.812 8.220 1.00 0.00 O ATOM 1073 CB ASN A 68 9.753 3.452 9.956 1.00 0.00 C ATOM 1074 CG ASN A 68 8.870 4.682 10.051 1.00 0.00 C ATOM 1075 OD1 ASN A 68 9.297 5.792 9.731 1.00 0.00 O ATOM 1076 ND2 ASN A 68 7.633 4.489 10.493 1.00 0.00 N ATOM 0 H ASN A 68 8.160 1.980 8.635 1.00 0.00 H new ATOM 0 HA ASN A 68 10.258 3.878 7.910 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.295 2.635 10.514 1.00 0.00 H new ATOM 0 HB3 ASN A 68 10.714 3.660 10.427 1.00 0.00 H new ATOM 0 HD21 ASN A 68 6.993 5.279 10.579 1.00 0.00 H new ATOM 0 HD22 ASN A 68 7.323 3.551 10.747 1.00 0.00 H new ATOM 1083 N ASN A 69 12.345 2.482 8.660 1.00 0.00 N ATOM 1084 CA ASN A 69 13.522 1.622 8.630 1.00 0.00 C ATOM 1085 C ASN A 69 13.701 0.990 7.253 1.00 0.00 C ATOM 1086 O ASN A 69 13.890 -0.221 7.133 1.00 0.00 O ATOM 1087 CB ASN A 69 13.407 0.528 9.694 1.00 0.00 C ATOM 1088 CG ASN A 69 13.620 1.061 11.097 1.00 0.00 C ATOM 1089 OD1 ASN A 69 13.354 2.230 11.376 1.00 0.00 O ATOM 1090 ND2 ASN A 69 14.102 0.203 11.989 1.00 0.00 N ATOM 0 H ASN A 69 12.545 3.464 8.853 1.00 0.00 H new ATOM 0 HA ASN A 69 14.396 2.238 8.843 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.422 0.065 9.630 1.00 0.00 H new ATOM 0 HB3 ASN A 69 14.140 -0.252 9.490 1.00 0.00 H new ATOM 0 HD21 ASN A 69 14.266 0.504 12.950 1.00 0.00 H new ATOM 0 HD22 ASN A 69 14.308 -0.757 11.713 1.00 0.00 H new ATOM 1097 N CYS A 70 13.640 1.819 6.216 1.00 0.00 N ATOM 1098 CA CYS A 70 13.794 1.343 4.846 1.00 0.00 C ATOM 1099 C CYS A 70 15.209 0.826 4.607 1.00 0.00 C ATOM 1100 O CYS A 70 16.177 1.582 4.682 1.00 0.00 O ATOM 1101 CB CYS A 70 13.472 2.462 3.855 1.00 0.00 C ATOM 1102 SG CYS A 70 11.786 3.101 3.986 1.00 0.00 S ATOM 0 H CYS A 70 13.485 2.824 6.298 1.00 0.00 H new ATOM 0 HA CYS A 70 13.095 0.521 4.692 1.00 0.00 H new ATOM 0 HB2 CYS A 70 14.173 3.282 4.009 1.00 0.00 H new ATOM 0 HB3 CYS A 70 13.631 2.093 2.842 1.00 0.00 H new ATOM 0 HG CYS A 70 11.269 2.732 5.120 1.00 0.00 H new ATOM 1108 N GLN A 71 15.321 -0.467 4.320 1.00 0.00 N ATOM 1109 CA GLN A 71 16.618 -1.085 4.072 1.00 0.00 C ATOM 1110 C GLN A 71 16.658 -1.731 2.691 1.00 0.00 C ATOM 1111 O GLN A 71 15.618 -1.999 2.090 1.00 0.00 O ATOM 1112 CB GLN A 71 16.922 -2.130 5.146 1.00 0.00 C ATOM 1113 CG GLN A 71 18.404 -2.272 5.454 1.00 0.00 C ATOM 1114 CD GLN A 71 18.861 -1.345 6.563 1.00 0.00 C ATOM 1115 OE1 GLN A 71 19.134 -1.784 7.681 1.00 0.00 O ATOM 1116 NE2 GLN A 71 18.946 -0.056 6.260 1.00 0.00 N ATOM 0 H GLN A 71 14.529 -1.107 4.254 1.00 0.00 H new ATOM 0 HA GLN A 71 17.378 -0.304 4.110 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.393 -1.863 6.061 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.532 -3.095 4.823 1.00 0.00 H new ATOM 0 HG2 GLN A 71 18.615 -3.303 5.737 1.00 0.00 H new ATOM 0 HG3 GLN A 71 18.980 -2.065 4.552 1.00 0.00 H new ATOM 0 HE21 GLN A 71 18.710 0.264 5.321 1.00 0.00 H new ATOM 0 HE22 GLN A 71 19.247 0.615 6.966 1.00 0.00 H new ATOM 1125 N MET A 72 17.865 -1.978 2.193 1.00 0.00 N ATOM 1126 CA MET A 72 18.040 -2.594 0.883 1.00 0.00 C ATOM 1127 C MET A 72 17.317 -3.935 0.812 1.00 0.00 C ATOM 1128 O MET A 72 16.347 -4.091 0.069 1.00 0.00 O ATOM 1129 CB MET A 72 19.527 -2.786 0.581 1.00 0.00 C ATOM 1130 CG MET A 72 20.230 -1.509 0.150 1.00 0.00 C ATOM 1131 SD MET A 72 20.916 -0.591 1.541 1.00 0.00 S ATOM 1132 