USER MOD reduce.3.24.130724 H: found=0, std=0, add=838, rem=0, adj=16 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 Set 1.1: A 28 SER OG : rot 149:sc= 0 USER MOD Set 1.2: A 39 LYS NZ :NH3+ 158:sc= 0.165 (180deg=-0.11) 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+ -147:sc= -0.368 (180deg=-2.61!) USER MOD Single : A 4 GLN : amide:sc= -0.416 X(o=-0.42,f=-0.034) USER MOD Single : A 7 SER OG : rot 33:sc= 0.412 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 :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00333 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 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 -110:sc= -0.899 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -1.14 X(o=-1.1,f=-1.3!) USER MOD Single : A 63 GLN : amide:sc= -0.757 K(o=-0.76,f=-1.4) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot -63:sc= 0.53 USER MOD Single : A 76 THR OG1 : rot -85:sc= -1.53 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN :FLIP amide:sc= -0.449 F(o=-1.7,f=-0.45) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= 0.148 K(o=0.15,f=-2.9!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.187 K(o=-0.19,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.776 -6.445 -1.540 1.00 0.00 N ATOM 2 CA MET A 1 2.574 -5.303 -2.468 1.00 0.00 C ATOM 3 C MET A 1 1.116 -5.200 -2.905 1.00 0.00 C ATOM 4 O MET A 1 0.627 -6.029 -3.674 1.00 0.00 O ATOM 5 CB MET A 1 3.483 -5.499 -3.685 1.00 0.00 C ATOM 6 CG MET A 1 3.563 -4.283 -4.594 1.00 0.00 C ATOM 7 SD MET A 1 3.941 -4.719 -6.303 1.00 0.00 S ATOM 8 CE MET A 1 5.712 -4.968 -6.204 1.00 0.00 C ATOM 0 H1 MET A 1 3.776 -6.491 -1.259 1.00 0.00 H new ATOM 0 H2 MET A 1 2.185 -6.314 -0.695 1.00 0.00 H new ATOM 0 H3 MET A 1 2.509 -7.330 -2.016 1.00 0.00 H new ATOM 0 HA MET A 1 2.827 -4.374 -1.957 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.486 -5.750 -3.341 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.122 -6.350 -4.263 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.615 -3.746 -4.561 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.328 -3.603 -4.219 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.096 -5.244 -7.186 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.191 -4.047 -5.873 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.928 -5.765 -5.493 1.00 0.00 H new ATOM 20 N VAL A 2 0.427 -4.178 -2.409 1.00 0.00 N ATOM 21 CA VAL A 2 -0.974 -3.961 -2.748 1.00 0.00 C ATOM 22 C VAL A 2 -1.112 -3.512 -4.196 1.00 0.00 C ATOM 23 O VAL A 2 -0.249 -2.809 -4.721 1.00 0.00 O ATOM 24 CB VAL A 2 -1.610 -2.904 -1.818 1.00 0.00 C ATOM 25 CG1 VAL A 2 -3.090 -2.711 -2.129 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.415 -3.298 -0.360 1.00 0.00 C ATOM 0 H VAL A 2 0.817 -3.486 -1.770 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.497 -4.908 -2.615 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.108 -1.953 -1.994 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.508 -1.961 -1.457 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.205 -2.379 -3.161 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.617 -3.655 -1.991 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.868 -2.544 0.284 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.888 -4.263 -0.178 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.349 -3.369 -0.142 1.00 0.00 H new ATOM 36 N LYS A 3 -2.194 -3.929 -4.848 1.00 0.00 N ATOM 37 CA LYS A 3 -2.418 -3.568 -6.235 1.00 0.00 C ATOM 38 C LYS A 3 -3.896 -3.329 -6.487 1.00 0.00 C ATOM 39 O LYS A 3 -4.727 -4.209 -6.279 1.00 0.00 O ATOM 40 CB LYS A 3 -1.894 -4.670 -7.166 1.00 0.00 C ATOM 41 CG LYS A 3 -2.295 -6.080 -6.745 1.00 0.00 C ATOM 42 CD LYS A 3 -1.101 -7.025 -6.734 1.00 0.00 C ATOM 43 CE LYS A 3 -1.450 -8.359 -6.091 1.00 0.00 C ATOM 44 NZ LYS A 3 -1.665 -9.427 -7.107 1.00 0.00 N ATOM 0 H LYS A 3 -2.922 -4.513 -4.437 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.874 -2.647 -6.444 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.262 -4.485 -8.175 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.806 -4.610 -7.208 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -2.744 -6.050 -5.752 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.055 -6.461 -7.427 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.758 -7.191 -7.755 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.276 -6.564 -6.192 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -0.648 -8.657 -5.415 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -2.350 -8.246 -5.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -2.389 -10.090 -6.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.982 -8.998 -8.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.774 -9.939 -7.266 1.00 0.00 H new ATOM 58 N GLN A 4 -4.218 -2.118 -6.925 1.00 0.00 N ATOM 59 CA GLN A 4 -5.598 -1.755 -7.197 1.00 0.00 C ATOM 60 C GLN A 4 -6.066 -2.406 -8.497 1.00 0.00 C ATOM 61 O GLN A 4 -5.400 -2.309 -9.527 1.00 0.00 O ATOM 62 CB GLN A 4 -5.737 -0.231 -7.273 1.00 0.00 C ATOM 63 CG GLN A 4 -7.149 0.242 -7.586 1.00 0.00 C ATOM 64 CD GLN A 4 -7.693 1.199 -6.542 1.00 0.00 C ATOM 65 OE1 GLN A 4 -7.260 2.348 -6.452 1.00 0.00 O ATOM 66 NE2 GLN A 4 -8.645 0.729 -5.747 1.00 0.00 N ATOM 0 H GLN A 4 -3.542 -1.374 -7.098 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.228 -2.118 -6.384 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.421 0.201 -6.323 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.059 0.149 -8.037 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.156 0.732 -8.560 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.809 -0.622 -7.659 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -8.974 -0.230 -5.857 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -9.048 1.327 -5.026 1.00 0.00 H new ATOM 75 N ILE A 5 -7.211 -3.075 -8.438 1.00 0.00 N ATOM 76 CA ILE A 5 -7.771 -3.752 -9.603 1.00 0.00 C ATOM 77 C ILE A 5 -8.902 -2.918 -10.211 1.00 0.00 C ATOM 78 O ILE A 5 -9.987 -2.812 -9.638 1.00 0.00 O ATOM 79 CB ILE A 5 -8.258 -5.175 -9.217 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.139 -6.204 -9.432 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.494 -5.582 -10.006 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.757 -5.721 -9.036 1.00 0.00 C ATOM 0 H ILE A 5 -7.773 -3.164 -7.591 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.993 -3.859 -10.359 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.526 -5.150 -8.161 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.374 -7.102 -8.861 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.123 -6.490 -10.484 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.803 -6.584 -9.707 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.302 -4.878 -9.806 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.264 -5.576 -11.071 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.029 -6.511 -9.221 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.496 -4.842 -9.625 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.751 -5.463 -7.977 1.00 0.00 H new ATOM 94 N GLU A 6 -8.629 -2.323 -11.372 1.00 0.00 N ATOM 95 CA GLU A 6 -9.609 -1.487 -12.064 1.00 0.00 C ATOM 96 C GLU A 6 -10.326 -2.243 -13.177 1.00 0.00 C ATOM 97 O GLU A 6 -10.884 -1.632 -14.089 1.00 0.00 O ATOM 98 CB GLU A 6 -8.932 -0.237 -12.640 1.00 0.00 C ATOM 99 CG GLU A 6 -8.876 0.935 -11.672 1.00 0.00 C ATOM 100 CD GLU A 6 -8.011 2.071 -12.183 1.00 0.00 C ATOM 101 OE1 GLU A 6 -7.008 1.790 -12.872 1.00 0.00 O ATOM 102 OE2 GLU A 6 -8.338 3.242 -11.896 1.00 0.00 O ATOM 0 H GLU A 6 -7.734 -2.405 -11.854 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.356 -1.193 -11.327 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.917 -0.493 -12.944 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.466 0.072 -13.539 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -9.886 1.304 -11.494 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.489 0.591 -10.713 1.00 0.00 H new ATOM 109 N SER A 7 -10.305 -3.566 -13.113 1.00 0.00 N ATOM 110 CA SER A 7 -10.952 -4.380 -14.135 1.00 0.00 C ATOM 111 C SER A 7 -11.337 -5.753 -13.592 1.00 0.00 C ATOM 112 O SER A 7 -10.793 -6.209 -12.583 1.00 0.00 O ATOM 113 CB SER A 7 -10.021 -4.539 -15.335 1.00 0.00 C ATOM 114 OG SER A 7 -10.211 -3.493 -16.271 1.00 0.00 O ATOM 0 H SER A 7 -9.851 -4.097 -12.370 1.00 0.00 H new ATOM 0 HA SER A 7 -11.865 -3.872 -14.444 1.00 0.00 H new ATOM 0 HB2 SER A 7 -8.985 -4.545 -14.997 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.204 -5.500 -15.816 1.00 0.00 H new ATOM 0 HG SER A 7 -10.451 -2.670 -15.797 1.00 0.00 H new ATOM 120 N LYS A 8 -12.267 -6.417 -14.273 1.00 0.00 N ATOM 121 CA LYS A 8 -12.712 -7.744 -13.861 1.00 0.00 C ATOM 122 C LYS A 8 -11.640 -8.787 -14.160 1.00 0.00 C ATOM 123 O LYS A 8 -11.560 -9.818 -13.493 1.00 0.00 O ATOM 124 CB LYS A 8 -14.018 -8.115 -14.570 1.00 0.00 C ATOM 125 CG LYS A 8 -14.576 -9.466 -14.150 1.00 0.00 C ATOM 126 CD LYS A 8 -15.109 -10.253 -15.340 1.00 0.00 C ATOM 127 CE LYS A 8 -14.060 -11.202 -15.898 1.00 0.00 C ATOM 128 NZ LYS A 8 -14.635 -12.538 -16.220 1.00 0.00 N ATOM 0 H LYS A 8 -12.726 -6.059 -15.111 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.889 -7.725 -12.786 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.763 -7.345 -14.368 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.848 -8.120 -15.647 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.796 -10.043 -13.653 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.376 -9.319 -13.424 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.989 -10.820 -15.037 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -15.428 -9.562 -16.121 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -13.621 -10.770 -16.797 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -13.254 -11.319 -15.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -13.888 -13.156 -16.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -15.032 -12.962 -15.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -15.387 -12.430 -16.930 1.00 0.00 H new ATOM 142 N THR A 9 -10.816 -8.509 -15.166 1.00 0.00 N ATOM 143 CA THR A 9 -9.745 -9.421 -15.551 1.00 0.00 C ATOM 144 C THR A 9 -8.548 -9.275 -14.621 1.00 0.00 C ATOM 145 O THR A 9 -7.815 -10.233 -14.378 1.00 0.00 O ATOM 146 CB THR A 9 -9.314 -9.162 -16.994 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.445 -8.996 -17.831 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.471 -10.278 -17.574 1.00 0.00 C ATOM 0 H THR A 9 -10.870 -7.660 -15.729 1.00 0.00 H new ATOM 0 HA THR A 9 -10.126 -10.439 -15.471 1.00 0.00 H new ATOM 0 HB THR A 9 -8.712 -8.254 -16.960 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.150 -8.829 -18.751 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.198 -10.032 -18.600 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.567 -10.399 -16.977 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.040 -11.208 -17.563 1.00 0.00 H new ATOM 156 N ALA A 10 -8.351 -8.066 -14.106 1.00 0.00 N ATOM 157 CA ALA A 10 -7.239 -7.794 -13.208 1.00 0.00 C ATOM 158 C ALA A 10 -7.400 -8.562 -11.902 1.00 0.00 C ATOM 159 O ALA A 10 -6.432 -9.103 -11.369 1.00 0.00 O ATOM 160 CB ALA A 10 -7.122 -6.299 -12.944 1.00 0.00 C ATOM 0 H ALA A 10 -8.947 -7.261 -14.296 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.320 -8.131 -13.687 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.285 -6.113 -12.271 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.954 -5.775 -13.885 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.043 -5.937 -12.487 1.00 0.00 H new ATOM 166 N PHE A 11 -8.630 -8.633 -11.401 1.00 0.00 N ATOM 167 CA PHE A 11 -8.904 -9.356 -10.160 1.00 0.00 C ATOM 168 C PHE A 11 -8.437 -10.799 -10.294 1.00 0.00 C ATOM 169 O PHE A 11 -7.806 -11.351 -9.393 1.00 0.00 O ATOM 170 CB PHE A 11 -10.403 -9.307 -9.840 1.00 0.00 C ATOM 171 CG PHE A 11 -10.723 -9.566 -8.393 1.00 0.00 C ATOM 172 CD1 PHE A 11 -10.031 -8.903 -7.393 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.713 -10.467 -8.034 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.318 -9.135 -6.062 1.00 0.00 C ATOM 175 CE2 PHE A 11 -12.004 -10.703 -6.703 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.305 -10.036 -5.716 1.00 0.00 C ATOM 0 H PHE A 11 -9.449 -8.202 -11.831 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.361 -8.883 -9.342 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.793 -8.328 -10.119 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.921 -10.044 -10.455 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.258 -8.196 -7.657 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.263 -10.990 -8.802 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.770 -8.612 -5.292 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.777 -11.408 -6.435 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.530 -10.219 -4.676 1.00 0.00 H new ATOM 186 N GLN A 12 -8.732 -11.392 -11.447 1.00 0.00 N ATOM 187 CA GLN A 12 -8.326 -12.760 -11.731 1.00 0.00 C ATOM 188 C GLN A 12 -6.806 -12.841 -11.824 1.00 0.00 C ATOM 189 O GLN A 12 -6.183 -13.735 -11.254 1.00 0.00 O ATOM 190 CB GLN A 12 -8.959 -13.245 -13.039 1.00 0.00 C ATOM 191 CG GLN A 12 -10.474 -13.115 -13.068 1.00 0.00 C ATOM 192 CD GLN A 12 -11.182 -14.431 -12.808 1.00 0.00 C ATOM 193 OE1 GLN A 12 -10.733 -15.154 -11.789 1.00 0.00 O flip ATOM 194 NE2 GLN A 12 -12.123 -14.794 -13.515 1.00 0.00 N flip ATOM 0 H GLN A 12 -9.253 -10.943 -12.200 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.669 -13.403 -10.920 