USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1060 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 128 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 95 THR OG1 : rot 170:sc= -0.38 USER MOD Set 2.2: A 96 THR OG1 : rot 84:sc= 0.409 USER MOD Set 3.1: A 80 GLN : amide:sc= -0.135 K(o=-0.71,f=-1.4) USER MOD Set 3.2: A 83 GLN : amide:sc= -0.57 K(o=-0.71,f=-4.5!) USER MOD Set 4.1: A 41 GLN : amide:sc= 0.233 K(o=1.2,f=0.21) USER MOD Set 4.2: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 4.3: A 114 THR OG1 : rot -81:sc= 0.964 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 163:sc= 1.24 (180deg=0.42) USER MOD Single : A 8 SER OG : rot -33:sc= 0.626 USER MOD Single : A 12 SER OG : rot 180:sc= -0.0457 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.272 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -164:sc= -0.0437 (180deg=-0.422) USER MOD Single : A 38 GLN : amide:sc= -0.306 K(o=-0.31,f=-2.7) USER MOD Single : A 43 ASN : amide:sc= -0.636 K(o=-0.64,f=-2.6!) USER MOD Single : A 45 MET CE :methyl 158:sc= -0.255 (180deg=-0.999) USER MOD Single : A 47 LYS NZ :NH3+ 166:sc=-0.00295 (180deg=-0.322) USER MOD Single : A 48 TYR OH : rot 130:sc= -0.157 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 102:sc= 0.414 USER MOD Single : A 58 ASN : amide:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 165:sc= -0.0611 (180deg=-0.375) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.21 K(o=-1.2,f=-0.59) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 136:sc= -0.109 (180deg=-0.493) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 90 MET CE :methyl 167:sc= 0 (180deg=-0.158) USER MOD Single : A 94 THR OG1 : rot -79:sc= 0.45 USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 99 HIS : no HD1:sc= -0.0173 X(o=-0.017,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-4.8!) USER MOD Single : A 101 LYS NZ :NH3+ 165:sc= -0.0525 (180deg=-0.282) USER MOD Single : A 111 MET CE :methyl -163:sc= -0.75 (180deg=-1.28) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 160:sc= -0.186 (180deg=-0.787) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.112 4.633 27.686 1.00 0.00 N ATOM 2 CA MET A 1 15.982 3.489 27.307 1.00 0.00 C ATOM 3 C MET A 1 17.153 3.961 26.453 1.00 0.00 C ATOM 4 O MET A 1 17.019 4.891 25.657 1.00 0.00 O ATOM 5 CB MET A 1 15.177 2.437 26.538 1.00 0.00 C ATOM 6 CG MET A 1 14.059 1.799 27.352 1.00 0.00 C ATOM 7 SD MET A 1 12.671 2.917 27.631 1.00 0.00 S ATOM 8 CE MET A 1 11.612 1.897 28.652 1.00 0.00 C ATOM 0 H1 MET A 1 14.190 4.276 28.009 1.00 0.00 H new ATOM 0 H2 MET A 1 15.562 5.172 28.453 1.00 0.00 H new ATOM 0 H3 MET A 1 14.974 5.252 26.862 1.00 0.00 H new ATOM 0 HA MET A 1 16.371 3.044 28.223 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.748 2.900 25.650 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.854 1.655 26.194 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.703 0.907 26.836 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.456 1.473 28.313 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.709 2.452 28.908 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.340 0.994 28.106 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.141 1.623 29.565 1.00 0.00 H new ATOM 18 N ASP A 2 18.303 3.316 26.626 1.00 0.00 N ATOM 19 CA ASP A 2 19.498 3.671 25.870 1.00 0.00 C ATOM 20 C ASP A 2 20.440 2.478 25.743 1.00 0.00 C ATOM 21 O ASP A 2 20.654 1.739 26.703 1.00 0.00 O ATOM 22 CB ASP A 2 20.222 4.840 26.541 1.00 0.00 C ATOM 23 CG ASP A 2 21.437 5.294 25.755 1.00 0.00 C ATOM 24 OD1 ASP A 2 21.283 6.174 24.883 1.00 0.00 O ATOM 25 OD2 ASP A 2 22.540 4.769 26.012 1.00 0.00 O ATOM 0 H ASP A 2 18.432 2.546 27.282 1.00 0.00 H new ATOM 0 HA ASP A 2 19.187 3.971 24.869 1.00 0.00 H new ATOM 0 HB2 ASP A 2 19.531 5.676 26.653 1.00 0.00 H new ATOM 0 HB3 ASP A 2 20.531 4.545 27.544 1.00 0.00 H new ATOM 30 N ALA A 3 20.997 2.298 24.550 1.00 0.00 N ATOM 31 CA ALA A 3 21.918 1.197 24.294 1.00 0.00 C ATOM 32 C ALA A 3 22.960 1.591 23.252 1.00 0.00 C ATOM 33 O ALA A 3 22.880 2.665 22.655 1.00 0.00 O ATOM 34 CB ALA A 3 21.154 -0.037 23.840 1.00 0.00 C ATOM 0 H ALA A 3 20.826 2.901 23.745 1.00 0.00 H new ATOM 0 HA ALA A 3 22.438 0.964 25.223 1.00 0.00 H new ATOM 0 HB1 ALA A 3 21.855 -0.850 23.653 1.00 0.00 H new ATOM 0 HB2 ALA A 3 20.451 -0.336 24.617 1.00 0.00 H new ATOM 0 HB3 ALA A 3 20.608 0.190 22.924 1.00 0.00 H new ATOM 40 N LEU A 4 23.937 0.715 23.038 1.00 0.00 N ATOM 41 CA LEU A 4 24.994 0.970 22.067 1.00 0.00 C ATOM 42 C LEU A 4 25.116 -0.196 21.092 1.00 0.00 C ATOM 43 O LEU A 4 25.621 -1.263 21.443 1.00 0.00 O ATOM 44 CB LEU A 4 26.328 1.206 22.785 1.00 0.00 C ATOM 45 CG LEU A 4 27.400 1.932 21.963 1.00 0.00 C ATOM 46 CD1 LEU A 4 28.477 2.498 22.876 1.00 0.00 C ATOM 47 CD2 LEU A 4 28.019 0.997 20.932 1.00 0.00 C ATOM 0 H LEU A 4 24.018 -0.178 23.524 1.00 0.00 H new ATOM 0 HA LEU A 4 24.737 1.866 21.502 1.00 0.00 H new ATOM 0 HB2 LEU A 4 26.137 1.782 23.690 1.00 0.00 H new ATOM 0 HB3 LEU A 4 26.727 0.242 23.100 1.00 0.00 H new ATOM 0 HG LEU A 4 26.921 2.756 21.434 1.00 0.00 H new ATOM 0 HD11 LEU A 4 29.230 3.010 22.277 1.00 0.00 H new ATOM 0 HD12 LEU A 4 28.028 3.204 23.575 1.00 0.00 H new ATOM 0 HD13 LEU A 4 28.946 1.686 23.432 1.00 0.00 H new ATOM 0 HD21 LEU A 4 28.776 1.535 20.361 1.00 0.00 H new ATOM 0 HD22 LEU A 4 28.481 0.150 21.440 1.00 0.00 H new ATOM 0 HD23 LEU A 4 27.244 0.636 20.256 1.00 0.00 H new ATOM 59 N GLU A 5 24.646 0.016 19.867 1.00 0.00 N ATOM 60 CA GLU A 5 24.698 -1.015 18.836 1.00 0.00 C ATOM 61 C GLU A 5 25.289 -0.458 17.544 1.00 0.00 C ATOM 62 O GLU A 5 24.827 0.558 17.025 1.00 0.00 O ATOM 63 CB GLU A 5 23.297 -1.573 18.573 1.00 0.00 C ATOM 64 CG GLU A 5 23.262 -2.674 17.526 1.00 0.00 C ATOM 65 CD GLU A 5 24.117 -3.867 17.906 1.00 0.00 C ATOM 66 OE1 GLU A 5 23.592 -4.789 18.565 1.00 0.00 O ATOM 67 OE2 GLU A 5 25.313 -3.880 17.543 1.00 0.00 O ATOM 0 H GLU A 5 24.224 0.894 19.564 1.00 0.00 H new ATOM 0 HA GLU A 5 25.340 -1.821 19.191 1.00 0.00 H new ATOM 0 HB2 GLU A 5 22.889 -1.959 19.507 1.00 0.00 H new ATOM 0 HB3 GLU A 5 22.646 -0.759 18.253 1.00 0.00 H new ATOM 0 HG2 GLU A 5 22.232 -3.001 17.382 1.00 0.00 H new ATOM 0 HG3 GLU A 5 23.606 -2.274 16.572 1.00 0.00 H new ATOM 74 N GLY A 6 26.314 -1.134 17.030 1.00 0.00 N ATOM 75 CA GLY A 6 26.951 -0.691 15.802 1.00 0.00 C ATOM 76 C GLY A 6 28.367 -1.216 15.662 1.00 0.00 C ATOM 77 O GLY A 6 29.329 -0.511 15.965 1.00 0.00 O ATOM 0 H GLY A 6 26.713 -1.978 17.441 1.00 0.00 H new ATOM 0 HA2 GLY A 6 26.358 -1.021 14.949 1.00 0.00 H new ATOM 0 HA3 GLY A 6 26.966 0.399 15.777 1.00 0.00 H new ATOM 81 N GLU A 7 28.493 -2.456 15.200 1.00 0.00 N ATOM 82 CA GLU A 7 29.802 -3.074 15.020 1.00 0.00 C ATOM 83 C GLU A 7 29.781 -4.064 13.859 1.00 0.00 C ATOM 84 O GLU A 7 30.514 -3.907 12.883 1.00 0.00 O ATOM 85 CB GLU A 7 30.232 -3.787 16.303 1.00 0.00 C ATOM 86 CG GLU A 7 31.617 -4.407 16.218 1.00 0.00 C ATOM 87 CD GLU A 7 31.996 -5.167 17.474 1.00 0.00 C ATOM 88 OE1 GLU A 7 32.558 -4.544 18.399 1.00 0.00 O ATOM 89 OE2 GLU A 7 31.729 -6.386 17.534 1.00 0.00 O ATOM 0 H GLU A 7 27.706 -3.052 14.944 1.00 0.00 H new ATOM 0 HA GLU A 7 30.520 -2.286 14.791 1.00 0.00 H new ATOM 0 HB2 GLU A 7 30.211 -3.076 17.129 1.00 0.00 H new ATOM 0 HB3 GLU A 7 29.507 -4.567 16.536 1.00 0.00 H new ATOM 0 HG2 GLU A 7 31.656 -5.083 15.364 1.00 0.00 H new ATOM 0 HG3 GLU A 7 32.352 -3.622 16.038 1.00 0.00 H new ATOM 96 N SER A 8 28.936 -5.084 13.976 1.00 0.00 N ATOM 97 CA SER A 8 28.820 -6.104 12.940 1.00 0.00 C ATOM 98 C SER A 8 27.673 -5.788 11.986 1.00 0.00 C ATOM 99 O SER A 8 27.424 -6.528 11.032 1.00 0.00 O ATOM 100 CB SER A 8 28.608 -7.479 13.576 1.00 0.00 C ATOM 101 OG SER A 8 28.516 -8.490 12.589 1.00 0.00 O ATOM 0 H SER A 8 28.322 -5.226 14.778 1.00 0.00 H new ATOM 0 HA SER A 8 29.748 -6.113 12.368 1.00 0.00 H new ATOM 0 HB2 SER A 8 29.433 -7.701 14.252 1.00 0.00 H new ATOM 0 HB3 SER A 8 27.698 -7.469 14.176 1.00 0.00 H new ATOM 0 HG SER A 8 28.088 -8.125 11.786 1.00 0.00 H new ATOM 107 N PHE A 9 26.976 -4.688 12.248 1.00 0.00 N ATOM 108 CA PHE A 9 25.856 -4.274 11.412 1.00 0.00 C ATOM 109 C PHE A 9 26.349 -3.760 10.064 1.00 0.00 C ATOM 110 O PHE A 9 27.089 -2.777 9.999 1.00 0.00 O ATOM 111 CB PHE A 9 25.038 -3.192 12.119 1.00 0.00 C ATOM 112 CG PHE A 9 23.826 -2.752 11.345 1.00 0.00 C ATOM 113 CD1 PHE A 9 22.655 -3.490 11.391 1.00 0.00 C ATOM 114 CD2 PHE A 9 23.861 -1.600 10.575 1.00 0.00 C ATOM 115 CE1 PHE A 9 21.539 -3.088 10.681 1.00 0.00 C ATOM 116 CE2 PHE A 9 22.748 -1.193 9.863 1.00 0.00 C ATOM 117 CZ PHE A 9 21.586 -1.938 9.916 1.00 0.00 C ATOM 0 H PHE A 9 27.167 -4.066 13.034 1.00 0.00 H new ATOM 0 HA PHE A 9 25.220 -5.142 11.239 1.00 0.00 H new ATOM 0 HB2 PHE A 9 24.721 -3.566 13.093 1.00 0.00 H new ATOM 0 HB3 PHE A 9 25.676 -2.327 12.302 1.00 0.00 H new ATOM 0 HD1 PHE A 9 22.613 -4.389 11.988 1.00 0.00 H new ATOM 0 HD2 PHE A 9 24.767 -1.014 10.531 1.00 0.00 H new ATOM 0 HE1 PHE A 9 20.632 -3.672 10.724 1.00 0.00 H new ATOM 0 HE2 PHE A 9 22.787 -0.294 9.266 1.00 0.00 H new ATOM 0 HZ PHE A 9 20.715 -1.622 9.360 1.00 0.00 H new ATOM 127 N ALA A 10 25.937 -4.436 8.994 1.00 0.00 N ATOM 128 CA ALA A 10 26.328 -4.059 7.638 1.00 0.00 C ATOM 129 C ALA A 10 27.834 -4.200 7.434 1.00 0.00 C ATOM 130 O ALA A 10 28.603 -4.241 8.395 1.00 0.00 O ATOM 131 CB ALA A 10 25.883 -2.636 7.328 1.00 0.00 C ATOM 0 H ALA A 10 25.328 -5.253 9.041 1.00 0.00 H new ATOM 0 HA ALA A 10 25.830 -4.740 6.948 1.00 0.00 H new ATOM 0 HB1 ALA A 10 26.183 -2.374 6.314 1.00 0.00 H new ATOM 0 HB2 ALA A 10 24.799 -2.567 7.415 1.00 0.00 H new ATOM 0 HB3 ALA A 10 26.348 -1.948 8.034 1.00 0.00 H new ATOM 137 N LEU A 11 28.247 -4.278 6.172 1.00 0.00 N ATOM 138 CA LEU A 11 29.659 -4.414 5.835 1.00 0.00 C ATOM 139 C LEU A 11 30.282 -3.049 5.565 1.00 0.00 C ATOM 140 O LEU A 11 31.162 -2.599 6.299 1.00 0.00 O ATOM 141 CB LEU A 11 29.828 -5.312 4.607 1.00 0.00 C ATOM 142 CG LEU A 11 29.283 -6.733 4.760 1.00 0.00 C ATOM 143 CD1 LEU A 11 29.350 -7.473 3.433 1.00 0.00 C ATOM 144 CD2 LEU A 11 30.056 -7.490 5.830 1.00 0.00 C ATOM 0 H LEU A 11 27.623 -4.249 5.366 1.00 0.00 H new ATOM 0 HA LEU A 11 30.169 -4.870 6.684 1.00 0.00 H new ATOM 0 HB2 LEU A 11 29.332 -4.839 3.760 1.00 0.00 H new ATOM 0 HB3 LEU A 11 30.889 -5.371 4.363 1.00 0.00 H new ATOM 0 HG LEU A 11 28.240 -6.670 5.069 1.00 0.00 H new ATOM 0 HD11 LEU A 11 28.959 -8.482 3.559 1.00 0.00 H new ATOM 0 HD12 LEU A 11 28.754 -6.943 2.690 1.00 0.00 H new ATOM 0 HD13 LEU A 11 30.386 -7.525 3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 11 29.654 -8.499 5.924 1.00 0.00 H new ATOM 0 HD22 LEU A 11 31.108 -7.544 5.550 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.961 -6.971 6.784 1.00 0.00 H new ATOM 156 N SER A 12 29.813 -2.393 4.509 1.00 0.00 N ATOM 157 CA SER A 12 30.318 -1.078 4.135 1.00 0.00 C ATOM 158 C SER A 12 29.256 -0.285 3.380 1.00 0.00 C ATOM 159 O SER A 12 29.236 0.945 3.424 1.00 0.00 O ATOM 160 CB SER A 12 31.575 -1.217 3.274 1.00 0.00 C ATOM 161 OG SER A 12 32.603 -1.894 3.976 1.00 0.00 O ATOM 0 H SER A 12 29.082 -2.752 3.896 1.00 0.00 H new ATOM 0 HA SER A 12 30.570 -0.539 5.048 1.00 0.00 H new ATOM 0 HB2 SER A 12 31.335 -1.761 2.360 1.00 0.00 H new ATOM 0 HB3 SER A 12 31.925 -0.229 2.974 1.00 0.00 H new ATOM 0 HG SER A 12 33.394 -1.971 3.403 1.00 0.00 H new ATOM 167 N PHE A 13 28.375 -1.001 2.688 1.00 0.00 N ATOM 168 CA PHE A 13 27.309 -0.370 1.921 1.00 0.00 C ATOM 169 C PHE A 13 25.946 -0.669 2.537 1.00 0.00 C ATOM 170 O PHE A 13 25.475 -1.806 2.505 1.00 0.00 O ATOM 171 CB PHE A 13 27.350 -0.853 0.470 1.00 0.00 C ATOM 172 CG PHE A 13 28.661 -0.585 -0.210 1.00 0.00 C ATOM 173 CD1 PHE A 13 29.694 -1.507 -0.140 1.00 0.00 C ATOM 174 CD2 PHE A 13 28.863 0.589 -0.916 1.00 0.00 C ATOM 175 CE1 PHE A 13 30.904 -1.263 -0.762 1.00 0.00 C ATOM 176 CE2 PHE A 13 30.071 0.839 -1.540 1.00 0.00 C ATOM 177 CZ PHE A 13 31.093 -0.088 -1.463 1.00 0.00 C ATOM 0 H PHE A 13 28.379 -2.020 2.643 1.00 0.00 H new ATOM 0 HA PHE A 13 27.463 0.709 1.942 1.00 0.00 H new ATOM 0 HB2 PHE A 13 27.149 -1.924 0.445 1.00 0.00 H new ATOM 0 HB3 PHE A 13 26.552 -0.366 -0.090 1.00 0.00 H new ATOM 0 HD1 PHE A 13 29.552 -2.427 0.407 1.00 0.00 H new ATOM 0 HD2 PHE A 13 28.068 1.317 -0.980 1.00 0.00 H new ATOM 0 HE1 PHE A 13 31.700 -1.990 -0.700 1.00 0.00 H new ATOM 0 HE2 PHE A 13 30.216 1.759 -2.088 1.00 0.00 H new ATOM 0 HZ PHE A 13 32.037 0.106 -1.950 1.00 0.00 H new ATOM 187 N SER A 14 25.317 0.359 3.099 1.00 0.00 N ATOM 188 CA SER A 14 24.009 0.208 3.726 1.00 0.00 C ATOM 189 C SER A 14 22.896 0.662 2.788 1.00 0.00 C ATOM 190 O SER A 14 22.985 1.725 2.173 1.00 0.00 O ATOM 191 CB SER A 14 23.949 1.007 5.028 1.00 0.00 C ATOM 192 OG SER A 14 24.166 2.387 4.790 1.00 0.00 O ATOM 0 H SER A 14 25.693 1.307 3.133 1.00 0.00 H new ATOM 0 HA SER A 14 23.863 -0.849 3.947 1.00 0.00 H new ATOM 0 HB2 SER A 14 22.977 0.865 5.501 1.00 0.00 H new ATOM 0 HB3 SER A 14 24.700 0.632 5.723 1.00 0.00 H new ATOM 0 HG SER A 14 24.121 2.876 5.638 1.00 0.00 H new ATOM 198 N SER A 15 21.846 -0.149 2.685 1.00 0.00 N ATOM 199 CA SER A 15 20.713 0.171 1.824 1.00 0.00 C ATOM 200 C SER A 15 19.516 -0.720 2.145 1.00 0.00 C ATOM 201 O SER A 15 18.611 -0.320 2.879 1.00 0.00 O ATOM 202 CB SER A 15 21.103 0.013 0.352 1.00 0.00 C ATOM 203 OG SER A 15 20.006 0.295 -0.499 1.00 0.00 O ATOM 0 H SER A 15 21.757 -1.032 3.187 1.00 0.00 H new ATOM 0 HA SER A 15 20.430 1.207 2.008 1.00 0.00 H new ATOM 0 HB2 SER A 15 21.931 0.683 0.118 1.00 0.00 H new ATOM 0 HB3 SER A 15 21.455 -1.003 0.173 1.00 0.00 H new ATOM 0 HG SER A 15 20.281 0.189 -1.434 1.00 0.00 H new ATOM 209 N ALA A 16 19.520 -1.929 1.592 1.00 0.00 N ATOM 210 CA ALA A 16 18.437 -2.877 1.823 1.00 0.00 C ATOM 211 C ALA A 16 18.437 -3.357 3.270 1.00 0.00 C ATOM 212 O ALA A 16 17.513 -4.044 3.706 1.00 0.00 O ATOM 213 CB ALA A 16 18.558 -4.057 0.870 1.00 0.00 C ATOM 0 H ALA A 16 20.261 -2.274 0.982 1.00 0.00 H new ATOM 0 HA ALA A 16 17.490 -2.371 1.634 1.00 0.00 H new ATOM 0 HB1 ALA A 16 17.743 -4.758 1.053 1.00 0.00 H new ATOM 0 HB2 ALA A 16 18.506 -3.701 -0.159 1.00 0.00 H new ATOM 0 HB3 ALA A 16 19.512 -4.559 1.032 1.00 0.00 H new ATOM 219 N SER A 17 19.480 -2.989 4.007 1.00 0.00 N ATOM 220 CA SER A 17 19.603 -3.378 5.408 1.00 0.00 C ATOM 221 C SER A 17 18.580 -2.645 6.269 1.00 0.00 C ATOM 222 O SER A 17 17.717 -3.269 6.887 1.00 0.00 O ATOM 223 CB SER A 17 21.016 -3.087 5.919 1.00 0.00 C ATOM 224 OG SER A 17 21.982 -3.837 5.203 1.00 0.00 O ATOM 0 H SER A 17 20.252 -2.422 3.658 1.00 0.00 H new ATOM 0 HA SER A 17 19.411 -4.449 5.478 1.00 0.00 H new ATOM 0 HB2 SER A 17 21.230 -2.023 5.819 1.00 0.00 H new ATOM 0 HB3 SER A 17 21.079 -3.327 6.980 1.00 0.00 H new ATOM 0 HG SER A 17 22.876 -3.632 5.547 1.00 0.00 H new ATOM 230 N ASP A 18 18.684 -1.319 6.307 1.00 0.00 N ATOM 231 CA ASP A 18 17.767 -0.505 7.097 1.00 0.00 C ATOM 232 C ASP A 18 17.891 0.972 6.735 1.00 0.00 C ATOM 233 O ASP A 18 17.002 1.768 7.029 1.00 0.00 O ATOM 234 CB ASP A 18 18.039 -0.701 8.591 1.00 0.00 C ATOM 235 CG ASP A 18 17.084 0.091 9.463 1.00 0.00 C ATOM 236 OD1 ASP A 18 17.379 1.271 9.748 1.00 0.00 O ATOM 237 OD2 ASP A 18 16.039 -0.468 9.860 1.00 0.00 O ATOM 0 H ASP A 18 19.392 -0.787 5.801 1.00 0.00 H new ATOM 0 HA ASP A 18 16.751 -0.828 6.872 1.00 0.00 H new ATOM 0 HB2 ASP A 18 17.957 -1.760 8.836 1.00 0.00 H new ATOM 0 HB3 ASP A 18 19.063 -0.401 8.813 1.00 0.00 H new ATOM 242 N ALA A 19 18.998 1.333 6.096 1.00 0.00 N ATOM 243 CA ALA A 19 19.229 2.718 5.703 1.00 0.00 C ATOM 244 C ALA A 19 18.264 3.153 4.605 1.00 0.00 C ATOM 245 O ALA A 19 17.505 4.110 4.773 1.00 0.00 O ATOM 246 CB ALA A 19 20.668 2.901 5.243 1.00 0.00 C ATOM 0 H ALA A 19 19.747 0.689 5.840 1.00 0.00 H new ATOM 0 HA ALA A 19 19.050 3.348 6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.828 3.939 4.952 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.346 2.644 6.057 1.00 0.00 H new ATOM 0 HB3 ALA A 19 20.863 2.251 4.390 1.00 0.00 H new ATOM 252 N GLU A 20 18.284 2.436 3.487 1.00 0.00 N ATOM 253 CA GLU A 20 17.415 2.758 2.362 1.00 0.00 C ATOM 254 C GLU A 20 15.977 2.344 2.649 1.00 0.00 C ATOM 255 O GLU A 20 15.039 3.065 2.308 1.00 0.00 O ATOM 256 CB GLU A 20 17.912 2.077 1.085 1.00 0.00 C ATOM 257 CG GLU A 20 17.095 2.430 -0.148 1.00 0.00 C ATOM 258 CD GLU A 20 17.613 1.756 -1.403 1.00 0.00 C ATOM 259 OE1 GLU A 20 17.174 0.622 -1.692 1.00 0.00 O ATOM 260 OE2 GLU A 20 18.456 2.360 -2.097 1.00 0.00 O ATOM 0 H GLU A 20 18.891 1.630 3.336 1.00 0.00 H new ATOM 0 HA GLU A 20 17.441 3.838 2.217 1.00 0.00 H new ATOM 0 HB2 GLU A 20 18.952 2.357 0.915 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.892 0.997 1.227 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.057 2.140 0.013 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.106 3.511 -0.289 1.00 0.00 H new ATOM 267 N PHE A 21 15.807 1.183 3.275 1.00 0.00 N ATOM 268 CA PHE A 21 14.474 0.687 3.600 1.00 0.00 C ATOM 269 C PHE A 21 13.700 1.722 4.410 1.00 0.00 C ATOM 270 O PHE A 21 12.571 2.071 4.069 1.00 0.00 O ATOM 271 CB PHE A 21 14.555 -0.630 4.372 1.00 0.00 C ATOM 272 CG PHE A 21 13.294 -1.443 4.291 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.145 -1.038 4.952 1.00 0.00 C ATOM 274 CD2 PHE A 21 13.257 -2.611 3.547 1.00 0.00 C ATOM 275 CE1 PHE A 21 10.983 -1.781 4.869 1.00 0.00 C ATOM 276 CE2 PHE A 21 12.099 -3.360 3.463 1.00 0.00 C ATOM 277 CZ PHE A 21 10.960 -2.944 4.125 1.00 0.00 C ATOM 0 H PHE A 21 16.570 0.572 3.566 1.00 0.00 H new ATOM 0 HA PHE A 21 13.946 0.506 2.664 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.385 -1.220 3.984 1.00 0.00 H new ATOM 0 HB3 PHE A 21 14.776 -0.417 5.418 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.158 -0.131 5.539 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.144 -2.940 3.026 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.093 -1.452 5.386 1.00 0.00 H new ATOM 0 HE2 PHE A 21 12.084 -4.269 2.881 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.053 -3.527 4.061 1.00 0.00 H new ATOM 287 N ASP A 22 14.316 2.211 5.485 1.00 0.00 N ATOM 288 CA ASP A 22 13.681 3.210 6.336 1.00 0.00 C ATOM 289 C ASP A 22 13.404 4.485 5.549 1.00 0.00 C ATOM 290 O ASP A 22 12.364 5.120 5.727 1.00 0.00 O ATOM 291 CB ASP A 22 14.559 3.519 7.550 1.00 0.00 C ATOM 292 CG ASP A 22 14.531 2.405 8.578 1.00 0.00 C ATOM 293 OD1 ASP A 22 14.699 1.231 8.187 1.00 0.00 O ATOM 294 OD2 ASP A 22 14.341 2.706 9.776 1.00 0.00 O ATOM 0 H ASP A 22 15.250 1.932 5.785 1.00 0.00 H new ATOM 0 HA ASP A 22 12.732 2.805 6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.585 3.682 7.221 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.222 4.446 8.013 1.00 0.00 H new ATOM 299 N ALA A 23 14.343 4.857 4.681 1.00 0.00 N ATOM 300 CA ALA A 23 14.188 6.051 3.858 1.00 0.00 C ATOM 301 C ALA A 23 12.877 6.003 3.079 1.00 0.00 C ATOM 302 O ALA A 23 12.163 7.004 2.979 1.00 0.00 O ATOM 303 CB ALA A 23 15.365 6.194 2.907 1.00 0.00 C ATOM 0 H ALA A 23 15.215 4.350 4.531 1.00 0.00 H new ATOM 0 HA ALA A 23 14.163 6.920 4.515 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.235 7.090 2.299 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.288 6.275 3.481 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.417 5.320 2.258 1.00 0.00 H new ATOM 309 N VAL A 24 12.564 4.831 2.532 1.00 0.00 N ATOM 310 CA VAL A 24 11.336 4.649 1.768 1.00 0.00 C ATOM 311 C VAL A 24 10.115 4.786 2.670 1.00 0.00 C ATOM 312 O VAL A 24 9.109 5.379 2.281 1.00 0.00 O ATOM 313 CB VAL A 24 11.297 3.274 1.071 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.051 3.144 0.208 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.551 3.061 0.239 1.00 0.00 C ATOM 0 H VAL A 24 13.144 3.995 2.604 1.00 0.00 H new ATOM 0 HA VAL A 24 11.318 5.427 1.005 1.00 0.00 H new ATOM 0 HB VAL A 24 11.261 2.502 1.839 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.043 2.167 -0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.164 3.248 0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.052 3.924 -0.553 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.505 2.085 -0.245 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.621 3.840 -0.520 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.428 3.105 0.885 1.00 0.00 H new ATOM 325 N VAL A 25 10.212 4.233 3.877 1.00 0.00 N ATOM 326 CA VAL A 25 9.116 4.301 4.836 1.00 0.00 C ATOM 327 C VAL A 25 8.729 5.749 5.105 1.00 0.00 C ATOM 328 O VAL A 25 7.550 6.071 5.260 1.00 0.00 O ATOM 329 CB VAL A 25 9.487 3.622 6.170 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.335 3.722 7.160 1.00 0.00 C ATOM 331 CG2 VAL A 25 9.874 2.170 5.940 1.00 0.00 C ATOM 0 H VAL A 25 11.036 3.735 4.212 1.00 0.00 H new ATOM 0 HA VAL A 25 8.271 3.770 4.397 1.00 0.00 H new ATOM 0 HB VAL A 25 10.346 4.142 6.593 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.616 3.237 8.095 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.108 4.771 7.349 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.455 3.229 6.746 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.133 1.707 6.892 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.035 1.636 5.493 1.00 0.00 H new ATOM 0 HG23 VAL A 25 10.732 2.124 5.269 1.00 0.00 H new ATOM 341 N GLY A 26 9.732 6.620 5.154 1.00 0.00 N ATOM 342 CA GLY A 26 9.483 8.028 5.396 1.00 0.00 C ATOM 343 C GLY A 26 8.744 8.682 4.247 1.00 0.00 C ATOM 344 O GLY A 26 7.775 9.414 4.459 1.00 0.00 O ATOM 0 H GLY A 26 10.714 6.374 5.030 1.00 0.00 H new ATOM 0 HA2 GLY A 26 8.902 8.141 6.311 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.431 8.541 5.555 1.00 0.00 H new ATOM 348 N TYR A 27 9.200 8.418 3.024 1.00 0.00 N ATOM 349 CA TYR A 27 8.569 8.983 1.837 1.00 0.00 C ATOM 350 C TYR A 27 7.129 8.498 1.708 1.00 0.00 C ATOM 351 O TYR A 27 6.292 9.158 1.092 1.00 0.00 O ATOM 352 CB TYR A 27 9.359 8.614 0.578 1.00 0.00 C ATOM 353 CG TYR A 27 10.755 9.202 0.539 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.978 10.537 0.854 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.848 8.420 0.186 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.250 11.076 0.819 1.00 0.00 C ATOM 357 CE2 TYR A 27 13.124 8.952 0.149 1.00 0.00 C ATOM 358 CZ TYR A 27 13.319 10.280 0.466 1.00 0.00 C ATOM 359 OH TYR A 27 14.586 10.813 0.429 1.00 0.00 O ATOM 0 H TYR A 27 10.002 7.818 