CE MET A 72 19.855 0.852 1.551 1.00 0.00 C ATOM 0 H MET A 72 18.736 -1.761 2.677 1.00 0.00 H new ATOM 0 HA MET A 72 17.608 -1.929 0.135 1.00 0.00 H new ATOM 0 HB2 MET A 72 20.021 -3.181 1.468 1.00 0.00 H new ATOM 0 HB3 MET A 72 19.636 -3.534 -0.204 1.00 0.00 H new ATOM 0 HG2 MET A 72 21.031 -1.757 -0.547 1.00 0.00 H new ATOM 0 HG3 MET A 72 19.525 -0.874 -0.387 1.00 0.00 H new ATOM 0 HE1 MET A 72 20.399 1.701 1.966 1.00 0.00 H new ATOM 0 HE2 MET A 72 19.545 1.083 0.532 1.00 0.00 H new ATOM 0 HE3 MET A 72 18.974 0.652 2.161 1.00 0.00 H new ATOM 1142 N THR A 73 17.795 -4.902 1.588 1.00 0.00 N ATOM 1143 CA THR A 73 17.195 -6.230 1.612 1.00 0.00 C ATOM 1144 C THR A 73 15.701 -6.153 1.902 1.00 0.00 C ATOM 1145 O THR A 73 14.942 -7.055 1.546 1.00 0.00 O ATOM 1146 CB THR A 73 17.866 -7.131 2.666 1.00 0.00 C ATOM 1147 OG1 THR A 73 17.234 -8.416 2.686 1.00 0.00 O ATOM 1148 CG2 THR A 73 17.785 -6.500 4.048 1.00 0.00 C ATOM 0 H THR A 73 18.597 -4.790 2.209 1.00 0.00 H new ATOM 0 HA THR A 73 17.348 -6.664 0.624 1.00 0.00 H new ATOM 0 HB THR A 73 18.916 -7.247 2.397 1.00 0.00 H new ATOM 0 HG1 THR A 73 17.667 -8.983 3.357 1.00 0.00 H new ATOM 0 HG21 THR A 73 18.265 -7.154 4.775 1.00 0.00 H new ATOM 0 HG22 THR A 73 18.292 -5.535 4.038 1.00 0.00 H new ATOM 0 HG23 THR A 73 16.740 -6.358 4.322 1.00 0.00 H new ATOM 1156 N ASP A 74 15.284 -5.071 2.550 1.00 0.00 N ATOM 1157 CA ASP A 74 13.878 -4.876 2.887 1.00 0.00 C ATOM 1158 C ASP A 74 13.059 -4.562 1.639 1.00 0.00 C ATOM 1159 O ASP A 74 11.910 -4.985 1.516 1.00 0.00 O ATOM 1160 CB ASP A 74 13.729 -3.747 3.908 1.00 0.00 C ATOM 1161 CG ASP A 74 14.055 -4.196 5.319 1.00 0.00 C ATOM 1162 OD1 ASP A 74 15.134 -4.792 5.518 1.00 0.00 O ATOM 1163 OD2 ASP A 74 13.232 -3.950 6.225 1.00 0.00 O ATOM 0 H ASP A 74 15.899 -4.316 2.853 1.00 0.00 H new ATOM 0 HA ASP A 74 13.502 -5.802 3.323 1.00 0.00 H new ATOM 0 HB2 ASP A 74 14.386 -2.922 3.632 1.00 0.00 H new ATOM 0 HB3 ASP A 74 12.708 -3.366 3.878 1.00 0.00 H new ATOM 1168 N ASP A 75 13.658 -3.816 0.717 1.00 0.00 N ATOM 1169 CA ASP A 75 12.984 -3.445 -0.522 1.00 0.00 C ATOM 1170 C ASP A 75 12.210 -4.627 -1.095 1.00 0.00 C ATOM 1171 O ASP A 75 12.799 -5.624 -1.512 1.00 0.00 O ATOM 1172 CB ASP A 75 13.999 -2.938 -1.548 1.00 0.00 C ATOM 1173 CG ASP A 75 14.588 -4.060 -2.381 1.00 0.00 C ATOM 1174 OD1 ASP A 75 15.145 -5.009 -1.791 1.00 0.00 O ATOM 1175 OD2 ASP A 75 14.491 -3.988 -3.624 1.00 0.00 O ATOM 0 H ASP A 75 14.609 -3.456 0.804 1.00 0.00 H new ATOM 0 HA ASP A 75 12.277 -2.646 -0.297 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.516 -2.215 -2.206 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.802 -2.412 -1.032 1.00 0.00 H new ATOM 1180 N SER A 76 10.886 -4.510 -1.110 1.00 0.00 N ATOM 1181 CA SER A 76 10.030 -5.571 -1.627 1.00 0.00 C ATOM 1182 C SER A 76 8.913 -4.995 -2.493 1.00 0.00 C ATOM 1183 O SER A 76 8.726 -3.781 -2.556 1.00 0.00 O ATOM 1184 CB SER A 76 9.431 -6.380 -0.475 1.00 0.00 C ATOM 1185 OG SER A 76 8.831 -7.573 -0.947 1.00 0.00 O ATOM 0 H SER A 76 10.383 -3.691 -0.770 1.00 0.00 H new ATOM 0 HA SER A 76 10.642 -6.229 -2.244 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.211 -6.623 0.247 1.00 0.00 H new ATOM 0 HB3 SER A 76 8.688 -5.778 0.048 1.00 0.00 H new ATOM 0 HG SER A 76 7.926 -7.652 -0.579 1.00 0.00 H new ATOM 1191 N GLU