USER MOD reduce.3.24.130724 H: found=0, std=0, add=838, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 837 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -179:sc= -0.566 (180deg=-0.576) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.0051) USER MOD Single : A 7 SER OG : rot 34:sc= 0.263 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.291 X(o=-0.29,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.116 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -40:sc= 1.13 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= -0.498 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -1.21 X(o=-1.2,f=-1.3!) USER MOD Single : A 63 GLN : amide:sc= 0.0538 X(o=0.054,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot -65:sc= 1.1 USER MOD Single : A 76 THR OG1 : rot -89:sc= 1.08 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN :FLIP amide:sc= -0.568 F(o=-1.2,f=-0.57) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0151) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0.363 K(o=0.36,f=-3!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.3 K(o=-0.3,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.750 -6.779 -1.627 1.00 0.00 N ATOM 2 CA MET A 1 2.487 -5.475 -2.290 1.00 0.00 C ATOM 3 C MET A 1 1.021 -5.342 -2.690 1.00 0.00 C ATOM 4 O MET A 1 0.426 -6.273 -3.230 1.00 0.00 O ATOM 5 CB MET A 1 3.385 -5.364 -3.524 1.00 0.00 C ATOM 6 CG MET A 1 4.747 -4.755 -3.233 1.00 0.00 C ATOM 7 SD MET A 1 4.771 -2.967 -3.460 1.00 0.00 S ATOM 8 CE MET A 1 6.352 -2.749 -4.275 1.00 0.00 C ATOM 0 H1 MET A 1 3.755 -6.840 -1.367 1.00 0.00 H new ATOM 0 H2 MET A 1 2.165 -6.857 -0.770 1.00 0.00 H new ATOM 0 H3 MET A 1 2.514 -7.554 -2.279 1.00 0.00 H new ATOM 0 HA MET A 1 2.709 -4.669 -1.591 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.524 -6.357 -3.952 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.880 -4.760 -4.278 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.035 -4.991 -2.209 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.491 -5.210 -3.886 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.512 -1.691 -4.482 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.149 -3.117 -3.628 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.359 -3.307 -5.211 1.00 0.00 H new ATOM 20 N VAL A 2 0.450 -4.174 -2.418 1.00 0.00 N ATOM 21 CA VAL A 2 -0.943 -3.905 -2.747 1.00 0.00 C ATOM 22 C VAL A 2 -1.072 -3.385 -4.172 1.00 0.00 C ATOM 23 O VAL A 2 -0.197 -2.670 -4.662 1.00 0.00 O ATOM 24 CB VAL A 2 -1.554 -2.871 -1.777 1.00 0.00 C ATOM 25 CG1 VAL A 2 -3.041 -2.672 -2.052 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.321 -3.297 -0.335 1.00 0.00 C ATOM 0 H VAL A 2 0.933 -3.396 -1.969 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.485 -4.846 -2.654 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.057 -1.915 -1.939 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.445 -1.939 -1.354 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.178 -2.315 -3.073 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.564 -3.620 -1.926 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.757 -2.558 0.338 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.789 -4.266 -0.162 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.250 -3.372 -0.146 1.00 0.00 H new ATOM 36 N LYS A 3 -2.166 -3.742 -4.831 1.00 0.00 N ATOM 37 CA LYS A 3 -2.399 -3.304 -6.194 1.00 0.00 C ATOM 38 C LYS A 3 -3.882 -3.089 -6.428 1.00 0.00 C ATOM 39 O LYS A 3 -4.693 -3.999 -6.259 1.00 0.00 O ATOM 40 CB LYS A 3 -1.850 -4.324 -7.198 1.00 0.00 C ATOM 41 CG LYS A 3 -2.056 -5.775 -6.788 1.00 0.00 C ATOM 42 CD LYS A 3 -1.225 -6.716 -7.648 1.00 0.00 C ATOM 43 CE LYS A 3 -0.576 -7.810 -6.813 1.00 0.00 C ATOM 44 NZ LYS A 3 -1.568 -8.821 -6.355 1.00 0.00 N ATOM 0 H LYS A 3 -2.902 -4.332 -4.443 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.874 -2.360 -6.343 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.328 -4.160 -8.164 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.784 -4.145 -7.335 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -1.784 -5.901 -5.740 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.111 -6.034 -6.877 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -1.859 -7.167 -8.411 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.454 -6.149 -8.169 1.00 0.00 H new ATOM 0 HE2 LYS A 3 0.200 -8.302 -7.399 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.086 -7.364 -5.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -1.089 -9.540 -5.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -2.304 -8.353 -5.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.005 -9.278 -7.181 1.00 0.00 H new ATOM 58 N GLN A 4 -4.231 -1.870 -6.807 1.00 0.00 N ATOM 59 CA GLN A 4 -5.617 -1.529 -7.059 1.00 0.00 C ATOM 60 C GLN A 4 -6.075 -2.171 -8.367 1.00 0.00 C ATOM 61 O GLN A 4 -5.389 -2.083 -9.387 1.00 0.00 O ATOM 62 CB GLN A 4 -5.781 -0.006 -7.103 1.00 0.00 C ATOM 63 CG GLN A 4 -7.191 0.456 -7.440 1.00 0.00 C ATOM 64 CD GLN A 4 -7.678 1.561 -6.520 1.00 0.00 C ATOM 65 OE1 GLN A 4 -7.010 2.580 -6.345 1.00 0.00 O ATOM 66 NE2 GLN A 4 -8.853 1.364 -5.933 1.00 0.00 N ATOM 0 H GLN A 4 -3.573 -1.103 -6.946 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.241 -1.913 -6.252 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.496 0.408 -6.136 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.090 0.402 -7.841 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.217 0.809 -8.471 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.873 -0.392 -7.376 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -9.372 0.504 -6.107 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -9.236 2.073 -5.308 1.00 0.00 H new ATOM 75 N ILE A 5 -7.228 -2.827 -8.329 1.00 0.00 N ATOM 76 CA ILE A 5 -7.771 -3.496 -9.507 1.00 0.00 C ATOM 77 C ILE A 5 -8.906 -2.669 -10.117 1.00 0.00 C ATOM 78 O ILE A 5 -9.996 -2.575 -9.554 1.00 0.00 O ATOM 79 CB ILE A 5 -8.235 -4.936 -9.152 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.105 -5.942 -9.414 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.478 -5.343 -9.932 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.730 -5.458 -8.998 1.00 0.00 C ATOM 0 H ILE A 5 -7.807 -2.911 -7.494 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.985 -3.581 -10.257 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.489 -4.941 -8.092 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.328 -6.867 -8.883 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.087 -6.181 -10.477 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.767 -6.356 -9.653 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.293 -4.657 -9.702 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.265 -5.308 -11.000 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -4.991 -6.229 -9.218 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.482 -4.550 -9.548 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.727 -5.247 -7.929 1.00 0.00 H new ATOM 94 N GLU A 6 -8.631 -2.068 -11.275 1.00 0.00 N ATOM 95 CA GLU A 6 -9.614 -1.243 -11.971 1.00 0.00 C ATOM 96 C GLU A 6 -10.297 -2.003 -13.106 1.00 0.00 C ATOM 97 O GLU A 6 -10.856 -1.395 -14.019 1.00 0.00 O ATOM 98 CB GLU A 6 -8.947 0.023 -12.516 1.00 0.00 C ATOM 99 CG GLU A 6 -8.880 1.160 -11.508 1.00 0.00 C ATOM 100 CD GLU A 6 -8.283 2.428 -12.091 1.00 0.00 C ATOM 101 OE1 GLU A 6 -7.050 2.473 -12.278 1.00 0.00 O ATOM 102 OE2 GLU A 6 -9.051 3.377 -12.357 1.00 0.00 O ATOM 0 H GLU A 6 -7.732 -2.139 -11.751 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.382 -0.969 -11.248 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.936 -0.221 -12.843 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.494 0.361 -13.396 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -9.884 1.372 -11.139 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.286 0.845 -10.650 1.00 0.00 H new ATOM 109 N SER A 7 -10.246 -3.329 -13.051 1.00 0.00 N ATOM 110 CA SER A 7 -10.856 -4.157 -14.087 1.00 0.00 C ATOM 111 C SER A 7 -11.212 -5.539 -13.548 1.00 0.00 C ATOM 112 O SER A 7 -10.690 -5.970 -12.520 1.00 0.00 O ATOM 113 CB SER A 7 -9.909 -4.294 -15.279 1.00 0.00 C ATOM 114 OG SER A 7 -10.156 -3.291 -16.247 1.00 0.00 O ATOM 0 H SER A 7 -9.791 -3.853 -12.304 1.00 0.00 H new ATOM 0 HA SER A 7 -11.775 -3.668 -14.411 1.00 0.00 H new ATOM 0 HB2 SER A 7 -8.877 -4.226 -14.936 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.030 -5.278 -15.732 1.00 0.00 H new ATOM 0 HG SER A 7 -10.433 -2.465 -15.799 1.00 0.00 H new ATOM 120 N LYS A 8 -12.092 -6.237 -14.258 1.00 0.00 N ATOM 121 CA LYS A 8 -12.506 -7.575 -13.857 1.00 0.00 C ATOM 122 C LYS A 8 -11.407 -8.591 -14.160 1.00 0.00 C ATOM 123 O LYS A 8 -11.302 -9.621 -13.494 1.00 0.00 O ATOM 124 CB LYS A 8 -13.805 -7.966 -14.566 1.00 0.00 C ATOM 125 CG LYS A 8 -14.278 -9.377 -14.253 1.00 0.00 C ATOM 126 CD LYS A 8 -15.280 -9.867 -15.284 1.00 0.00 C ATOM 127 CE LYS A 8 -14.613 -10.136 -16.623 1.00 0.00 C ATOM 128 NZ LYS A 8 -15.436 -11.032 -17.482 1.00 0.00 N ATOM 0 H LYS A 8 -12.532 -5.898 -15.114 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.684 -7.572 -12.782 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.587 -7.261 -14.285 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.662 -7.872 -15.642 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.422 -10.052 -14.226 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -14.733 -9.399 -13.263 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.758 -10.778 -14.924 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -16.067 -9.123 -15.411 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -14.443 -9.192 -17.141 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -13.635 -10.589 -16.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -14.947 -11.191 -18.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -15.577 -11.942 -16.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -16.360 -10.589 -17.661 1.00 0.00 H new ATOM 142 N THR A 9 -10.581 -8.290 -15.160 1.00 0.00 N ATOM 143 CA THR A 9 -9.485 -9.175 -15.537 1.00 0.00 C ATOM 144 C THR A 9 -8.301 -8.993 -14.591 1.00 0.00 C ATOM 145 O THR A 9 -7.558 -9.937 -14.321 1.00 0.00 O ATOM 146 CB THR A 9 -9.049 -8.910 -16.978 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.176 -8.746 -17.821 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.197 -10.020 -17.557 1.00 0.00 C ATOM 0 H THR A 9 -10.651 -7.441 -15.722 1.00 0.00 H new ATOM 0 HA THR A 9 -9.839 -10.203 -15.463 1.00 0.00 H new ATOM 0 HB THR A 9 -8.452 -7.999 -16.938 1.00 0.00 H new ATOM 0 HG1 THR A 9 -9.876 -8.576 -18.738 1.00 0.00 H new ATOM 0 HG21 THR A 9 -7.921 -9.770 -18.582 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.295 -10.137 -16.957 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.761 -10.953 -17.550 1.00 0.00 H new ATOM 156 N ALA A 10 -8.133 -7.771 -14.093 1.00 0.00 N ATOM 157 CA ALA A 10 -7.042 -7.464 -13.179 1.00 0.00 C ATOM 158 C ALA A 10 -7.221 -8.215 -11.866 1.00 0.00 C ATOM 159 O ALA A 10 -6.255 -8.717 -11.291 1.00 0.00 O ATOM 160 CB ALA A 10 -6.964 -5.963 -12.933 1.00 0.00 C ATOM 0 H ALA A 10 -8.739 -6.979 -14.308 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.106 -7.787 -13.633 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.144 -5.749 -12.248 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.791 -5.448 -13.878 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -7.901 -5.617 -12.497 1.00 0.00 H new ATOM 166 N PHE A 11 -8.466 -8.320 -11.409 1.00 0.00 N ATOM 167 CA PHE A 11 -8.763 -9.031 -10.168 1.00 0.00 C ATOM 168 C PHE A 11 -8.254 -10.466 -10.250 1.00 0.00 C ATOM 169 O PHE A 11 -7.664 -10.983 -9.301 1.00 0.00 O ATOM 170 CB PHE A 11 -10.271 -9.021 -9.892 1.00 0.00 C ATOM 171 CG PHE A 11 -10.614 -9.290 -8.455 1.00 0.00 C ATOM 172 CD1 PHE A 11 -9.931 -8.644 -7.437 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.607 -10.194 -8.121 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.232 -8.897 -6.113 1.00 0.00 C ATOM 175 CE2 PHE A 11 -11.914 -10.449 -6.797 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.225 -9.800 -5.792 1.00 0.00 C ATOM 0 H PHE A 11 -9.282 -7.924 -11.876 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.256 -8.523 -9.347 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.680 -8.053 -10.181 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.753 -9.770 -10.520 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.154 -7.935 -7.682 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.148 -10.706 -8.903 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.690 -8.388 -5.329 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.692 -11.156 -6.549 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.462 -9.998 -4.757 1.00 0.00 H new ATOM 186 N GLN A 12 -8.467 -11.090 -11.400 1.00 0.00 N ATOM 187 CA GLN A 12 -8.012 -12.455 -11.620 1.00 0.00 C ATOM 188 C GLN A 12 -6.488 -12.501 -11.618 1.00 0.00 C ATOM 189 O GLN A 12 -5.880 -13.399 -11.034 1.00 0.00 O ATOM 190 CB GLN A 12 -8.554 -12.992 -12.946 1.00 0.00 C ATOM 191 CG GLN A 12 -10.051 -12.786 -13.118 1.00 0.00 C ATOM 192 CD GLN A 12 -10.847 -14.058 -12.896 1.00 0.00 C ATOM 193 OE1 GLN A 12 -11.759 -14.374 -13.660 1.00 0.00 O ATOM 194 NE2 GLN A 12 -10.505 -14.794 -11.844 1.00 0.00 N ATOM 0 H GLN A 12 -8.952 -10.673 -12.195 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.388 -13.084 -10.813 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.031 -12.503 -13.768 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.331 -14.057 -13.016 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.391 -12.023 -12.418 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.249 -12.409 -14.122 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.742 -14.493 -11.238 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.005 -15.660 -11.643 1.00 0.00 H new ATOM 203 N GLU A 13 -5.880 -11.521 -12.282 1.00 0.00 N ATOM 204 CA GLU A 13 -4.428 -11.432 -12.375 1.00 0.00 C ATOM 205 C GLU A 13 -3.789 -11.355 -10.992 1.00 0.00 C ATOM 206 O GLU A 13 -2.818 -12.059 -10.708 1.00 0.00 O ATOM 207 CB GLU A 13 -4.029 -10.213 -13.209 1.00 0.00 C ATOM 208 CG GLU A 13 -4.010 -10.489 -14.703 1.00 0.00 C ATOM 209 CD GLU A 13 -3.488 -9.315 -15.510 1.00 0.00 C ATOM 210 OE1 GLU A 13 -3.857 -8.165 -15.192 1.00 0.00 O ATOM 211 OE2 GLU A 13 -2.713 -9.548 -16.460 1.00 0.00 O ATOM 0 H GLU A 13 -6.376 -10.773 -12.766 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.064 -12.336 -12.864 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.724 -9.399 -13.006 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.041 -9.875 -12.896 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.389 -11.363 -14.899 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.019 -10.733 -15.036 1.00 0.00 H new ATOM 218 N ALA A 14 -4.339 -10.505 -10.131 1.00 0.00 N ATOM 219 CA ALA A 14 -3.819 -10.351 -8.778 1.00 0.00 C ATOM 220 C ALA A 14 -4.062 -11.618 -7.962 1.00 0.00 C ATOM 221 O ALA A 14 -3.247 -11.993 -7.116 1.00 0.00 O ATOM 222 CB ALA A 14 -4.459 -9.148 -8.100 1.00 0.00 C ATOM 0 H ALA A 14 -5.142 -9.914 -10.346 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.743 -10.184 -8.838 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.061 -9.045 -7.090 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.236 -8.247 -8.671 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.539 -9.289 -8.052 1.00 0.00 H new ATOM 228 N LEU A 15 -5.184 -12.279 -8.230 1.00 0.00 N ATOM 229 CA LEU A 15 -5.532 -13.507 -7.528 1.00 0.00 C ATOM 230 C LEU A 15 -4.530 -14.605 -7.870 1.00 0.00 C ATOM 231 O LEU A 15 -4.067 -15.334 -6.993 1.00 0.00 O ATOM 232 CB LEU A 15 -6.949 -13.954 -7.902 1.00 0.00 C ATOM 233 CG LEU A 15 -8.067 -13.378 -7.028 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.421 -13.896 -7.489 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.837 -13.724 -5.565 1.00 0.00 C ATOM 0 H LEU A 15 -5.867 -11.984 -8.928 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.499 -13.317 -6.455 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.139 -13.674 -8.938 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.995 -15.042 -7.852 1.00 0.00 H new ATOM 0 HG LEU A 15 -8.057 -12.293 -7.129 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.205 -13.477 -6.858 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.591 -13.599 -8.524 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.439 -14.983 -7.416 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.642 -13.306 -4.961 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.819 -14.807 -5.446 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.884 -13.307 -5.238 1.00 0.00 H new ATOM 247 N ASP A 16 -4.187 -14.701 -9.153 1.00 0.00 N ATOM 248 CA ASP A 16 -3.225 -15.694 -9.619 1.00 0.00 C ATOM 249 C ASP A 16 -1.842 -15.410 -9.038 1.00 0.00 C ATOM 250 O ASP A 16 -1.013 -16.311 -8.908 1.00 0.00 O ATOM 251 CB ASP A 16 -3.165 -15.691 -11.149 1.00 0.00 C ATOM 252 CG ASP A 16 -2.583 -16.974 -11.710 1.00 0.00 C ATOM 253 OD1 ASP A 16 -2.803 -18.043 -11.103 1.00 0.00 O ATOM 254 OD2 ASP A 16 -1.909 -16.911 -12.761 1.00 0.00 O ATOM 0 H ASP A 16 -4.562 -14.102 -9.888 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.549 -16.678 -9.280 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -4.169 -15.546 -11.548 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.564 -14.846 -11.484 1.00 0.00 H new ATOM 259 N ALA A 17 -1.594 -14.142 -8.721 1.00 0.00 N ATOM 260 CA ALA A 17 -0.305 -13.730 -8.186 1.00 0.00 C ATOM 261 C ALA A 17 -0.035 -14.394 -6.842 1.00 0.00 C ATOM 262 O ALA A 17 1.028 -14.982 -6.642 1.00 0.00 O ATOM 263 CB ALA A 17 -0.249 -12.214 -8.050 1.00 0.00 C ATOM 0 H ALA A 17 -2.269 -13.385 -8.826 1.00 0.00 H new ATOM 0 HA ALA A 17 0.470 -14.049 -8.883 1.00 0.00 H new ATOM 0 HB1 ALA A 17 0.721 -11.920 -7.649 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -0.391 -11.755 -9.029 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -1.037 -11.880 -7.375 1.00 0.00 H new ATOM 269 N ALA A 18 -0.996 -14.326 -5.926 1.00 0.00 N ATOM 270 CA ALA A 18 -0.818 -14.958 -4.624 1.00 0.00 C ATOM 271 C ALA A 18 -0.806 -16.476 -4.784 1.00 0.00 C ATOM 272 O ALA A 18 0.197 -17.138 -4.515 1.00 0.00 O ATOM 273 CB ALA A 18 -1.931 -14.533 -3.681 1.00 0.00 C ATOM 0 H ALA A 18 -1.889 -13.850 -6.056 1.00 0.00 H new ATOM 0 HA ALA A 18 0.135 -14.641 -4.200 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -1.789 -15.011 -2.712 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.910 -13.450 -3.559 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -2.893 -14.833 -4.095 1.00 0.00 H new ATOM 279 N GLY A 19 -1.937 -17.017 -5.223 1.00 0.00 N ATOM 280 CA GLY A 19 -2.058 -18.452 -5.423 1.00 0.00 C ATOM 281 C GLY A 19 -2.394 -19.203 -4.145 1.00 0.00 C ATOM 282 O GLY A 19 -3.556 -19.508 -3.888 1.00 0.00 O ATOM 0 H GLY A 19 -2.778 -16.485 -5.446 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -2.832 -18.646 -6.166 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -1.123 -18.837 -5.829 1.00 0.00 H new ATOM 286 N ASP A 20 -1.378 -19.504 -3.341 1.00 0.00 N ATOM 287 CA ASP A 20 -1.591 -20.231 -2.091 1.00 0.00 C ATOM 288 C ASP A 20 -1.684 -19.282 -0.903 1.00 0.00 C ATOM 289 O ASP A 20 -2.198 -19.648 0.154 1.00 0.00 O ATOM 290 CB ASP A 20 -0.464 -21.236 -1.857 1.00 0.00 C ATOM 291 CG ASP A 20 -0.724 -22.123 -0.656 1.00 0.00 C ATOM 292 OD1 ASP A 20 -1.604 -23.005 -0.749 1.00 0.00 O ATOM 293 OD2 ASP A 20 -0.053 -21.933 0.380 1.00 0.00 O ATOM 0 H ASP A 20 -0.406 -19.259 -3.529 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.538 -20.764 -2.181 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.344 -21.857 -2.745 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.474 -20.700 -1.713 1.00 0.00 H new ATOM 298 N LYS A 21 -1.197 -18.062 -1.083 1.00 0.00 N ATOM 299 CA LYS A 21 -1.245 -17.075 -0.024 1.00 0.00 C ATOM 300 C LYS A 21 -2.667 -16.582 0.143 1.00 0.00 C ATOM 301 O LYS A 21 -3.468 -16.634 -0.789 1.00 0.00 O ATOM 302 CB LYS A 21 -0.316 -15.900 -0.335 1.00 0.00 C ATOM 303 CG LYS A 21 1.157 -16.234 -0.180 1.00 0.00 C ATOM 304 CD LYS A 21 2.038 -15.188 -0.840 1.00 0.00 C ATOM 305 CE LYS A 21 3.487 -15.639 -0.892 1.00 0.00 C ATOM 306 NZ LYS A 21 4.386 -14.563 -1.387 1.00 0.00 N ATOM 0 H LYS A 21 -0.767 -17.737 -1.949 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.909 -17.539 0.903 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.498 -15.563 -1.356 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.563 -15.068 0.324 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.406 -16.305 0.879 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.358 -17.211 -0.620 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.679 -14.993 -1.851 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.967 -14.250 -0.290 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.806 -15.950 0.103 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.573 -16.511 -1.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.366 -14.911 -1.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 4.098 -14.284 -2.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 4.324 -13.740 -0.754 1.00 0.00 H new ATOM 320 N LEU A 22 -2.978 -16.095 1.327 1.00 0.00 N ATOM 321 CA LEU A 22 -4.306 -15.586 1.610 1.00 0.00 C ATOM 322 C LEU A 22 -4.464 -14.192 1.017 1.00 0.00 C ATOM 323 O LEU A 22 -3.571 -13.353 1.138 1.00 0.00 O ATOM 324 CB LEU A 22 -4.540 -15.564 3.123 1.00 0.00 C ATOM 325 CG LEU A 22 -5.795 -14.829 3.601 1.00 0.00 C ATOM 326 CD1 LEU A 22 -6.989 -15.148 2.711 1.00 0.00 C ATOM 327 CD2 LEU A 22 -6.093 -15.198 5.045 1.00 0.00 C ATOM 0 H LEU A 22 -2.328 -16.041 2.111 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.050 -16.239 1.154 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.590 -16.594 3.477 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.672 -15.105 3.597 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.611 -13.756 3.540 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.866 -14.613 3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.773 -14.840 1.688 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.183 -16.220 2.733 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.987 -14.671 5.378 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.256 -16.273 5.120 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.249 -14.915 5.674 1.00 0.00 H new ATOM 339 N VAL A 23 -5.591 -13.951 0.361 1.00 0.00 N ATOM 340 CA VAL A 23 -5.839 -12.658 -0.257 1.00 0.00 C ATOM 341 C VAL A 23 -6.988 -11.929 0.418 1.00 0.00 C ATOM 342 O VAL A 23 -8.151 -12.307 0.289 1.00 0.00 O ATOM 343 CB VAL A 23 -6.134 -12.789 -1.766 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.121 -11.421 -2.433 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.130 -13.719 -2.434 1.00 0.00 C ATOM 0 H VAL A 23 -6.343 -14.630 0.244 1.00 0.00 H new ATOM 0 HA VAL A 23 -4.925 -12.077 -0.129 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.128 -13.221 -1.883 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.331 -11.533 -3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.882 -10.787 -1.978 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.141 -10.962 -2.303 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.357 -13.796 -3.497 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.124 -13.320 -2.306 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.189 -14.707 -1.977 1.00 0.00 H new ATOM 355 N VAL A 24 -6.646 -10.860 1.121 1.00 0.00 N ATOM 356 CA VAL A 24 -7.636 -10.048 1.795 1.00 0.00 C ATOM 357 C VAL A 24 -7.821 -8.767 1.004 1.00 0.00 C ATOM 358 O VAL A 24 -6.882 -7.994 0.825 1.00 0.00 O ATOM 359 CB VAL A 24 -7.229 -9.721 3.247 1.00 0.00 C ATOM 360 CG1 VAL A 24 -5.880 -9.017 3.284 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.298 -8.882 3.929 1.00 0.00 C ATOM 0 H VAL A 24 -5.685 -10.537 1.237 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.570 -10.608 1.847 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.135 -10.659 3.794 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.613 -8.796 4.317 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.120 -9.663 2.843 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -5.939 -8.087 2.718 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -7.991 -8.663 4.952 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.432 -7.949 3.382 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.239 -9.432 3.943 1.00 0.00 H new ATOM 371 N VAL A 25 -9.026 -8.569 0.494 1.00 0.00 N ATOM 372 CA VAL A 25 -9.312 -7.404 -0.323 1.00 0.00 C ATOM 373 C VAL A 25 -10.517 -6.624 0.195 1.00 0.00 C ATOM 374 O VAL A 25 -11.260 -7.096 1.056 1.00 0.00 O ATOM 375 CB VAL A 25 -9.522 -7.819 -1.791 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.190 -8.156 -2.439 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.444 -9.017 -1.885 1.00 0.00 C ATOM 0 H VAL A 25 -9.818 -9.198 0.631 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.450 -6.740 -0.263 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.979 -6.980 -2.316 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.354 -8.448 -3.476 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.538 -7.283 -2.406 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.721 -8.979 -1.900 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.578 -9.292 -2.931 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.008 -9.855 -1.342 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.411 -8.767 -1.449 1.00 0.00 H new ATOM 387 N ASP A 26 -10.691 -5.416 -0.328 1.00 0.00 N ATOM 388 CA ASP A 26 -11.789 -4.553 0.090 1.00 0.00 C ATOM 389 C ASP A 26 -12.546 -3.974 -1.102 1.00 0.00 C ATOM 390 O ASP A 26 -11.942 -3.449 -2.038 1.00 0.00 O ATOM 391 CB ASP A 26 -11.254 -3.420 0.966 1.00 0.00 C ATOM 392 CG ASP A 26 -12.356 -2.667 1.684 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.488 -2.621 1.157 1.00 0.00 O ATOM 394 OD2 ASP A 26 -12.087 -2.123 2.776 1.00 0.00 O ATOM 0 H ASP A 26 -10.086 -5.012 -1.043 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.489 -5.163 0.661 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.561 -3.830 1.701 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.687 -2.724 0.347 1.00 0.00 H new ATOM 399 N PHE A 27 -13.874 -4.042 -1.039 1.00 0.00 N ATOM 400 CA PHE A 27 -14.730 -3.498 -2.094 1.00 0.00 C ATOM 401 C PHE A 27 -15.215 -2.110 -1.683 1.00 0.00 C ATOM 402 O PHE A 27 -15.995 -1.976 -0.739 1.00 0.00 O ATOM 403 CB PHE A 27 -15.923 -4.422 -2.341 1.00 0.00 C ATOM 404 CG PHE A 27 -15.677 -5.401 -3.451 1.00 0.00 C ATOM 405 CD1 PHE A 27 -14.823 -6.476 -3.265 1.00 0.00 C ATOM 406 CD2 PHE A 27 -16.279 -5.233 -4.689 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.574 -7.367 -4.291 1.00 0.00 C ATOM 408 CE2 PHE A 27 -16.036 -6.123 -5.719 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.182 -7.192 -5.519 1.00 0.00 C ATOM 0 H PHE A 27 -14.383 -4.470 -0.266 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.158 -3.423 -3.019 