2.831 1.00 0.00 H new ATOM 0 HA TYR A 27 8.564 10.068 1.943 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.430 7.528 0.510 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.807 8.953 -0.299 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.143 11.164 1.131 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.699 7.380 -0.064 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.406 12.116 1.067 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.963 8.331 -0.127 1.00 0.00 H new ATOM 0 HH TYR A 27 15.225 10.119 0.163 1.00 0.00 H new ATOM 369 N LEU A 28 6.848 7.338 2.296 1.00 0.00 N ATOM 370 CA LEU A 28 5.509 6.765 2.252 1.00 0.00 C ATOM 371 C LEU A 28 4.554 7.545 3.150 1.00 0.00 C ATOM 372 O LEU A 28 3.461 7.917 2.728 1.00 0.00 O ATOM 373 CB LEU A 28 5.547 5.295 2.680 1.00 0.00 C ATOM 374 CG LEU A 28 6.185 4.340 1.667 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.377 2.961 2.280 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.333 4.251 0.409 1.00 0.00 C ATOM 0 H LEU A 28 7.530 6.778 2.808 1.00 0.00 H new ATOM 0 HA LEU A 28 5.146 6.828 1.226 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.093 5.220 3.620 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.527 4.963 2.876 1.00 0.00 H new ATOM 0 HG LEU A 28 7.164 4.733 1.393 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.831 2.296 1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.027 3.038 3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.410 2.560 2.583 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.801 3.568 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.340 3.882 0.667 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.246 5.239 -0.042 1.00 0.00 H new ATOM 388 N GLU A 29 4.980 7.796 4.385 1.00 0.00 N ATOM 389 CA GLU A 29 4.161 8.531 5.344 1.00 0.00 C ATOM 390 C GLU A 29 3.808 9.915 4.813 1.00 0.00 C ATOM 391 O GLU A 29 2.697 10.405 5.018 1.00 0.00 O ATOM 392 CB GLU A 29 4.894 8.660 6.680 1.00 0.00 C ATOM 393 CG GLU A 29 5.225 7.324 7.325 1.00 0.00 C ATOM 394 CD GLU A 29 5.953 7.480 8.646 1.00 0.00 C ATOM 395 OE1 GLU A 29 7.198 7.580 8.630 1.00 0.00 O ATOM 396 OE2 GLU A 29 5.277 7.504 9.696 1.00 0.00 O ATOM 0 H GLU A 29 5.888 7.501 4.745 1.00 0.00 H new ATOM 0 HA GLU A 29 3.237 7.972 5.495 1.00 0.00 H new ATOM 0 HB2 GLU A 29 5.818 9.218 6.526 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.280 9.243 7.367 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.304 6.764 7.486 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.840 6.737 6.642 1.00 0.00 H new ATOM 403 N ASP A 30 4.762 10.542 4.132 1.00 0.00 N ATOM 404 CA ASP A 30 4.554 11.872 3.569 1.00 0.00 C ATOM 405 C ASP A 30 3.378 11.873 2.598 1.00 0.00 C ATOM 406 O ASP A 30 2.659 12.866 2.480 1.00 0.00 O ATOM 407 CB ASP A 30 5.820 12.349 2.858 1.00 0.00 C ATOM 408 CG ASP A 30 5.653 13.721 2.234 1.00 0.00 C ATOM 409 OD1 ASP A 30 5.215 13.791 1.066 1.00 0.00 O ATOM 410 OD2 ASP A 30 5.959 14.723 2.912 1.00 0.00 O ATOM 0 H ASP A 30 5.687 10.150 3.956 1.00 0.00 H new ATOM 0 HA ASP A 30 4.326 12.556 4.387 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.645 12.375 3.570 1.00 0.00 H new ATOM 0 HB3 ASP A 30 6.090 11.631 2.083 1.00 0.00 H new ATOM 415 N ILE A 31 3.189 10.756 1.903 1.00 0.00 N ATOM 416 CA ILE A 31 2.101 10.629 0.941 1.00 0.00 C ATOM 417 C ILE A 31 0.796 10.238 1.632 1.00 0.00 C ATOM 418 O ILE A 31 -0.282 10.674 1.232 1.00 0.00 O ATOM 419 CB ILE A 31 2.431 9.584 -0.144 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.744 9.945 -0.844 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.294 9.486 -1.152 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.223 8.891 -1.819 1.00 0.00 C ATOM 0 H ILE A 31 3.775 9.926 1.988 1.00 0.00 H new ATOM 0 HA ILE A 31 1.979 11.604 0.470 1.00 0.00 H new ATOM 0 HB ILE A 31 2.549 8.611 0.332 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.615 10.888 -1.376 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.515 10.107 -0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.543 8.744 -1.911 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.379 9.188 -0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.145 10.455 -1.628 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.158 9.216 -2.276 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.385 7.952 -1.289 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.471 8.745 -2.595 1.00 0.00 H new ATOM 434 N ILE A 32 0.902 9.415 2.671 1.00 0.00 N ATOM 435 CA ILE A 32 -0.271 8.964 3.413 1.00 0.00 C ATOM 436 C ILE A 32 -1.037 10.144 4.006 1.00 0.00 C ATOM 437 O ILE A 32 -2.268 10.142 4.037 1.00 0.00 O ATOM 438 CB ILE A 32 0.119 7.992 4.547 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.811 6.756 3.968 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.111 7.589 5.351 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.382 5.829 5.020 1.00 0.00 C ATOM 0 H ILE A 32 1.788 9.047 3.018 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.912 8.441 2.703 1.00 0.00 H new ATOM 0 HB ILE A 32 0.814 8.498 5.217 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.097 6.203 3.358 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.614 7.077 3.305 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.817 6.904 6.146 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.567 8.477 5.788 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.829 7.097 4.695 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.856 4.976 4.535 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.121 6.365 5.615 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.580 5.477 5.669 1.00 0.00 H new ATOM 453 N MET A 33 -0.305 11.150 4.472 1.00 0.00 N ATOM 454 CA MET A 33 -0.922 12.331 5.066 1.00 0.00 C ATOM 455 C MET A 33 -1.127 13.427 4.023 1.00 0.00 C ATOM 456 O MET A 33 -1.628 14.507 4.335 1.00 0.00 O ATOM 457 CB MET A 33 -0.057 12.863 6.211 1.00 0.00 C ATOM 458 CG MET A 33 0.223 11.833 7.296 1.00 0.00 C ATOM 459 SD MET A 33 -1.282 11.195 8.060 1.00 0.00 S ATOM 460 CE MET A 33 -1.935 12.679 8.821 1.00 0.00 C ATOM 0 H MET A 33 0.715 11.172 4.450 1.00 0.00 H new ATOM 0 HA MET A 33 -1.897 12.039 5.457 1.00 0.00 H new ATOM 0 HB2 MET A 33 0.891 13.216 5.805 1.00 0.00 H new ATOM 0 HB3 MET A 33 -0.553 13.724 6.659 1.00 0.00 H new ATOM 0 HG2 MET A 33 0.787 11.004 6.867 1.00 0.00 H new ATOM 0 HG3 MET A 33 0.852 12.283 8.064 1.00 0.00 H new ATOM 0 HE1 MET A 33 -2.692 12.408 9.557 1.00 0.00 H new ATOM 0 HE2 MET A 33 -1.128 13.221 9.314 1.00 0.00 H new ATOM 0 HE3 MET A 33 -2.383 13.313 8.056 1.00 0.00 H new ATOM 470 N ASP A 34 -0.737 13.142 2.784 1.00 0.00 N ATOM 471 CA ASP A 34 -0.875 14.107 1.699 1.00 0.00 C ATOM 472 C ASP A 34 -2.346 14.357 1.376 1.00 0.00 C ATOM 473 O ASP A 34 -3.133 13.417 1.248 1.00 0.00 O ATOM 474 CB ASP A 34 -0.139 13.612 0.453 1.00 0.00 C ATOM 475 CG ASP A 34 -0.097 14.654 -0.645 1.00 0.00 C ATOM 476 OD1 ASP A 34 0.700 15.609 -0.527 1.00 0.00 O ATOM 477 OD2 ASP A 34 -0.860 14.517 -1.622 1.00 0.00 O ATOM 0 H ASP A 34 -0.323 12.252 2.507 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.431 15.048 2.023 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.879 13.332 0.723 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.628 12.713 0.078 1.00 0.00 H new ATOM 482 N ASP A 35 -2.706 15.631 1.241 1.00 0.00 N ATOM 483 CA ASP A 35 -4.080 16.019 0.940 1.00 0.00 C ATOM 484 C ASP A 35 -4.591 15.339 -0.328 1.00 0.00 C ATOM 485 O ASP A 35 -5.686 14.777 -0.341 1.00 0.00 O ATOM 486 CB ASP A 35 -4.175 17.538 0.789 1.00 0.00 C ATOM 487 CG ASP A 35 -3.786 18.271 2.058 1.00 0.00 C ATOM 488 OD1 ASP A 35 -2.576 18.499 2.265 1.00 0.00 O ATOM 489 OD2 ASP A 35 -4.692 18.616 2.845 1.00 0.00 O ATOM 0 H ASP A 35 -2.061 16.415 1.336 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.706 15.695 1.771 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.528 17.860 -0.026 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.194 17.810 0.514 1.00 0.00 H new ATOM 494 N GLU A 36 -3.793 15.393 -1.391 1.00 0.00 N ATOM 495 CA GLU A 36 -4.173 14.788 -2.665 1.00 0.00 C ATOM 496 C GLU A 36 -4.453 13.296 -2.507 1.00 0.00 C ATOM 497 O GLU A 36 -5.292 12.735 -3.212 1.00 0.00 O ATOM 498 CB GLU A 36 -3.073 15.003 -3.706 1.00 0.00 C ATOM 499 CG GLU A 36 -3.423 14.467 -5.085 1.00 0.00 C ATOM 500 CD GLU A 36 -4.647 15.139 -5.678 1.00 0.00 C ATOM 501 OE1 GLU A 36 -4.484 16.174 -6.357 1.00 0.00 O ATOM 502 OE2 GLU A 36 -5.766 14.627 -5.464 1.00 0.00 O ATOM 0 H GLU A 36 -2.880 15.849 -1.396 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.088 15.274 -3.004 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.862 16.070 -3.783 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.159 14.521 -3.360 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.574 14.611 -5.753 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.598 13.393 -5.020 1.00 0.00 H new ATOM 509 N PHE A 37 -3.745 12.658 -1.581 1.00 0.00 N ATOM 510 CA PHE A 37 -3.922 11.231 -1.338 1.00 0.00 C ATOM 511 C PHE A 37 -5.227 10.962 -0.598 1.00 0.00 C ATOM 512 O PHE A 37 -5.900 9.964 -0.852 1.00 0.00 O ATOM 513 CB PHE A 37 -2.741 10.676 -0.540 1.00 0.00 C ATOM 514 CG PHE A 37 -2.866 9.213 -0.220 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.764 8.261 -1.221 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.085 8.791 1.082 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.878 6.914 -0.930 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.200 7.446 1.379 1.00 0.00 C ATOM 519 CZ PHE A 37 -3.096 6.506 0.372 1.00 0.00 C ATOM 0 H PHE A 37 -3.045 13.105 -0.988 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.965 10.727 -2.303 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.823 10.839 -1.105 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.646 11.236 0.390 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.593 8.574 -2.240 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.167 9.521 1.873 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.797 6.182 -1.720 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.371 7.130 2.398 1.00 0.00 H new ATOM 0 HZ PHE A 37 -3.185 5.455 0.602 1.00 0.00 H new ATOM 529 N GLN A 38 -5.577 11.858 0.318 1.00 0.00 N ATOM 530 CA GLN A 38 -6.805 11.719 1.091 1.00 0.00 C ATOM 531 C GLN A 38 -8.028 11.829 0.186 1.00 0.00 C ATOM 532 O GLN A 38 -9.018 11.121 0.373 1.00 0.00 O ATOM 533 CB GLN A 38 -6.869 12.782 2.184 1.00 0.00 C ATOM 534 CG GLN A 38 -5.850 12.575 3.289 1.00 0.00 C ATOM 535 CD GLN A 38 -6.014 11.247 4.001 1.00 0.00 C ATOM 536 OE1 GLN A 38 -7.114 10.697 4.074 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.917 10.726 4.539 1.00 0.00 N ATOM 0 H GLN A 38 -5.028 12.688 0.543 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.804 10.733 1.556 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.713 13.763 1.735 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.869 12.786 2.618 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -4.847 12.634 2.867 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -5.939 13.384 4.014 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -4.026 11.215 4.455 