A 77 8.175 -5.878 -3.160 1.00 0.00 N ATOM 1192 CA GLU A 77 7.078 -5.457 -4.023 1.00 0.00 C ATOM 1193 C GLU A 77 5.750 -5.494 -3.272 1.00 0.00 C ATOM 1194 O GLU A 77 5.213 -6.566 -2.991 1.00 0.00 O ATOM 1195 CB GLU A 77 7.001 -6.353 -5.261 1.00 0.00 C ATOM 1196 CG GLU A 77 5.882 -5.977 -6.217 1.00 0.00 C ATOM 1197 CD GLU A 77 5.861 -6.843 -7.461 1.00 0.00 C ATOM 1198 OE1 GLU A 77 5.792 -8.082 -7.321 1.00 0.00 O ATOM 1199 OE2 GLU A 77 5.913 -6.282 -8.575 1.00 0.00 O ATOM 0 H GLU A 77 8.317 -6.887 -3.119 1.00 0.00 H new ATOM 0 HA GLU A 77 7.270 -4.431 -4.337 1.00 0.00 H new ATOM 0 HB2 GLU A 77 7.952 -6.307 -5.792 1.00 0.00 H new ATOM 0 HB3 GLU A 77 6.864 -7.386 -4.943 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.925 -6.064 -5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.994 -4.933 -6.508 1.00 0.00 H new ATOM 1206 N TYR A 78 5.226 -4.317 -2.950 1.00 0.00 N ATOM 1207 CA TYR A 78 3.963 -4.213 -2.229 1.00 0.00 C ATOM 1208 C TYR A 78 2.784 -4.194 -3.197 1.00 0.00 C ATOM 1209 O TYR A 78 2.845 -3.568 -4.255 1.00 0.00 O ATOM 1210 CB TYR A 78 3.948 -2.953 -1.363 1.00 0.00 C ATOM 1211 CG TYR A 78 5.152 -2.826 -0.458 1.00 0.00 C ATOM 1212 CD1 TYR A 78 6.382 -2.416 -0.958 1.00 0.00 C ATOM 1213 CD2 TYR A 78 5.061 -3.116 0.898 1.00 0.00 C ATOM 1214 CE1 TYR A 78 7.485 -2.299 -0.135 1.00 0.00 C ATOM 1215 CE2 TYR A 78 6.158 -3.000 1.729 1.00 0.00 C ATOM 1216 CZ TYR A 78 7.368 -2.592 1.208 1.00 0.00 C ATOM 1217 OH TYR A 78 8.464 -2.477 2.032 1.00 0.00 O ATOM 0 H TYR A 78 5.657 -3.421 -3.177 1.00 0.00 H new ATOM 0 HA TYR A 78 3.867 -5.088 -1.586 1.00 0.00 H new ATOM 0 HB2 TYR A 78 3.897 -2.078 -2.011 1.00 0.00 H new ATOM 0 HB3 TYR A 78 3.044 -2.952 -0.754 1.00 0.00 H new ATOM 0 HD1 TYR A 78 6.477 -2.185 -2.009 1.00 0.00 H new ATOM 0 HD2 TYR A 78 4.116 -3.438 1.309 1.00 0.00 H new ATOM 0 HE1 TYR A 78 8.434 -1.980 -0.541 1.00 0.00 H new ATOM 0 HE2 TYR A 78 6.069 -3.228 2.781 1.00 0.00 H new ATOM 0 HH TYR A 78 9.058 -1.776 1.691 1.00 0.00 H new ATOM 1227 N TYR A 79 1.711 -4.883 -2.825 1.00 0.00 N ATOM 1228 CA TYR A 79 0.517 -4.947 -3.659 1.00 0.00 C ATOM 1229 C TYR A 79 -0.746 -4.965 -2.803 1.00 0.00 C ATOM 1230 O TYR A 79 -0.874 -5.771 -1.881 1.00 0.00 O ATOM 1231 CB TYR A 79 0.559 -6.188 -4.552 1.00 0.00 C ATOM 1232 CG TYR A 79 0.331 -7.481 -3.802 1.00 0.00 C ATOM 1233 CD1 TYR A 79 1.377 -8.121 -3.148 1.00 0.00 C ATOM 1234 CD2 TYR A 79 -0.929 -8.062 -3.747 1.00 0.00 C ATOM 1235 CE1 TYR A 79 1.174 -9.303 -2.463 1.00 0.00 C ATOM 1236 CE2 TYR A 79 -1.142 -9.243 -3.063 1.00 0.00 C ATOM 1237 CZ TYR A 79 -0.088 -9.860 -2.423 1.00 0.00 C ATOM 1238 OH TYR A 79 -0.294 -11.037 -1.740 1.00 0.00 O ATOM 0 H TYR A 79 1.644 -5.405 -1.951 1.00 0.00 H new ATOM 0 HA TYR A 79 0.496 -4.056 -4.287 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.198 -6.091 -5.331 1.00 0.00 H new ATOM 0 HB3 TYR A 79 1.527 -6.233 -5.052 1.00 0.00 H new ATOM 0 HD1 TYR A 79 2.365 -7.687 -3.176 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.757 -7.582 -4.248 1.00 0.00 H new ATOM 0 HE1 TYR A 79 1.998 -9.789 -1.962 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.129 -9.681 -3.030 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.646 -10.840 -0.847 1.00 0.00 H new ATOM 1248 N VAL A 80 -1.678 -4.070 -3.116 1.00 0.00 N ATOM 1249 CA VAL A 80 -2.932 -3.983 -2.377 1.00 0.00 C ATOM 1250 C VAL A 80 -4.085 -4.575 -3.180 1.00 0.00 C ATOM 1251 O VAL A 80 -4.058 -4.585 -4.412 1.00 0.00 O ATOM 1252 CB VAL A 80 -3.270 -2.524 -2.015 1.00 0.00 C ATOM 1253 CG1 VAL A 80 -3.565 -1.716 -3.270 1.00 0.00 C ATOM 1254 CG2 VAL A 80 -4.444 -2.474 -1.050 1.00 0.00 C ATOM 0 H VAL A 80 -1.588 -3.395 -3.876 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.799 -4.556 -1.460 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.405 -2.080 -1.522 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.802 -0.688 -2.994 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.692 -1.725 -3.922 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.414 -2.155 -3.794 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.669 -1.436 -0.805 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.316 -2.935 -1.514 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -4.189 -3.015 -0.139 1.00 0.00 H new ATOM 1264 N THR A 81 -5.098 -5.068 -2.475 1.00 0.00 N ATOM 1265 CA THR A 81 -6.261 -5.664 -3.122 1.00 0.00 C ATOM 1266 C THR A 81 -7.550 -5.000 -2.652 1.00 0.00 C ATOM 1267 O THR A 81 -7.736 -4.758 -1.460 1.00 0.00 O ATOM 1268 CB THR A 81 -6.345 -7.177 -2.844 1.00 0.00 C ATOM 1269 OG1 THR A 81 -6.544 -7.408 -1.445 1.00 0.00 O ATOM 1270 CG2 THR A 81 -5.078 -7.882 -3.304 1.00 0.00 C ATOM 0 H THR A 81 -5.137 -5.067 -1.456 1.00 0.00 H new ATOM 0 HA THR A 81 -6.143 -5.506 -4.194 1.00 0.00 H new ATOM 0 HB THR A 81 -7.190 -7.580 -3.402 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.598 -8.372 -1.277 1.00 0.00 H new ATOM 0 HG21 THR A 81 -5.160 -8.949 -3.098 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.945 -7.729 -4.375 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.220 -7.474 -2.770 1.00 0.00 H new ATOM 1278 N ALA A 82 -8.439 -4.710 -3.597 1.00 0.00 N ATOM 1279 CA ALA A 82 -9.713 -4.077 -3.279 1.00 0.00 C ATOM 1280 C ALA A 82 -10.804 -4.523 -4.246 1.00 0.00 C ATOM 1281 O ALA A 82 -10.805 -4.140 -5.415 1.00 0.00 O ATOM 1282 CB ALA A 82 -9.570 -2.562 -3.303 1.00 0.00 C ATOM 0 H ALA A 82 -8.300 -4.903 -4.589 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.005 -4.387 -2.276 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.529 -2.102 -3.064 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.827 -2.255 -2.567 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.252 -2.242 -4.295 1.00 0.00 H new ATOM 1288 N GLY A 83 -11.732 -5.336 -3.750 1.00 0.00 N ATOM 1289 CA GLY A 83 -12.816 -5.821 -4.585 1.00 0.00 C ATOM 1290 C GLY A 83 -12.360 -6.880 -5.569 1.00 0.00 C ATOM 1291 O GLY A 83 -11.954 -7.973 -5.172 1.00 0.00 O ATOM 0 H GLY A 83 -11.753 -5.667 -2.786 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -13.602 -6.232 -3.952 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -13.252 -4.985 -5.132 1.00 0.00 H new ATOM 1295 N ASP A 84 -12.428 -6.558 -6.856 1.00 0.00 N ATOM 1296 CA ASP A 84 -12.019 -7.490 -7.900 1.00 0.00 C ATOM 1297 C ASP A 84 -10.800 -6.965 -8.651 1.00 0.00 C ATOM 1298 O ASP A 84 -10.452 -7.469 -9.718 1.00 0.00 O ATOM 1299 CB ASP A 84 -13.171 -7.731 -8.877 1.00 0.00 C ATOM 1300 CG ASP A 84 -13.010 -9.023 -9.655 1.00 0.00 C ATOM 1301 OD1 ASP A 84 -12.058 -9.117 -10.457 1.00 0.00 O ATOM 1302 OD2 ASP A 84 -13.836 -9.939 -9.461 1.00 0.00 O ATOM 0 H ASP A 84 -12.763 -5.658 -7.201 