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.538 -12.677 -13.869 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.689 -14.289 -13.198 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.786 -12.386 -12.320 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.782 -12.727 -14.039 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -12.436 -14.207 -14.288 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -12.589 -15.681 -13.327 1.00 0.00 H new ATOM 203 N GLU A 13 -6.223 -11.893 -12.555 1.00 0.00 N ATOM 204 CA GLU A 13 -4.778 -11.839 -12.746 1.00 0.00 C ATOM 205 C GLU A 13 -4.046 -11.674 -11.418 1.00 0.00 C ATOM 206 O GLU A 13 -3.051 -12.352 -11.161 1.00 0.00 O ATOM 207 CB GLU A 13 -4.416 -10.688 -13.687 1.00 0.00 C ATOM 208 CG GLU A 13 -4.555 -11.040 -15.159 1.00 0.00 C ATOM 209 CD GLU A 13 -4.686 -9.814 -16.041 1.00 0.00 C ATOM 210 OE1 GLU A 13 -3.644 -9.283 -16.478 1.00 0.00 O ATOM 211 OE2 GLU A 13 -5.831 -9.384 -16.294 1.00 0.00 O ATOM 0 H GLU A 13 -6.735 -11.148 -13.027 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.463 -12.784 -13.190 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -5.054 -9.833 -13.464 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.389 -10.379 -13.491 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.687 -11.619 -15.474 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.429 -11.677 -15.296 1.00 0.00 H new ATOM 218 N ALA A 14 -4.543 -10.774 -10.575 1.00 0.00 N ATOM 219 CA ALA A 14 -3.926 -10.535 -9.276 1.00 0.00 C ATOM 220 C ALA A 14 -4.030 -11.773 -8.399 1.00 0.00 C ATOM 221 O ALA A 14 -3.131 -12.068 -7.611 1.00 0.00 O ATOM 222 CB ALA A 14 -4.579 -9.345 -8.591 1.00 0.00 C ATOM 0 H ALA A 14 -5.366 -10.202 -10.767 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.871 -10.311 -9.432 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.108 -9.179 -7.622 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.457 -8.457 -9.211 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.641 -9.545 -8.448 1.00 0.00 H new ATOM 228 N LEU A 15 -5.132 -12.501 -8.550 1.00 0.00 N ATOM 229 CA LEU A 15 -5.357 -13.717 -7.777 1.00 0.00 C ATOM 230 C LEU A 15 -4.369 -14.806 -8.193 1.00 0.00 C ATOM 231 O LEU A 15 -3.891 -15.586 -7.363 1.00 0.00 O ATOM 232 CB LEU A 15 -6.796 -14.205 -7.967 1.00 0.00 C ATOM 233 CG LEU A 15 -7.838 -13.499 -7.096 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.241 -13.770 -7.613 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.705 -13.947 -5.648 1.00 0.00 C ATOM 0 H LEU A 15 -5.883 -12.270 -9.201 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.199 -13.492 -6.722 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.072 -14.077 -9.014 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.832 -15.274 -7.756 1.00 0.00 H new ATOM 0 HG LEU A 15 -7.660 -12.425 -7.145 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -9.967 -13.259 -6.980 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.329 -13.403 -8.636 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.435 -14.842 -7.595 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.452 -13.437 -5.039 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.859 -15.024 -5.585 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.709 -13.701 -5.281 1.00 0.00 H new ATOM 247 N ASP A 16 -4.052 -14.841 -9.485 1.00 0.00 N ATOM 248 CA ASP A 16 -3.112 -15.823 -10.012 1.00 0.00 C ATOM 249 C ASP A 16 -1.743 -15.648 -9.362 1.00 0.00 C ATOM 250 O ASP A 16 -1.038 -16.622 -9.102 1.00 0.00 O ATOM 251 CB ASP A 16 -2.992 -15.680 -11.532 1.00 0.00 C ATOM 252 CG ASP A 16 -2.823 -17.015 -12.230 1.00 0.00 C ATOM 253 OD1 ASP A 16 -3.805 -17.786 -12.286 1.00 0.00 O ATOM 254 OD2 ASP A 16 -1.709 -17.291 -12.723 1.00 0.00 O ATOM 0 H ASP A 16 -4.432 -14.202 -10.183 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.486 -16.820 -9.780 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.881 -15.182 -11.918 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.141 -15.041 -11.767 1.00 0.00 H new ATOM 259 N ALA A 17 -1.385 -14.399 -9.083 1.00 0.00 N ATOM 260 CA ALA A 17 -0.114 -14.091 -8.442 1.00 0.00 C ATOM 261 C ALA A 17 -0.166 -14.407 -6.948 1.00 0.00 C ATOM 262 O ALA A 17 0.869 -14.612 -6.311 1.00 0.00 O ATOM 263 CB ALA A 17 0.250 -12.631 -8.662 1.00 0.00 C ATOM 0 H ALA A 17 -1.960 -13.583 -9.292 1.00 0.00 H new ATOM 0 HA ALA A 17 0.656 -14.716 -8.895 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.202 -12.416 -8.177 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.335 -12.434 -9.731 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.526 -11.994 -8.236 1.00 0.00 H new ATOM 269 N ALA A 18 -1.377 -14.441 -6.393 1.00 0.00 N ATOM 270 CA ALA A 18 -1.564 -14.729 -4.976 1.00 0.00 C ATOM 271 C ALA A 18 -1.200 -16.172 -4.654 1.00 0.00 C ATOM 272 O ALA A 18 -0.693 -16.455 -3.567 1.00 0.00 O ATOM 273 CB ALA A 18 -2.994 -14.422 -4.550 1.00 0.00 C ATOM 0 H ALA A 18 -2.242 -14.272 -6.906 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.892 -14.084 -4.410 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.113 -14.644 -3.489 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.208 -13.368 -4.727 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.685 -15.035 -5.129 1.00 0.00 H new ATOM 279 N GLY A 19 -1.437 -17.087 -5.593 1.00 0.00 N ATOM 280 CA GLY A 19 -1.101 -18.481 -5.361 1.00 0.00 C ATOM 281 C GLY A 19 -1.769 -19.054 -4.131 1.00 0.00 C ATOM 282 O GLY A 19 -2.992 -19.002 -4.000 1.00 0.00 O ATOM 0 H GLY A 19 -1.853 -16.889 -6.503 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.391 -19.069 -6.232 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -0.020 -18.576 -5.258 1.00 0.00 H new ATOM 286 N ASP A 20 -0.966 -19.606 -3.229 1.00 0.00 N ATOM 287 CA ASP A 20 -1.493 -20.196 -2.008 1.00 0.00 C ATOM 288 C ASP A 20 -1.519 -19.181 -0.875 1.00 0.00 C ATOM 289 O ASP A 20 -1.844 -19.522 0.262 1.00 0.00 O ATOM 290 CB ASP A 20 -0.666 -21.414 -1.595 1.00 0.00 C ATOM 291 CG ASP A 20 -1.261 -22.139 -0.402 1.00 0.00 C ATOM 292 OD1 ASP A 20 -2.324 -22.773 -0.564 1.00 0.00 O ATOM 293 OD2 ASP A 20 -0.664 -22.071 0.694 1.00 0.00 O ATOM 0 H ASP A 20 0.049 -19.657 -3.321 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.515 -20.515 -2.211 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.594 -22.103 -2.436 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.349 -21.096 -1.355 1.00 0.00 H new ATOM 298 N LYS A 21 -1.201 -17.927 -1.186 1.00 0.00 N ATOM 299 CA LYS A 21 -1.219 -16.878 -0.189 1.00 0.00 C ATOM 300 C LYS A 21 -2.650 -16.433 0.047 1.00 0.00 C ATOM 301 O LYS A 21 -3.480 -16.480 -0.859 1.00 0.00 O ATOM 302 CB LYS A 21 -0.374 -15.686 -0.641 1.00 0.00 C ATOM 303 CG LYS A 21 1.083 -16.033 -0.897 1.00 0.00 C ATOM 304 CD LYS A 21 1.708 -15.092 -1.915 1.00 0.00 C ATOM 305 CE LYS A 21 3.227 -15.140 -1.854 1.00 0.00 C ATOM 306 NZ LYS A 21 3.848 -14.848 -3.176 1.00 0.00 N ATOM 0 H LYS A 21 -0.929 -17.620 -2.120 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.796 -17.267 0.737 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.805 -15.271 -1.552 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.425 -14.907 0.119 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.640 -15.981 0.038 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.156 -17.060 -1.256 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.374 -15.363 -2.917 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.367 -14.074 -1.729 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.583 -14.418 -1.119 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.545 -16.125 -1.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.884 -14.891 -3.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.529 -15.551 -3.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.566 -13.897 -3.490 1.00 0.00 H new ATOM 320 N LEU A 22 -2.934 -15.983 1.254 1.00 0.00 N ATOM 321 CA LEU A 22 -4.269 -15.514 1.583 1.00 0.00 C ATOM 322 C LEU A 22 -4.462 -14.115 1.021 1.00 0.00 C ATOM 323 O LEU A 22 -3.582 -13.263 1.149 1.00 0.00 O ATOM 324 CB LEU A 22 -4.474 -15.525 3.101 1.00 0.00 C ATOM 325 CG LEU A 22 -5.760 -14.864 3.609 1.00 0.00 C ATOM 326 CD1 LEU A 22 -6.952 -15.246 2.743 1.00 0.00 C ATOM 327 CD2 LEU A 22 -6.010 -15.252 5.059 1.00 0.00 C ATOM 0 H LEU A 22 -2.263 -15.932 2.021 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.010 -16.179 1.139 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.462 -16.560 3.442 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.624 -15.026 3.566 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.635 -13.783 3.548 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.850 -14.763 3.127 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.775 -14.922 1.717 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.085 -16.328 2.764 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.926 -14.777 5.410 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.111 -16.335 5.134 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.172 -14.923 5.673 1.00 0.00 H new ATOM 339 N VAL A 23 -5.594 -13.885 0.375 1.00 0.00 N ATOM 340 CA VAL A 23 -5.858 -12.586 -0.220 1.00 0.00 C ATOM 341 C VAL A 23 -7.013 -11.873 0.460 1.00 0.00 C ATOM 342 O VAL A 23 -8.175 -12.255 0.321 1.00 0.00 O ATOM 343 CB VAL A 23 -6.147 -12.701 -1.729 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.086 -11.330 -2.386 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.167 -13.658 -2.394 1.00 0.00 C ATOM 0 H VAL A 23 -6.337 -14.573 0.250 1.00 0.00 H new ATOM 0 HA VAL A 23 -4.952 -11.997 -0.076 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.153 -13.102 -1.857 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.292 -11.428 -3.452 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.829 -10.675 -1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.093 -10.903 -2.246 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.389 -13.724 -3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.150 -13.290 -2.258 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.259 -14.646 -1.942 1.00 0.00 H new ATOM 355 N VAL A 24 -6.679 -10.811 1.177 1.00 0.00 N ATOM 356 CA VAL A 24 -7.676 -10.008 1.855 1.00 0.00 C ATOM 357 C VAL A 24 -7.895 -8.747 1.037 1.00 0.00 C ATOM 358 O VAL A 24 -6.992 -7.928 0.882 1.00 0.00 O ATOM 359 CB VAL A 24 -7.248 -9.650 3.293 1.00 0.00 C ATOM 360 CG1 VAL A 24 -5.918 -8.910 3.299 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.328 -8.835 3.989 1.00 0.00 C ATOM 0 H VAL A 24 -5.720 -10.487 1.303 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.600 -10.580 1.939 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.115 -10.579 3.847 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.640 -8.670 4.325 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.149 -9.540 2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.011 -7.989 2.723 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.006 -8.593 5.002 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.503 -7.913 3.434 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.251 -9.414 4.030 1.00 0.00 H new ATOM 371 N VAL A 25 -9.091 -8.615 0.482 1.00 0.00 N ATOM 372 CA VAL A 25 -9.408 -7.474 -0.359 1.00 0.00 C ATOM 373 C VAL A 25 -10.592 -6.685 0.183 1.00 0.00 C ATOM 374 O VAL A 25 -11.318 -7.148 1.064 1.00 0.00 O ATOM 375 CB VAL A 25 -9.690 -7.927 -1.809 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.391 -8.214 -2.539 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.564 -9.162 -1.828 1.00 0.00 C ATOM 0 H VAL A 25 -9.854 -9.282 0.599 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.538 -6.817 -0.355 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.215 -7.117 -2.315 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.609 -8.532 -3.559 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.780 -7.312 -2.563 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.849 -9.005 -2.020 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.748 -9.461 -2.860 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.061 -9.972 -1.300 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.513 -8.944 -1.338 1.00 0.00 H new ATOM 387 N ASP A 26 -10.772 -5.480 -0.341 1.00 0.00 N ATOM 388 CA ASP A 26 -11.854 -4.612 0.099 1.00 0.00 C ATOM 389 C ASP A 26 -12.588 -3.980 -1.077 1.00 0.00 C ATOM 390 O ASP A 26 -11.966 -3.426 -1.982 1.00 0.00 O ATOM 391 CB ASP A 26 -11.301 -3.515 1.008 1.00 0.00 C ATOM 392 CG ASP A 26 -12.395 -2.715 1.689 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.488 -2.579 1.100 1.00 0.00 O ATOM 394 OD2 ASP A 26 -12.158 -2.223 2.813 1.00 0.00 O ATOM 0 H ASP A 26 -10.182 -5.082 -1.072 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.568 -5.226 0.648 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.660 -3.965 1.766 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.676 -2.842 0.421 1.00 0.00 H new ATOM 399 N PHE A 27 -13.918 -4.022 -1.026 1.00 0.00 N ATOM 400 CA PHE A 27 -14.749 -3.412 -2.063 1.00 0.00 C ATOM 401 C PHE A 27 -15.191 -2.028 -1.587 1.00 0.00 C ATOM 402 O PHE A 27 -15.972 -1.914 -0.641 1.00 0.00 O ATOM 403 CB PHE A 27 -15.968 -4.286 -2.366 1.00 0.00 C ATOM 404 CG PHE A 27 -15.706 -5.281 -3.462 1.00 0.00 C ATOM 405 CD1 PHE A 27 -14.965 -6.428 -3.211 1.00 0.00 C ATOM 406 CD2 PHE A 27 -16.175 -5.060 -4.749 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.699 -7.334 -4.223 1.00 0.00 C ATOM 408 CE2 PHE A 27 -15.913 -5.966 -5.764 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.174 -7.103 -5.500 1.00 0.00 C ATOM 0 H PHE A 27 -14.444 -4.472 -0.277 