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.966 9.837 5.036 1.00 0.00 H new ATOM 546 N LEU A 39 -7.948 12.720 -0.797 1.00 0.00 N ATOM 547 CA LEU A 39 -9.045 12.929 -1.734 1.00 0.00 C ATOM 548 C LEU A 39 -9.229 11.717 -2.642 1.00 0.00 C ATOM 549 O LEU A 39 -10.340 11.216 -2.806 1.00 0.00 O ATOM 550 CB LEU A 39 -8.785 14.176 -2.583 1.00 0.00 C ATOM 551 CG LEU A 39 -9.896 14.532 -3.573 1.00 0.00 C ATOM 552 CD1 LEU A 39 -11.160 14.945 -2.834 1.00 0.00 C ATOM 553 CD2 LEU A 39 -9.441 15.638 -4.512 1.00 0.00 C ATOM 0 H LEU A 39 -7.133 13.310 -0.965 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.959 13.069 -1.156 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.629 15.024 -1.916 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.858 14.032 -3.138 1.00 0.00 H new ATOM 0 HG LEU A 39 -10.121 13.647 -4.168 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.938 15.194 -3.555 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.499 14.122 -2.205 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.950 15.815 -2.212 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.244 15.877 -5.209 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.187 16.526 -3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.565 15.305 -5.069 1.00 0.00 H new ATOM 565 N LEU A 40 -8.130 11.251 -3.226 1.00 0.00 N ATOM 566 CA LEU A 40 -8.161 10.102 -4.125 1.00 0.00 C ATOM 567 C LEU A 40 -8.679 8.851 -3.417 1.00 0.00 C ATOM 568 O LEU A 40 -9.527 8.135 -3.947 1.00 0.00 O ATOM 569 CB LEU A 40 -6.762 9.837 -4.690 1.00 0.00 C ATOM 570 CG LEU A 40 -6.626 8.566 -5.534 1.00 0.00 C ATOM 571 CD1 LEU A 40 -6.381 8.913 -6.995 1.00 0.00 C ATOM 572 CD2 LEU A 40 -5.501 7.690 -5.001 1.00 0.00 C ATOM 0 H LEU A 40 -7.202 11.653 -3.092 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.845 10.337 -4.941 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.467 10.691 -5.299 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.058 9.779 -3.860 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.561 8.010 -5.466 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.287 7.996 -7.576 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -7.218 9.500 -7.375 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.462 9.493 -7.082 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.419 6.791 -5.613 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.562 8.242 -5.038 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.716 7.409 -3.970 1.00 0.00 H new ATOM 584 N GLN A 41 -8.168 8.597 -2.218 1.00 0.00 N ATOM 585 CA GLN A 41 -8.564 7.423 -1.448 1.00 0.00 C ATOM 586 C GLN A 41 -10.063 7.419 -1.149 1.00 0.00 C ATOM 587 O GLN A 41 -10.760 6.452 -1.453 1.00 0.00 O ATOM 588 CB GLN A 41 -7.775 7.360 -0.140 1.00 0.00 C ATOM 589 CG GLN A 41 -7.935 6.044 0.603 1.00 0.00 C ATOM 590 CD GLN A 41 -7.436 4.858 -0.198 1.00 0.00 C ATOM 591 OE1 GLN A 41 -6.522 4.984 -1.013 1.00 0.00 O ATOM 592 NE2 GLN A 41 -8.037 3.694 0.029 1.00 0.00 N ATOM 0 H GLN A 41 -7.477 9.189 -1.757 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.341 6.544 -2.053 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.718 7.521 -0.354 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.096 8.175 0.508 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.391 6.095 1.546 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.986 5.895 0.849 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.791 3.634 0.714 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.744 2.861 -0.481 1.00 0.00 H new ATOM 601 N ARG A 42 -10.553 8.502 -0.557 1.00 0.00 N ATOM 602 CA ARG A 42 -11.967 8.612 -0.209 1.00 0.00 C ATOM 603 C ARG A 42 -12.852 8.643 -1.454 1.00 0.00 C ATOM 604 O ARG A 42 -13.982 8.153 -1.431 1.00 0.00 O ATOM 605 CB ARG A 42 -12.212 9.863 0.637 1.00 0.00 C ATOM 606 CG ARG A 42 -11.991 9.649 2.128 1.00 0.00 C ATOM 607 CD ARG A 42 -10.541 9.314 2.443 1.00 0.00 C ATOM 608 NE ARG A 42 -10.359 8.954 3.846 1.00 0.00 N ATOM 609 CZ ARG A 42 -9.250 8.403 4.330 1.00 0.00 C ATOM 610 NH1 ARG A 42 -8.219 8.165 3.531 1.00 0.00 N ATOM 611 NH2 ARG A 42 -9.171 8.091 5.617 1.00 0.00 N ATOM 0 H ARG A 42 -9.993 9.317 -0.307 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.232 7.728 0.371 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.552 10.659 0.292 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.234 10.205 0.476 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -12.282 10.548 2.671 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.635 8.842 2.479 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.213 8.489 1.811 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.910 10.170 2.203 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.127 9.136 4.492 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.275 8.405 2.541 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -7.370 7.742 3.906 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -9.961 8.274 6.236 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.320 7.668 5.988 1.00 0.00 H new ATOM 625 N ASN A 43 -12.337 9.219 -2.534 1.00 0.00 N ATOM 626 CA ASN A 43 -13.091 9.316 -3.782 1.00 0.00 C ATOM 627 C ASN A 43 -13.479 7.935 -4.303 1.00 0.00 C ATOM 628 O ASN A 43 -14.637 7.696 -4.646 1.00 0.00 O ATOM 629 CB ASN A 43 -12.274 10.063 -4.840 1.00 0.00 C ATOM 630 CG ASN A 43 -13.089 10.395 -6.077 1.00 0.00 C ATOM 631 OD1 ASN A 43 -14.011 9.668 -6.445 1.00 0.00 O ATOM 632 ND2 ASN A 43 -12.749 11.501 -6.729 1.00 0.00 N ATOM 0 H ASN A 43 -11.402 9.626 -2.573 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.006 9.872 -3.577 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.883 10.984 -4.409 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.415 9.456 -5.127 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.259 11.775 -7.569 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.978 12.076 -6.390 1.00 0.00 H new ATOM 639 N PHE A 44 -12.510 7.026 -4.357 1.00 0.00 N ATOM 640 CA PHE A 44 -12.763 5.675 -4.849 1.00 0.00 C ATOM 641 C PHE A 44 -13.444 4.810 -3.790 1.00 0.00 C ATOM 642 O PHE A 44 -14.284 3.972 -4.116 1.00 0.00 O ATOM 643 CB PHE A 44 -11.457 5.020 -5.308 1.00 0.00 C ATOM 644 CG PHE A 44 -10.983 5.517 -6.647 1.00 0.00 C ATOM 645 CD1 PHE A 44 -10.230 6.675 -6.745 1.00 0.00 C ATOM 646 CD2 PHE A 44 -11.297 4.827 -7.807 1.00 0.00 C ATOM 647 CE1 PHE A 44 -9.797 7.137 -7.974 1.00 0.00 C ATOM 648 CE2 PHE A 44 -10.867 5.283 -9.039 1.00 0.00 C ATOM 649 CZ PHE A 44 -10.116 6.440 -9.122 1.00 0.00 C ATOM 0 H PHE A 44 -11.547 7.199 -4.068 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.439 5.755 -5.700 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.683 5.207 -4.564 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.597 3.940 -5.357 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.978 7.224 -5.850 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.884 3.923 -7.748 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.210 8.042 -8.036 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.118 4.736 -9.936 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.779 6.798 -10.084 1.00 0.00 H new ATOM 659 N MET A 45 -13.087 5.017 -2.527 1.00 0.00 N ATOM 660 CA MET A 45 -13.677 4.246 -1.433 1.00 0.00 C ATOM 661 C MET A 45 -15.183 4.470 -1.351 1.00 0.00 C ATOM 662 O MET A 45 -15.918 3.620 -0.851 1.00 0.00 O ATOM 663 CB MET A 45 -13.027 4.618 -0.100 1.00 0.00 C ATOM 664 CG MET A 45 -11.660 3.990 0.108 1.00 0.00 C ATOM 665 SD MET A 45 -10.948 4.396 1.715 1.00 0.00 S ATOM 666 CE MET A 45 -12.200 3.733 2.813 1.00 0.00 C ATOM 0 H MET A 45 -12.396 5.708 -2.234 1.00 0.00 H new ATOM 0 HA MET A 45 -13.494 3.191 -1.637 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.932 5.702 -0.042 1.00 0.00 H new ATOM 0 HB3 MET A 45 -13.685 4.312 0.713 1.00 0.00 H new ATOM 0 HG2 MET A 45 -11.744 2.907 0.015 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.986 4.327 -0.680 1.00 0.00 H new ATOM 0 HE1 MET A 45 -11.762 3.545 3.793 1.00 0.00 H new ATOM 0 HE2 MET A 45 -13.015 4.450 2.911 1.00 0.00 H new ATOM 0 HE3 MET A 45 -12.586 2.800 2.403 1.00 0.00 H new ATOM 676 N ASP A 46 -15.634 5.619 -1.845 1.00 0.00 N ATOM 677 CA ASP A 46 -17.052 5.960 -1.824 1.00 0.00 C ATOM 678 C ASP A 46 -17.869 4.982 -2.665 1.00 0.00 C ATOM 679 O ASP A 46 -19.034 4.717 -2.370 1.00 0.00 O ATOM 680 CB ASP A 46 -17.262 7.387 -2.336 1.00 0.00 C ATOM 681 CG ASP A 46 -18.727 7.763 -2.417 1.00 0.00 C ATOM 682 OD1 ASP A 46 -19.292 8.178 -1.384 1.00 0.00 O ATOM 683 OD2 ASP A 46 -19.312 7.640 -3.514 1.00 0.00 O ATOM 0 H ASP A 46 -15.036 6.331 -2.265 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.396 5.893 -0.792 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.747 8.086 -1.677 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.809 7.486 -3.323 1.00 0.00 H new ATOM 688 N LYS A 47 -17.250 4.452 -3.714 1.00 0.00 N ATOM 689 CA LYS A 47 -17.920 3.511 -4.606 1.00 0.00 C ATOM 690 C LYS A 47 -17.596 2.070 -4.225 1.00 0.00 C ATOM 691 O LYS A 47 -18.477 1.210 -4.194 1.00 0.00 O ATOM 692 CB LYS A 47 -17.497 3.779 -6.052 1.00 0.00 C ATOM 693 CG LYS A 47 -18.481 3.258 -7.089 1.00 0.00 C ATOM 694 CD LYS A 47 -18.301 1.770 -7.349 1.00 0.00 C ATOM 695 CE LYS A 47 -16.985 1.479 -8.052 1.00 0.00 C ATOM 696 NZ LYS A 47 -16.850 0.039 -8.404 1.00 0.00 N ATOM 0 H LYS A 47 -16.284 4.658 -3.968 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.997 3.653 -4.511 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -17.373 4.853 -6.191 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -16.524 3.320 -6.226 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -19.499 3.446 -6.749 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -18.350 3.807 -8.021 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -18.337 1.228 -6.404 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.128 1.404 -7.958 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -16.916 2.082 -8.957 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -16.156 1.775 -7.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -16.068 -0.081 -9.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -16.652 -0.512 -7.