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.751 -8.434 -7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -14.111 -7.757 -8.326 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -13.233 -6.896 -9.574 1.00 0.00 H new ATOM 1307 N GLU A 85 -10.156 -5.949 -8.085 1.00 0.00 N ATOM 1308 CA GLU A 85 -8.976 -5.354 -8.703 1.00 0.00 C ATOM 1309 C GLU A 85 -7.821 -5.279 -7.709 1.00 0.00 C ATOM 1310 O GLU A 85 -8.027 -5.314 -6.496 1.00 0.00 O ATOM 1311 CB GLU A 85 -9.300 -3.955 -9.232 1.00 0.00 C ATOM 1312 CG GLU A 85 -10.170 -3.962 -10.478 1.00 0.00 C ATOM 1313 CD GLU A 85 -9.436 -4.479 -11.699 1.00 0.00 C ATOM 1314 OE1 GLU A 85 -8.683 -3.695 -12.315 1.00 0.00 O ATOM 1315 OE2 GLU A 85 -9.613 -5.667 -12.040 1.00 0.00 O ATOM 0 H GLU A 85 -10.431 -5.521 -7.201 1.00 0.00 H new ATOM 0 HA GLU A 85 -8.675 -5.989 -9.536 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.805 -3.388 -8.450 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -8.368 -3.434 -9.453 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.050 -4.580 -10.299 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.526 -2.950 -10.674 1.00 0.00 H new ATOM 1322 N LYS A 86 -6.604 -5.177 -8.233 1.00 0.00 N ATOM 1323 CA LYS A 86 -5.414 -5.096 -7.394 1.00 0.00 C ATOM 1324 C LYS A 86 -4.229 -4.546 -8.182 1.00 0.00 C ATOM 1325 O LYS A 86 -4.173 -4.672 -9.406 1.00 0.00 O ATOM 1326 CB LYS A 86 -5.068 -6.476 -6.830 1.00 0.00 C ATOM 1327 CG LYS A 86 -4.302 -7.357 -7.802 1.00 0.00 C ATOM 1328 CD LYS A 86 -3.921 -8.685 -7.170 1.00 0.00 C ATOM 1329 CE LYS A 86 -2.930 -9.449 -8.034 1.00 0.00 C ATOM 1330 NZ LYS A 86 -2.371 -10.632 -7.323 1.00 0.00 N ATOM 0 H LYS A 86 -6.416 -5.148 -9.235 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.627 -4.416 -6.569 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.476 -6.350 -5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.989 -6.983 -6.542 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.910 -7.536 -8.689 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.402 -6.839 -8.132 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.487 -8.510 -6.185 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.816 -9.289 -7.021 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.423 -9.775 -8.950 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.117 -8.785 -8.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -1.700 -11.126 -7.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -1.879 -10.319 -6.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.143 -11.279 -7.064 1.00 0.00 H new ATOM 1344 N CYS A 87 -3.284 -3.939 -7.473 1.00 0.00 N ATOM 1345 CA CYS A 87 -2.100 -3.370 -8.106 1.00 0.00 C ATOM 1346 C CYS A 87 -0.848 -3.673 -7.289 1.00 0.00 C ATOM 1347 O CYS A 87 -0.931 -4.191 -6.176 1.00 0.00 O ATOM 1348 CB CYS A 87 -2.261 -1.858 -8.273 1.00 0.00 C ATOM 1349 SG CYS A 87 -1.381 -1.174 -9.696 1.00 0.00 S ATOM 0 H CYS A 87 -3.315 -3.828 -6.459 1.00 0.00 H new ATOM 0 HA CYS A 87 -1.990 -3.827 -9.090 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -3.321 -1.625 -8.369 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -1.907 -1.364 -7.368 1.00 0.00 H new ATOM 0 HG CYS A 87 -0.519 -0.290 -9.289 1.00 0.00 H new ATOM 1355 N SER A 88 0.312 -3.349 -7.851 1.00 0.00 N ATOM 1356 CA SER A 88 1.582 -3.592 -7.178 1.00 0.00 C ATOM 