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.151 -4.967 -1.425 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.800 -3.820 -2.580 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.346 -6.619 -2.307 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.945 -4.398 -4.850 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -13.905 -8.200 -4.133 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.512 -5.983 -6.678 1.00 0.00 H new ATOM 0 HZ PHE A 27 -14.991 -7.889 -6.322 1.00 0.00 H new ATOM 419 N SER A 28 -14.731 -1.077 -2.363 1.00 0.00 N ATOM 420 CA SER A 28 -15.104 0.291 -2.021 1.00 0.00 C ATOM 421 C SER A 28 -15.795 1.017 -3.174 1.00 0.00 C ATOM 422 O SER A 28 -16.181 0.411 -4.174 1.00 0.00 O ATOM 423 CB SER A 28 -13.861 1.067 -1.582 1.00 0.00 C ATOM 424 OG SER A 28 -13.068 0.297 -0.694 1.00 0.00 O ATOM 0 H SER A 28 -14.085 -1.159 -3.148 1.00 0.00 H new ATOM 0 HA SER A 28 -15.822 0.239 -1.203 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.271 1.341 -2.457 1.00 0.00 H new ATOM 0 HB3 SER A 28 -14.161 1.995 -1.096 1.00 0.00 H new ATOM 0 HG SER A 28 -12.279 0.814 -0.429 1.00 0.00 H new ATOM 430 N ALA A 29 -15.939 2.329 -3.010 1.00 0.00 N ATOM 431 CA ALA A 29 -16.573 3.178 -4.010 1.00 0.00 C ATOM 432 C ALA A 29 -16.022 4.599 -3.930 1.00 0.00 C ATOM 433 O ALA A 29 -15.578 5.037 -2.870 1.00 0.00 O ATOM 434 CB ALA A 29 -18.084 3.181 -3.819 1.00 0.00 C ATOM 0 H ALA A 29 -15.620 2.831 -2.182 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.349 2.777 -4.999 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.545 3.819 -4.573 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.466 2.165 -3.921 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -18.324 3.561 -2.826 1.00 0.00 H new ATOM 440 N THR A 30 -16.088 5.333 -5.035 1.00 0.00 N ATOM 441 CA THR A 30 -15.625 6.714 -5.043 1.00 0.00 C ATOM 442 C THR A 30 -16.601 7.583 -4.255 1.00 0.00 C ATOM 443 O THR A 30 -16.212 8.540 -3.587 1.00 0.00 O ATOM 444 CB THR A 30 -15.485 7.229 -6.477 1.00 0.00 C ATOM 445 OG1 THR A 30 -16.242 6.436 -7.373 1.00 0.00 O ATOM 446 CG2 THR A 30 -14.054 7.236 -6.967 1.00 0.00 C ATOM 0 H THR A 30 -16.453 4.999 -5.927 1.00 0.00 H new ATOM 0 HA THR A 30 -14.643 6.762 -4.572 1.00 0.00 H new ATOM 0 HB THR A 30 -15.853 8.255 -6.454 1.00 0.00 H new ATOM 0 HG1 THR A 30 -16.140 6.783 -8.284 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.021 7.612 -7.990 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.453 7.880 -6.325 1.00 0.00 H new ATOM 0 HG23 THR A 30 -13.655 6.222 -6.940 1.00 0.00 H new ATOM 454 N TRP A 31 -17.879 7.226 -4.357 1.00 0.00 N ATOM 455 CA TRP A 31 -18.956 7.950 -3.682 1.00 0.00 C ATOM 456 C TRP A 31 -19.175 7.436 -2.254 1.00 0.00 C ATOM 457 O TRP A 31 -20.175 7.771 -1.618 1.00 0.00 O ATOM 458 CB TRP A 31 -20.253 7.778 -4.480 1.00 0.00 C ATOM 459 CG TRP A 31 -20.730 6.356 -4.499 1.00 0.00 C ATOM 460 CD1 TRP A 31 -20.306 5.353 -5.328 1.00 0.00 C ATOM 461 CD2 TRP A 31 -21.708 5.772 -3.631 1.00 0.00 C ATOM 462 NE1 TRP A 31 -20.957 4.182 -5.017 1.00 0.00 N ATOM 463 CE2 TRP A 31 -21.822 4.416 -3.984 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.495 6.263 -2.587 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.689 3.547 -3.331 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -23.357 5.399 -1.940 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.446 4.054 -2.314 1.00 0.00 C ATOM 0 H TRP A 31 -18.198 6.429 -4.908 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.674 9.001 -3.625 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -21.028 8.412 -4.049 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -20.094 8.119 -5.503 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -19.570 5.464 -6.110 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -20.817 3.285 -5.481 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -22.431 7.300 -2.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.761 2.508 -3.618 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -23.972 5.768 -1.132 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -24.128 3.403 -1.787 1.00 0.00 H new ATOM 478 N CYS A 32 -18.250 6.618 -1.754 1.00 0.00 N ATOM 479 CA CYS A 32 -18.373 6.072 -0.406 1.00 0.00 C ATOM 480 C CYS A 32 -17.644 6.932 0.619 1.00 0.00 C ATOM 481 O CYS A 32 -16.719 7.673 0.286 1.00 0.00 O ATOM 482 CB CYS A 32 -17.843 4.637 -0.345 1.00 0.00 C ATOM 483 SG CYS A 32 -18.371 3.719 1.140 1.00 0.00 S ATOM 0 H CYS A 32 -17.414 6.321 -2.258 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.435 6.071 -0.160 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -18.177 4.098 -1.232 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -16.754 4.660 -0.378 1.00 0.00 H new ATOM 488 N GLY A 33 -18.064 6.807 1.874 1.00 0.00 N ATOM 489 CA GLY A 33 -17.445 7.557 2.949 1.00 0.00 C ATOM 490 C GLY A 33 -16.663 6.664 3.897 1.00 0.00 C ATOM 491 O GLY A 33 -15.438 6.755 3.967 1.00 0.00 O ATOM 0 H GLY A 33 -18.827 6.196 2.166 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.778 8.309 2.528 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.214 8.091 3.507 1.00 0.00 H new ATOM 495 N PRO A 34 -17.349 5.778 4.644 1.00 0.00 N ATOM 496 CA PRO A 34 -16.693 4.866 5.590 1.00 0.00 C ATOM 497 C PRO A 34 -15.711 3.924 4.900 1.00 0.00 C ATOM 498 O PRO A 34 -14.806 3.383 5.536 1.00 0.00 O ATOM 499 CB PRO A 34 -17.856 4.066 6.194 1.00 0.00 C ATOM 500 CG PRO A 34 -19.071 4.888 5.929 1.00 0.00 C ATOM 501 CD PRO A 34 -18.810 5.594 4.630 1.00 0.00 C ATOM 0 HA PRO A 34 -16.104 5.410 6.329 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -17.938 3.081 5.734 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.713 3.908 7.263 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.960 4.261 5.862 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -19.244 5.602 6.734 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -19.134 5.000 3.775 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.337 6.547 4.575 1.00 0.00 H new ATOM 509 N CYS A 35 -15.895 3.728 3.598 1.00 0.00 N ATOM 510 CA CYS A 35 -15.022 2.849 2.830 1.00 0.00 C ATOM 511 C CYS A 35 -13.579 3.339 2.879 1.00 0.00 C ATOM 512 O CYS A 35 -12.648 2.552 3.048 1.00 0.00 O ATOM 513 CB CYS A 35 -15.495 2.768 1.376 1.00 0.00 C ATOM 514 SG CYS A 35 -17.170 2.081 1.169 1.00 0.00 S ATOM 0 H CYS A 35 -16.639 4.165 3.054 1.00 0.00 H new ATOM 0 HA CYS A 35 -15.066 1.855 3.275 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.469 3.767 0.942 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -14.792 2.156 0.811 1.00 0.00 H new ATOM 519 N LYS A 36 -13.405 4.647 2.736 1.00 0.00 N ATOM 520 CA LYS A 36 -12.080 5.259 2.765 1.00 0.00 C ATOM 521 C LYS A 36 -11.458 5.185 4.163 1.00 0.00 C ATOM 522 O LYS A 36 -10.255 5.386 4.325 1.00 0.00 O ATOM 523 CB LYS A 36 -12.163 6.715 2.302 1.00 0.00 C ATOM 524 CG LYS A 36 -11.966 6.885 0.803 1.00 0.00 C ATOM 525 CD LYS A 36 -12.836 7.999 0.243 1.00 0.00 C ATOM 526 CE LYS A 36 -12.319 9.368 0.653 1.00 0.00 C ATOM 527 NZ LYS A 36 -13.335 10.434 0.439 1.00 0.00 N ATOM 0 H LYS A 36 -14.169 5.309 2.598 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.438 4.700 2.084 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.134 7.123 2.582 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.409 7.299 2.829 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.918 7.103 0.596 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.203 5.949 0.297 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.863 7.930 -0.844 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.860 7.875 0.596 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -12.031 9.347 1.704 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -11.421 9.603 0.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.942 11.352 0.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.591 10.472 -0.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.182 10.224 1.004 1.00 0.00 H new ATOM 541 N MET A 37 -12.282 4.901 5.171 1.00 0.00 N ATOM 542 CA MET A 37 -11.803 4.811 6.548 1.00 0.00 C ATOM 543 C MET A 37 -10.986 3.542 6.779 1.00 0.00 C ATOM 544 O MET A 37 -10.154 3.489 7.683 1.00 0.00 O ATOM 545 CB MET A 37 -12.978 4.851 7.528 1.00 0.00 C ATOM 546 CG MET A 37 -13.756 6.156 7.496 1.00 0.00 C ATOM 547 SD MET A 37 -15.013 6.245 8.786 1.00 0.00 S ATOM 548 CE MET A 37 -14.286 7.461 9.882 1.00 0.00 C ATOM 0 H MET A 37 -13.281 4.730 5.060 1.00 0.00 H new ATOM 0 HA MET A 37 -11.155 5.670 6.723 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.656 4.028 7.302 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.603 4.687 8.538 1.00 0.00 H new ATOM 0 HG2 MET A 37 -13.064 6.990 7.610 1.00 0.00 H new ATOM 0 HG3 MET A 37 -14.232 6.267 6.522 1.00 0.00 H new ATOM 0 HE1 MET A 37 -14.948 7.626 10.732 1.00 0.00 H new ATOM 0 HE2 MET A 37 -13.321 7.100 10.238 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.146 8.399 9.344 1.00 0.00 H new ATOM 558 N ILE A 38 -11.230 2.517 5.967 1.00 0.00 N ATOM 559 CA ILE A 38 -10.518 1.248 6.106 1.00 0.00 C ATOM 560 C ILE A 38 -9.185 1.264 5.360 1.00 0.00 C ATOM 561 O ILE A 38 -8.283 0.486 5.670 1.00 0.00 O ATOM 562 CB ILE A 38 -11.365 0.078 5.567 1.00 0.00 C ATOM 563 CG1 ILE A 38 -12.805 0.168 6.089 1.00 0.00 C ATOM 564 CG2 ILE A 38 -10.734 -1.254 5.945 1.00 0.00 C ATOM 565 CD1 ILE A 38 -12.953 -0.196 7.552 1.00 0.00 C ATOM 0 H ILE A 38 -11.912 2.539 5.209 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.331 1.111 7.171 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.395 0.145 4.479 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.172 1.183 5.939 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.438 -0.491 5.495 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.345 -2.069 5.557 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.733 -1.316 5.519 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.672 -1.332 7.030 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -13.999 -0.108 7.845 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.618 -1.222 7.707 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.348 0.479 8.158 1.00 0.00 H new ATOM 577 N LYS A 39 -9.071 2.144 4.368 1.00 0.00 N ATOM 578 CA LYS A 39 -7.855 2.252 3.563 1.00 0.00 C ATOM 579 C LYS A 39 -6.592 2.360 4.422 1.00 0.00 C ATOM 580 O LYS A 39 -5.693 1.526 4.311 1.00 0.00 O ATOM 581 CB LYS A 39 -7.951 3.459 2.629 1.00 0.00 C ATOM 582 CG LYS A 39 -8.649 3.152 1.314 1.00 0.00 C ATOM 583 CD LYS A 39 -8.812 4.405 0.468 1.00 0.00 C ATOM 584 CE LYS A 39 -7.593 4.647 -0.411 1.00 0.00 C ATOM 585 NZ LYS A 39 -7.598 6.011 -1.006 1.00 0.00 N ATOM 0 H LYS A 39 -9.809 2.796 4.101 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.774 1.335 2.979 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.487 4.261 3.137 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.947 3.829 2.421 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.075 2.409 0.760 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -9.628 2.715 1.513 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.700 4.310 -0.157 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.970 5.266 1.118 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.687 4.512 0.180 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.567 3.904 -1.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -6.751 6.135 -1.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.449 6.131 -1.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.597 6.721 -0.246 1.00 0.00 H new ATOM 599 N PRO A 40 -6.490 3.395 5.277 1.00 0.00 N ATOM 600 CA PRO A 40 -5.317 3.599 6.131 1.00 0.00 C ATOM 601 C PRO A 40 -4.915 2.342 6.896 1.00 0.00 C ATOM 602 O PRO A 40 -3.734 2.002 6.964 1.00 0.00 O ATOM 603 CB PRO A 40 -5.749 4.709 7.105 1.00 0.00 C ATOM 604 CG PRO A 40 -7.212 4.907 6.878 1.00 0.00 C ATOM 605 CD PRO A 40 -7.487 4.454 5.474 1.00 0.00 C ATOM 0 HA PRO A 40 -4.439 3.859 5.539 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -5.549 4.422 8.137 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.197 5.630 6.918 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.798 4.331 7.594 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.488 5.953 7.010 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.504 4.079 5.361 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -7.365 5.264 4.755 1.00 0.00 H new ATOM 613 N PHE A 41 -5.892 1.665 7.492 1.00 0.00 N ATOM 614 CA PHE A 41 -5.614 0.465 8.278 1.00 0.00 C ATOM 615 C PHE A 41 -5.400 -0.759 7.391 1.00 0.00 C ATOM 616 O PHE A 41 -4.661 -1.673 7.760 1.00 0.00 O ATOM 617 CB PHE A 41 -6.766 0.191 9.246 1.00 0.00 C ATOM 618 CG PHE A 41 -7.249 1.410 9.983 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.399 2.117 10.819 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.555 1.849 9.838 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.843 3.238 11.494 1.00 0.00 C ATOM 622 CE2 PHE A 41 -9.004 2.969 10.510 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.147 3.664 11.340 1.00 0.00 C ATOM 0 H PHE A 41 -6.878 1.924 7.447 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.695 0.648 8.834 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.599 -0.239 8.690 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.447 -0.557 9.972 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.378 1.788 10.944 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.230 1.309 9.191 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.170 3.781 12.142 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -10.024 3.301 10.386 