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -17.735 -0.297 -8.835 1.00 0.00 H new ATOM 710 N TYR A 48 -16.325 1.814 -3.937 1.00 0.00 N ATOM 711 CA TYR A 48 -15.872 0.477 -3.565 1.00 0.00 C ATOM 712 C TYR A 48 -16.636 -0.068 -2.360 1.00 0.00 C ATOM 713 O TYR A 48 -17.104 -1.206 -2.378 1.00 0.00 O ATOM 714 CB TYR A 48 -14.374 0.495 -3.261 1.00 0.00 C ATOM 715 CG TYR A 48 -13.491 0.425 -4.488 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.627 1.341 -5.525 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.512 -0.554 -4.606 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.816 1.282 -6.642 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.697 -0.621 -5.720 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.852 0.299 -6.734 1.00 0.00 C ATOM 721 OH TYR A 48 -11.042 0.237 -7.844 1.00 0.00 O ATOM 0 H TYR A 48 -15.587 2.517 -3.954 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.068 -0.182 -4.411 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.138 1.404 -2.709 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.137 -0.345 -2.608 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.380 2.112 -5.456 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.386 -1.276 -3.813 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.936 2.001 -7.439 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.943 -1.390 -5.795 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.105 0.179 -7.562 1.00 0.00 H new ATOM 731 N TYR A 49 -16.762 0.745 -1.312 1.00 0.00 N ATOM 732 CA TYR A 49 -17.458 0.322 -0.099 1.00 0.00 C ATOM 733 C TYR A 49 -18.924 -0.002 -0.386 1.00 0.00 C ATOM 734 O TYR A 49 -19.578 -0.693 0.395 1.00 0.00 O ATOM 735 CB TYR A 49 -17.337 1.396 0.994 1.00 0.00 C ATOM 736 CG TYR A 49 -18.570 2.259 1.174 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.783 3.379 0.379 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.517 1.957 2.147 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.902 4.172 0.549 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.639 2.745 2.320 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.827 3.850 1.519 1.00 0.00 C ATOM 742 OH TYR A 49 -21.943 4.638 1.690 1.00 0.00 O ATOM 0 H TYR A 49 -16.393 1.695 -1.279 1.00 0.00 H new ATOM 0 HA TYR A 49 -16.983 -0.590 0.262 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.111 0.907 1.942 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.490 2.041 0.759 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -18.062 3.634 -0.384 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.373 1.092 2.778 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -20.051 5.040 -0.076 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.365 2.496 3.080 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.494 4.273 2.414 1.00 0.00 H new ATOM 752 N LEU A 50 -19.432 0.497 -1.510 1.00 0.00 N ATOM 753 CA LEU A 50 -20.821 0.254 -1.894 1.00 0.00 C ATOM 754 C LEU A 50 -20.975 -1.114 -2.553 1.00 0.00 C ATOM 755 O LEU A 50 -21.923 -1.846 -2.267 1.00 0.00 O ATOM 756 CB LEU A 50 -21.316 1.348 -2.846 1.00 0.00 C ATOM 757 CG LEU A 50 -21.560 2.716 -2.205 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.889 3.752 -3.270 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.682 2.633 -1.181 1.00 0.00 C ATOM 0 H LEU A 50 -18.905 1.070 -2.169 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.425 0.272 -0.987 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.586 1.466 -3.647 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.244 1.011 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.648 3.023 -1.693 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -22.060 4.719 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -21.057 3.832 -3.969 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.787 3.448 -3.808 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.841 3.615 -0.736 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.598 2.304 -1.671 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.411 1.921 -0.402 1.00 0.00 H new ATOM 771 N GLU A 51 -20.038 -1.451 -3.433 1.00 0.00 N ATOM 772 CA GLU A 51 -20.073 -2.727 -4.140 1.00 0.00 C ATOM 773 C GLU A 51 -19.833 -3.896 -3.188 1.00 0.00 C ATOM 774 O GLU A 51 -20.485 -4.935 -3.292 1.00 0.00 O ATOM 775 CB GLU A 51 -19.028 -2.741 -5.256 1.00 0.00 C ATOM 776 CG GLU A 51 -19.218 -1.633 -6.278 1.00 0.00 C ATOM 777 CD GLU A 51 -20.545 -1.733 -7.005 1.00 0.00 C ATOM 778 OE1 GLU A 51 -21.534 -1.145 -6.519 1.00 0.00 O ATOM 779 OE2 GLU A 51 -20.594 -2.399 -8.060 1.00 0.00 O ATOM 0 H GLU A 51 -19.244 -0.858 -3.674 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.066 -2.841 -4.574 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.035 -2.651 -4.815 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.064 -3.704 -5.765 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -19.154 -0.667 -5.777 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.406 -1.670 -7.004 1.00 0.00 H new ATOM 786 N PHE A 52 -18.898 -3.718 -2.261 1.00 0.00 N ATOM 787 CA PHE A 52 -18.576 -4.765 -1.295 1.00 0.00 C ATOM 788 C PHE A 52 -19.688 -4.913 -0.261 1.00 0.00 C ATOM 789 O PHE A 52 -19.677 -4.251 0.777 1.00 0.00 O ATOM 790 CB PHE A 52 -17.250 -4.460 -0.595 1.00 0.00 C ATOM 791 CG PHE A 52 -16.041 -4.815 -1.414 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.710 -4.086 -2.545 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.233 -5.880 -1.049 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.596 -4.411 -3.296 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.118 -6.210 -1.797 1.00 0.00 C ATOM 796 CZ PHE A 52 -13.799 -5.475 -2.922 1.00 0.00 C ATOM 0 H PHE A 52 -18.351 -2.863 -2.157 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.481 -5.705 -1.839 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.214 -3.398 -0.351 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.213 -5.006 0.348 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.330 -3.254 -2.843 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.477 -6.459 -0.170 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.349 -3.833 -4.174 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.497 -7.042 -1.502 1.00 0.00 H new ATOM 0 HZ PHE A 52 -12.929 -5.732 -3.508 1.00 0.00 H new ATOM 806 N GLU A 53 -20.653 -5.780 -0.558 1.00 0.00 N ATOM 807 CA GLU A 53 -21.771 -6.019 0.348 1.00 0.00 C ATOM 808 C GLU A 53 -21.656 -7.393 0.997 1.00 0.00 C ATOM 809 O GLU A 53 -21.296 -8.372 0.344 1.00 0.00 O ATOM 810 CB GLU A 53 -23.098 -5.909 -0.403 1.00 0.00 C ATOM 811 CG GLU A 53 -24.317 -6.030 0.496 1.00 0.00 C ATOM 812 CD GLU A 53 -25.616 -5.832 -0.257 1.00 0.00 C ATOM 813 OE1 GLU A 53 -26.153 -6.828 -0.787 1.00 0.00 O ATOM 814 OE2 GLU A 53 -26.097 -4.681 -0.320 1.00 0.00 O ATOM 0 H GLU A 53 -20.682 -6.328 -1.418 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.741 -5.260 1.130 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.134 -4.951 -0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -23.140 -6.687 -1.165 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -24.320 -7.013 0.967 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -24.249 -5.293 1.296 1.00 0.00 H new ATOM 821 N ASP A 54 -21.971 -7.458 2.286 1.00 0.00 N ATOM 822 CA ASP A 54 -21.903 -8.712 3.026 1.00 0.00 C ATOM 823 C ASP A 54 -22.971 -9.691 2.546 1.00 0.00 C ATOM 824 O ASP A 54 -24.146 -9.561 2.889 1.00 0.00 O ATOM 825 CB ASP A 54 -22.066 -8.453 4.524 1.00 0.00 C ATOM 826 CG ASP A 54 -22.065 -9.734 5.334 1.00 0.00 C ATOM 827 OD1 ASP A 54 -20.969 -10.282 5.577 1.00 0.00 O ATOM 828 OD2 ASP A 54 -23.159 -10.190 5.726 1.00 0.00 O ATOM 0 H ASP A 54 -22.276 -6.657 2.840 1.00 0.00 H new ATOM 0 HA ASP A 54 -20.925 -9.157 2.845 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.258 -7.808 4.869 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -22.999 -7.917 4.698 1.00 0.00 H new ATOM 833 N THR A 55 -22.552 -10.667 1.747 1.00 0.00 N ATOM 834 CA THR A 55 -23.467 -11.676 1.225 1.00 0.00 C ATOM 835 C THR A 55 -22.904 -13.080 1.421 1.00 0.00 C ATOM 836 O THR A 55 -21.782 -13.248 1.899 1.00 0.00 O ATOM 837 CB THR A 55 -23.759 -11.453 -0.271 1.00 0.00 C ATOM 838 OG1 THR A 55 -22.534 -11.428 -1.013 1.00 0.00 O ATOM 839 CG2 THR A 55 -24.516 -10.151 -0.483 1.00 0.00 C ATOM 0 H THR A 55 -21.584 -10.781 1.447 1.00 0.00 H new ATOM 0 HA THR A 55 -24.398 -11.579 1.784 1.00 0.00 H new ATOM 0 HB THR A 55 -24.378 -12.277 -0.626 1.00 0.00 H new ATOM 0 HG1 THR A 55 -22.412 -12.285 -1.472 1.00 0.00 H new ATOM 0 HG21 THR A 55 -24.712 -10.013 -1.546 1.00 0.00 H new ATOM 0 HG22 THR A 55 -25.461 -10.187 0.058 1.00 0.00 H new ATOM 0 HG23 THR A 55 -23.918 -9.318 -0.113 1.00 0.00 H new ATOM 847 N GLU A 56 -23.690 -14.086 1.048 1.00 0.00 N ATOM 848 CA GLU A 56 -23.271 -15.477 1.187 1.00 0.00 C ATOM 849 C GLU A 56 -22.704 -16.010 -0.126 1.00 0.00 C ATOM 850 O GLU A 56 -22.023 -17.035 -0.148 1.00 0.00 O ATOM 851 CB GLU A 56 -24.449 -16.341 1.641 1.00 0.00 C ATOM 852 CG GLU A 56 -25.616 -16.346 0.666 1.00 0.00 C ATOM 853 CD GLU A 56 -26.800 -17.145 1.177 1.00 0.00 C ATOM 854 OE1 GLU A 56 -26.783 -18.386 1.039 1.00 0.00 O ATOM 855 OE2 GLU A 56 -27.745 -16.529 1.714 1.00 0.00 O ATOM 0 H GLU A 56 -24.620 -13.964 0.647 1.00 0.00 H new ATOM 0 HA GLU A 56 -22.486 -15.522 1.942 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -24.103 -17.365 1.785 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -24.798 -15.983 2.610 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -25.930 -15.320 0.476 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -25.287 -16.760 -0.287 1.00 0.00 H new ATOM 862 N GLU A 57 -22.988 -15.305 -1.218 1.00 0.00 N ATOM 863 CA GLU A 57 -22.506 -15.707 -2.535 1.00 0.00 C ATOM 864 C GLU A 57 -21.412 -14.764 -3.030 1.00 0.00 C ATOM 865 O GLU A 57 -21.372 -13.594 -2.652 1.00 0.00 O ATOM 866 CB GLU A 57 -23.663 -15.731 -3.537 1.00 0.00 C ATOM 867 CG GLU A 57 -24.340 -14.382 -3.717 1.00 0.00 C ATOM 868 CD GLU A 57 -25.501 -14.435 -4.690 1.00 0.00 C ATOM 869 OE1 GLU A 57 -25.266 -14.260 -5.904 1.00 0.00 O ATOM 870 OE2 GLU A 57 -26.644 -14.652 -4.238 1.00 0.00 O ATOM 0 H GLU A 57 -23.549 -14.453 -1.216 1.00 0.00 H new ATOM 0 HA GLU A 57 -22.084 -16.708 -2.448 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -23.290 -16.072 -4.502 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -24.404 -16.459 -3.206 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -24.698 -14.028 -2.750 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -23.607 -13.657 -4.071 1.00 0.00 H new ATOM 877 N ASN A 58 -20.531 -15.283 -3.881 1.00 0.00 N ATOM 878 CA ASN A 58 -19.438 -14.487 -4.429 1.00 0.00 C ATOM 879 C ASN A 58 -19.784 -13.977 -5.823 1.00 0.00 C ATOM 880 O ASN A 58 -20.220 -14.742 -6.684 1.00 0.00 O ATOM 881 CB ASN A 58 -18.152 -15.317 -4.484 1.00 0.00 C ATOM 882 CG ASN A 58 -16.977 -14.529 -5.030 1.00 0.00 C ATOM 883 OD1 ASN A 58 -16.251 -13.876 -4.282 1.00 0.00 O ATOM 884 ND2 ASN A 58 -16.782 -14.588 -6.344 1.00 0.00 N ATOM 0 H ASN A 58 -20.553 -16.250 -4.205 1.00 0.00 H new ATOM 0 HA ASN A 58 -19.283 -13.630 -3.774 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -17.912 -15.676 -3.483 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -18.317 -16.196 -5.107 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.006 -14.079 -6.768 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -17.408 -15.142 -6.928 1.00 0.00 H new ATOM 891 N LYS A 59 -19.591 -12.680 -6.039 1.00 0.00 N ATOM 892 CA LYS A 59 -19.883 -12.070 -7.331 1.00 0.00 C ATOM 893 C LYS A 59 -18.618 -11.961 -8.176 1.00 0.00 C ATOM 894 O LYS A 59 -17.509 -11.903 -7.647 1.00 0.00 O ATOM 895 CB LYS A 59 -20.507 -10.687 -7.140 1.00 0.00 C ATOM 896 CG LYS A 59 -21.835 -10.720 -6.400 1.00 0.00 C ATOM 897 CD LYS A 59 -22.401 -9.322 -6.195 1.00 0.00 C ATOM 898 CE LYS A 59 -22.771 -8.663 -7.517 1.00 0.00 C ATOM 899 NZ LYS A 59 -23.756 -9.473 -8.286 1.00 0.00 N ATOM 0 H LYS A 59 -19.234 -12.032 -5.337 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.595 -12.708 -7.854 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -19.809 -10.055 -6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.655 -10.225 -8.116 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -22.549 -11.323 -6.961 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -21.700 -11.203 -5.432 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -23.283 -9.377 -5.557 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -21.668 -8.706 -5.674 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -23.186 -7.673 -7.326 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -21.871 -8.521 -8.