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.171 -3.319 -2.982 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.264 -4.817 -1.461 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.806 -3.649 -2.651 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.592 -6.615 -2.215 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.751 -4.172 -4.962 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -14.120 -8.222 -4.015 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.286 -5.783 -6.761 1.00 0.00 H new ATOM 0 HZ PHE A 27 -14.968 -7.810 -6.290 1.00 0.00 H new ATOM 419 N SER A 28 -14.668 -0.981 -2.213 1.00 0.00 N ATOM 420 CA SER A 28 -14.992 0.384 -1.807 1.00 0.00 C ATOM 421 C SER A 28 -15.613 1.193 -2.944 1.00 0.00 C ATOM 422 O SER A 28 -16.012 0.647 -3.972 1.00 0.00 O ATOM 423 CB SER A 28 -13.726 1.082 -1.306 1.00 0.00 C ATOM 424 OG SER A 28 -12.869 1.415 -2.384 1.00 0.00 O ATOM 0 H SER A 28 -14.022 -1.048 -2.999 1.00 0.00 H new ATOM 0 HA SER A 28 -15.731 0.325 -1.008 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.997 1.985 -0.760 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.201 0.432 -0.607 1.00 0.00 H new ATOM 0 HG SER A 28 -12.371 2.230 -2.166 1.00 0.00 H new ATOM 430 N ALA A 29 -15.681 2.506 -2.741 1.00 0.00 N ATOM 431 CA ALA A 29 -16.237 3.419 -3.728 1.00 0.00 C ATOM 432 C ALA A 29 -15.596 4.796 -3.590 1.00 0.00 C ATOM 433 O ALA A 29 -15.185 5.183 -2.496 1.00 0.00 O ATOM 434 CB ALA A 29 -17.751 3.511 -3.573 1.00 0.00 C ATOM 0 H ALA A 29 -15.353 2.963 -1.890 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.019 3.035 -4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.152 4.198 -4.318 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.192 2.524 -3.714 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -17.993 3.877 -2.575 1.00 0.00 H new ATOM 440 N THR A 30 -15.545 5.552 -4.681 1.00 0.00 N ATOM 441 CA THR A 30 -14.986 6.898 -4.639 1.00 0.00 C ATOM 442 C THR A 30 -15.928 7.814 -3.865 1.00 0.00 C ATOM 443 O THR A 30 -15.499 8.704 -3.132 1.00 0.00 O ATOM 444 CB THR A 30 -14.776 7.439 -6.055 1.00 0.00 C ATOM 445 OG1 THR A 30 -14.366 6.406 -6.932 1.00 0.00 O ATOM 446 CG2 THR A 30 -13.741 8.542 -6.131 1.00 0.00 C ATOM 0 H THR A 30 -15.881 5.259 -5.598 1.00 0.00 H new ATOM 0 HA THR A 30 -14.018 6.863 -4.139 1.00 0.00 H new ATOM 0 HB THR A 30 -15.742 7.849 -6.350 1.00 0.00 H new ATOM 0 HG1 THR A 30 -14.239 6.772 -7.832 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.643 8.879 -7.163 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.053 9.378 -5.505 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.781 8.165 -5.780 1.00 0.00 H new ATOM 454 N TRP A 31 -17.223 7.573 -4.055 1.00 0.00 N ATOM 455 CA TRP A 31 -18.277 8.355 -3.412 1.00 0.00 C ATOM 456 C TRP A 31 -18.635 7.800 -2.028 1.00 0.00 C ATOM 457 O TRP A 31 -19.645 8.191 -1.442 1.00 0.00 O ATOM 458 CB TRP A 31 -19.527 8.321 -4.298 1.00 0.00 C ATOM 459 CG TRP A 31 -20.110 6.943 -4.405 1.00 0.00 C ATOM 460 CD1 TRP A 31 -19.710 5.938 -5.244 1.00 0.00 C ATOM 461 CD2 TRP A 31 -21.187 6.410 -3.628 1.00 0.00 C ATOM 462 NE1 TRP A 31 -20.465 4.812 -5.021 1.00 0.00 N ATOM 463 CE2 TRP A 31 -21.380 5.080 -4.039 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.006 6.926 -2.620 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.351 4.259 -3.480 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -22.973 6.110 -2.065 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.139 4.789 -2.497 1.00 0.00 C ATOM 0 H TRP A 31 -17.572 6.829 -4.660 1.00 0.00 H new ATOM 0 HA TRP A 31 -17.913 9.375 -3.284 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -20.277 9.000 -3.892 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -19.274 8.685 -5.294 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -18.918 6.018 -5.974 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -20.361 3.922 -5.508 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -21.885 7.944 -2.281 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.479 3.239 -3.810 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -23.611 6.498 -1.285 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -23.905 4.176 -2.045 1.00 0.00 H new ATOM 478 N CYS A 32 -17.821 6.879 -1.515 1.00 0.00 N ATOM 479 CA CYS A 32 -18.086 6.283 -0.208 1.00 0.00 C ATOM 480 C CYS A 32 -17.370 7.020 0.917 1.00 0.00 C ATOM 481 O CYS A 32 -16.345 7.668 0.702 1.00 0.00 O ATOM 482 CB CYS A 32 -17.683 4.805 -0.191 1.00 0.00 C ATOM 483 SG CYS A 32 -18.315 3.886 1.252 1.00 0.00 S ATOM 0 H CYS A 32 -16.981 6.532 -1.979 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.159 6.369 -0.037 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -18.047 4.328 -1.101 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -16.595 4.734 -0.207 1.00 0.00 H new ATOM 488 N GLY A 33 -17.916 6.893 2.124 1.00 0.00 N ATOM 489 CA GLY A 33 -17.324 7.528 3.286 1.00 0.00 C ATOM 490 C GLY A 33 -16.598 6.534 4.176 1.00 0.00 C ATOM 491 O GLY A 33 -15.369 6.479 4.169 1.00 0.00 O ATOM 0 H GLY A 33 -18.763 6.358 2.317 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.626 8.299 2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.104 8.027 3.862 1.00 0.00 H new ATOM 495 N PRO A 34 -17.336 5.724 4.958 1.00 0.00 N ATOM 496 CA PRO A 34 -16.737 4.726 5.851 1.00 0.00 C ATOM 497 C PRO A 34 -15.749 3.814 5.126 1.00 0.00 C ATOM 498 O PRO A 34 -14.848 3.247 5.742 1.00 0.00 O ATOM 499 CB PRO A 34 -17.939 3.915 6.362 1.00 0.00 C ATOM 500 CG PRO A 34 -19.087 4.305 5.488 1.00 0.00 C ATOM 501 CD PRO A 34 -18.803 5.708 5.038 1.00 0.00 C ATOM 0 HA PRO A 34 -16.161 5.197 6.647 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -17.745 2.844 6.299 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -18.148 4.140 7.408 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.175 3.632 4.635 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -20.029 4.253 6.034 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -19.265 5.927 4.075 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.179 6.446 5.747 1.00 0.00 H new ATOM 509 N CYS A 35 -15.920 3.675 3.815 1.00 0.00 N ATOM 510 CA CYS A 35 -15.035 2.832 3.020 1.00 0.00 C ATOM 511 C CYS A 35 -13.600 3.337 3.109 1.00 0.00 C ATOM 512 O CYS A 35 -12.656 2.557 3.247 1.00 0.00 O ATOM 513 CB CYS A 35 -15.488 2.814 1.557 1.00 0.00 C ATOM 514 SG CYS A 35 -17.185 2.199 1.304 1.00 0.00 S ATOM 0 H CYS A 35 -16.660 4.133 3.283 1.00 0.00 H new ATOM 0 HA CYS A 35 -15.079 1.818 3.417 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.417 3.824 1.154 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -14.800 2.193 0.984 1.00 0.00 H new ATOM 519 N LYS A 36 -13.450 4.655 3.043 1.00 0.00 N ATOM 520 CA LYS A 36 -12.143 5.295 3.125 1.00 0.00 C ATOM 521 C LYS A 36 -11.546 5.159 4.527 1.00 0.00 C ATOM 522 O LYS A 36 -10.350 5.373 4.726 1.00 0.00 O ATOM 523 CB LYS A 36 -12.263 6.770 2.739 1.00 0.00 C ATOM 524 CG LYS A 36 -12.859 6.980 1.355 1.00 0.00 C ATOM 525 CD LYS A 36 -13.009 8.457 1.023 1.00 0.00 C ATOM 526 CE LYS A 36 -13.913 9.164 2.018 1.00 0.00 C ATOM 527 NZ LYS A 36 -14.647 10.299 1.393 1.00 0.00 N ATOM 0 H LYS A 36 -14.227 5.307 2.932 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.472 4.794 2.427 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.882 7.283 3.476 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.276 7.230 2.776 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -12.223 6.502 0.609 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -13.833 6.495 1.301 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.028 8.932 1.021 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.418 8.565 0.018 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.628 8.451 2.429 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -13.316 9.533 2.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -15.253 10.755 2.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.965 10.992 1.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -15.237 9.944 0.613 1.00 0.00 H new ATOM 541 N MET A 37 -12.390 4.801 5.494 1.00 0.00 N ATOM 542 CA MET A 37 -11.950 4.636 6.876 1.00 0.00 C ATOM 543 C MET A 37 -11.118 3.367 7.050 1.00 0.00 C ATOM 544 O MET A 37 -10.259 3.298 7.927 1.00 0.00 O ATOM 545 CB MET A 37 -13.153 4.606 7.819 1.00 0.00 C ATOM 546 CG MET A 37 -14.035 5.839 7.713 1.00 0.00 C ATOM 547 SD MET A 37 -13.195 7.337 8.259 1.00 0.00 S ATOM 548 CE MET A 37 -14.370 7.966 9.454 1.00 0.00 C ATOM 0 H MET A 37 -13.383 4.620 5.344 1.00 0.00 H new ATOM 0 HA MET A 37 -11.321 5.490 7.126 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.752 3.721 7.604 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.798 4.509 8.845 1.00 0.00 H new ATOM 0 HG2 MET A 37 -14.357 5.963 6.679 1.00 0.00 H new ATOM 0 HG3 MET A 37 -14.934 5.691 8.312 1.00 0.00 H new ATOM 0 HE1 MET A 37 -13.992 8.894 9.882 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.324 8.156 8.961 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.511 7.232 10.247 1.00 0.00 H new ATOM 558 N ILE A 38 -11.374 2.365 6.210 1.00 0.00 N ATOM 559 CA ILE A 38 -10.645 1.102 6.284 1.00 0.00 C ATOM 560 C ILE A 38 -9.328 1.173 5.518 1.00 0.00 C ATOM 561 O ILE A 38 -8.399 0.413 5.792 1.00 0.00 O ATOM 562 CB ILE A 38 -11.470 -0.061 5.700 1.00 0.00 C ATOM 563 CG1 ILE A 38 -12.920 -0.021 6.203 1.00 0.00 C ATOM 564 CG2 ILE A 38 -10.814 -1.392 6.035 1.00 0.00 C ATOM 565 CD1 ILE A 38 -13.097 -0.505 7.627 1.00 0.00 C ATOM 0 H ILE A 38 -12.078 2.404 5.473 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.451 0.924 7.342 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.496 0.049 4.616 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.290 1.002 6.130 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.538 -0.631 5.544 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.407 -2.205 5.617 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.810 -1.420 5.611 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.754 -1.506 7.117 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -14.150 -0.444 7.904 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.761 -1.539 7.704 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.508 0.119 8.299 1.00 0.00 H new ATOM 577 N LYS A 39 -9.258 2.079 4.547 1.00 0.00 N ATOM 578 CA LYS A 39 -8.058 2.234 3.726 1.00 0.00 C ATOM 579 C LYS A 39 -6.791 2.346 4.581 1.00 0.00 C ATOM 580 O LYS A 39 -5.838 1.593 4.386 1.00 0.00 O ATOM 581 CB LYS A 39 -8.191 3.452 2.804 1.00 0.00 C ATOM 582 CG LYS A 39 -8.020 3.108 1.330 1.00 0.00 C ATOM 583 CD LYS A 39 -8.715 4.119 0.429 1.00 0.00 C ATOM 584 CE LYS A 39 -8.939 3.560 -0.969 1.00 0.00 C ATOM 585 NZ LYS A 39 -10.014 2.529 -0.989 1.00 0.00 N ATOM 0 H LYS A 39 -10.017 2.717 4.308 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.963 1.336 3.115 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.170 3.908 2.953 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.446 4.196 3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.958 3.073 1.086 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.424 2.114 1.140 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.673 4.400 0.867 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.114 5.026 0.367 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.202 4.372 -1.647 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.011 3.124 -1.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.395 2.443 -1.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.623 1.613 -0.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -10.776 2.810 -0.339 1.00 0.00 H new ATOM 599 N PRO A 40 -6.760 3.291 5.539 1.00 0.00 N ATOM 600 CA PRO A 40 -5.595 3.493 6.412 1.00 0.00 C ATOM 601 C PRO A 40 -5.113 2.210 7.084 1.00 0.00 C ATOM 602 O PRO A 40 -3.917 1.922 7.104 1.00 0.00 O ATOM 603 CB PRO A 40 -6.110 4.472 7.470 1.00 0.00 C ATOM 604 CG PRO A 40 -7.219 5.209 6.804 1.00 0.00 C ATOM 605 CD PRO A 40 -7.849 4.237 5.842 1.00 0.00 C ATOM 0 HA PRO A 40 -4.736 3.850 5.844 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -6.462 3.945 8.357 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.323 5.152 7.795 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.947 5.561 7.535 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.843 6.088 6.280 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.706 3.732 6.287 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -8.206 4.738 4.942 1.00 0.00 H new ATOM 613 N PHE A 41 -6.043 1.463 7.671 1.00 0.00 N ATOM 614 CA PHE A 41 -5.701 0.240 8.394 1.00 0.00 C ATOM 615 C PHE A 41 -5.479 -0.946 7.464 1.00 0.00 C ATOM 616 O PHE A 41 -4.711 -1.854 7.787 1.00 0.00 O ATOM 617 CB PHE A 41 -6.817 -0.098 9.381 1.00 0.00 C ATOM 618 CG PHE A 41 -7.323 1.098 10.134 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.491 1.787 10.999 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.625 1.541 9.966 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.946 2.897 11.684 1.00 0.00 C ATOM 622 CE2 PHE A 41 -9.087 2.648 10.650 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.247 3.327 11.509 1.00 0.00 C ATOM 0 H PHE A 41 -7.039 1.682 7.661 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.764 0.426 8.919 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.645 -0.556 8.840 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.452 -0.839 10.092 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.474 1.453 11.140 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.286 1.015 9.293 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.286 