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.496 4.539 11.868 1.00 0.00 H new ATOM 633 N PHE A 42 -6.031 -0.778 6.222 1.00 0.00 N ATOM 634 CA PHE A 42 -5.878 -1.903 5.303 1.00 0.00 C ATOM 635 C PHE A 42 -4.445 -1.982 4.796 1.00 0.00 C ATOM 636 O PHE A 42 -3.847 -3.057 4.748 1.00 0.00 O ATOM 637 CB PHE A 42 -6.837 -1.765 4.117 1.00 0.00 C ATOM 638 CG PHE A 42 -7.241 -3.080 3.506 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.090 -3.940 4.184 1.00 0.00 C ATOM 640 CD2 PHE A 42 -6.781 -3.451 2.251 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.473 -5.144 3.622 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.160 -4.654 1.685 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.009 -5.502 2.371 1.00 0.00 C ATOM 0 H PHE A 42 -6.647 -0.036 5.890 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.116 -2.818 5.845 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.732 -1.237 4.445 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.366 -1.148 3.351 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.457 -3.667 5.162 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.119 -2.792 1.709 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.135 -5.805 4.161 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.793 -4.931 0.708 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.309 -6.441 1.930 1.00 0.00 H new ATOM 653 N HIS A 43 -3.907 -0.834 4.404 1.00 0.00 N ATOM 654 CA HIS A 43 -2.550 -0.766 3.879 1.00 0.00 C ATOM 655 C HIS A 43 -1.508 -1.086 4.951 1.00 0.00 C ATOM 656 O HIS A 43 -0.501 -1.735 4.664 1.00 0.00 O ATOM 657 CB HIS A 43 -2.281 0.613 3.273 1.00 0.00 C ATOM 658 CG HIS A 43 -1.707 0.547 1.891 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.362 0.986 0.763 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.510 0.069 1.468 1.00 0.00 C ATOM 661 CE1 HIS A 43 -1.563 0.763 -0.289 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.425 0.209 0.086 1.00 0.00 N ATOM 0 H HIS A 43 -4.391 0.063 4.440 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.463 -1.522 3.099 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.212 1.179 3.246 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.594 1.159 3.919 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.255 -0.353 2.103 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -1.817 1.005 -1.311 1.00 0.00 H new ATOM 0 HE2 HIS A 43 0.355 -0.061 -0.513 1.00 0.00 H new ATOM 670 N SER A 44 -1.738 -0.633 6.181 1.00 0.00 N ATOM 671 CA SER A 44 -0.795 -0.888 7.266 1.00 0.00 C ATOM 672 C SER A 44 -0.657 -2.387 7.519 1.00 0.00 C ATOM 673 O SER A 44 0.449 -2.896 7.708 1.00 0.00 O ATOM 674 CB SER A 44 -1.242 -0.174 8.545 1.00 0.00 C ATOM 675 OG SER A 44 -0.680 1.125 8.624 1.00 0.00 O ATOM 0 H SER A 44 -2.561 -0.093 6.449 1.00 0.00 H new ATOM 0 HA SER A 44 0.178 -0.496 6.970 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.330 -0.106 8.566 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.942 -0.758 9.415 1.00 0.00 H new ATOM 0 HG SER A 44 -0.981 1.562 9.448 1.00 0.00 H new ATOM 681 N LEU A 45 -1.784 -3.089 7.519 1.00 0.00 N ATOM 682 CA LEU A 45 -1.780 -4.529 7.748 1.00 0.00 C ATOM 683 C LEU A 45 -0.945 -5.230 6.681 1.00 0.00 C ATOM 684 O LEU A 45 -0.128 -6.099 6.986 1.00 0.00 O ATOM 685 CB LEU A 45 -3.210 -5.077 7.731 1.00 0.00 C ATOM 686 CG LEU A 45 -4.076 -4.669 8.925 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.552 -4.778 8.574 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.750 -5.530 10.137 1.00 0.00 C ATOM 0 H LEU A 45 -2.708 -2.687 7.364 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.341 -4.721 8.727 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.700 -4.743 6.816 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.165 -6.165 7.690 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.857 -3.630 9.172 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.153 -4.484 9.434 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.776 -4.121 7.734 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.786 -5.807 8.302 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.375 -5.227 10.977 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.941 -6.577 9.902 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.700 -5.404 10.401 1.00 0.00 H new ATOM 700 N SER A 46 -1.152 -4.835 5.430 1.00 0.00 N ATOM 701 CA SER A 46 -0.419 -5.409 4.308 1.00 0.00 C ATOM 702 C SER A 46 1.089 -5.339 4.529 1.00 0.00 C ATOM 703 O SER A 46 1.839 -6.156 3.996 1.00 0.00 O ATOM 704 CB SER A 46 -0.776 -4.674 3.015 1.00 0.00 C ATOM 705 OG SER A 46 -0.071 -3.449 2.915 1.00 0.00 O ATOM 0 H SER A 46 -1.825 -4.116 5.167 1.00 0.00 H new ATOM 0 HA SER A 46 -0.706 -6.457 4.229 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.540 -5.304 2.157 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.849 -4.484 2.985 1.00 0.00 H new ATOM 0 HG SER A 46 -0.041 -3.016 3.794 1.00 0.00 H new ATOM 711 N GLU A 47 1.532 -4.356 5.311 1.00 0.00 N ATOM 712 CA GLU A 47 2.954 -4.185 5.584 1.00 0.00 C ATOM 713 C GLU A 47 3.406 -5.060 6.749 1.00 0.00 C ATOM 714 O GLU A 47 4.588 -5.383 6.869 1.00 0.00 O ATOM 715 CB GLU A 47 3.258 -2.716 5.883 1.00 0.00 C ATOM 716 CG GLU A 47 4.687 -2.310 5.557 1.00 0.00 C ATOM 717 CD GLU A 47 5.161 -1.131 6.386 1.00 0.00 C ATOM 718 OE1 GLU A 47 5.337 -1.300 7.611 1.00 0.00 O ATOM 719 OE2 GLU A 47 5.357 -0.040 5.811 1.00 0.00 O ATOM 0 H GLU A 47 0.928 -3.670 5.764 1.00 0.00 H new ATOM 0 HA GLU A 47 3.506 -4.495 4.697 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.572 -2.089 5.313 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.066 -2.522 6.938 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.350 -3.159 5.726 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.757 -2.057 4.499 1.00 0.00 H new ATOM 726 N LYS A 48 2.462 -5.453 7.599 1.00 0.00 N ATOM 727 CA LYS A 48 2.776 -6.303 8.744 1.00 0.00 C ATOM 728 C LYS A 48 2.526 -7.770 8.397 1.00 0.00 C ATOM 729 O LYS A 48 3.021 -8.673 9.072 1.00 0.00 O ATOM 730 CB LYS A 48 1.928 -5.899 9.955 1.00 0.00 C ATOM 731 CG LYS A 48 2.245 -6.689 11.217 1.00 0.00 C ATOM 732 CD LYS A 48 1.142 -6.542 12.256 1.00 0.00 C ATOM 733 CE LYS A 48 0.957 -7.819 13.062 1.00 0.00 C ATOM 734 NZ LYS A 48 1.827 -7.847 14.270 1.00 0.00 N ATOM 0 H LYS A 48 1.478 -5.198 7.518 1.00 0.00 H new ATOM 0 HA LYS A 48 3.829 -6.174 8.994 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.078 -4.838 10.154 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.874 -6.031 9.710 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.373 -7.742 10.966 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.190 -6.344 11.636 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.382 -5.718 12.928 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.206 -6.286 11.760 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.086 -7.909 13.364 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.182 -8.680 12.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.670 -8.734 14.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.824 -7.787 13.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.595 -7.040 14.883 1.00 0.00 H new ATOM 748 N TYR A 49 1.760 -7.994 7.332 1.00 0.00 N ATOM 749 CA TYR A 49 1.440 -9.343 6.879 1.00 0.00 C ATOM 750 C TYR A 49 2.332 -9.750 5.711 1.00 0.00 C ATOM 751 O TYR A 49 2.010 -9.488 4.552 1.00 0.00 O ATOM 752 CB TYR A 49 -0.027 -9.420 6.451 1.00 0.00 C ATOM 753 CG TYR A 49 -0.974 -9.733 7.585 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.379 -8.745 8.471 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.464 -11.021 7.768 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.245 -9.029 9.510 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.330 -11.314 8.804 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.718 -10.313 9.672 1.00 0.00 C ATOM 759 OH TYR A 49 -3.584 -10.597 10.703 1.00 0.00 O ATOM 0 H TYR A 49 1.348 -7.253 6.765 1.00 0.00 H new ATOM 0 HA TYR A 49 1.614 -10.029 7.708 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.315 -8.470 6.000 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.132 -10.184 5.680 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -1.011 -7.737 8.347 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -1.163 -11.805 7.089 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.549 -8.248 10.192 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.701 -12.320 8.934 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.824 -11.547 10.677 1.00 0.00 H new ATOM 769 N SER A 50 3.447 -10.401 6.019 1.00 0.00 N ATOM 770 CA SER A 50 4.378 -10.852 4.990 1.00 0.00 C ATOM 771 C SER A 50 4.019 -12.263 4.529 1.00 0.00 C ATOM 772 O SER A 50 4.874 -13.146 4.462 1.00 0.00 O ATOM 773 CB SER A 50 5.813 -10.817 5.522 1.00 0.00 C ATOM 774 OG SER A 50 6.233 -9.486 5.763 1.00 0.00 O ATOM 0 H SER A 50 3.729 -10.629 6.972 1.00 0.00 H new ATOM 0 HA SER A 50 4.305 -10.179 4.136 1.00 0.00 H new ATOM 0 HB2 SER A 50 5.877 -11.395 6.444 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.483 -11.289 4.803 1.00 0.00 H new ATOM 0 HG SER A 50 7.152 -9.490 6.104 1.00 0.00 H new ATOM 780 N ASN A 51 2.744 -12.460 4.208 1.00 0.00 N ATOM 781 CA ASN A 51 2.252 -13.752 3.747 1.00 0.00 C ATOM 782 C ASN A 51 1.023 -13.578 2.858 1.00 0.00 C ATOM 783 O ASN A 51 0.887 -14.235 1.826 1.00 0.00 O ATOM 784 CB ASN A 51 1.900 -14.640 4.941 1.00 0.00 C ATOM 785 CG ASN A 51 2.180 -16.107 4.677 1.00 0.00 C ATOM 786 OD1 ASN A 51 3.115 -16.454 3.955 1.00 0.00 O ATOM 787 ND2 ASN A 51 1.365 -16.979 5.260 1.00 0.00 N ATOM 0 H ASN A 51 2.029 -11.735 4.260 1.00 0.00 H new ATOM 0 HA ASN A 51 3.041 -14.227 3.164 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.470 -14.316 5.811 1.00 0.00 H new ATOM 0 HB3 ASN A 51 0.845 -14.513 5.186 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.502 -17.980 5.117 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.602 -16.648 5.851 1.00 0.00 H new ATOM 794 N VAL A 52 0.122 -12.696 3.286 1.00 0.00 N ATOM 795 CA VAL A 52 -1.115 -12.438 2.559 1.00 0.00 C ATOM 796 C VAL A 52 -0.977 -11.262 1.603 1.00 0.00 C ATOM 797 O VAL A 52 -0.140 -10.381 1.798 1.00 0.00 O ATOM 798 CB VAL A 52 -2.271 -12.141 3.534 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.359 -13.223 4.593 1.00 0.00 C ATOM 800 CG2 VAL A 52 -2.099 -10.774 4.181 1.00 0.00 C ATOM 0 H VAL A 52 0.229 -12.146 4.138 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.331 -13.339 1.984 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.202 -12.132 2.967 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.180 -12.999 5.274 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.536 -14.186 4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.424 -13.262 5.152 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.927 -10.588 4.865 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.160 -10.749 4.734 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.086 -10.005 3.409 1.00 0.00 H new ATOM 810 N ILE A 53 -1.813 -11.254 0.570 1.00 0.00 N ATOM 811 CA ILE A 53 -1.795 -10.188 -0.418 1.00 0.00 C ATOM 812 C ILE A 53 -2.988 -9.253 -0.233 1.00 0.00 C ATOM 813 O ILE A 53 -4.143 -9.649 -0.397 1.00 0.00 O ATOM 814 CB ILE A 53 -1.755 -10.761 -1.861 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.033 -9.795 -2.799 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.147 -11.079 -2.394 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.474 -9.901 -2.728 1.00 0.00 C ATOM 0 H ILE A 53 -2.512 -11.977 0.397 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.885 -9.607 -0.266 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.202 -11.700 -1.820 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.355 -9.986 -3.823 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.330 -8.775 -2.556 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.067 -11.477 -3.406 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.623 -11.818 -1.750 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.748 -10.170 -2.408 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.922 -9.187 -3.419 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.807 -9.681 -1.714 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.781 -10.911 -3.000 1.00 0.00 H new ATOM 829 N PHE A 54 -2.689 -8.008 0.126 1.00 0.00 N ATOM 830 CA PHE A 54 -3.711 -6.990 0.353 1.00 0.00 C ATOM 831 C PHE A 54 -3.886 -6.136 -0.899 1.00 0.00 C ATOM 832 O PHE A 54 -2.966 -5.419 -1.287 1.00 0.00 O ATOM 833 CB PHE A 54 -3.277 -6.051 1.488 1.00 0.00 C ATOM 834 CG PHE A 54 -3.666 -6.460 2.887 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.172 -7.615 3.484 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.520 -5.649 3.619 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.532 -7.944 4.783 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.883 -5.978 4.909 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.388 -7.124 5.491 1.00 0.00 C ATOM 0 H PHE A 54 -1.735 -7.677 0.268 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.641 -7.498 0.607 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.192 -5.950 1.451 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.695 -5.064 1.293 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.504 -8.260 2.933 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.907 -4.745 3.172 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.143 -8.842 5.240 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.554 -5.338 5.462 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.669 -7.381 6.501 1.00 0.00 H new ATOM 849 N LEU A 55 -5.062 -6.174 -1.516 1.00 0.00 N ATOM 850 CA LEU A 55 -5.293 -5.354 -2.693 1.00 0.00 C ATOM 851 C LEU A 55 -6.591 -4.576 -2.578 1.00 0.00 C ATOM 852 O LEU A 55 -7.382 -4.793 -1.660 1.00 0.00 O ATOM 853 CB LEU A 55 -5.222 -6.174 -3.986 1.00 0.00 C ATOM 854 CG LEU A 55 -6.545 -6.559 -4.657 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.797 -5.673 -5.865 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.507 -8.020 -5.082 1.00 0.00 C ATOM 0 H LEU A 55 -5.852 -6.751 -1.227 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.485 -4.624 -2.746 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.631 -5.611 -4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.675 -7.092 -3.772 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.356 -6.418 -3.942 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.740 -5.956 -6.333 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.848 -4.631 -5.548 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.985 -5.795 -6.582 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.451 -8.285 -5.558 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.690 -8.173 -5.787 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.353 -8.650 -4.206 1.00 0.00 H new ATOM 868 N GLU A 56 -6.776 -3.634 -3.485 1.00 0.00 N ATOM 869 CA GLU A 56 -7.945 -2.776 -3.453 1.00 0.00 C ATOM 870 C GLU A 56 -8.774 -2.859 -4.722 1.00 0.00 C ATOM 871 O GLU A 56 -8.276 -2.618 -5.820 1.00 0.00 O ATOM 872 CB GLU A 56 -7.473 -1.347 -3.271 1.00 0.00 C ATOM 873 CG GLU A 56 -8.375 -0.497 -2.391 1.00 0.00 C ATOM 874 CD GLU A 56 -7.813 0.893 -2.158 1.00 0.00 C ATOM 875 OE1 GLU A 56 -6.898 1.031 -1.320 1.00 0.00 O ATOM 876 OE2 GLU A 56 -8.285 1.843 -2.818 1.00 0.00 O ATOM 0 H GLU A 56 -6.132 -3.444 -4.252 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.581 -3.106 -2.632 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.472 -1.360 -2.840 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.392 -0.876 -4.251 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.358 -0.415 -2.855 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.515 -0.995 -1.431 1.00 0.00 H new ATOM 883 N VAL A 57 -10.049 -3.179 -4.566 1.00 0.00 N ATOM 884 CA VAL A 57 -10.942 -3.262 -5.709 1.00 0.00 C ATOM 885 C VAL A 57 -12.058 -2.233 -5.602 1.00 0.00 C ATOM 886 O VAL A 57 -12.834 -2.237 -4.649 1.00 0.00 O ATOM 887 CB VAL A 57 -11.572 -4.658 -5.862 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.019 -4.856 -7.295 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.600 -5.756 -5.448 1.00 0.00 C ATOM 0 H VAL A 57 -10.485 -3.384 -3.667 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.330 -3.061 -6.588 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.436 -4.722 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.465 -5.845 -7.404 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.755 -4.095 -7.555 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.159 -4.771 -7.959 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.077 -6.729 -5.568 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.709 -5.709 -6.074 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.317 -5.617 -4.404 1.00 0.00 H new ATOM 899 N ASP A 58 -12.135 -1.349 -6.587 1.00 0.00 N ATOM 900 CA ASP A 58 -13.161 -0.319 -6.607 1.00 0.00 C ATOM 901 C ASP A 58 -14.305 -0.774 -7.501 1.00 0.00 C ATOM 902 O ASP A 58 -14.105 -1.040 -8.686 1.00 0.00 O ATOM 903 CB ASP A 58 -12.579 1.006 -7.111 1.00 0.00 C ATOM 904 CG ASP A 58 -13.636 2.081 -7.286 1.00 0.00 C ATOM 905 OD1 ASP A 58 -14.731 1.936 -6.703 1.00 0.00 O ATOM 906 OD2 ASP A 58 -13.367 3.066 -8.004 1.00 0.00 O ATOM 0 H ASP A 58 -11.498 -1.326 -7.383 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.535 -0.159 -5.596 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.823 1.357 -6.409 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.076 0.838 -8.063 1.00 0.00 H new ATOM 911 N VAL A 59 -15.494 -0.900 -6.924 1.00 0.00 N ATOM 912 CA VAL A 59 -16.650 -1.357 -7.677 1.00 0.00 C ATOM 913 C VAL A 59 -16.985 -0.411 -8.826 1.00 0.00 C ATOM 914 O VAL A 59 -17.667 -0.797 -9.776 1.00 0.00 O ATOM 915 CB VAL A 59 -17.880 -1.540 -6.769 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.278 -0.222 -6.126 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.039 -2.137 -7.552 1.00 0.00 C ATOM 0 H VAL A 59 -15.680 -0.693 -5.943 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.385 -2.327 -8.099 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.616 -2.235 -5.972 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.149 -0.376 -5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.451 0.154 -5.524 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.520 0.503 -6.903 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.899 -2.259 -6.893 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.303 -1.472 -8.374 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.747 -3.109 -7.950 1.00 0.00 H new ATOM 927 N ASP A 60 -16.489 0.820 -8.751 1.00 0.00 N ATOM 928 CA ASP A 60 -16.725 1.792 -9.811 1.00 0.00 C ATOM 929 C ASP A 60 -16.116 1.277 -11.111 1.00 0.00 C ATOM 930 O ASP A 60 -16.710 1.390 -12.183 1.00 0.00 O ATOM 931 CB ASP A 60 -16.111 3.146 -9.441 1.00 0.00 C ATOM 932 CG ASP A 60 -16.924 4.317 -9.957 1.00 0.00 C ATOM 933 OD1 ASP A 60 -16.754 4.682 -11.140 1.00 0.00 O ATOM 934 OD2 ASP A 60 -17.726 4.873 -9.177 1.00 0.00 O ATOM 0 H ASP A 60 -15.926 1.166 -7.974 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.799 1.927 -9.941 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.026 3.218 -8.357 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.100 3.205 -9.845 1.00 0.00 H new ATOM 939 N ASP A 61 -14.927 0.696 -10.989 1.00 0.00 N ATOM 940 CA ASP A 61 -14.213 0.132 -12.129 1.00 0.00 C ATOM 941 C ASP A 61 -14.432 -1.376 -12.200 1.00 0.00 C ATOM 942 O ASP A 61 -14.492 -1.961 -13.282 1.00 0.00 O ATOM 943 CB ASP A 61 -12.717 0.433 -12.015 1.00 0.00 C ATOM 944 CG ASP A 61 -12.414 1.916 -12.082 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.415 2.473 -13.200 1.00 0.00 O ATOM 946 OD2 ASP A 61 -12.174 2.521 -11.015 1.00 0.00 O ATOM 0 H ASP A 61 -14.433 0.603 -10.101 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.601 0.588 -13.040 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.340 0.031 -11.075 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.185 -0.079 -12.817 1.00 0.00 H new ATOM 951 N ALA A 62 -14.541 -1.996 -11.029 1.00 0.00 N ATOM 952 CA ALA A 62 -14.748 -3.434 -10.930 1.00 0.00 C ATOM 953 C ALA A 62 -16.231 -3.766 -10.791 1.00 0.00 C ATOM 954 O ALA A 62 -16.617 -4.636 -10.006 1.00 0.00 O ATOM 955 CB ALA A 62 -13.962 -3.989 -9.751 1.00 0.00 C ATOM 0 H ALA A 62 -14.489 -1.519 -10.129 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.388 -3.900 -11.847 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -14.121 -5.065 -9.682 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.900 -3.787 -9.894 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.301 -3.513 -8.831 1.00 0.00 H new ATOM 961 N GLN A 63 -17.060 -3.060 -11.554 1.00 0.00 N ATOM 962 CA GLN A 63 -18.502 -3.266 -11.515 1.00 0.00 C ATOM 963 C GLN A 63 -18.891 -4.627 -12.091 1.00 0.00 C ATOM 964 O GLN A 63 -20.044 -5.043 -11.980 1.00 0.00 O ATOM 965 CB GLN A 63 -19.217 -2.153 -12.284 1.00 0.00 C ATOM 966 CG GLN A 63 -20.488 -1.667 -11.606 1.00 0.00 C ATOM 967 CD GLN A 63 -21.742 -2.061 -12.360 1.00 0.00 C ATOM 968 OE1 GLN A 63 -22.258 -1.297 -13.176 1.00 0.00 O ATOM 969 NE2 GLN A 63 -22.239 -3.263 -12.092 1.00 0.00 N ATOM 0 H GLN A 63 -16.756 -2.339 -12.208 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.811 -3.241 -10.470 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.535 -1.311 -12.407 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -19.462 -2.513 -13.283 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -20.534 -2.074 -10.596 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -20.452 -0.582 -11.511 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -21.779 -3.864 -11.408 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -23.081 -3.585 -12.570 1.00 0.00 H new ATOM 978 N ASP A 64 -17.935 -5.318 -12.709 1.00 0.00 N ATOM 979 CA ASP A 64 -18.209 -6.623 -13.298 1.00 0.00 C ATOM 980 C ASP A 64 -17.849 -7.756 -12.337 1.00 0.00 C ATOM 981 O ASP A 64 -18.382 -8.860 -12.450 1.00 0.00 O ATOM 982 CB ASP A 64 -17.439 -6.790 -14.609 1.00 0.00 C ATOM 983 CG ASP A 64 -18.022 -5.957 -15.734 1.00 0.00 C ATOM 984 OD1 ASP A 64 -19.096 -6.330 -16.252 1.00 0.00 O ATOM 985 OD2 ASP A 64 -17.408 -4.930 -16.095 1.00 0.00 O ATOM 0 H ASP A 64 -16.972 -4.998 -12.813 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.279 -6.675 -13.501 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.398 -6.507 -14.454 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -17.444 -7.841 -14.899 1.00 0.00 H new ATOM 990 N VAL A 65 -16.954 -7.488 -11.388 1.00 0.00 N ATOM 991 CA VAL A 65 -16.558 -8.513 -10.426 1.00 0.00 C ATOM 992 C VAL A 65 -17.616 -8.684 -9.341 1.00 0.00 C ATOM 993 O VAL A 65 -17.991 -9.808 -9.009 1.00 0.00 O ATOM 994 CB VAL A 65 -15.179 -8.235 -9.778 1.00 0.00 C ATOM 995 CG1 VAL A 65 -14.059 -8.685 -10.703 1.00 0.00 C ATOM 996 CG2 VAL A 65 -15.016 -6.771 -9.418 1.00 0.00 C ATOM 0 H VAL A 65 -16.496 -6.585 -11.265 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.468 -9.439 -10.993 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.125 -8.809 -8.853 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.096 -8.483 -10.234 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.152 -9.754 -10.894 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.125 -8.141 -11.645 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -14.037 -6.614 -8.966 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -15.101 -6.163 -10.319 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.793 -6.482 -8.710 1.00 0.00 H new ATOM 1006 N ALA A 66 -18.095 -7.575 -8.774 1.00 0.00 N ATOM 1007 CA ALA A 66 -19.100 -7.635 -7.713 1.00 0.00 C ATOM 1008 C ALA A 66 -20.281 -8.526 -8.099 1.00 0.00 C ATOM 1009 O ALA A 66 -20.590 -9.495 -7.405 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.596 -6.232 -7.396 1.00 0.00 C ATOM 0 H ALA A 66 -17.805 -6.631 -9.030 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.629 -8.071 -6.832 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.345 -6.281 -6.605 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.759 -5.616 -7.066 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -20.040 -5.793 -8.289 1.00 0.00 H new ATOM 1016 N PRO A 67 -20.959 -8.209 -9.214 1.00 0.00 N ATOM 1017 CA PRO A 67 -22.111 -8.986 -9.689 1.00 0.00 C ATOM 1018 C PRO A 67 -21.806 -10.477 -9.775 1.00 0.00 C ATOM 1019 O PRO A 67 -22.692 -11.314 -9.600 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.368 -8.413 -11.083 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.847 -7.019 -11.014 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.662 -7.067 -10.096 1.00 0.00 C ATOM 0 HA PRO A 67 -22.964 -8.908 -9.015 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.854 -8.991 -11.851 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.430 -8.428 -11.329 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.561 -6.660 -12.003 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.607 -6.336 -10.635 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.733 -7.216 -10.647 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -20.553 -6.141 -9.531 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.542 -10.797 -10.021 1.00 0.00 N ATOM 1031 CA LYS A 68 -20.110 -12.186 -10.107 1.00 0.00 C ATOM 1032 C LYS A 68 -19.992 -12.802 -8.712 1.00 0.00 C ATOM 1033 O LYS A 68 -20.048 -14.022 -8.559 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.768 -12.285 -10.840 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.897 -12.705 -12.297 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.561 -12.627 -13.023 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.512 -13.570 -14.215 1.00 0.00 C ATOM 1038 NZ LYS A 68 -16.112 -13.870 -14.627 1.00 0.00 N ATOM 0 H LYS A 68 -19.798 -10.114 -10.164 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.860 -12.741 -10.670 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.266 -11.319 -10.793 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -18.132 -13.001 -10.320 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -19.282 -13.724 -12.350 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.622 -12.064 -12.798 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.390 -11.605 -13.360 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.756 -12.873 -12.331 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -18.024 -14.499 -13.965 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -18.050 -13.125 -15.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.121 -14.516 -15.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -15.631 -12.986 -14.