1357 C SER A 88 2.573 -2.468 -7.466 1.00 0.00 C ATOM 1358 O SER A 88 2.443 -1.747 -8.455 1.00 0.00 O ATOM 1359 CB SER A 88 2.171 -4.932 -7.621 1.00 0.00 C ATOM 1360 OG SER A 88 2.304 -4.990 -9.031 1.00 0.00 O ATOM 0 H SER A 88 0.398 -2.917 -8.771 1.00 0.00 H new ATOM 0 HA SER A 88 1.395 -3.623 -6.105 1.00 0.00 H new ATOM 0 HB2 SER A 88 3.145 -5.076 -7.155 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.530 -5.745 -7.279 1.00 0.00 H new ATOM 0 HG SER A 88 2.684 -5.856 -9.288 1.00 0.00 H new ATOM 1366 N THR A 89 3.566 -2.325 -6.593 1.00 0.00 N ATOM 1367 CA THR A 89 4.579 -1.289 -6.751 1.00 0.00 C ATOM 1368 C THR A 89 5.955 -1.798 -6.335 1.00 0.00 C ATOM 1369 O THR A 89 6.076 -2.863 -5.731 1.00 0.00 O ATOM 1370 CB THR A 89 4.236 -0.037 -5.923 1.00 0.00 C ATOM 1371 OG1 THR A 89 5.342 0.873 -5.930 1.00 0.00 O ATOM 1372 CG2 THR A 89 3.891 -0.412 -4.490 1.00 0.00 C ATOM 0 H THR A 89 3.690 -2.914 -5.769 1.00 0.00 H new ATOM 0 HA THR A 89 4.597 -1.023 -7.808 1.00 0.00 H new ATOM 0 HB THR A 89 3.368 0.443 -6.375 1.00 0.00 H new ATOM 0 HG1 THR A 89 5.053 1.742 -5.580 1.00 0.00 H new ATOM 0 HG21 THR A 89 3.652 0.489 -3.925 1.00 0.00 H new ATOM 0 HG22 THR A 89 3.030 -1.081 -4.486 1.00 0.00 H new ATOM 0 HG23 THR A 89 4.743 -0.913 -4.030 1.00 0.00 H new ATOM 1380 N GLU A 90 6.989 -1.029 -6.662 1.00 0.00 N ATOM 1381 CA GLU A 90 8.356 -1.404 -6.321 1.00 0.00 C ATOM 1382 C GLU A 90 9.031 -0.310 -5.499 1.00 0.00 C ATOM 1383 O GLU A 90 9.011 0.864 -5.871 1.00 0.00 O ATOM 1384 CB GLU A 90 9.166 -1.675 -7.591 1.00 0.00 C ATOM 1385 CG GLU A 90 8.751 -2.943 -8.317 1.00 0.00 C ATOM 1386 CD GLU A 90 9.688 -3.296 -9.456 1.00 0.00 C ATOM 1387 OE1 GLU A 90 10.105 -2.374 -10.188 1.00 0.00 O ATOM 1388 OE2 GLU A 90 10.005 -4.493 -9.616 1.00 0.00 O ATOM 0 H GLU A 90 6.906 -0.144 -7.162 1.00 0.00 H new ATOM 0 HA GLU A 90 8.317 -2.314 -5.722 1.00 0.00 H new ATOM 0 HB2 GLU A 90 9.060 -0.827 -8.268 1.00 0.00 H new ATOM 0 HB3 GLU A 90 10.222 -1.744 -7.331 1.00 0.00 H new ATOM 0 HG2 GLU A 90 8.720 -3.770 -7.607 1.00 0.00 H new ATOM 0 HG3 GLU A 90 7.741 -2.820 -8.707 1.00 0.00 H new ATOM 1395 N LEU A 91 9.628 -0.703 -4.379 1.00 0.00 N ATOM 1396 CA LEU A 91 10.309 0.243 -3.502 1.00 0.00 C ATOM 1397 C LEU A 91 11.812 0.241 -3.761 1.00 0.00 C ATOM 1398 O LEU A 91 12.459 -0.806 -3.718 1.00 0.00 O ATOM 1399 CB LEU A 91 10.032 -0.099 -2.037 1.00 0.00 C ATOM 1400 CG LEU A 91 10.883 0.640 -1.003 1.00 0.00 C ATOM 1401 CD1 LEU A 91 12.300 0.089 -0.985 1.00 0.00 C ATOM 1402 CD2 LEU A 91 10.893 2.134 -1.291 1.00 0.00 C ATOM 0 H LEU A 91 9.654 -1.670 -4.057 1.00 0.00 H new ATOM 0 HA LEU A 91 9.924 1.240 -3.715 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.982 0.108 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 91 10.179 -1.170 -1.901 1.00 0.00 H new ATOM 0 HG LEU A 91 10.442 0.483 -0.019 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.890 0.627 -0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 91 12.275 -0.970 -0.730 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.752 0.215 -1.969 1.00 0.00 H new ATOM 0 HD21 LEU A 91 11.503 2.644 -0.546 1.00 0.00 H new ATOM 0 HD22 LEU A 91 11.309 2.311 -2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 91 9.874 2.519 -1.251 1.00 0.00 H new ATOM 1414 N PHE A 92 12.363 1.421 -4.029 1.00 0.00 N ATOM 