3.427 12.355 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -10.105 2.982 10.513 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.606 4.194 12.044 1.00 0.00 H new ATOM 633 N PHE A 42 -6.132 -0.942 6.313 1.00 0.00 N ATOM 634 CA PHE A 42 -5.971 -2.029 5.361 1.00 0.00 C ATOM 635 C PHE A 42 -4.546 -2.051 4.825 1.00 0.00 C ATOM 636 O PHE A 42 -3.918 -3.106 4.739 1.00 0.00 O ATOM 637 CB PHE A 42 -6.964 -1.875 4.210 1.00 0.00 C ATOM 638 CG PHE A 42 -7.392 -3.178 3.598 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.247 -4.031 4.278 1.00 0.00 C ATOM 640 CD2 PHE A 42 -6.945 -3.547 2.339 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.649 -5.227 3.714 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.341 -4.744 1.770 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.196 -5.583 2.459 1.00 0.00 C ATOM 0 H PHE A 42 -6.773 -0.206 6.017 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.169 -2.972 5.870 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.846 -1.348 4.572 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.515 -1.252 3.437 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.603 -3.758 5.260 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.280 -2.892 1.796 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.316 -5.882 4.254 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.983 -5.022 0.790 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.510 -6.517 2.016 1.00 0.00 H new ATOM 653 N HIS A 43 -4.049 -0.875 4.457 1.00 0.00 N ATOM 654 CA HIS A 43 -2.703 -0.750 3.913 1.00 0.00 C ATOM 655 C HIS A 43 -1.632 -1.045 4.964 1.00 0.00 C ATOM 656 O HIS A 43 -0.606 -1.648 4.650 1.00 0.00 O ATOM 657 CB HIS A 43 -2.493 0.641 3.308 1.00 0.00 C ATOM 658 CG HIS A 43 -1.994 0.597 1.897 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.771 0.881 0.795 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.766 0.279 1.416 1.00 0.00 C ATOM 661 CE1 HIS A 43 -2.010 0.726 -0.296 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.784 0.362 0.026 1.00 0.00 N ATOM 0 H HIS A 43 -4.559 0.006 4.526 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.601 -1.496 3.125 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.434 1.190 3.337 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.782 1.194 3.922 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.089 0.005 2.016 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -2.355 0.879 -1.308 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -0.009 0.179 -0.611 1.00 0.00 H new ATOM 670 N SER A 44 -1.855 -0.620 6.208 1.00 0.00 N ATOM 671 CA SER A 44 -0.881 -0.860 7.270 1.00 0.00 C ATOM 672 C SER A 44 -0.694 -2.354 7.498 1.00 0.00 C ATOM 673 O SER A 44 0.431 -2.837 7.640 1.00 0.00 O ATOM 674 CB SER A 44 -1.322 -0.184 8.571 1.00 0.00 C ATOM 675 OG SER A 44 -0.205 0.313 9.290 1.00 0.00 O ATOM 0 H SER A 44 -2.691 -0.114 6.502 1.00 0.00 H new ATOM 0 HA SER A 44 0.071 -0.431 6.958 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.007 0.633 8.346 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.868 -0.897 9.188 1.00 0.00 H new ATOM 0 HG SER A 44 -0.512 0.742 10.116 1.00 0.00 H new ATOM 681 N LEU A 45 -1.803 -3.085 7.528 1.00 0.00 N ATOM 682 CA LEU A 45 -1.759 -4.527 7.738 1.00 0.00 C ATOM 683 C LEU A 45 -0.938 -5.191 6.641 1.00 0.00 C ATOM 684 O LEU A 45 -0.134 -6.084 6.906 1.00 0.00 O ATOM 685 CB LEU A 45 -3.176 -5.106 7.748 1.00 0.00 C ATOM 686 CG LEU A 45 -4.001 -4.777 8.992 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.484 -4.749 8.655 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.724 -5.783 10.099 1.00 0.00 C ATOM 0 H LEU A 45 -2.742 -2.703 7.410 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.291 -4.723 8.702 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.708 -4.739 6.870 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.110 -6.190 7.651 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.709 -3.788 9.347 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.057 -4.513 9.552 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.670 -3.990 7.896 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.789 -5.724 8.275 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.320 -5.532 10.976 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.987 -6.784 9.756 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.666 -5.755 10.360 1.00 0.00 H new ATOM 700 N SER A 46 -1.142 -4.742 5.408 1.00 0.00 N ATOM 701 CA SER A 46 -0.418 -5.283 4.265 1.00 0.00 C ATOM 702 C SER A 46 1.092 -5.195 4.473 1.00 0.00 C ATOM 703 O SER A 46 1.849 -5.979 3.900 1.00 0.00 O ATOM 704 CB SER A 46 -0.809 -4.534 2.987 1.00 0.00 C ATOM 705 OG SER A 46 -0.233 -5.140 1.842 1.00 0.00 O ATOM 0 H SER A 46 -1.805 -4.003 5.174 1.00 0.00 H new ATOM 0 HA SER A 46 -0.689 -6.334 4.166 1.00 0.00 H new ATOM 0 HB2 SER A 46 -1.894 -4.521 2.888 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.482 -3.496 3.056 1.00 0.00 H new ATOM 0 HG SER A 46 0.462 -4.554 1.476 1.00 0.00 H new ATOM 711 N GLU A 47 1.532 -4.236 5.287 1.00 0.00 N ATOM 712 CA GLU A 47 2.959 -4.058 5.548 1.00 0.00 C ATOM 713 C GLU A 47 3.424 -4.912 6.725 1.00 0.00 C ATOM 714 O GLU A 47 4.613 -5.196 6.861 1.00 0.00 O ATOM 715 CB GLU A 47 3.275 -2.580 5.803 1.00 0.00 C ATOM 716 CG GLU A 47 3.216 -1.723 4.548 1.00 0.00 C ATOM 717 CD GLU A 47 3.307 -0.238 4.843 1.00 0.00 C ATOM 718 OE1 GLU A 47 3.937 0.129 5.857 1.00 0.00 O ATOM 719 OE2 GLU A 47 2.749 0.559 4.058 1.00 0.00 O ATOM 0 H GLU A 47 0.926 -3.575 5.773 1.00 0.00 H new ATOM 0 HA GLU A 47 3.502 -4.388 4.663 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.570 -2.187 6.536 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.269 -2.500 6.242 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.031 -2.007 3.882 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.285 -1.927 4.018 1.00 0.00 H new ATOM 726 N LYS A 48 2.485 -5.331 7.567 1.00 0.00 N ATOM 727 CA LYS A 48 2.813 -6.167 8.718 1.00 0.00 C ATOM 728 C LYS A 48 2.590 -7.636 8.378 1.00 0.00 C ATOM 729 O LYS A 48 3.140 -8.528 9.024 1.00 0.00 O ATOM 730 CB LYS A 48 1.952 -5.774 9.922 1.00 0.00 C ATOM 731 CG LYS A 48 2.255 -6.568 11.185 1.00 0.00 C ATOM 732 CD LYS A 48 1.345 -6.157 12.335 1.00 0.00 C ATOM 733 CE LYS A 48 0.683 -7.363 12.986 1.00 0.00 C ATOM 734 NZ LYS A 48 1.537 -7.962 14.050 1.00 0.00 N ATOM 0 H LYS A 48 1.494 -5.107 7.475 1.00 0.00 H new ATOM 0 HA LYS A 48 3.862 -6.016 8.971 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.096 -4.714 10.128 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.902 -5.908 9.664 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.132 -7.632 10.985 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.296 -6.416 11.471 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.924 -5.613 13.081 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.578 -5.475 11.967 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.274 -7.064 13.414 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.471 -8.115 12.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.049 -8.780 14.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.440 -8.271 13.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.719 -7.253 14.789 1.00 0.00 H new ATOM 748 N TYR A 49 1.783 -7.872 7.348 1.00 0.00 N ATOM 749 CA TYR A 49 1.476 -9.222 6.895 1.00 0.00 C ATOM 750 C TYR A 49 2.341 -9.599 5.696 1.00 0.00 C ATOM 751 O TYR A 49 1.983 -9.325 4.550 1.00 0.00 O ATOM 752 CB TYR A 49 -0.001 -9.320 6.516 1.00 0.00 C ATOM 753 CG TYR A 49 -0.901 -9.647 7.685 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.355 -8.648 8.536 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.291 -10.956 7.944 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.171 -8.942 9.611 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.108 -11.258 9.019 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.544 -10.248 9.847 1.00 0.00 C ATOM 759 OH TYR A 49 -3.358 -10.543 10.918 1.00 0.00 O ATOM 0 H TYR A 49 1.327 -7.137 6.808 1.00 0.00 H new ATOM 0 HA TYR A 49 1.689 -9.915 7.709 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.319 -8.375 6.076 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.122 -10.085 5.749 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -1.065 -7.624 8.354 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.951 -11.750 7.296 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.515 -8.153 10.263 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.402 -12.280 9.208 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.528 -11.508 10.943 1.00 0.00 H new ATOM 769 N SER A 50 3.479 -10.233 5.967 1.00 0.00 N ATOM 770 CA SER A 50 4.397 -10.652 4.913 1.00 0.00 C ATOM 771 C SER A 50 4.079 -12.074 4.455 1.00 0.00 C ATOM 772 O SER A 50 4.969 -12.917 4.341 1.00 0.00 O ATOM 773 CB SER A 50 5.845 -10.568 5.409 1.00 0.00 C ATOM 774 OG SER A 50 6.049 -11.392 6.544 1.00 0.00 O ATOM 0 H SER A 50 3.787 -10.468 6.910 1.00 0.00 H new ATOM 0 HA SER A 50 4.275 -9.981 4.063 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.523 -10.870 4.611 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.087 -9.535 5.659 1.00 0.00 H new ATOM 0 HG SER A 50 6.981 -11.320 6.837 1.00 0.00 H new ATOM 780 N ASN A 51 2.801 -12.324 4.185 1.00 0.00 N ATOM 781 CA ASN A 51 2.348 -13.633 3.729 1.00 0.00 C ATOM 782 C ASN A 51 1.098 -13.497 2.866 1.00 0.00 C ATOM 783 O ASN A 51 0.943 -14.187 1.859 1.00 0.00 O ATOM 784 CB ASN A 51 2.054 -14.542 4.922 1.00 0.00 C ATOM 785 CG ASN A 51 2.321 -16.002 4.611 1.00 0.00 C ATOM 786 OD1 ASN A 51 3.241 -16.331 3.861 1.00 0.00 O ATOM 787 ND2 ASN A 51 1.513 -16.889 5.182 1.00 0.00 N ATOM 0 H ASN A 51 2.057 -11.632 4.275 1.00 0.00 H new ATOM 0 HA ASN A 51 3.143 -14.078 3.131 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.667 -14.235 5.770 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.013 -14.421 5.221 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.643 -17.885 5.005 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.763 -16.574 5.797 1.00 0.00 H new ATOM 794 N VAL A 52 0.202 -12.607 3.284 1.00 0.00 N ATOM 795 CA VAL A 52 -1.049 -12.376 2.572 1.00 0.00 C ATOM 796 C VAL A 52 -0.938 -11.204 1.613 1.00 0.00 C ATOM 797 O VAL A 52 -0.104 -10.317 1.791 1.00 0.00 O ATOM 798 CB VAL A 52 -2.199 -12.084 3.552 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.294 -13.170 4.606 1.00 0.00 C ATOM 800 CG2 VAL A 52 -2.017 -10.722 4.207 1.00 0.00 C ATOM 0 H VAL A 52 0.322 -12.031 4.118 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.258 -13.287 2.012 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.131 -12.071 2.986 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.113 -12.944 5.288 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.478 -14.130 4.124 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.359 -13.218 5.165 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.841 -10.536 4.896 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.075 -10.705 4.755 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.004 -9.948 3.440 1.00 0.00 H new ATOM 810 N ILE A 53 -1.791 -11.203 0.596 1.00 0.00 N ATOM 811 CA ILE A 53 -1.793 -10.135 -0.385 1.00 0.00 C ATOM 812 C ILE A 53 -3.002 -9.224 -0.195 1.00 0.00 C ATOM 813 O ILE A 53 -4.147 -9.643 -0.359 1.00 0.00 O ATOM 814 CB ILE A 53 -1.746 -10.698 -1.829 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.136 -9.670 -2.777 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.121 -11.131 -2.323 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.372 -9.593 -2.687 1.00 0.00 C ATOM 0 H ILE A 53 -2.487 -11.930 0.433 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.893 -9.540 -0.231 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.116 -11.588 -1.812 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.420 -9.916 -3.800 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.557 -8.689 -2.557 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.037 -11.518 -3.338 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.514 -11.909 -1.669 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.796 -10.276 -2.315 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.740 -8.843 -3.387 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.662 -9.317 -1.673 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.801 -10.563 -2.936 1.00 0.00 H new ATOM 829 N PHE A 54 -2.727 -7.972 0.160 1.00 0.00 N ATOM 830 CA PHE A 54 -3.773 -6.982 0.383 1.00 0.00 C ATOM 831 C PHE A 54 -3.960 -6.156 -0.882 1.00 0.00 C ATOM 832 O PHE A 54 -3.054 -5.425 -1.278 1.00 0.00 O ATOM 833 CB PHE A 54 -3.356 -6.023 1.510 1.00 0.00 C ATOM 834 CG PHE A 54 -3.717 -6.434 2.918 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.207 -7.589 3.503 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.554 -5.626 3.674 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.531 -7.919 4.811 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.883 -5.956 4.975 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.370 -7.104 5.545 1.00 0.00 C ATOM 0 H PHE A 54 -1.781 -7.618 0.300 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.694 -7.500 0.650 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.275 -5.890 1.461 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.807 -5.050 1.313 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.554 -8.234 2.934 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.956 -4.723 3.238 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.126 -8.816 5.256 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.541 -5.317 5.545 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.624 -7.364 6.562 1.00 0.00 H new ATOM 849 N LEU A 55 -5.128 -6.238 -1.514 1.00 0.00 N ATOM 850 CA LEU A 55 -5.358 -5.453 -2.715 1.00 0.00 C ATOM 851 C LEU A 55 -6.642 -4.655 -2.626 1.00 0.00 C ATOM 852 O LEU A 55 -7.455 -4.854 -1.723 1.00 0.00 O ATOM 853 CB LEU A 55 -5.304 -6.313 -3.982 1.00 0.00 C ATOM 854 CG LEU A 55 -6.631 -6.677 -4.651 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.872 -5.786 -5.857 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.615 -8.134 -5.078 1.00 0.00 C ATOM 0 H LEU A 55 -5.909 -6.825 -1.222 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.541 -4.735 -2.788 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.690 -5.791 -4.716 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.787 -7.240 -3.736 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.438 -6.525 -3.935 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.819 -6.055 -6.324 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.907 -4.744 -5.538 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.063 -5.919 -6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.563 -8.384 -5.553 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.801 -8.297 -5.784 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.469 -8.768 -4.203 1.00 0.00 H new ATOM 868 N GLU A 56 -6.789 -3.707 -3.536 1.00 0.00 N ATOM 869 CA GLU A 56 -7.938 -2.824 -3.524 1.00 0.00 C ATOM 870 C GLU A 56 -8.802 -2.933 -4.767 1.00 0.00 C ATOM 871 O GLU A 56 -8.350 -2.661 -5.878 1.00 0.00 O ATOM 872 CB GLU A 56 -7.430 -1.401 -3.421 1.00 0.00 C ATOM 873 CG GLU A 56 -8.289 -0.492 -2.559 1.00 0.00 C ATOM 874 CD GLU A 56 -7.664 -0.222 -1.205 1.00 0.00 C ATOM 875 OE1 GLU A 56 -6.422 -0.106 -1.137 1.00 0.00 O ATOM 876 OE2 GLU A 56 -8.417 -0.128 -0.212 1.00 0.00 O ATOM 0 H GLU A 56 -6.126 -3.531 -4.291 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.561 -3.112 -2.677 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.418 -1.417 -3.016 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.365 -0.977 -4.423 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.448 0.453 -3.078 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.269 -0.948 -2.420 1.00 0.00 H new ATOM 883 N VAL A 57 -10.062 -3.295 -4.574 1.00 0.00 N ATOM 884 CA VAL A 57 -10.988 -3.392 -5.689 1.00 0.00 C ATOM 885 C VAL A 57 -12.098 -2.352 -5.561 1.00 0.00 C ATOM 886 O VAL A 57 -12.874 -2.366 -4.609 1.00 0.00 O ATOM 887 CB VAL A 57 -11.627 -4.789 -5.805 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.108 -5.007 -7.226 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.653 -5.887 -5.393 1.00 0.00 C ATOM 0 H VAL A 57 -10.462 -3.524 -3.664 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.403 -3.208 -6.590 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.476 -4.838 -5.123 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.560 -5.995 -7.309 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.847 -4.247 -7.481 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.263 -4.936 -7.911 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.138 -6.858 -5.488 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.775 -5.856 -6.038 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.348 -5.733 -4.358 1.00 0.00 H new ATOM 899 N ASP A 58 -12.167 -1.446 -6.527 1.00 0.00 N ATOM 900 CA ASP A 58 -13.185 -0.406 -6.529 1.00 0.00 C ATOM 901 C ASP A 58 -14.321 -0.827 -7.452 1.00 0.00 C ATOM 902 O ASP A 58 -14.102 -1.081 -8.636 1.00 0.00 O ATOM 903 CB ASP A 58 -12.579 0.923 -6.985 1.00 0.00 C ATOM 904 CG ASP A 58 -13.611 2.026 -7.113 1.00 0.00 C ATOM 905 OD1 ASP A 58 -14.603 2.002 -6.355 1.00 0.00 O ATOM 906 OD2 ASP A 58 -13.427 2.914 -7.973 1.00 0.00 O ATOM 0 H ASP A 58 -11.528 -1.411 -7.321 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.576 -0.269 -5.521 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.812 1.230 -6.274 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.085 0.781 -7.946 1.00 0.00 H new ATOM 911 N VAL A 59 -15.523 -0.945 -6.899 1.00 0.00 N ATOM 912 CA VAL A 59 -16.671 -1.380 -7.681 1.00 0.00 C ATOM 913 C VAL A 59 -16.983 -0.415 -8.822 1.00 0.00 C ATOM 914 O VAL A 59 -17.680 -0.775 -9.770 1.00 0.00 O ATOM 915 CB VAL A 59 -17.920 -1.566 -6.798 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.357 -0.243 -6.190 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.050 -2.196 -7.597 1.00 0.00 C ATOM 0 H VAL A 59 -15.726 -0.747 -5.919 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.402 -2.344 -8.113 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.663 -2.240 -5.981 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.240 -0.401 -5.571 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.551 0.159 -5.576 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.593 0.463 -6.986 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.923 -2.320 -6.957 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.305 -1.551 -8.438 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.733 -3.170 -7.970 1.00 0.00 H new ATOM 927 N ASP A 60 -16.459 0.803 -8.744 1.00 0.00 N ATOM 928 CA ASP A 60 -16.686 1.781 -9.799 1.00 0.00 C ATOM 929 C ASP A 60 -15.994 1.322 -11.078 1.00 0.00 C ATOM 930 O ASP A 60 -16.517 1.489 -12.181 1.00 0.00 O ATOM 931 CB ASP A 60 -16.167 3.159 -9.383 1.00 0.00 C ATOM 932 CG ASP A 60 -17.077 4.285 -9.834 1.00 0.00 C ATOM 933 OD1 ASP A 60 -17.480 4.289 -11.016 1.00 0.00 O ATOM 934 OD2 ASP A 60 -17.387 5.166 -9.004 1.00 0.00 O ATOM 0 H ASP A 60 -15.881 1.133 -7.971 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.758 1.862 -9.977 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.064 3.192 -8.298 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.172 3.310 -9.802 1.00 0.00 H new ATOM 939 N ASP A 61 -14.817 0.728 -10.909 1.00 0.00 N ATOM 940 CA ASP A 61 -14.036 0.215 -12.030 1.00 0.00 C ATOM 941 C ASP A 61 -14.260 -1.285 -12.183 1.00 0.00 C ATOM 942 O ASP A 61 -14.339 -1.808 -13.295 1.00 0.00 O ATOM 943 CB ASP A 61 -12.551 0.509 -11.815 1.00 0.00 C ATOM 944 CG ASP A 61 -12.269 1.994 -11.692 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.570 2.569 -10.626 1.00 0.00 O ATOM 946 OD2 ASP A 61 -11.752 2.583 -12.665 1.00 0.00 O ATOM 0 H ASP A 61 -14.380 0.589 -9.998 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.363 0.712 -12.943 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.209 0.001 -10.913 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -11.978 0.101 -12.647 1.00 0.00 H new ATOM 951 N ALA A 62 -14.371 -1.968 -11.047 1.00 0.00 N ATOM 952 CA ALA A 62 -14.599 -3.406 -11.027 1.00 0.00 C ATOM 953 C ALA A 62 -16.086 -3.704 -10.859 1.00 0.00 C ATOM 954 O ALA A 62 -16.478 -4.564 -10.068 1.00 0.00 O ATOM 955 CB ALA A 62 -13.793 -4.048 -9.909 1.00 0.00 C ATOM 0 H ALA A 62 -14.306 -1.543 -10.122 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.270 -3.828 -11.977 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -13.971 -5.123 -9.903 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.732 -3.857 -10.069 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.097 -3.625 -8.952 1.00 0.00 H new ATOM 961 N GLN A 63 -16.907 -2.970 -11.601 1.00 0.00 N ATOM 962 CA GLN A 63 -18.356 -3.130 -11.538 1.00 0.00 C ATOM 963 C GLN A 63 -18.804 -4.468 -12.116 1.00 0.00 C ATOM 964 O GLN A 63 -19.970 -4.840 -11.995 1.00 0.00 O ATOM 965 CB GLN A 63 -19.041 -1.991 -12.289 1.00 0.00 C ATOM 966 CG GLN A 63 -20.395 -1.615 -11.711 1.00 0.00 C ATOM 967 CD GLN A 63 -21.532 -2.423 -12.304 1.00 0.00 C ATOM 968 OE1 GLN A 63 -22.069 -3.330 -11.665 1.00 0.00 O ATOM 969 NE2 GLN A 63 -21.912 -2.091 -13.531 1.00 0.00 N ATOM 0 H GLN A 63 -16.592 -2.255 -12.257 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.644 -3.105 -10.487 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.393 -1.115 -12.275 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -19.167 -2.278 -13.333 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -20.377 -1.760 -10.631 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -20.578 -0.555 -11.887 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -21.439 -1.333 -14.024 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -22.677 -2.594 -13.982 1.00 0.00 H new ATOM 978 N ASP A 64 -17.882 -5.188 -12.751 1.00 0.00 N ATOM 979 CA ASP A 64 -18.208 -6.478 -13.346 1.00 0.00 C ATOM 980 C ASP A 64 -17.869 -7.631 -12.402 1.00 0.00 C ATOM 981 O ASP A 64 -18.433 -8.718 -12.525 1.00 0.00 O ATOM 982 CB ASP A 64 -17.478 -6.649 -14.680 1.00 0.00 C ATOM 983 CG ASP A 64 -18.422 -7.029 -15.807 1.00 0.00 C ATOM 984 OD1 ASP A 64 -19.370 -6.260 -16.073 1.00 0.00 O ATOM 985 OD2 ASP A 64 -18.215 -8.097 -16.421 1.00 0.00 O ATOM 0 H ASP A 64 -16.910 -4.901 -12.865 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.283 -6.500 -13.526 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.967 -5.720 -14.934 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.711 -7.417 -14.577 1.00 0.00 H new ATOM 990 N VAL A 65 -16.960 -7.400 -11.453 1.00 0.00 N ATOM 991 CA VAL A 65 -16.591 -8.447 -10.501 1.00 0.00 C ATOM 992 C VAL A 65 -17.644 -8.569 -9.406 1.00 0.00 C ATOM 993 O VAL A 65 -18.074 -9.674 -9.074 1.00 0.00 O ATOM 994 CB VAL A 65 -15.191 -8.227 -9.873 1.00 0.00 C ATOM 995 CG1 VAL A 65 -14.107 -8.657 -10.849 1.00 0.00 C ATOM 996 CG2 VAL A 65 -14.989 -6.782 -9.456 1.00 0.00 C ATOM 0 H VAL A 65 -16.473 -6.513 -11.324 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.543 -9.378 -11.066 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.124 -8.841 -8.975 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.127 -8.498 -10.398 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.230 -9.714 -11.087 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.185 -8.068 -11.763 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -13.997 -6.664 -9.020 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -15.081 -6.135 -10.329 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.744 -6.507 -8.720 1.00 0.00 H new ATOM 1006 N ALA A 66 -18.056 -7.438 -8.831 1.00 0.00 N ATOM 1007 CA ALA A 66 -19.052 -7.441 -7.760 1.00 0.00 C ATOM 1008 C ALA A 66 -20.278 -8.272 -8.131 1.00 0.00 C ATOM 1009 O ALA A 66 -20.631 -9.217 -7.425 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.467 -6.013 -7.450 1.00 0.00 C ATOM 0 H ALA A 66 -17.716 -6.511 -9.088 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.600 -7.896 -6.878 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.209 -6.015 -6.652 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.595 -5.441 -7.133 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -19.895 -5.557 -8.342 1.00 0.00 H new ATOM 1016 N PRO A 67 -20.945 -7.932 -9.242 1.00 0.00 N ATOM 1017 CA PRO A 67 -22.130 -8.663 -9.703 1.00 0.00 C ATOM 1018 C PRO A 67 -21.871 -10.162 -9.775 1.00 0.00 C ATOM 1019 O PRO A 67 -22.778 -10.976 -9.611 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.373 -8.094 -11.099 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.796 -6.722 -11.042 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.599 -6.819 -10.143 1.00 0.00 C ATOM 0 HA PRO A 67 -22.980 -8.545 -9.031 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.887 -8.698 -11.865 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.436 -8.069 -11.339 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.512 -6.376 -12.036 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.522 -6.009 -10.651 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.688 -7.024 -10.706 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -20.432 -5.893 -9.593 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.612 -10.514 -10.007 1.00 0.00 N ATOM 1031 CA LYS A 68 -20.208 -11.909 -10.085 1.00 0.00 C ATOM 1032 C LYS A 68 -20.134 -12.535 -8.691 1.00 0.00 C ATOM 1033 O LYS A 68 -20.198 -13.756 -8.551 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.854 -12.029 -10.789 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.791 -13.162 -11.803 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.745 -12.894 -12.876 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.633 -14.059 -13.850 1.00 0.00 C ATOM 1038 NZ LYS A 68 -16.583 -15.031 -13.435 1.00 0.00 N ATOM 0 H LYS A 68 -19.852 -9.848 -10.145 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.958 -12.449 -10.663 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.632 -11.089 -11.294 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -18.077 -12.180 -10.040 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -18.558 -14.096 -11.292 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.768 -13.289 -12.270 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -18.006 -11.987 -13.421 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.778 -12.717 -12.406 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -18.594 -14.569 -13.918 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -17.403 -13.679 -14.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.538 -15.809 -14.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -15.662 -14.551 -13.