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.606 -14.318 -13.836 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.824 -11.946 -7.699 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.684 -12.395 -6.308 1.00 0.00 C ATOM 1054 C TYR A 69 -20.927 -12.066 -5.475 1.00 0.00 C ATOM 1055 O TYR A 69 -21.020 -12.442 -4.306 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.474 -11.720 -5.671 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.151 -12.244 -6.175 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -16.733 -13.536 -5.882 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.326 -11.446 -6.957 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.528 -14.018 -6.357 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -15.120 -11.919 -7.434 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.725 -13.206 -7.132 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.526 -13.685 -7.605 1.00 0.00 O ATOM 0 H TYR A 69 -19.781 -10.934 -7.816 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.557 -13.477 -6.324 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.526 -10.648 -5.860 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.521 -11.856 -4.590 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.359 -14.173 -5.274 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.633 -10.439 -7.196 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.216 -15.025 -6.123 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.489 -11.285 -8.040 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.927 -13.868 -6.852 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.879 -11.384 -6.091 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.112 -11.030 -5.409 1.00 0.00 C ATOM 1075 C GLY A 70 -22.923 -10.059 -4.253 1.00 0.00 C ATOM 1076 O GLY A 70 -23.634 -10.146 -3.252 1.00 0.00 O ATOM 0 H GLY A 70 -21.822 -11.066 -7.058 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.801 -10.590 -6.130 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.581 -11.939 -5.033 1.00 0.00 H new ATOM 1080 N ILE A 71 -21.983 -9.123 -4.383 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.743 -8.138 -3.328 1.00 0.00 C ATOM 1082 C ILE A 71 -22.840 -7.069 -3.326 1.00 0.00 C ATOM 1083 O ILE A 71 -23.206 -6.548 -4.380 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.369 -7.447 -3.488 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.235 -8.477 -3.471 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -20.159 -6.416 -2.385 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.895 -7.909 -3.884 1.00 0.00 C ATOM 0 H ILE A 71 -21.380 -9.026 -5.200 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.753 -8.680 -2.382 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.357 -6.938 -4.452 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.150 -8.895 -2.468 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.493 -9.300 -4.138 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -19.187 -5.939 -2.513 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.943 -5.661 -2.439 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -20.196 -6.909 -1.414 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.140 -8.695 -3.848 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.963 -7.517 -4.899 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.615 -7.106 -3.203 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.359 -6.744 -2.144 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.409 -5.733 -2.026 1.00 0.00 C ATOM 1101 C ARG A 72 -24.362 -5.036 -0.666 1.00 0.00 C ATOM 1102 O ARG A 72 -25.372 -4.941 0.031 1.00 0.00 O ATOM 1103 CB ARG A 72 -25.789 -6.362 -2.242 1.00 0.00 C ATOM 1104 CG ARG A 72 -26.867 -5.352 -2.608 1.00 0.00 C ATOM 1105 CD ARG A 72 -26.790 -4.955 -4.073 1.00 0.00 C ATOM 1106 NE ARG A 72 -28.116 -4.791 -4.667 1.00 0.00 N ATOM 1107 CZ ARG A 72 -28.346 -4.771 -5.978 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -27.341 -4.894 -6.837 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -29.584 -4.627 -6.432 1.00 0.00 N ATOM 0 H ARG A 72 -23.072 -7.163 -1.259 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.233 -4.985 -2.799 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -25.719 -7.109 -3.033 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -26.087 -6.886 -1.334 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -27.849 -5.775 -2.397 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -26.761 -4.464 -1.984 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -26.233 -4.023 -4.167 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -26.237 -5.714 -4.626 1.00 0.00 H new ATOM 0 HE ARG A 72 -28.913 -4.686 -4.039 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -26.387 -5.005 -6.493 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -27.523 -4.878 -7.841 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -30.360 -4.532 -5.777 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -29.760 -4.612 -7.437 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.181 -4.550 -0.298 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.023 -3.864 0.972 1.00 0.00 C ATOM 1125 C GLY A 73 -21.594 -3.415 1.212 1.00 0.00 C ATOM 1126 O GLY A 73 -20.731 -4.223 1.551 1.00 0.00 O ATOM 0 H GLY A 73 -22.330 -4.619 -0.856 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.683 -2.997 0.998 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.334 -4.526 1.781 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.345 -2.122 1.028 1.00 0.00 N ATOM 1131 CA ILE A 74 -20.011 -1.564 1.217 1.00 0.00 C ATOM 1132 C ILE A 74 -19.907 -0.812 2.544 1.00 0.00 C ATOM 1133 O ILE A 74 -20.907 -0.308 3.056 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.648 -0.609 0.064 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -20.756 0.429 -0.131 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.423 -1.394 -1.221 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -20.261 1.753 -0.672 1.00 0.00 C ATOM 0 H ILE A 74 -22.051 -1.441 0.748 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.311 -2.399 1.229 1.00 0.00 H new ATOM 0 HB ILE A 74 -18.724 -0.089 0.318 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -21.504 0.025 -0.813 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -21.254 0.600 0.824 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.167 -0.707 -2.027 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.608 -2.103 -1.076 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.333 -1.935 -1.481 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -21.102 2.438 -0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -19.535 2.180 0.020 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -19.789 1.596 -1.642 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.693 -0.722 3.123 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.471 -1.301 2.557 1.00 0.00 C ATOM 1151 C PRO A 75 -17.367 -2.799 2.826 1.00 0.00 C ATOM 1152 O PRO A 75 -17.271 -3.225 3.977 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.337 -0.555 3.284 1.00 0.00 C ATOM 1154 CG PRO A 75 -16.996 0.412 4.220 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.417 -0.043 4.389 1.00 0.00 C ATOM 0 HA PRO A 75 -17.441 -1.194 1.473 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.702 -1.252 3.830 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -15.698 -0.032 2.572 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.480 0.432 5.180 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.960 1.424 3.817 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -18.528 -0.714 5.241 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -19.093 0.796 4.554 1.00 0.00 H new ATOM 1163 N THR A 76 -17.388 -3.598 1.763 1.00 0.00 N ATOM 1164 CA THR A 76 -17.295 -5.047 1.891 1.00 0.00 C ATOM 1165 C THR A 76 -15.848 -5.530 1.925 1.00 0.00 C ATOM 1166 O THR A 76 -15.010 -5.078 1.145 1.00 0.00 O ATOM 1167 CB THR A 76 -18.028 -5.731 0.733 1.00 0.00 C ATOM 1168 OG1 THR A 76 -18.877 -4.818 0.062 1.00 0.00 O ATOM 1169 CG2 THR A 76 -18.873 -6.907 1.173 1.00 0.00 C ATOM 0 H THR A 76 -17.469 -3.265 0.802 1.00 0.00 H new ATOM 0 HA THR A 76 -17.763 -5.313 2.839 1.00 0.00 H new ATOM 0 HB THR A 76 -17.242 -6.095 0.071 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.759 -4.817 0.489 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.365 -7.346 0.305 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.237 -7.655 1.647 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.626 -6.568 1.884 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.573 -6.482 2.805 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.247 -7.065 2.905 1.00 0.00 C ATOM 1179 C LEU A 77 -14.297 -8.474 2.332 1.00 0.00 C ATOM 1180 O LEU A 77 -15.108 -9.297 2.753 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.762 -7.079 4.362 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.477 -6.288 4.628 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -12.611 -4.862 4.116 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -12.150 -6.293 6.114 1.00 0.00 C ATOM 0 H LEU A 77 -16.254 -6.866 3.460 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.537 -6.464 2.338 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.554 -6.679 4.996 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.602 -8.114 4.665 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.659 -6.769 4.092 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.689 -4.316 4.314 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.800 -4.877 3.043 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.440 -4.369 4.624 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.235 -5.727 6.287 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.970 -5.836 6.668 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -12.011 -7.320 6.453 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.454 -8.737 1.342 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.447 -10.040 0.688 1.00 0.00 C ATOM 1198 C LEU A 78 -12.138 -10.787 0.925 1.00 0.00 C ATOM 1199 O LEU A 78 -11.049 -10.231 0.775 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.675 -9.865 -0.823 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.139 -9.765 -1.287 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.236 -10.004 -2.786 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.022 -10.751 -0.537 1.00 0.00 C ATOM 0 H LEU A 78 -12.772 -8.073 0.976 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.253 -10.632 1.121 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.152 -8.965 -1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.210 -10.705 -1.338 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.494 -8.758 -1.066 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.277 -9.930 -3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.644 -9.255 -3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.856 -10.998 -3.021 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.050 -10.657 -0.886 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.669 -11.766 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -15.981 -10.537 0.531 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.262 -12.060 1.290 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.106 -12.906 1.541 1.00 0.00 C ATOM 1217 C LEU A 79 -11.054 -14.031 0.516 1.00 0.00 C ATOM 1218 O LEU A 79 -11.999 -14.811 0.394 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.174 -13.497 2.953 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.387 -12.743 4.029 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -8.892 -12.892 3.803 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -10.784 -11.275 4.052 1.00 0.00 C ATOM 0 H LEU A 79 -13.159 -12.528 1.418 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.205 -12.299 1.456 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.219 -13.541 3.258 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.809 -14.523 2.915 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.630 -13.178 4.999 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.351 -12.349 4.578 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.621 -13.947 3.843 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.630 -12.487 2.826 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.214 -10.756 4.823 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.574 -10.826 3.081 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.849 -11.189 4.268 1.00 0.00 H new ATOM 1234 N PHE A 80 -9.952 -14.107 -0.220 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.789 -15.128 -1.248 1.00 0.00 C ATOM 1236 C PHE A 80 -8.671 -16.106 -0.890 1.00 0.00 C ATOM 1237 O PHE A 80 -7.690 -15.738 -0.245 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.495 -14.455 -2.590 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.720 -13.898 -3.253 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.126 -12.598 -2.994 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.469 -14.671 -4.129 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.257 -12.078 -3.593 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.602 -14.155 -4.733 1.00 0.00 C ATOM 1244 CZ PHE A 80 -12.996 -12.855 -4.464 1.00 0.00 C ATOM 0 H PHE A 80 -9.158 -13.474 -0.124 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.715 -15.698 -1.319 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.776 -13.651 -2.436 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -9.026 -15.178 -3.257 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -10.551 -11.985 -2.316 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -11.165 -15.685 -4.341 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -12.563 -11.064 -3.380 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -13.178 -14.765 -5.413 1.00 0.00 H new ATOM 0 HZ PHE A 80 -13.879 -12.449 -4.934 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.833 -17.356 -1.320 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.849 -18.403 -1.062 1.00 0.00 C ATOM 1256 C LYS A 81 -7.817 -19.386 -2.228 1.00 0.00 C ATOM 1257 O LYS A 81 -8.783 -20.111 -2.461 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.189 -19.142 0.236 1.00 0.00 C ATOM 1259 CG LYS A 81 -6.968 -19.558 1.044 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.171 -19.309 2.531 1.00 0.00 C ATOM 1261 CE LYS A 81 -5.854 -19.359 3.293 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.299 -20.740 3.352 1.00 0.00 N ATOM 0 H LYS A 81 -9.644 -17.669 -1.853 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.866 -17.943 -0.957 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.820 -18.502 0.853 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.774 -20.030 -0.005 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.762 -20.615 0.876 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.095 -19.004 0.697 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.640 -18.336 2.677 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.855 -20.056 2.935 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.132 -18.698 2.814 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.006 -18.985 4.