1415 CA PHE A 92 13.790 1.555 -4.294 1.00 0.00 C ATOM 1416 C PHE A 92 14.480 2.333 -3.177 1.00 0.00 C ATOM 1417 O PHE A 92 14.485 3.564 -3.173 1.00 0.00 O ATOM 1418 CB PHE A 92 14.018 2.257 -5.635 1.00 0.00 C ATOM 1419 CG PHE A 92 13.789 1.367 -6.823 1.00 0.00 C ATOM 1420 CD1 PHE A 92 14.708 0.386 -7.158 1.00 0.00 C ATOM 1421 CD2 PHE A 92 12.654 1.512 -7.605 1.00 0.00 C ATOM 1422 CE1 PHE A 92 14.500 -0.433 -8.251 1.00 0.00 C ATOM 1423 CE2 PHE A 92 12.440 0.695 -8.699 1.00 0.00 C ATOM 1424 CZ PHE A 92 13.364 -0.279 -9.022 1.00 0.00 C ATOM 0 H PHE A 92 11.843 2.297 -4.068 1.00 0.00 H new ATOM 0 HA PHE A 92 14.221 0.555 -4.337 1.00 0.00 H new ATOM 0 HB2 PHE A 92 13.354 3.118 -5.703 1.00 0.00 H new ATOM 0 HB3 PHE A 92 15.039 2.638 -5.668 1.00 0.00 H new ATOM 0 HD1 PHE A 92 15.597 0.260 -6.558 1.00 0.00 H new ATOM 0 HD2 PHE A 92 11.928 2.272 -7.357 1.00 0.00 H new ATOM 0 HE1 PHE A 92 15.225 -1.193 -8.503 1.00 0.00 H new ATOM 0 HE2 PHE A 92 11.551 0.818 -9.300 1.00 0.00 H new ATOM 0 HZ PHE A 92 13.199 -0.919 -9.876 1.00 0.00 H new ATOM 1434 N VAL A 93 15.062 1.605 -2.229 1.00 0.00 N ATOM 1435 CA VAL A 93 15.755 2.225 -1.106 1.00 0.00 C ATOM 1436 C VAL A 93 17.259 2.280 -1.351 1.00 0.00 C ATOM 1437 O VAL A 93 17.914 1.246 -1.484 1.00 0.00 O ATOM 1438 CB VAL A 93 15.487 1.467 0.207 1.00 0.00 C ATOM 1439 CG1 VAL A 93 15.869 0.001 0.065 1.00 0.00 C ATOM 1440 CG2 VAL A 93 16.241 2.114 1.359 1.00 0.00 C ATOM 0 H VAL A 93 15.067 0.585 -2.217 1.00 0.00 H new ATOM 0 HA VAL A 93 15.367 3.240 -1.016 1.00 0.00 H new ATOM 0 HB VAL A 93 14.420 1.520 0.426 1.00 0.00 H new ATOM 0 HG11 VAL A 93 15.673 -0.519 1.003 1.00 0.00 H new ATOM 0 HG12 VAL A 93 15.280 -0.453 -0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 93 16.929 -0.077 -0.178 1.00 0.00 H new ATOM 0 HG21 VAL A 93 16.040 1.565 2.279 1.00 0.00 H new ATOM 0 HG22 VAL A 93 17.311 2.094 1.151 1.00 0.00 H new ATOM 0 HG23 VAL A 93 15.913 3.147 1.474 1.00 0.00 H new ATOM 1450 N ARG A 94 17.800 3.492 -1.409 1.00 0.00 N ATOM 1451 CA ARG A 94 19.227 3.682 -1.638 1.00 0.00 C ATOM 1452 C ARG A 94 19.993 3.697 -0.319 1.00 0.00 C ATOM 1453 O ARG A 94 19.406 3.872 0.749 1.00 0.00 O ATOM 1454 CB ARG A 94 19.474 4.986 -2.398 1.00 0.00 C ATOM 1455 CG ARG A 94 18.536 5.191 -3.577 1.00 0.00 C ATOM 1456 CD ARG A 94 19.134 6.137 -4.607 1.00 0.00 C ATOM 1457 NE ARG A 94 20.402 5.640 -5.135 1.00 0.00 N ATOM 1458 CZ ARG A 94 20.988 6.130 -6.222 1.00 0.00 C ATOM 1459 NH1 ARG A 94 20.423 7.125 -6.892 1.00 0.00 N ATOM 1460 NH2 ARG A 94 22.142 5.625 -6.640 1.00 0.00 N ATOM 0 H ARG A 94 17.271 4.358 -1.301 1.00 0.00 H new ATOM 0 HA ARG A 94 19.587 2.846 -2.237 1.00 0.00 H new ATOM 0 HB2 ARG A 94 19.367 5.824 -1.709 1.00 0.00 H new ATOM 0 HB3 ARG A 94 20.503 4.998 -2.757 1.00 0.00 H new ATOM 0 HG2 ARG A 94 18.322 4.230 -4.045 1.00 0.00 H new ATOM 0 HG3 ARG A 94 17.586 5.591 -3.222 1.00 0.00 H new ATOM 0 HD2 ARG A 94 18.429 6.273 -5.427 1.00 0.00 H new ATOM 0 HD3 ARG A 94 19.289 7.116 -4.153 1.00 0.00 H new ATOM 0 HE ARG A 94 20.863 4.875 -4.642 1.00 0.00 H new ATOM 0 HH11 ARG A 94 19.537 7.516 -6.573 1.00 0.00 H new ATOM 0 HH12 ARG A 94 20.875 7.499 -7.726 1.00 0.00 H new ATOM 0 HH21 ARG A 94 22.580 4.860 -6.127 1.00 0.00 H new ATOM 0 HH22 ARG A 94 22.591 6.002 -7.475 1.00 0.00 H new ATOM 1474 N SER A 95 21.306 3.510 -0.401 1.00 0.00 N ATOM 1475 CA SER A 95 22.152 3.498 0.787 1.00 0.00 C ATOM 1476 C SER A 95 22.966 4.784 0.888 1.00 0.00 C ATOM 1477 O SER A 95 23.053 5.396 1.952 1.00 0.00 O ATOM 1478 CB SER A 95 23.089 2.289 0.760 1.00 0.00 C ATOM 1479 OG SER A 95 24.177 2.467 1.650 1.00 0.00 O ATOM 0 H SER A 95 21.807 3.365 -1.277 1.00 0.00 H new ATOM 0 HA SER A 95 21.505 3.428 1.662 1.00 0.00 H new ATOM 0 HB2 SER A 95 22.536 1.390 1.032 1.00 0.00 H new ATOM 0 HB3 SER A 95 23.464 2.138 -0.252 1.00 0.00 H new ATOM 0 HG SER A 95 24.760 1.680 1.615 1.00 0.00 H new ATOM 1485 N GLY A 96 23.562 5.189 -0.230 1.00 0.00 N ATOM 1486 CA GLY A 96 24.362 6.400 -0.247 1.00 0.00 C ATOM 1487 C GLY A 96 25.830 6.129 0.013 1.00 0.00 C ATOM 1488 O GLY A 96 26.191 5.282 0.831 1.00 0.00 O ATOM 0 H GLY A 96 23.505 4.700 -1.123 1.00 0.00 H new ATOM 0 HA2 GLY A 96 24.252 6.891 -1.214 1.00 0.00 H new ATOM 0 HA3 GLY A 96 23.985 7.092 0.506 1.00 0.00 H new ATOM 1492 N PRO A 97 26.705 6.858 -0.694 1.00 0.00 N ATOM 1493 CA PRO A 97 28.157 6.709 -0.553 1.00 0.00 C ATOM 1494 C PRO A 97 28.665 7.223 0.789 1.00 0.00 C ATOM 1495 O PRO A 97 29.844 7.080 1.114 1.00 0.00 O ATOM 1496 CB PRO A 97 28.714 7.560 -1.697 1.00 0.00 C ATOM 1497 CG PRO A 97 27.654 8.571 -1.968 1.00 0.00 C ATOM 1498 CD PRO A 97 26.346 7.885 -1.687 1.00 0.00 C ATOM 0 HA PRO A 97 28.465 5.664 -0.592 1.00 0.00 H new ATOM 0 HB2 PRO A 97 29.653 8.037 -1.415 1.00 0.00 H new ATOM 0 HB3 PRO A 97 28.917 6.953 -2.579 1.00 0.00 H new ATOM 0 HG2 PRO A 97 27.779 9.448 -1.333 1.00 0.00 H new ATOM 0 HG3 PRO A 97 27.699 8.917 -3.001 1.00 0.00 H new ATOM 0 HD2 PRO A 97 25.604 8.580 -1.295 1.00 0.00 H new ATOM 0 HD3 PRO A 97 25.923 7.442 -2.588 1.00 0.00 H new ATOM 1506 N SER A 98 27.768 7.822 1.566 1.00 0.00 N ATOM 1507 CA SER A 98 28.127 8.360 2.873 1.00 0.00 C ATOM 1508 C SER A 98 26.963 8.232 3.851 1.00 0.00 C ATOM 1509 O SER A 98 25.826 7.983 3.452 1.00 0.00 O ATOM 1510 CB SER A 98 28.542 9.827 2.747 1.00 0.00 C ATOM 1511 OG SER A 98 27.450 10.634 2.342 1.00 0.00 O ATOM 0 H SER A 98 26.788 7.947 1.313 1.00 0.00 H new ATOM 0 HA SER A 98 28.968 7.783 3.258 1.00 0.00 H new ATOM 0 HB2 SER A 98 28.926 10.183 3.703 1.00 0.00 H new ATOM 0 HB3 SER A 98 29.353 9.918 2.024 1.00 0.00 H new ATOM 0 HG SER A 98 27.741 11.567 2.271 1.00 0.00 H new ATOM 1517 N SER A 99 27.257 8.403 5.136 1.00 0.00 N ATOM 1518 CA SER A 99 26.237 8.303 6.174 1.00 0.00 C ATOM 1519 C SER A 99 26.688 9.008 7.449 1.00 0.00 C ATOM 1520 O SER A 99 27.742 8.698 8.004 1.00 0.00 O ATOM 1521 CB SER A 99 25.925 6.835 6.472 1.00 0.00 C ATOM 1522 OG SER A 99 24.824 6.717 7.356 1.00 0.00 O ATOM 0 H SER A 99 28.193 8.611 5.483 1.00 0.00 H new ATOM 0 HA SER A 99 25.334 8.792 5.810 1.00 0.00 H new ATOM 0 HB2 SER A 99 25.706 6.310 5.542 1.00 0.00 H new ATOM 0 HB3 SER A 99 26.800 6.356 6.910 1.00 0.00 H new ATOM 0 HG SER A 99 24.644 5.769 7.529 1.00 0.00 H new ATOM 1528 N GLY A 100 25.882 9.960 7.909 1.00 0.00 N ATOM 1529 CA GLY A 100 26.214 10.695 9.116 1.00 0.00 C ATOM 1530 C GLY A 100 25.320 11.901 9.325 1.00 0.00 C ATOM 1531 O GLY A 100 25.688 13.023 8.975 1.00 0.00 O ATOM 0 H GLY A 100 25.005 10.236 7.467 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.130 10.031 9.976 1.00 0.00 H new ATOM 0 HA3 GLY A 100 27.253 11.021 9.065 1.00 0.00 H new TER 1535 GLY A 100