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -24.172 -8.890 -9.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -23.277 -10.294 -8.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -24.509 -9.802 -7.648 1.00 0.00 H new ATOM 913 N LEU A 60 -18.795 -11.935 -9.492 1.00 0.00 N ATOM 914 CA LEU A 60 -17.669 -11.837 -10.413 1.00 0.00 C ATOM 915 C LEU A 60 -17.179 -10.395 -10.529 1.00 0.00 C ATOM 916 O LEU A 60 -16.064 -10.144 -10.987 1.00 0.00 O ATOM 917 CB LEU A 60 -18.068 -12.368 -11.793 1.00 0.00 C ATOM 918 CG LEU A 60 -16.933 -12.443 -12.816 1.00 0.00 C ATOM 919 CD1 LEU A 60 -15.896 -13.472 -12.391 1.00 0.00 C ATOM 920 CD2 LEU A 60 -17.482 -12.777 -14.196 1.00 0.00 C ATOM 0 H LEU A 60 -19.708 -11.980 -9.945 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.854 -12.444 -10.018 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -18.493 -13.364 -11.672 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -18.857 -11.732 -12.195 1.00 0.00 H new ATOM 0 HG LEU A 60 -16.448 -11.468 -12.864 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -15.097 -13.511 -13.131 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.481 -13.192 -11.423 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -16.367 -14.452 -12.314 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -16.661 -12.827 -14.912 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -17.992 -13.740 -14.161 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -18.186 -12.004 -14.504 1.00 0.00 H new ATOM 932 N ILE A 61 -18.017 -9.452 -10.107 1.00 0.00 N ATOM 933 CA ILE A 61 -17.674 -8.035 -10.168 1.00 0.00 C ATOM 934 C ILE A 61 -16.477 -7.712 -9.271 1.00 0.00 C ATOM 935 O ILE A 61 -15.858 -6.654 -9.398 1.00 0.00 O ATOM 936 CB ILE A 61 -18.876 -7.155 -9.759 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.613 -5.685 -10.097 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.177 -7.316 -8.275 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.518 -5.410 -11.583 1.00 0.00 C ATOM 0 H ILE A 61 -18.940 -9.645 -9.718 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.407 -7.815 -11.201 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.747 -7.485 -10.325 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.412 -5.076 -9.674 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.685 -5.372 -9.618 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -20.027 -6.688 -8.006 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.414 -8.358 -8.063 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.306 -7.016 -7.692 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.331 -4.349 -11.745 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.701 -5.992 -12.009 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.454 -5.691 -12.066 1.00 0.00 H new ATOM 951 N TYR A 62 -16.146 -8.637 -8.373 1.00 0.00 N ATOM 952 CA TYR A 62 -15.025 -8.446 -7.458 1.00 0.00 C ATOM 953 C TYR A 62 -13.687 -8.535 -8.188 1.00 0.00 C ATOM 954 O TYR A 62 -12.684 -7.993 -7.724 1.00 0.00 O ATOM 955 CB TYR A 62 -15.073 -9.484 -6.333 1.00 0.00 C ATOM 956 CG TYR A 62 -16.110 -9.187 -5.273 1.00 0.00 C ATOM 957 CD1 TYR A 62 -17.465 -9.343 -5.535 1.00 0.00 C ATOM 958 CD2 TYR A 62 -15.733 -8.753 -4.009 1.00 0.00 C ATOM 959 CE1 TYR A 62 -18.415 -9.074 -4.567 1.00 0.00 C ATOM 960 CE2 TYR A 62 -16.676 -8.482 -3.035 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.015 -8.644 -3.319 1.00 0.00 C ATOM 962 OH TYR A 62 -18.958 -8.375 -2.353 1.00 0.00 O ATOM 0 H TYR A 62 -16.637 -9.524 -8.260 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.114 -7.447 -7.031 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.278 -10.464 -6.764 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.092 -9.542 -5.862 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -17.782 -9.680 -6.511 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -14.685 -8.625 -3.783 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -19.465 -9.200 -4.787 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.365 -8.145 -2.057 1.00 0.00 H new ATOM 0 HH TYR A 62 -18.511 -8.084 -1.531 1.00 0.00 H new ATOM 972 N THR A 63 -13.676 -9.217 -9.331 1.00 0.00 N ATOM 973 CA THR A 63 -12.450 -9.373 -10.111 1.00 0.00 C ATOM 974 C THR A 63 -12.017 -8.052 -10.761 1.00 0.00 C ATOM 975 O THR A 63 -10.871 -7.634 -10.600 1.00 0.00 O ATOM 976 CB THR A 63 -12.597 -10.460 -11.196 1.00 0.00 C ATOM 977 OG1 THR A 63 -13.065 -11.679 -10.606 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.270 -10.710 -11.896 1.00 0.00 C ATOM 0 H THR A 63 -14.496 -9.668 -9.736 1.00 0.00 H new ATOM 0 HA THR A 63 -11.677 -9.685 -9.408 1.00 0.00 H new ATOM 0 HB THR A 63 -13.319 -10.110 -11.934 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.158 -12.364 -11.301 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.399 -11.480 -12.656 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.928 -9.789 -12.367 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.531 -11.041 -11.167 1.00 0.00 H new ATOM 986 N PRO A 64 -12.916 -7.371 -11.507 1.00 0.00 N ATOM 987 CA PRO A 64 -12.585 -6.095 -12.155 1.00 0.00 C ATOM 988 C PRO A 64 -12.320 -4.985 -11.143 1.00 0.00 C ATOM 989 O PRO A 64 -11.408 -4.177 -11.321 1.00 0.00 O ATOM 990 CB PRO A 64 -13.828 -5.774 -12.990 1.00 0.00 C ATOM 991 CG PRO A 64 -14.931 -6.534 -12.343 1.00 0.00 C ATOM 992 CD PRO A 64 -14.304 -7.782 -11.793 1.00 0.00 C ATOM 0 HA PRO A 64 -11.672 -6.168 -12.746 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.035 -4.704 -12.994 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.695 -6.077 -14.029 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.396 -5.948 -11.550 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.714 -6.775 -13.062 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.815 -8.125 -10.893 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.341 -8.600 -12.512 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.124 -4.949 -10.082 1.00 0.00 N ATOM 1001 CA ILE A 65 -12.969 -3.939 -9.040 1.00 0.00 C ATOM 1002 C ILE A 65 -11.594 -4.037 -8.383 1.00 0.00 C ATOM 1003 O ILE A 65 -10.917 -3.028 -8.180 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.061 -4.071 -7.956 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.439 -3.773 -8.552 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.771 -3.139 -6.787 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.584 -4.038 -7.598 1.00 0.00 C ATOM 0 H ILE A 65 -13.887 -5.606 -9.922 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.070 -2.967 -9.523 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.058 -5.096 -7.584 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.472 -2.729 -8.864 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.576 -4.378 -9.448 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.551 -3.246 -6.034 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.806 -3.394 -6.349 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.748 -2.108 -7.141 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.528 -3.804 -8.089 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.578 -5.088 -7.305 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.472 -3.413 -6.712 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.188 -5.260 -8.056 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.896 -5.493 -7.421 1.00 0.00 C ATOM 1021 C PHE A 66 -8.754 -5.042 -8.329 1.00 0.00 C ATOM 1022 O PHE A 66 -7.831 -4.358 -7.886 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.736 -6.975 -7.076 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.411 -7.309 -6.451 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.201 -7.113 -5.095 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.376 -7.818 -7.219 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -6.983 -7.419 -4.517 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.156 -8.125 -6.647 1.00 0.00 C ATOM 1029 CZ PHE A 66 -5.960 -7.925 -5.295 1.00 0.00 C ATOM 0 H PHE A 66 -11.735 -6.105 -8.220 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.858 -4.907 -6.503 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.534 -7.269 -6.394 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.859 -7.566 -7.984 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -8.998 -6.717 -4.483 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.524 -7.977 -8.277 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -6.832 -7.263 -3.459 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.357 -8.521 -7.257 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.007 -8.164 -4.846 1.00 0.00 H new ATOM 1039 N ASN A 67 -8.825 -5.431 -9.598 1.00 0.00 N ATOM 1040 CA ASN A 67 -7.796 -5.070 -10.568 1.00 0.00 C ATOM 1041 C ASN A 67 -7.674 -3.554 -10.698 1.00 0.00 C ATOM 1042 O ASN A 67 -6.581 -3.025 -10.900 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.112 -5.685 -11.933 1.00 0.00 C ATOM 1044 CG ASN A 67 -8.243 -7.197 -11.877 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -9.005 -7.791 -12.639 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -7.497 -7.826 -10.977 1.00 0.00 N ATOM 0 H ASN A 67 -9.584 -5.996 -9.979 1.00 0.00 H new ATOM 0 HA ASN A 67 -6.844 -5.463 -10.210 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.040 -5.258 -12.314 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.325 -5.418 -12.638 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -7.542 -8.842 -10.897 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -6.879 -7.293 -10.365 1.00 0.00 H new ATOM 1053 N GLU A 68 -8.804 -2.860 -10.580 1.00 0.00 N ATOM 1054 CA GLU A 68 -8.822 -1.404 -10.685 1.00 0.00 C ATOM 1055 C GLU A 68 -8.072 -0.766 -9.520 1.00 0.00 C ATOM 1056 O GLU A 68 -7.385 0.240 -9.690 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.265 -0.892 -10.719 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.377 0.617 -10.872 1.00 0.00 C ATOM 1059 CD GLU A 68 -9.817 1.118 -12.191 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -8.583 1.287 -12.285 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -10.613 1.341 -13.127 1.00 0.00 O ATOM 0 H GLU A 68 -9.717 -3.282 -10.412 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.322 -1.125 -11.613 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -10.792 -1.372 -11.544 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.769 -1.193 -9.801 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.424 0.909 -10.793 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -9.848 1.101 -10.051 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.212 -1.356 -8.337 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.549 -0.848 -7.140 1.00 0.00 C ATOM 1070 C