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.402 -20.732 3.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.977 -21.366 3.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.130 -21.088 2.387 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.713 -19.399 -2.970 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.586 -20.289 -4.121 1.00 0.00 C ATOM 1278 C ASN A 82 -7.668 -19.978 -5.154 1.00 0.00 C ATOM 1279 O ASN A 82 -8.310 -20.882 -5.688 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.682 -21.754 -3.685 1.00 0.00 C ATOM 1281 CG ASN A 82 -5.920 -22.043 -2.403 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -4.614 -21.801 -2.420 1.00 0.00 O flip ATOM 1283 ND2 ASN A 82 -6.501 -22.470 -1.406 1.00 0.00 N flip ATOM 0 H ASN A 82 -5.899 -18.809 -2.797 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.608 -20.125 -4.573 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.730 -22.018 -3.545 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.297 -22.390 -4.482 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -7.506 -22.642 -1.436 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -5.978 -22.652 -0.549 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.839 -18.690 -5.448 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.821 -18.272 -6.432 1.00 0.00 C ATOM 1292 C GLY A 83 -10.258 -18.448 -5.972 1.00 0.00 C ATOM 1293 O GLY A 83 -11.189 -18.223 -6.747 1.00 0.00 O ATOM 0 H GLY A 83 -7.313 -17.928 -5.020 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.653 -17.223 -6.677 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.670 -18.842 -7.349 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.450 -18.860 -4.721 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.793 -19.070 -4.196 1.00 0.00 C ATOM 1299 C GLU A 84 -12.026 -18.275 -2.912 1.00 0.00 C ATOM 1300 O GLU A 84 -11.156 -18.198 -2.045 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.032 -20.562 -3.942 1.00 0.00 C ATOM 1302 CG GLU A 84 -13.469 -20.998 -4.177 1.00 0.00 C ATOM 1303 CD GLU A 84 -14.251 -21.151 -2.888 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -13.781 -21.884 -1.992 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -15.334 -20.540 -2.772 1.00 0.00 O ATOM 0 H GLU A 84 -9.699 -19.053 -4.059 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.502 -18.712 -4.943 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.375 -21.142 -4.590 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.754 -20.796 -2.914 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.967 -20.267 -4.815 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.474 -21.946 -4.715 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.220 -17.705 -2.801 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.600 -16.919 -1.627 1.00 0.00 C ATOM 1314 C VAL A 85 -13.721 -17.812 -0.390 1.00 0.00 C ATOM 1315 O VAL A 85 -14.575 -18.699 -0.346 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.943 -16.199 -1.853 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -15.251 -15.264 -0.693 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -14.926 -15.436 -3.169 1.00 0.00 C ATOM 0 H VAL A 85 -13.948 -17.772 -3.513 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.816 -16.178 -1.467 1.00 0.00 H new ATOM 0 HB VAL A 85 -15.731 -16.950 -1.904 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.203 -14.765 -0.871 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.310 -15.838 0.232 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -14.461 -14.518 -0.607 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.883 -14.934 -3.311 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -14.127 -14.695 -3.150 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.756 -16.132 -3.991 1.00 0.00 H new ATOM 1328 N ALA A 86 -12.874 -17.590 0.615 1.00 0.00 N ATOM 1329 CA ALA A 86 -12.922 -18.399 1.831 1.00 0.00 C ATOM 1330 C ALA A 86 -13.392 -17.594 3.040 1.00 0.00 C ATOM 1331 O ALA A 86 -13.304 -18.057 4.178 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.568 -19.038 2.110 1.00 0.00 C ATOM 0 H ALA A 86 -12.155 -16.866 0.612 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.654 -19.188 1.660 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.628 -19.635 3.020 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.289 -19.678 1.273 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -10.817 -18.258 2.237 1.00 0.00 H new ATOM 1338 N ALA A 87 -13.894 -16.395 2.787 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.385 -15.529 3.854 1.00 0.00 C ATOM 1340 C ALA A 87 -15.041 -14.269 3.293 1.00 0.00 C ATOM 1341 O ALA A 87 -14.567 -13.698 2.311 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.250 -15.166 4.801 1.00 0.00 C ATOM 0 H ALA A 87 -13.973 -15.997 1.851 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.146 -16.077 4.409 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.629 -14.520 5.593 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -12.838 -16.075 5.240 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.469 -14.643 4.249 1.00 0.00 H new ATOM 1348 N THR A 88 -16.121 -13.827 3.931 1.00 0.00 N ATOM 1349 CA THR A 88 -16.821 -12.623 3.493 1.00 0.00 C ATOM 1350 C THR A 88 -17.215 -11.753 4.684 1.00 0.00 C ATOM 1351 O THR A 88 -17.853 -12.225 5.625 1.00 0.00 O ATOM 1352 CB THR A 88 -18.065 -12.988 2.679 1.00 0.00 C ATOM 1353 OG1 THR A 88 -18.919 -11.866 2.541 1.00 0.00 O ATOM 1354 CG2 THR A 88 -18.879 -14.110 3.288 1.00 0.00 C ATOM 0 H THR A 88 -16.529 -14.281 4.748 1.00 0.00 H new ATOM 0 HA THR A 88 -16.139 -12.054 2.861 1.00 0.00 H new ATOM 0 HB THR A 88 -17.687 -13.322 1.713 1.00 0.00 H new ATOM 0 HG1 THR A 88 -19.708 -12.118 2.017 1.00 0.00 H new ATOM 0 HG21 THR A 88 -19.745 -14.315 2.658 1.00 0.00 H new ATOM 0 HG22 THR A 88 -18.264 -15.007 3.362 1.00 0.00 H new ATOM 0 HG23 THR A 88 -19.215 -13.817 4.283 1.00 0.00 H new ATOM 1362 N LYS A 89 -16.843 -10.475 4.630 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.163 -9.531 5.694 1.00 0.00 C ATOM 1364 C LYS A 89 -17.825 -8.285 5.110 1.00 0.00 C ATOM 1365 O LYS A 89 -17.417 -7.793 4.060 1.00 0.00 O ATOM 1366 CB LYS A 89 -15.892 -9.137 6.453 1.00 0.00 C ATOM 1367 CG LYS A 89 -15.849 -9.648 7.884 1.00 0.00 C ATOM 1368 CD LYS A 89 -16.177 -8.546 8.878 1.00 0.00 C ATOM 1369 CE LYS A 89 -16.540 -9.114 10.241 1.00 0.00 C ATOM 1370 NZ LYS A 89 -17.921 -9.670 10.262 1.00 0.00 N ATOM 0 H LYS A 89 -16.317 -10.070 3.855 1.00 0.00 H new ATOM 0 HA LYS A 89 -17.855 -10.009 6.387 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.025 -9.519 5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -15.808 -8.050 6.462 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -16.558 -10.468 8.000 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -14.859 -10.050 8.098 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -15.322 -7.878 8.977 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -17.006 -7.948 8.499 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -15.830 -9.896 10.509 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.452 -8.332 10.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -18.172 -9.938 11.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -18.590 -8.952 9.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -17.967 -10.509 9.649 1.00 0.00 H new ATOM 1384 N VAL A 90 -18.852 -7.785 5.786 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.570 -6.601 5.321 1.00 0.00 C ATOM 1386 C VAL A 90 -19.539 -5.481 6.357 1.00 0.00 C ATOM 1387 O VAL A 90 -19.560 -5.738 7.562 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.034 -6.926 4.975 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.684 -5.749 4.268 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.112 -8.181 4.119 1.00 0.00 C ATOM 0 H VAL A 90 -19.207 -8.179 6.657 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.057 -6.265 4.420 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.578 -7.112 5.901 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -22.719 -5.994 4.030 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.659 -4.875 4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.141 -5.533 3.348 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.154 -8.397 3.883 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.556 -8.026 3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -20.682 -9.021 4.665 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.497 -4.238 5.882 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.465 -3.104 6.782 1.00 0.00 C ATOM 1402 C GLY A 91 -18.084 -2.832 7.335 1.00 0.00 C ATOM 1403 O GLY A 91 -17.208 -3.696 7.299 1.00 0.00 O ATOM 0 H GLY A 91 -19.485 -3.999 4.890 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -19.821 -2.218 6.256 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.153 -3.282 7.608 1.00 0.00 H new ATOM 1407 N ALA A 92 -17.891 -1.615 7.835 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.606 -1.202 8.385 1.00 0.00 C ATOM 1409 C ALA A 92 -16.271 -1.967 9.659 1.00 0.00 C ATOM 1410 O ALA A 92 -17.136 -2.600 10.265 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.609 0.295 8.656 1.00 0.00 C ATOM 0 H ALA A 92 -18.613 -0.895 7.870 1.00 0.00 H new ATOM 0 HA ALA A 92 -15.837 -1.432 7.647 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.644 0.592 9.067 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.788 0.833 7.725 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.397 0.534 9.371 1.00 0.00 H new ATOM 1417 N LEU A 93 -15.004 -1.906 10.056 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.542 -2.598 11.250 1.00 0.00 C ATOM 1419 C LEU A 93 -13.238 -1.997 11.761 1.00 0.00 C ATOM 1420 O LEU A 93 -12.445 -1.460 10.988 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.351 -4.086 10.950 1.00 0.00 C ATOM 1422 CG LEU A 93 -13.776 -4.399 9.565 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -13.087 -5.753 9.564 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -14.873 -4.360 8.511 1.00 0.00 C ATOM 0 H LEU A 93 -14.279 -1.383 9.566 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.298 -2.481 12.027 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.691 -4.512 11.706 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.314 -4.588 11.049 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.035 -3.637 9.322 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.686 -5.956 8.571 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.274 -5.748 10.290 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.806 -6.527 9.830 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.446 -4.585 7.533 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.636 -5.100 8.753 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.323 -3.368 8.491 1.00 0.00 H new ATOM 1436 N SER A 94 -13.020 -2.088 13.070 1.00 0.00 N ATOM 1437 CA SER A 94 -11.808 -1.551 13.681 1.00 0.00 C ATOM 1438 C SER A 94 -10.576 -2.325 13.223 1.00 0.00 C ATOM 1439 O SER A 94 -10.681 -3.279 12.453 1.00 0.00 O ATOM 1440 CB SER A 94 -11.916 -1.600 15.207 1.00 0.00 C ATOM 1441 OG SER A 94 -11.178 -0.547 15.805 1.00 0.00 O ATOM 0 H SER A 94 -13.665 -2.527 13.727 1.00 0.00 H new ATOM 0 HA SER A 94 -11.701 -0.514 13.363 1.00 0.00 H new ATOM 0 HB2 SER A 94 -12.963 -1.529 15.503 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.547 -2.559 15.570 1.00 0.00 H new ATOM 0 HG SER A 94 -11.265 -0.599 16.780 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.411 -1.904 13.703 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.153 -2.554 13.345 1.00 0.00 C ATOM 1449 C LYS A 95 -8.043 -3.933 13.991 1.00 0.00 C ATOM 1450 O LYS A 95 -7.408 -4.835 13.443 1.00 0.00 O ATOM 1451 CB LYS A 95 -6.965 -1.686 13.770 1.00 0.00 C ATOM 1452 CG LYS A 95 -5.616 -2.257 13.360 1.00 0.00 C ATOM 1453 CD LYS A 95 -4.652 -1.167 12.917 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.345 -1.754 12.410 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.264 -0.730 12.326 1.00 0.00 N ATOM 0 H LYS A 95 -9.310 -1.115 14.342 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.137 -2.678 12.262 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.077 -0.693 13.335 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.984 -1.563 14.853 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.184 -2.806 14.197 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.755 -2.971 12.548 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.113 -0.569 12.131 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.451 -0.496 13.752 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -3.029 -2.560 13.072 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.504 -2.194 11.