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -16.815 -15.413 -12.496 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.990 -11.689 -7.661 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.890 -12.153 -6.268 1.00 0.00 C ATOM 1054 C TYR A 69 -21.107 -11.741 -5.434 1.00 0.00 C ATOM 1055 O TYR A 69 -21.243 -12.144 -4.279 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.641 -11.566 -5.619 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.351 -12.145 -6.147 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -17.000 -13.464 -5.888 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.489 -11.373 -6.913 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.824 -13.996 -6.381 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -15.312 -11.897 -7.408 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.984 -13.209 -7.139 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.812 -13.736 -7.629 1.00 0.00 O ATOM 0 H TYR A 69 -19.940 -10.676 -7.766 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.841 -13.242 -6.294 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.635 -10.487 -5.775 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.690 -11.732 -4.543 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.656 -14.082 -5.293 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.743 -10.345 -7.125 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.564 -15.024 -6.173 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.652 -11.283 -8.003 1.00 0.00 H new ATOM 0 HH TYR A 69 -13.231 -13.992 -6.882 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.989 -10.952 -6.027 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.186 -10.513 -5.327 1.00 0.00 C ATOM 1075 C GLY A 70 -22.894 -9.628 -4.125 1.00 0.00 C ATOM 1076 O GLY A 70 -23.554 -9.744 -3.092 1.00 0.00 O ATOM 0 H GLY A 70 -21.901 -10.605 -6.982 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.825 -9.969 -6.022 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.746 -11.388 -4.997 1.00 0.00 H new ATOM 1080 N ILE A 71 -21.912 -8.740 -4.255 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.548 -7.827 -3.171 1.00 0.00 C ATOM 1082 C ILE A 71 -22.517 -6.647 -3.098 1.00 0.00 C ATOM 1083 O ILE A 71 -22.222 -5.564 -3.601 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.112 -7.296 -3.357 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.135 -8.464 -3.490 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -19.711 -6.394 -2.197 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.754 -8.051 -3.945 1.00 0.00 C ATOM 0 H ILE A 71 -21.352 -8.632 -5.101 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.603 -8.391 -2.240 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.079 -6.703 -4.271 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.055 -8.971 -2.528 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.540 -9.187 -4.198 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -18.694 -6.032 -2.352 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.393 -5.546 -2.143 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -19.758 -6.957 -1.265 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.116 -8.932 -4.017 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.821 -7.571 -4.921 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.328 -7.352 -3.226 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.684 -6.866 -2.494 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.689 -5.810 -2.396 1.00 0.00 C ATOM 1101 C ARG A 72 -24.468 -4.927 -1.168 1.00 0.00 C ATOM 1102 O ARG A 72 -25.099 -5.113 -0.127 1.00 0.00 O ATOM 1103 CB ARG A 72 -26.098 -6.414 -2.361 1.00 0.00 C ATOM 1104 CG ARG A 72 -27.194 -5.427 -2.744 1.00 0.00 C ATOM 1105 CD ARG A 72 -28.230 -6.063 -3.662 1.00 0.00 C ATOM 1106 NE ARG A 72 -29.413 -5.219 -3.817 1.00 0.00 N ATOM 1107 CZ ARG A 72 -30.482 -5.563 -4.534 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -30.525 -6.733 -5.158 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -31.511 -4.731 -4.628 1.00 0.00 N ATOM 0 H ARG A 72 -23.954 -7.753 -2.070 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.588 -5.182 -3.281 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -26.136 -7.267 -3.039 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -26.297 -6.794 -1.359 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -27.684 -5.059 -1.842 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -26.749 -4.564 -3.240 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -27.785 -6.247 -4.640 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -28.526 -7.032 -3.259 1.00 0.00 H new ATOM 0 HE ARG A 72 -29.421 -4.313 -3.349 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -29.736 -7.376 -5.091 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -31.347 -6.989 -5.705 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -31.483 -3.829 -4.152 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -32.330 -4.993 -5.177 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.565 -3.959 -1.314 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.265 -3.041 -0.228 1.00 0.00 C ATOM 1125 C GLY A 73 -21.777 -2.810 -0.021 1.00 0.00 C ATOM 1126 O GLY A 73 -20.947 -3.585 -0.496 1.00 0.00 O ATOM 0 H GLY A 73 -23.034 -3.794 -2.169 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.748 -2.085 -0.428 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.696 -3.430 0.695 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.449 -1.741 0.702 1.00 0.00 N ATOM 1131 CA ILE A 74 -20.061 -1.388 0.999 1.00 0.00 C ATOM 1132 C ILE A 74 -19.967 -0.750 2.384 1.00 0.00 C ATOM 1133 O ILE A 74 -20.955 -0.214 2.886 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.488 -0.407 -0.046 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -20.471 0.739 -0.298 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.166 -1.134 -1.346 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -19.964 1.766 -1.287 1.00 0.00 C ATOM 0 H ILE A 74 -22.134 -1.097 1.097 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.476 -2.307 0.969 1.00 0.00 H new ATOM 0 HB ILE A 74 -18.562 0.013 0.347 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -21.411 0.326 -0.665 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -20.689 1.235 0.648 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -18.763 -0.425 -2.069 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.429 -1.914 -1.154 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.075 -1.584 -1.746 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -20.713 2.548 -1.416 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -19.040 2.207 -0.912 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -19.773 1.284 -2.246 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.787 -0.787 3.036 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.564 -1.405 2.505 1.00 0.00 C ATOM 1151 C PRO A 75 -17.505 -2.912 2.740 1.00 0.00 C ATOM 1152 O PRO A 75 -17.490 -3.369 3.884 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.474 -0.714 3.322 1.00 0.00 C ATOM 1154 CG PRO A 75 -17.109 -0.486 4.649 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.562 -0.201 4.371 1.00 0.00 C ATOM 0 HA PRO A 75 -17.482 -1.287 1.425 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.584 -1.337 3.407 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -16.164 0.224 2.861 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.999 -1.361 5.290 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.640 0.350 5.168 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -19.209 -0.655 5.121 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -18.768 0.869 4.378 1.00 0.00 H new ATOM 1163 N THR A 76 -17.462 -3.683 1.658 1.00 0.00 N ATOM 1164 CA THR A 76 -17.389 -5.136 1.756 1.00 0.00 C ATOM 1165 C THR A 76 -15.942 -5.626 1.820 1.00 0.00 C ATOM 1166 O THR A 76 -15.089 -5.179 1.053 1.00 0.00 O ATOM 1167 CB THR A 76 -18.094 -5.785 0.563 1.00 0.00 C ATOM 1168 OG1 THR A 76 -18.922 -4.849 -0.101 1.00 0.00 O ATOM 1169 CG2 THR A 76 -18.955 -6.969 0.945 1.00 0.00 C ATOM 0 H THR A 76 -17.476 -3.325 0.703 1.00 0.00 H new ATOM 0 HA THR A 76 -17.889 -5.425 2.680 1.00 0.00 H new ATOM 0 HB THR A 76 -17.293 -6.135 -0.088 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.796 -4.815 0.340 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.425 -7.381 0.052 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.335 -7.733 1.414 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.726 -6.647 1.645 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.684 -6.576 2.709 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.357 -7.158 2.834 1.00 0.00 C ATOM 1179 C LEU A 77 -14.402 -8.586 2.303 1.00 0.00 C ATOM 1180 O LEU A 77 -15.210 -9.400 2.750 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.877 -7.126 4.294 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.603 -6.309 4.544 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -12.791 -4.872 4.085 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -12.217 -6.348 6.017 1.00 0.00 C ATOM 0 H LEU A 77 -16.376 -6.959 3.353 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.645 -6.574 2.251 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.677 -6.721 4.914 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.704 -8.150 4.626 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.795 -6.755 3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.877 -4.308 4.271 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.016 -4.857 3.019 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.615 -4.419 4.636 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.311 -5.762 6.171 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -13.026 -5.930 6.616 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -12.038 -7.380 6.319 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.553 -8.874 1.325 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.530 -10.195 0.711 1.00 0.00 C ATOM 1198 C LEU A 78 -12.207 -10.904 0.967 1.00 0.00 C ATOM 1199 O LEU A 78 -11.131 -10.333 0.794 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.762 -10.082 -0.806 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.223 -9.973 -1.275 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.333 -10.349 -2.746 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.147 -10.848 -0.439 1.00 0.00 C ATOM 0 H LEU A 78 -12.875 -8.215 0.942 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.330 -10.781 1.163 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.222 -9.207 -1.169 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.315 -10.953 -1.284 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.537 -8.937 -1.145 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.372 -10.268 -3.066 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.717 -9.675 -3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.989 -11.374 -2.886 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.170 -10.745 -0.800 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.836 -11.889 -0.523 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.097 -10.537 0.604 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.302 -12.162 1.371 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.125 -12.970 1.639 1.00 0.00 C ATOM 1217 C LEU A 79 -11.046 -14.107 0.633 1.00 0.00 C ATOM 1218 O LEU A 79 -11.973 -14.909 0.524 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.178 -13.533 3.061 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.383 -12.750 4.103 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -8.892 -12.840 3.817 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -10.836 -11.299 4.137 1.00 0.00 C ATOM 0 H LEU A 79 -13.187 -12.646 1.521 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.238 -12.344 1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.220 -13.575 3.379 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.809 -14.559 3.042 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.570 -13.191 5.082 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.342 -12.276 4.570 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.579 -13.884 3.845 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.685 -12.425 2.830 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.259 -10.755 4.885 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.679 -10.846 3.158 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.895 -11.254 4.392 1.00 0.00 H new ATOM 1234 N PHE A 80 -9.947 -14.167 -0.106 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.772 -15.200 -1.118 1.00 0.00 C ATOM 1236 C PHE A 80 -8.651 -16.164 -0.746 1.00 0.00 C ATOM 1237 O PHE A 80 -7.665 -15.784 -0.115 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.492 -14.551 -2.474 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.736 -14.066 -3.163 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.456 -14.902 -4.006 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.191 -12.771 -2.959 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.606 -14.452 -4.632 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.339 -12.317 -3.580 1.00 0.00 C ATOM 1244 CZ PHE A 80 -13.048 -13.158 -4.418 1.00 0.00 C ATOM 0 H PHE A 80 -9.166 -13.516 -0.025 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.694 -15.779 -1.178 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.810 -13.712 -2.335 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -8.985 -15.271 -3.117 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -11.116 -15.913 -4.175 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -10.641 -12.109 -2.306 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -13.158 -15.110 -5.287 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -12.682 -11.307 -3.411 1.00 0.00 H new ATOM 0 HZ PHE A 80 -13.945 -12.806 -4.905 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.825 -17.421 -1.140 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.852 -18.469 -0.857 1.00 0.00 C ATOM 1256 C LYS A 81 -7.826 -19.480 -2.000 1.00 0.00 C ATOM 1257 O LYS A 81 -8.827 -20.143 -2.269 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.222 -19.172 0.450 1.00 0.00 C ATOM 1259 CG LYS A 81 -7.027 -19.562 1.304 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.215 -19.131 2.748 1.00 0.00 C ATOM 1261 CE LYS A 81 -5.879 -18.975 3.456 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.239 -20.293 3.732 1.00 0.00 N ATOM 0 H LYS A 81 -9.641 -17.741 -1.662 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.863 -18.022 -0.759 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.872 -18.518 1.031 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.797 -20.068 0.218 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.883 -20.642 1.261 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.124 -19.104 0.900 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.758 -18.187 2.780 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.824 -19.867 3.273 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.212 -18.369 2.843 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.025 -18.439 4.