TYR A 69 -6.036 -1.029 -7.236 1.00 0.00 C ATOM 1071 O TYR A 69 -5.266 -0.181 -6.781 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.083 -1.571 -5.901 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.604 -0.984 -4.592 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.280 0.071 -3.994 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.479 -1.490 -3.951 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -7.850 0.608 -2.796 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -6.042 -0.959 -2.752 1.00 0.00 C ATOM 1078 CZ TYR A 69 -6.732 0.090 -2.179 1.00 0.00 C ATOM 1079 OH TYR A 69 -6.301 0.622 -0.985 1.00 0.00 O ATOM 0 H TYR A 69 -8.780 -2.189 -8.181 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.762 0.218 -7.057 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.173 -1.548 -5.921 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.786 -2.619 -5.948 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.157 0.479 -4.474 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.938 -2.311 -4.397 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.387 1.429 -2.345 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.166 -1.363 -2.266 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.501 0.143 -0.683 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.621 -2.141 -7.832 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.206 -2.449 -7.990 1.00 0.00 C ATOM 1091 C ILE A 70 -3.564 -1.576 -9.064 1.00 0.00 C ATOM 1092 O ILE A 70 -2.371 -1.278 -9.006 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.001 -3.935 -8.350 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.620 -4.837 -7.276 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.521 -4.248 -8.528 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -3.982 -4.692 -5.907 1.00 0.00 C ATOM 0 H ILE A 70 -6.249 -2.847 -8.215 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.724 -2.242 -7.034 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.505 -4.131 -9.296 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.684 -4.612 -7.196 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.537 -5.876 -7.596 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.400 -5.301 -8.781 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.113 -3.633 -9.330 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.990 -4.035 -7.600 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.475 -5.362 -5.203 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.924 -4.946 -5.970 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.088 -3.663 -5.563 1.00 0.00 H new ATOM 1108 N SER A 71 -4.356 -1.169 -10.047 1.00 0.00 N ATOM 1109 CA SER A 71 -3.850 -0.338 -11.133 1.00 0.00 C ATOM 1110 C SER A 71 -3.968 1.148 -10.806 1.00 0.00 C ATOM 1111 O SER A 71 -3.203 1.964 -11.318 1.00 0.00 O ATOM 1112 CB SER A 71 -4.598 -0.647 -12.429 1.00 0.00 C ATOM 1113 OG SER A 71 -4.125 0.159 -13.495 1.00 0.00 O ATOM 0 H SER A 71 -5.347 -1.399 -10.116 1.00 0.00 H new ATOM 0 HA SER A 71 -2.793 -0.571 -11.261 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.474 -1.700 -12.682 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.665 -0.477 -12.286 1.00 0.00 H new ATOM 0 HG SER A 71 -4.618 -0.059 -14.313 1.00 0.00 H new ATOM 1119 N LEU A 72 -4.936 1.502 -9.967 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.148 2.899 -9.598 1.00 0.00 C ATOM 1121 C LEU A 72 -4.344 3.301 -8.358 1.00 0.00 C ATOM 1122 O LEU A 72 -3.463 4.158 -8.431 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.644 3.155 -9.366 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.056 4.613 -9.098 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -6.862 4.973 -7.632 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.282 5.575 -9.990 1.00 0.00 C ATOM 0 H LEU A 72 -5.584 0.845 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.793 3.515 -10.424 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.191 2.801 -10.240 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.967 2.548 -8.520 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.115 4.706 -9.337 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.160 6.009 -7.469 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.474 4.317 -7.012 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.813 4.851 -7.363 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -6.594 6.598 -9.779 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.214 5.473 -9.795 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.483 5.343 -11.036 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.648 2.673 -7.225 1.00 0.00 N ATOM 1139 CA VAL A 73 -3.981 2.993 -5.964 1.00 0.00 C ATOM 1140 C VAL A 73 -2.548 2.467 -5.892 1.00 0.00 C ATOM 1141 O VAL A 73 -1.604 3.245 -5.756 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.772 2.443 -4.763 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.133 2.877 -3.452 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.222 2.893 -4.833 1.00 0.00 C ATOM 0 H VAL A 73 -5.352 1.939 -7.153 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.943 4.082 -5.922 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.748 1.354 -4.804 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.708 2.477 -2.617 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.112 2.500 -3.403 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.121 3.965 -3.396 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.768 2.496 -3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.266 3.982 -4.818 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.673 2.524 -5.754 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.393 1.149 -5.975 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.072 0.528 -5.890 1.00 0.00 C ATOM 1156 C GLU A 74 -0.094 1.158 -6.876 1.00 0.00 C ATOM 1157 O GLU A 74 1.043 1.471 -6.520 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.171 -0.978 -6.138 1.00 0.00 C ATOM 1159 CG GLU A 74 0.165 -1.699 -6.055 1.00 0.00 C ATOM 1160 CD GLU A 74 0.041 -3.188 -6.309 1.00 0.00 C ATOM 1161 OE1 GLU A 74 -0.324 -3.923 -5.367 1.00 0.00 O ATOM 1162 OE2 GLU A 74 0.307 -3.619 -7.450 1.00 0.00 O ATOM 0 H GLU A 74 -3.162 0.491 -6.101 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.692 0.699 -4.883 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.855 -1.413 -5.409 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.605 -1.147 -7.123 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.853 -1.266 -6.782 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.600 -1.537 -5.069 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.537 1.343 -8.113 1.00 0.00 N ATOM 1170 CA LYS A 75 0.309 1.938 -9.139 1.00 0.00 C ATOM 1171 C LYS A 75 0.644 3.384 -8.787 1.00 0.00 C ATOM 1172 O LYS A 75 1.764 3.841 -9.013 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.381 1.879 -10.502 1.00 0.00 C ATOM 1174 CG LYS A 75 0.495 2.345 -11.655 1.00 0.00 C ATOM 1175 CD LYS A 75 1.608 1.349 -11.953 1.00 0.00 C ATOM 1176 CE LYS A 75 1.061 0.065 -12.557 1.00 0.00 C ATOM 1177 NZ LYS A 75 0.320 0.317 -13.823 1.00 0.00 N ATOM 0 H LYS A 75 -1.473 1.091 -8.429 1.00 0.00 H new ATOM 0 HA LYS A 75 1.236 1.367 -9.189 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.701 0.855 -10.692 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.281 2.494 -10.470 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -0.118 2.483 -12.546 1.00 0.00 H new ATOM 0 HG3 LYS A 75 0.929 3.315 -11.413 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.325 1.798 -12.640 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.147 1.119 -11.034 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.883 -0.625 -12.749 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.399 -0.420 -11.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.592 -0.394 -14.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.703 0.255 -13.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.552 1.266 -14.178 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.336 4.100 -8.236 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.141 5.495 -7.853 1.00 0.00 C ATOM 1193 C TYR A 76 1.042 5.640 -6.900 1.00 0.00 C ATOM 1194 O TYR A 76 1.934 6.457 -7.126 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.408 6.049 -7.197 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.331 7.524 -6.870 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -1.335 8.478 -7.879 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.255 7.961 -5.553 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -1.266 9.827 -7.585 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.186 9.309 -5.252 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.191 10.236 -6.272 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.121 11.579 -5.976 1.00 0.00 O ATOM 0 H TYR A 76 -1.270 3.737 -8.046 1.00 0.00 H new ATOM 0 HA TYR A 76 0.072 6.065 -8.757 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.255 5.877 -7.862 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.604 5.493 -6.280 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -1.393 8.161 -8.910 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -1.250 7.237 -4.752 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -1.271 10.557 -8.381 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.129 9.634 -4.224 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.074 11.698 -5.004 1.00 0.00 H new ATOM 1212 N ILE A 77 1.042 4.843 -5.836 1.00 0.00 N ATOM 1213 CA ILE A 77 2.116 4.883 -4.849 1.00 0.00 C ATOM 1214 C ILE A 77 3.471 4.631 -5.501 1.00 0.00 C ATOM 1215 O ILE A 77 4.437 5.356 -5.254 1.00 0.00 O ATOM 1216 CB ILE A 77 1.901 3.836 -3.736 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.505 3.980 -3.124 1.00 0.00 C ATOM 1218 CG2 ILE A 77 2.973 3.978 -2.664 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.163 2.888 -2.130 1.00 0.00 C ATOM 0 H ILE A 77 0.310 4.161 -5.635 1.00 0.00 H new ATOM 0 HA ILE A 77 2.101 5.881 -4.411 1.00 0.00 H new ATOM 0 HB ILE A 77 1.980 2.842 -4.175 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.433 4.948 -2.627 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.235 3.977 -3.924 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.809 3.233 -1.885 1.00 0.00 H new ATOM 0 HG22 ILE A 77 3.956 3.827 -3.110 1.00 0.00 H new ATOM 0 HG23 ILE A 77 2.922 4.976 -2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.840 3.055 -1.737 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.202 1.919 -2.627 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.881 2.905 -1.310 1.00 0.00 H new ATOM 1231 N GLU A 78 3.533 3.601 -6.338 1.00 0.00 N ATOM 1232 CA GLU A 78 4.770 3.241 -7.021 1.00 0.00 C ATOM 1233 C GLU A 78 5.312 4.408 -7.844 1.00 0.00 C ATOM 1234 O GLU A 78 6.479 4.769 -7.727 1.00 0.00 O ATOM 1235 CB GLU A 78 4.539 2.028 -7.925 1.00 0.00 C ATOM 1236 CG GLU A 78 5.802 1.526 -8.606 1.00 0.00 C ATOM 1237 CD GLU A 78 5.546 0.325 -9.495 1.00 0.00 C ATOM 1238 OE1 GLU A 78 5.633 -0.815 -8.990 1.00 0.00 O ATOM 1239 OE2 GLU A 78 5.260 0.523 -10.694 1.00 0.00 O ATOM 0 H GLU A 78 2.739 3.000 -6.560 1.00 0.00 H new ATOM 0 HA