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.391 -1.174 11.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.553 0.027 11.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.093 -0.328 13.270 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.651 -4.083 15.163 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.603 -5.350 15.863 1.00 0.00 C ATOM 1471 C GLY A 96 -9.561 -6.379 15.293 1.00 0.00 C ATOM 1472 O GLY A 96 -9.284 -7.579 15.332 1.00 0.00 O ATOM 0 H GLY A 96 -9.176 -3.349 15.639 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.588 -5.744 15.820 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.838 -5.187 16.915 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.683 -5.916 14.754 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.671 -6.815 14.172 1.00 0.00 C ATOM 1478 C GLN A 97 -11.219 -7.291 12.796 1.00 0.00 C ATOM 1479 O GLN A 97 -11.514 -8.413 12.387 1.00 0.00 O ATOM 1480 CB GLN A 97 -13.029 -6.120 14.071 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.560 -5.630 15.407 1.00 0.00 C ATOM 1482 CD GLN A 97 -14.834 -4.822 15.272 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -14.797 -3.610 15.063 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -15.972 -5.495 15.385 1.00 0.00 N ATOM 0 H GLN A 97 -10.930 -4.927 14.708 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.770 -7.684 14.823 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -12.945 -5.273 13.390 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.750 -6.811 13.634 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -13.745 -6.486 16.055 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.799 -5.021 15.894 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -15.955 -6.500 15.558 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -16.864 -5.007 15.298 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.499 -6.429 12.089 1.00 0.00 N ATOM 1494 CA LEU A 98 -9.999 -6.769 10.764 1.00 0.00 C ATOM 1495 C LEU A 98 -8.884 -7.804 10.868 1.00 0.00 C ATOM 1496 O LEU A 98 -8.915 -8.838 10.199 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.497 -5.518 10.041 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.829 -5.464 8.549 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -9.297 -4.186 7.925 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -9.263 -6.684 7.837 1.00 0.00 C ATOM 0 H LEU A 98 -10.249 -5.493 12.410 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.819 -7.195 10.186 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.923 -4.640 10.526 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.415 -5.455 10.161 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.913 -5.469 8.437 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.545 -4.169 6.864 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.750 -3.325 8.417 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.214 -4.145 8.046 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.507 -6.632 6.776 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.180 -6.707 7.960 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.696 -7.588 8.265 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.895 -7.513 11.706 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.760 -8.409 11.899 1.00 0.00 C ATOM 1514 C LYS A 99 -7.208 -9.766 12.435 1.00 0.00 C ATOM 1515 O LYS A 99 -6.674 -10.803 12.042 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.750 -7.785 12.861 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.328 -8.284 12.660 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.439 -7.913 13.834 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.479 -8.977 14.918 1.00 0.00 C ATOM 1520 NZ LYS A 99 -2.710 -8.569 16.124 1.00 0.00 N ATOM 0 H LYS A 99 -7.856 -6.660 12.265 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.290 -8.562 10.928 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.766 -6.702 12.739 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.058 -7.995 13.885 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.335 -9.367 12.535 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.918 -7.860 11.743 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.414 -7.782 13.489 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.761 -6.957 14.248 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.514 -9.173 15.197 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -3.073 -9.910 14.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.762 -9.322 16.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.716 -8.407 15.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.113 -7.693 16.513 1.00 0.00 H new ATOM 1534 N GLU A 100 -8.193 -9.757 13.329 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.701 -10.999 13.899 1.00 0.00 C ATOM 1536 C GLU A 100 -9.291 -11.882 12.802 1.00 0.00 C ATOM 1537 O GLU A 100 -9.109 -13.100 12.805 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.724 -10.712 15.012 1.00 0.00 C ATOM 1539 CG GLU A 100 -11.158 -10.530 14.537 1.00 0.00 C ATOM 1540 CD GLU A 100 -12.005 -11.767 14.759 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.911 -12.364 15.854 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -12.767 -12.137 13.842 1.00 0.00 O ATOM 0 H GLU A 100 -8.651 -8.912 13.671 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.872 -11.541 14.354 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.696 -11.532 15.730 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.416 -9.812 15.544 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.607 -9.687 15.062 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.157 -10.280 13.476 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.963 -11.252 11.842 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.552 -11.966 10.714 1.00 0.00 C ATOM 1551 C PHE A 101 -9.460 -12.667 9.909 1.00 0.00 C ATOM 1552 O PHE A 101 -9.614 -13.813 9.485 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.318 -10.980 9.825 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.257 -11.626 8.846 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.064 -12.689 9.226 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.335 -11.165 7.542 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.928 -13.275 8.321 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.196 -11.748 6.634 1.00 0.00 C ATOM 1559 CZ PHE A 101 -13.994 -12.806 7.023 1.00 0.00 C ATOM 0 H PHE A 101 -10.113 -10.243 11.824 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.245 -12.720 11.088 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -11.886 -10.302 10.462 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.600 -10.373 9.274 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.016 -13.062 10.239 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.714 -10.338 7.231 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.553 -14.101 8.629 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.246 -11.377 5.621 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.668 -13.265 6.315 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.346 -11.964 9.719 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.218 -12.508 8.976 1.00 0.00 C ATOM 1571 C LEU A 102 -6.602 -13.667 9.745 1.00 0.00 C ATOM 1572 O LEU A 102 -6.517 -14.782 9.238 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.169 -11.421 8.723 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.212 -10.794 7.327 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -5.083 -9.788 7.154 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -6.136 -11.873 6.257 1.00 0.00 C ATOM 0 H LEU A 102 -8.203 -11.017 10.070 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.575 -12.872 8.013 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.299 -10.632 9.464 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.179 -11.848 8.883 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.159 -10.265 7.217 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.132 -9.354 6.155 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.183 -8.998 7.898 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.125 -10.291 7.285 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.168 -11.410 5.271 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.205 -12.429 6.367 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.981 -12.553 6.366 1.00 0.00 H new ATOM 1588 N ASP A 103 -6.192 -13.401 10.980 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.602 -14.438 11.819 1.00 0.00 C ATOM 1590 C ASP A 103 -6.501 -15.671 11.843 1.00 0.00 C ATOM 1591 O ASP A 103 -6.022 -16.804 11.885 1.00 0.00 O ATOM 1592 CB ASP A 103 -5.388 -13.919 13.242 1.00 0.00 C ATOM 1593 CG ASP A 103 -4.120 -14.465 13.869 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -4.041 -15.695 14.074 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -3.204 -13.664 14.154 1.00 0.00 O ATOM 0 H ASP A 103 -6.256 -12.483 11.420 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.634 -14.713 11.399 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.343 -12.830 13.226 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -6.243 -14.194 13.859 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.810 -15.436 11.814 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.783 -16.519 11.828 1.00 0.00 C ATOM 1602 C ALA A 104 -8.770 -17.307 10.520 1.00 0.00 C ATOM 1603 O ALA A 104 -9.190 -18.463 10.484 1.00 0.00 O ATOM 1604 CB ALA A 104 -10.175 -15.974 12.110 1.00 0.00 C ATOM 0 H ALA A 104 -8.220 -14.503 11.781 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.504 -17.206 12.626 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.892 -16.795 12.118 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -10.182 -15.477 13.080 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -10.450 -15.259 11.335 1.00 0.00 H new ATOM 1610 N ASN A 105 -8.289 -16.682 9.443 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.233 -17.349 8.143 1.00 0.00 C ATOM 1612 C ASN A 105 -6.794 -17.729 7.786 1.00 0.00 C ATOM 1613 O ASN A 105 -6.501 -18.894 7.520 1.00 0.00 O ATOM 1614 CB ASN A 105 -8.829 -16.449 7.054 1.00 0.00 C ATOM 1615 CG ASN A 105 -9.792 -17.196 6.146 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.250 -18.291 6.476 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.107 -16.606 4.998 1.00 0.00 N ATOM 0 H ASN A 105 -7.936 -15.725 9.445 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.823 -18.263 8.206 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.350 -15.614 7.522 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.023 -16.027 6.454 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -10.751 -17.061 4.351 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.705 -15.698 4.764 1.00 0.00 H new ATOM 1624 N LEU A 106 -5.899 -16.743 7.790 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.488 -16.978 7.478 1.00 0.00 C ATOM 1626 C LEU A 106 -3.929 -18.118 8.320 1.00 0.00 C ATOM 1627 O LEU A 106 -3.475 -17.913 9.444 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.674 -15.718 7.738 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.219 -15.760 7.259 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -2.141 -16.198 5.804 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -1.560 -14.401 7.444 1.00 0.00 C ATOM 0 H LEU A 106 -6.125 -15.772 8.006 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.418 -17.248 6.424 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.173 -14.878 7.254 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.680 -15.518 8.809 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.681 -16.491 7.863 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.099 -16.220 5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.574 -17.193 5.700 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.695 -15.495 5.182 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.527 -14.448 7.099 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.102 -13.652 6.866 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -1.578 -14.128 8.499 1.00 0.00 H new ATOM 1643 N VAL A 107 -3.972 -19.316 7.765 1.00 0.00 N ATOM 1644 CA VAL A 107 -3.482 -20.500 8.459 1.00 0.00 C ATOM 1645 C VAL A 107 -3.674 -21.753 7.609 1.00 0.00 C ATOM 1646 O VAL A 107 -2.964 -22.750 7.858 1.00 0.00 O ATOM 1647 CB VAL A 107 -4.205 -20.682 9.810 1.00 0.00 C ATOM 1648 CG1 VAL A 107 -5.710 -20.695 9.605 1.00 0.00 C ATOM 1649 CG2 VAL A 107 -3.741 -21.949 10.515 1.00 0.00 C ATOM 0 H VAL A 107 -4.342 -19.498 6.832 1.00 0.00 H new ATOM 0 HA VAL A 107 -2.417 -20.355 8.639 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.951 -19.837 10.450 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -6.207 -20.824 10.566 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -6.024 -19.752 9.158 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -5.980 -21.518 8.944 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.267 -22.051 11.464 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.954 -22.814 9.887 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -2.668 -21.891 10.700 1.00 0.00 H new TER 1659 VAL A 107