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.330 -20.143 4.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.864 -20.862 4.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.076 -20.794 2.835 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.690 -19.593 -2.681 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.581 -20.526 -3.797 1.00 0.00 C ATOM 1278 C ASN A 82 -7.635 -20.211 -4.863 1.00 0.00 C ATOM 1279 O ASN A 82 -8.279 -21.114 -5.396 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.760 -21.968 -3.306 1.00 0.00 C ATOM 1281 CG ASN A 82 -5.505 -22.578 -2.683 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -4.491 -21.761 -2.394 1.00 0.00 O flip ATOM 1283 ND2 ASN A 82 -5.448 -23.789 -2.467 1.00 0.00 N flip ATOM 0 H ASN A 82 -5.844 -19.059 -2.484 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.589 -20.419 -4.236 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.565 -21.993 -2.572 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -7.074 -22.589 -4.145 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -6.241 -24.386 -2.700 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.608 -24.195 -2.055 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.783 -18.927 -5.186 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.741 -18.517 -6.203 1.00 0.00 C ATOM 1292 C GLY A 83 -10.191 -18.625 -5.762 1.00 0.00 C ATOM 1293 O GLY A 83 -11.100 -18.366 -6.554 1.00 0.00 O ATOM 0 H GLY A 83 -7.257 -18.163 -4.762 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.534 -17.486 -6.488 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.596 -19.129 -7.093 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.425 -19.020 -4.513 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.789 -19.169 -4.010 1.00 0.00 C ATOM 1299 C GLU A 84 -12.016 -18.349 -2.741 1.00 0.00 C ATOM 1300 O GLU A 84 -11.161 -18.295 -1.859 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.088 -20.645 -3.743 1.00 0.00 C ATOM 1302 CG GLU A 84 -13.540 -21.027 -3.983 1.00 0.00 C ATOM 1303 CD GLU A 84 -13.812 -22.494 -3.712 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -13.295 -23.342 -4.470 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -14.540 -22.796 -2.743 1.00 0.00 O ATOM 0 H GLU A 84 -9.695 -19.241 -3.835 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.470 -18.792 -4.773 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.450 -21.257 -4.381 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.826 -20.879 -2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.182 -20.419 -3.345 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.806 -20.797 -5.015 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.191 -17.723 -2.653 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.542 -16.908 -1.491 1.00 0.00 C ATOM 1314 C VAL A 85 -13.721 -17.781 -0.245 1.00 0.00 C ATOM 1315 O VAL A 85 -14.600 -18.643 -0.206 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.829 -16.088 -1.737 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -16.020 -16.995 -2.005 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -15.107 -15.166 -0.560 1.00 0.00 C ATOM 0 H VAL A 85 -13.914 -17.765 -3.372 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.717 -16.214 -1.328 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.672 -15.477 -2.626 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.909 -16.388 -2.174 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.823 -17.603 -2.888 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -16.183 -17.645 -1.146 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.017 -14.597 -0.751 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.234 -15.760 0.345 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.270 -14.480 -0.430 1.00 0.00 H new ATOM 1328 N ALA A 86 -12.886 -17.564 0.772 1.00 0.00 N ATOM 1329 CA ALA A 86 -12.972 -18.348 2.002 1.00 0.00 C ATOM 1330 C ALA A 86 -13.462 -17.511 3.181 1.00 0.00 C ATOM 1331 O ALA A 86 -13.422 -17.953 4.329 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.628 -18.987 2.314 1.00 0.00 C ATOM 0 H ALA A 86 -12.149 -16.858 0.768 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.709 -19.135 1.841 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.706 -19.568 3.233 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.338 -19.643 1.493 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -10.875 -18.209 2.440 1.00 0.00 H new ATOM 1338 N ALA A 87 -13.935 -16.308 2.883 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.452 -15.407 3.910 1.00 0.00 C ATOM 1340 C ALA A 87 -15.031 -14.133 3.298 1.00 0.00 C ATOM 1341 O ALA A 87 -14.435 -13.539 2.399 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.372 -15.066 4.924 1.00 0.00 C ATOM 0 H ALA A 87 -13.972 -15.931 1.936 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.260 -15.927 4.425 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.781 -14.394 5.679 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.022 -15.980 5.404 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.538 -14.579 4.418 1.00 0.00 H new ATOM 1348 N THR A 88 -16.182 -13.704 3.805 1.00 0.00 N ATOM 1349 CA THR A 88 -16.825 -12.488 3.318 1.00 0.00 C ATOM 1350 C THR A 88 -17.347 -11.654 4.483 1.00 0.00 C ATOM 1351 O THR A 88 -18.105 -12.144 5.320 1.00 0.00 O ATOM 1352 CB THR A 88 -17.970 -12.833 2.362 1.00 0.00 C ATOM 1353 OG1 THR A 88 -17.554 -13.799 1.412 1.00 0.00 O ATOM 1354 CG2 THR A 88 -18.501 -11.637 1.599 1.00 0.00 C ATOM 0 H THR A 88 -16.688 -14.179 4.552 1.00 0.00 H new ATOM 0 HA THR A 88 -16.082 -11.903 2.777 1.00 0.00 H new ATOM 0 HB THR A 88 -18.768 -13.218 2.997 1.00 0.00 H new ATOM 0 HG1 THR A 88 -18.299 -14.008 0.811 1.00 0.00 H new ATOM 0 HG21 THR A 88 -19.310 -11.955 0.941 1.00 0.00 H new ATOM 0 HG22 THR A 88 -18.876 -10.894 2.303 1.00 0.00 H new ATOM 0 HG23 THR A 88 -17.699 -11.200 1.003 1.00 0.00 H new ATOM 1362 N LYS A 89 -16.932 -10.391 4.536 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.353 -9.490 5.605 1.00 0.00 C ATOM 1364 C LYS A 89 -18.025 -8.242 5.032 1.00 0.00 C ATOM 1365 O LYS A 89 -17.627 -7.735 3.984 1.00 0.00 O ATOM 1366 CB LYS A 89 -16.147 -9.092 6.461 1.00 0.00 C ATOM 1367 CG LYS A 89 -16.302 -9.424 7.939 1.00 0.00 C ATOM 1368 CD LYS A 89 -16.414 -10.922 8.172 1.00 0.00 C ATOM 1369 CE LYS A 89 -16.422 -11.257 9.656 1.00 0.00 C ATOM 1370 NZ LYS A 89 -17.233 -12.473 9.945 1.00 0.00 N ATOM 0 H LYS A 89 -16.305 -9.969 3.851 1.00 0.00 H new ATOM 0 HA LYS A 89 -18.078 -10.013 6.229 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.260 -9.595 6.077 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -15.977 -8.021 6.355 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -15.447 -9.033 8.491 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -17.189 -8.928 8.332 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -17.327 -11.296 7.709 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -15.580 -11.430 7.688 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -15.399 -11.413 9.999 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.821 -10.412 10.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -17.214 -12.668 10.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -18.215 -12.316 9.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -16.837 -13.285 9.430 1.00 0.00 H new ATOM 1384 N VAL A 90 -19.051 -7.757 5.723 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.782 -6.572 5.282 1.00 0.00 C ATOM 1386 C VAL A 90 -19.729 -5.461 6.324 1.00 0.00 C ATOM 1387 O VAL A 90 -19.717 -5.728 7.526 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.254 -6.894 4.971 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.937 -5.699 4.321 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.356 -8.123 4.082 1.00 0.00 C ATOM 0 H VAL A 90 -19.396 -8.166 6.591 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.291 -6.232 4.370 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.765 -7.109 5.909 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -22.977 -5.946 4.108 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.897 -4.845 4.997 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.426 -5.449 3.391 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.405 -8.335 3.873 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.829 -7.939 3.146 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -20.907 -8.977 4.589 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.706 -4.213 5.862 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.658 -3.091 6.775 1.00 0.00 C ATOM 1402 C GLY A 91 -18.263 -2.809 7.288 1.00 0.00 C ATOM 1403 O GLY A 91 -17.384 -3.668 7.239 1.00 0.00 O ATOM 0 H GLY A 91 -19.720 -3.962 4.873 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -20.041 -2.203 6.272 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.318 -3.288 7.620 1.00 0.00 H new ATOM 1407 N ALA A 92 -18.065 -1.588 7.769 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.771 -1.163 8.285 1.00 0.00 C ATOM 1409 C ALA A 92 -16.446 -1.835 9.614 1.00 0.00 C ATOM 1410 O ALA A 92 -17.250 -1.816 10.546 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.748 0.349 8.440 1.00 0.00 C ATOM 0 H ALA A 92 -18.789 -0.871 7.812 1.00 0.00 H new ATOM 0 HA ALA A 92 -16.008 -1.466 7.568 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.777 0.660 8.826 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.920 0.817 7.471 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.530 0.656 9.134 1.00 0.00 H new ATOM 1417 N LEU A 93 -15.256 -2.423 9.697 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.819 -3.093 10.914 1.00 0.00 C ATOM 1419 C LEU A 93 -13.563 -2.432 11.472 1.00 0.00 C ATOM 1420 O LEU A 93 -12.759 -1.874 10.726 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.553 -4.576 10.644 1.00 0.00 C ATOM 1422 CG LEU A 93 -13.891 -4.885 9.300 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -13.043 -6.143 9.405 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -14.941 -5.034 8.210 1.00 0.00 C ATOM 0 H LEU A 93 -14.578 -2.448 8.935 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.616 -3.007 11.653 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.920 -4.966 11.441 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.500 -5.114 10.697 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.240 -4.052 9.034 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.578 -6.350 8.441 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.268 -5.998 10.158 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.674 -6.984 9.692 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.452 -5.254 7.261 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.618 -5.849 8.466 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.507 -4.107 8.120 1.00 0.00 H new ATOM 1436 N SER A 94 -13.404 -2.493 12.788 1.00 0.00 N ATOM 1437 CA SER A 94 -12.246 -1.899 13.440 1.00 0.00 C ATOM 1438 C SER A 94 -10.960 -2.592 12.999 1.00 0.00 C ATOM 1439 O SER A 94 -10.993 -3.528 12.198 1.00 0.00 O ATOM 1440 CB SER A 94 -12.395 -1.989 14.960 1.00 0.00 C ATOM 1441 OG SER A 94 -13.162 -0.908 15.462 1.00 0.00 O ATOM 0 H SER A 94 -14.061 -2.947 13.423 1.00 0.00 H new ATOM 0 HA SER A 94 -12.189 -0.850 13.148 1.00 0.00 H new ATOM 0 HB2 SER A 94 -12.872 -2.932 15.227 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.410 -1.987 15.426 1.00 0.00 H new ATOM 0 HG SER A 94 -13.244 -0.989 16.435 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.833 -2.128 13.530 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.535 -2.703 13.193 1.00 0.00 C ATOM 1449 C LYS A 95 -8.361 -4.072 13.838 1.00 0.00 C ATOM 1450 O LYS A 95 -7.687 -4.943 13.285 1.00 0.00 O ATOM 1451 CB LYS A 95 -7.401 -1.775 13.633 1.00 0.00 C ATOM 1452 CG LYS A 95 -6.021 -2.298 13.272 1.00 0.00 C ATOM 1453 CD LYS A 95 -5.087 -1.172 12.862 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.782 -1.707 12.291 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.642 -0.784 12.545 1.00 0.00 N ATOM 0 H LYS A 95 -9.792 -1.356 14.195 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.496 -2.820 12.110 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.543 -0.797 13.174 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -7.457 -1.631 14.712 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.598 -2.830 14.124 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.105 -3.017 12.457 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.579 -0.543 12.120 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.876 -0.541 13.725 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -3.566 -2.680 12.732 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.892 -1.860 11.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.773 -1.186 12.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.836 0.137 12.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.520 -0.657 13.570 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.945 -4.255 15.018 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.816 -5.522 15.704 1.00 0.00 C ATOM 1471 C GLY A 96 -9.711 -6.596 15.118 1.00 0.00 C ATOM 1472 O GLY A 96 -9.375 -7.780 15.156 1.00 0.00 O ATOM 0 H GLY A 96 -9.501 -3.553 15.506 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.779 -5.853 15.656 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -9.059 -5.387 16.758 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.848 -6.188 14.569 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.778 -7.136 13.970 1.00 0.00 C ATOM 1478 C GLN A 97 -11.276 -7.595 12.608 1.00 0.00 C ATOM 1479 O GLN A 97 -11.508 -8.733 12.196 1.00 0.00 O ATOM 1480 CB GLN A 97 -13.164 -6.516 13.836 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.638 -5.811 15.097 1.00 0.00 C ATOM 1482 CD GLN A 97 -15.064 -5.310 14.985 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -15.303 -4.119 14.784 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -16.018 -6.221 15.115 1.00 0.00 N ATOM 0 H GLN A 97 -11.147 -5.214 14.526 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.846 -8.004 14.626 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -13.156 -5.803 13.012 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.879 -7.297 13.575 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -13.563 -6.496 15.942 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.977 -4.970 15.309 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -15.772 -7.197 15.281 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -16.998 -5.946 15.049 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.575 -6.707 11.915 1.00 0.00 N ATOM 1494 CA LEU A 98 -10.024 -7.037 10.609 1.00 0.00 C ATOM 1495 C LEU A 98 -8.851 -7.995 10.780 1.00 0.00 C ATOM 1496 O LEU A 98 -8.778 -9.035 10.126 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.577 -5.773 9.868 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.886 -5.763 8.370 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -9.914 -4.337 7.838 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -8.867 -6.600 7.610 1.00 0.00 C ATOM 0 H LEU A 98 -10.376 -5.759 12.234 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.799 -7.518 10.012 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.057 -4.910 10.329 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.502 -5.650 10.004 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.872 -6.203 8.219 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.135 -4.351 6.771 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.683 -3.769 8.361 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.943 -3.869 8.001 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.102 -6.582 6.546 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.869 -6.191 7.768 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.899 -7.628 7.971 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.933 -7.625 11.670 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.750 -8.433 11.945 1.00 0.00 C ATOM 1514 C LYS A 99 -7.136 -9.800 12.507 1.00 0.00 C ATOM 1515 O LYS A 99 -6.588 -10.824 12.099 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.824 -7.701 12.924 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.345 -7.936 12.653 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.473 -6.876 13.313 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.240 -7.176 14.785 1.00 0.00 C ATOM 1520 NZ LYS A 99 -4.159 -6.401 15.665 1.00 0.00 N ATOM 0 H LYS A 99 -7.988 -6.765 12.216 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.221 -8.590 11.005 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.029 -6.632 12.874 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.055 -8.023 13.939 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.060 -8.922 13.021 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.168 -7.934 11.577 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.515 -6.820 12.797 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.947 -5.900 13.211 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.380 -8.242 14.964 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.207 -6.942 15.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.967 -6.635 16.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -4.008 -5.383 15.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -5.144 -6.643 15.437 1.00 0.00 H new ATOM 1534 N GLU A 100 -8.083 -9.813 13.444 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.532 -11.063 14.050 1.00 0.00 C ATOM 1536 C GLU A 100 -9.105 -12.004 12.992 1.00 0.00 C ATOM 1537 O GLU A 100 -8.790 -13.194 12.972 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.569 -10.796 15.154 1.00 0.00 C ATOM 1539 CG GLU A 100 -10.981 -10.549 14.647 1.00 0.00 C ATOM 1540 CD GLU A 100 -11.986 -10.411 15.776 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.559 -10.147 16.921 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -13.198 -10.566 15.517 1.00 0.00 O ATOM 0 H GLU A 100 -8.551 -8.978 13.797 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.667 -11.546 14.505 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.585 -11.648 15.834 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.248 -9.931 15.734 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.993 -9.643 14.041 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.280 -11.371 13.997 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.923 -11.456 12.095 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.528 -12.232 11.017 1.00 0.00 C ATOM 1551 C PHE A 101 -9.461 -12.816 10.094 1.00 0.00 C ATOM 1552 O PHE A 101 -9.541 -13.974 9.681 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.482 -11.340 10.215 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.367 -12.088 9.260 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.157 -13.137 9.701 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.408 -11.740 7.920 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.970 -13.826 8.821 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.220 -12.424 7.035 1.00 0.00 C ATOM 1559 CZ PHE A 101 -14.002 -13.469 7.487 1.00 0.00 C ATOM 0 H PHE A 101 -10.183 -10.470 12.095 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.084 -13.060 11.458 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -12.108 -10.780 10.910 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.896 -10.611 9.655 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.137 -13.419 10.743 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.798 -10.924 7.562 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.580 -14.643 9.176 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.243 -12.142 5.993 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.637 -14.006 6.798 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.456 -12.004 9.781 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.373 -12.438 8.907 1.00 0.00 C ATOM 1571 C LEU A 102 -6.557 -13.530 9.585 1.00 0.00 C ATOM 1572 O LEU A 102 -6.431 -14.634 9.062 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.479 -11.252 8.534 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.650 -10.749 7.099 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -5.848 -9.478 6.871 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -6.238 -11.826 6.109 1.00 0.00 C ATOM 0 H LEU A 102 -8.369 -11.045 10.118 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.804 -12.844 7.991 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.684 -10.430 9.220 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.438 -11.538 8.683 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.703 -10.516 6.941 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.986 -9.140 5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -6.191 -8.703 7.557 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.791 -9.678 7.049 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.365 -11.454 5.092 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.193 -12.089 6.271 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.860 -12.709 6.252 1.00 0.00 H new ATOM 1588 N ASP A 103 -6.019 -13.220 10.760 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.228 -14.186 11.517 1.00 0.00 C ATOM 1590 C ASP A 103 -5.966 -15.520 11.627 1.00 0.00 C ATOM 1591 O ASP A 103 -5.349 -16.585 11.615 1.00 0.00 O ATOM 1592 CB ASP A 103 -4.918 -13.645 12.917 1.00 0.00 C ATOM 1593 CG ASP A 103 -3.576 -14.123 13.432 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -2.554 -13.482 13.110 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -3.547 -15.140 14.158 1.00 0.00 O ATOM 0 H ASP A 103 -6.116 -12.309 11.209 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.291 -14.348 10.985 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.929 -12.555 12.894 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.702 -13.957 13.607 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.291 -15.448 11.732 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.123 -16.643 11.843 1.00 0.00 C ATOM 1602 C ALA A 104 -8.219 -17.407 10.521 1.00 0.00 C ATOM 1603 O ALA A 104 -8.527 -18.600 10.511 1.00 0.00 O ATOM 1604 CB ALA A 104 -9.514 -16.270 12.334 1.00 0.00 C ATOM 0 H ALA A 104 -7.813 -14.571 11.743 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.646 -17.304 12.567 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.125 -17.169 12.413 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.439 -15.795 13.312 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.975 -15.578 11.629 1.00 0.00 H new ATOM 1610 N ASN A 105 -7.977 -16.717 9.407 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.064 -17.341 8.088 1.00 0.00 C ATOM 1612 C ASN A 105 -6.680 -17.543 7.463 1.00 0.00 C ATOM 1613 O ASN A 105 -6.501 -18.406 6.604 1.00 0.00 O ATOM 1614 CB ASN A 105 -8.927 -16.479 7.164 1.00 0.00 C ATOM 1615 CG ASN A 105 -9.861 -17.302 6.296 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.181 -18.446 6.619 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.303 -16.721 5.185 1.00 0.00 N ATOM 0 H ASN A 105 -7.720 -15.730 9.391 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.520 -18.323 8.213 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.514 -15.785 7.765 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.280 -15.878 6.525 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -10.933 -17.226 4.562 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -10.012 -15.771 4.956 1.00 0.00 H new ATOM 1624 N LEU A 106 -5.710 -16.741 7.891 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.349 -16.832 7.367 1.00 0.00 C ATOM 1626 C LEU A 106 -3.625 -18.053 7.942 1.00 0.00 C ATOM 1627 O LEU A 106 -3.553 -19.098 7.295 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.586 -15.536 7.687 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.139 -15.449 7.181 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -1.180 -16.034 8.203 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -1.984 -16.142 5.835 1.00 0.00 C ATOM 0 H LEU A 106 -5.840 -16.019 8.600 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.392 -16.956 6.285 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.145 -14.699 7.268 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.577 -15.404 8.769 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.894 -14.396 7.042 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.160 -15.963 7.827 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.261 -15.479 9.138 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.430 -17.080 8.379 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.949 -16.064 5.503 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.255 -17.193 5.934 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.637 -15.666 5.103 1.00 0.00 H new ATOM 1643 N VAL A 107 -3.105 -17.921 9.164 1.00 0.00 N ATOM 1644 CA VAL A 107 -2.399 -19.014 9.837 1.00 0.00 C ATOM 1645 C VAL A 107 -1.535 -19.827 8.867 1.00 0.00 C ATOM 1646 O VAL A 107 -1.263 -21.011 9.163 1.00 0.00 O ATOM 1647 CB VAL A 107 -3.392 -19.950 10.556 1.00 0.00 C ATOM 1648 CG1 VAL A 107 -4.283 -20.670 9.555 1.00 0.00 C ATOM 1649 CG2 VAL A 107 -2.655 -20.944 11.440 1.00 0.00 C ATOM 0 H VAL A 107 -3.160 -17.062 9.711 1.00 0.00 H new ATOM 0 HA VAL A 107 -1.739 -18.554 10.573 1.00 0.00 H new ATOM 0 HB VAL A 107 -4.030 -19.339 11.194 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -4.974 -21.324 10.087 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -4.848 -19.938 8.978 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -3.666 -21.265 8.881 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -3.376 -21.593 11.937 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -1.984 -21.547 10.828 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -2.076 -20.405 12.190 1.00 0.00 H new TER 1659 VAL A 107