GLU A 78 5.510 2.990 -6.261 1.00 0.00 H new ATOM 0 HB2 GLU A 78 4.111 1.220 -7.332 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.804 2.288 -8.687 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.233 2.330 -9.203 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.539 1.262 -7.848 1.00 0.00 H new ATOM 1246 N GLU A 79 4.454 5.000 -8.668 1.00 0.00 N ATOM 1247 CA GLU A 79 4.856 6.118 -9.518 1.00 0.00 C ATOM 1248 C GLU A 79 5.426 7.273 -8.698 1.00 0.00 C ATOM 1249 O GLU A 79 6.485 7.812 -9.023 1.00 0.00 O ATOM 1250 CB GLU A 79 3.663 6.607 -10.342 1.00 0.00 C ATOM 1251 CG GLU A 79 3.142 5.576 -11.330 1.00 0.00 C ATOM 1252 CD GLU A 79 4.173 5.197 -12.375 1.00 0.00 C ATOM 1253 OE1 GLU A 79 4.233 5.875 -13.423 1.00 0.00 O ATOM 1254 OE2 GLU A 79 4.922 4.225 -12.145 1.00 0.00 O ATOM 0 H GLU A 79 3.477 4.726 -8.766 1.00 0.00 H new ATOM 0 HA GLU A 79 5.640 5.761 -10.186 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.856 6.890 -9.666 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.952 7.506 -10.886 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.834 4.682 -10.788 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.255 5.970 -11.826 1.00 0.00 H new ATOM 1261 N GLN A 80 4.724 7.641 -7.633 1.00 0.00 N ATOM 1262 CA GLN A 80 5.146 8.743 -6.774 1.00 0.00 C ATOM 1263 C GLN A 80 6.532 8.506 -6.181 1.00 0.00 C ATOM 1264 O GLN A 80 7.287 9.453 -5.957 1.00 0.00 O ATOM 1265 CB GLN A 80 4.132 8.954 -5.650 1.00 0.00 C ATOM 1266 CG GLN A 80 2.759 9.377 -6.147 1.00 0.00 C ATOM 1267 CD GLN A 80 2.794 10.693 -6.896 1.00 0.00 C ATOM 1268 OE1 GLN A 80 2.973 10.723 -8.113 1.00 0.00 O ATOM 1269 NE2 GLN A 80 2.623 11.791 -6.170 1.00 0.00 N ATOM 0 H GLN A 80 3.856 7.191 -7.342 1.00 0.00 H new ATOM 0 HA GLN A 80 5.197 9.638 -7.394 1.00 0.00 H new ATOM 0 HB2 GLN A 80 4.035 8.030 -5.080 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.512 9.712 -4.966 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.358 8.602 -6.800 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.080 9.463 -5.299 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.478 11.719 -5.163 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.637 12.707 -6.619 1.00 0.00 H new ATOM 1278 N LEU A 81 6.867 7.245 -5.927 1.00 0.00 N ATOM 1279 CA LEU A 81 8.162 6.906 -5.346 1.00 0.00 C ATOM 1280 C LEU A 81 9.262 6.943 -6.399 1.00 0.00 C ATOM 1281 O LEU A 81 10.389 7.357 -6.129 1.00 0.00 O ATOM 1282 CB LEU A 81 8.101 5.523 -4.695 1.00 0.00 C ATOM 1283 CG LEU A 81 7.202 5.430 -3.460 1.00 0.00 C ATOM 1284 CD1 LEU A 81 7.044 3.984 -3.018 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.769 6.276 -2.326 1.00 0.00 C ATOM 0 H LEU A 81 6.263 6.444 -6.113 1.00 0.00 H new ATOM 0 HA LEU A 81 8.397 7.649 -4.584 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.751 4.804 -5.436 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.111 5.225 -4.414 1.00 0.00 H new ATOM 0 HG LEU A 81 6.217 5.816 -3.722 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.401 3.940 -2.139 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.595 3.404 -3.824 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.022 3.569 -2.773 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.119 6.200 -1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.765 5.917 -2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.829 7.317 -2.644 1.00 0.00 H new ATOM 1297 N LEU A 82 8.915 6.515 -7.603 1.00 0.00 N ATOM 1298 CA LEU A 82 9.862 6.469 -8.708 1.00 0.00 C ATOM 1299 C LEU A 82 10.260 7.868 -9.162 1.00 0.00 C ATOM 1300 O LEU A 82 11.322 8.054 -9.758 1.00 0.00 O ATOM 1301 CB LEU A 82 9.259 5.685 -9.878 1.00 0.00 C ATOM 1302 CG LEU A 82 9.084 4.169 -9.668 1.00 0.00 C ATOM 1303 CD1 LEU A 82 10.090 3.401 -10.507 1.00 0.00 C ATOM 1304 CD2 LEU A 82 9.230 3.772 -8.203 1.00 0.00 C ATOM 0 H LEU A 82 7.977 6.192 -7.841 1.00 0.00 H new ATOM 0 HA LEU A 82 10.763 5.965 -8.359 1.00 0.00 H new ATOM 0 HB2 LEU A 82 8.284 6.113 -10.109 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.890 5.838 -10.753 1.00 0.00 H new ATOM 0 HG LEU A 82 8.072 3.916 -9.984 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.955 2.331 -10.348 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.938 3.634 -11.561 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.101 3.686 -10.215 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.099 2.695 -8.103 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.222 4.051 -7.847 1.00 0.00 H new ATOM 0 HD23 LEU A 82 8.474 4.286 -7.610 1.00 0.00 H new ATOM 1316 N GLN A 83 9.405 8.848 -8.884 1.00 0.00 N ATOM 1317 CA GLN A 83 9.682 10.230 -9.267 1.00 0.00 C ATOM 1318 C GLN A 83 11.038 10.684 -8.734 1.00 0.00 C ATOM 1319 O GLN A 83 11.638 11.621 -9.262 1.00 0.00 O ATOM 1320 CB GLN A 83 8.583 11.161 -8.750 1.00 0.00 C ATOM 1321 CG GLN A 83 7.215 10.884 -9.351 1.00 0.00 C ATOM 1322 CD GLN A 83 6.197 11.953 -9.000 1.00 0.00 C ATOM 1323 OE1 GLN A 83 5.504 11.859 -7.987 1.00 0.00 O ATOM 1324 NE2 GLN A 83 6.103 12.976 -9.841 1.00 0.00 N ATOM 0 H GLN A 83 8.519 8.713 -8.397 1.00 0.00 H new ATOM 0 HA GLN A 83 9.704 10.276 -10.356 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.520 11.067 -7.666 1.00 0.00 H new ATOM 0 HB3 GLN A 83 8.862 12.193 -8.965 1.00 0.00 H new ATOM 0 HG2 GLN A 83 7.305 10.815 -10.435 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.857 9.917 -8.999 1.00 0.00 H new ATOM 0 HE21 GLN A 83 6.698 13.012 -10.669 1.00 0.00 H new ATOM 0 HE22 GLN A 83 5.436 13.726 -9.659 1.00 0.00 H new ATOM 1333 N ARG A 84 11.519 10.013 -7.690 1.00 0.00 N ATOM 1334 CA ARG A 84 12.806 10.353 -7.090 1.00 0.00 C ATOM 1335 C ARG A 84 13.738 9.146 -7.060 1.00 0.00 C ATOM 1336 O ARG A 84 14.921 9.274 -6.746 1.00 0.00 O ATOM 1337 CB ARG A 84 12.602 10.896 -5.673 1.00 0.00 C ATOM 1338 CG ARG A 84 11.767 9.987 -4.785 1.00 0.00 C ATOM 1339 CD ARG A 84 11.416 10.665 -3.470 1.00 0.00 C ATOM 1340 NE ARG A 84 10.695 11.919 -3.680 1.00 0.00 N ATOM 1341 CZ ARG A 84 9.633 12.290 -2.973 1.00 0.00 C ATOM 1342 NH1 ARG A 84 9.167 11.510 -2.005 1.00 0.00 N ATOM 1343 NH2 ARG A 84 9.034 13.445 -3.234 1.00 0.00 N ATOM 0 H ARG A 84 11.038 9.232 -7.243 1.00 0.00 H new ATOM 0 HA ARG A 84 13.271 11.124 -7.705 1.00 0.00 H new ATOM 0 HB2 ARG A 84 13.576 11.049 -5.208 1.00 0.00 H new ATOM 0 HB3 ARG A 84 12.121 11.872 -5.733 1.00 0.00 H new ATOM 0 HG2 ARG A 84 10.852 9.707 -5.307 1.00 0.00 H new ATOM 0 HG3 ARG A 84 12.316 9.066 -4.586 1.00 0.00 H new ATOM 0 HD2 ARG A 84 10.807 9.993 -2.866 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.329 10.861 -2.907 1.00 0.00 H new ATOM 0 HE ARG A 84 11.027 12.546 -4.413 1.00 0.00 H new ATOM 0 HH11 ARG A 84 9.625 10.621 -1.801 1.00 0.00 H new ATOM 0 HH12 ARG A 84 8.351 11.799 -1.465 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.389 14.047 -3.977 1.00 0.00 H new ATOM 0 HH22 ARG A 84 8.219 13.731 -2.692 1.00 0.00 H new ATOM 1357 N ILE A 85 13.200 7.975 -7.392 1.00 0.00 N ATOM 1358 CA ILE A 85 13.988 6.745 -7.401 1.00 0.00 C ATOM 1359 C ILE A 85 13.711 5.928 -8.666 1.00 0.00 C ATOM 1360 O ILE A 85 12.791 5.111 -8.691 1.00 0.00 O ATOM 1361 CB ILE A 85 13.684 5.876 -6.164 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.814 6.706 -4.882 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.618 4.674 -6.120 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.320 5.993 -3.641 1.00 0.00 C ATOM 0 H ILE A 85 12.223 7.852 -7.658 1.00 0.00 H new ATOM 0 HA ILE A 85 15.038 7.037 -7.381 1.00 0.00 H new ATOM 0 HB ILE A 85 12.658 5.514 -6.236 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.860 6.979 -4.741 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.256 7.634 -5.003 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.392 4.070 -5.242 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.480 4.073 -7.019 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.651 5.018 -6.068 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.444 6.643 -2.775 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.265 5.744 -3.760 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.894 5.078 -3.494 1.00 0.00 H new ATOM 1376 N PRO A 86 14.504 6.137 -9.737 1.00 0.00 N ATOM 1377 CA PRO A 86 14.325 5.414 -11.001 1.00 0.00 C ATOM 1378 C PRO A 86 14.836 3.978 -10.937 1.00 0.00 C ATOM 1379 O PRO A 86 14.677 3.209 -11.884 1.00 0.00 O ATOM 1380 CB PRO A 86 15.157 6.231 -11.990 1.00 0.00 C ATOM 1381 CG PRO A 86 16.234 6.837 -11.160 1.00 0.00 C ATOM 1382 CD PRO A 86 15.628 7.094 -9.806 1.00 0.00 C ATOM 0 HA PRO A 86 13.273 5.324 -11.271 1.00 0.00 H new ATOM 0 HB2 PRO A 86 15.570 5.600 -12.777 1.00 0.00 H new ATOM 0 HB3 PRO A 86 14.554 6.997 -12.478 1.00 0.00 H new ATOM 0 HG2 PRO A 86 17.089 6.166 -11.082 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.595 7.763 -11.607 1.00 0.00 H new ATOM 0 HD2 PRO A 86 16.349 6.924 -9.006 1.00 0.00 H new ATOM 0 HD3 PRO A 86 15.283 8.124 -9.711 1.00 0.00 H new ATOM 1390 N GLU A 87 15.444 3.625 -9.812 1.00 0.00 N ATOM 1391 CA GLU A 87 15.980 2.281 -9.620 1.00 0.00 C ATOM 1392 C GLU A 87 15.201 1.540 -8.538 1.00 0.00 C ATOM 1393 O GLU A 87 15.666 0.537 -7.997 1.00 0.00 O ATOM 1394 CB GLU A 87 17.462 2.349 -9.249 1.00 0.00 C ATOM 1395 CG GLU A 87 18.313 3.074 -10.280 1.00 0.00 C ATOM 1396 CD GLU A 87 18.284 2.400 -11.638 1.00 0.00 C ATOM 1397 OE1 GLU A 87 19.102 1.483 -11.863 1.00 0.00 O ATOM 1398 OE2 GLU A 87 17.443 2.788 -12.476 1.00 0.00 O ATOM 0 H GLU A 87 15.579 4.250 -9.017 1.00 0.00 H new ATOM 0 HA GLU A 87 15.876 1.734 -10.557 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.565 2.851 -8.287 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.844 1.336 -9.122 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.960 4.100 -10.380 1.00 0.00 H new ATOM 0 HG3 GLU A 87 19.342 3.124 -9.925 1.00 0.00 H new ATOM 1405 N PHE A 88 14.011 2.045 -8.230 1.00 0.00 N ATOM 1406 CA PHE A 88 13.158 1.445 -7.209 1.00 0.00 C ATOM 1407 C PHE A 88 12.630 0.084 -7.653 1.00 0.00 C ATOM 1408 O PHE A 88 12.414 -0.154 -8.842 1.00 0.00 O ATOM 1409 CB PHE A 88 11.983 2.368 -6.895 1.00 0.00 C ATOM 1410 CG PHE A 88 11.261 2.013 -5.626 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.837 2.266 -4.392 1.00 0.00 C ATOM 1412 CD2 PHE A 88 10.009 1.422 -5.667 1.00 0.00 C ATOM 1413 CE1 PHE A 88 11.178 1.939 -3.222 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.344 1.092 -4.502 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.929 1.351 -3.277 1.00 0.00 C ATOM 0 H PHE A 88 13.614 2.872 -8.675 1.00 0.00 H new ATOM 0 HA PHE A 88 13.764 1.304 -6.314 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.347 3.393 -6.822 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.277 2.339 -7.725 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.814 2.725 -4.343 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.547 1.217 -6.621 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.638 2.143 -2.267 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.368 0.632 -4.548 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.411 1.094 -2.365 1.00 0.00 H new ATOM 1425 N ASN A 89 12.429 -0.805 -6.686 1.00 0.00 N ATOM 1426 CA ASN A 89 11.913 -2.140 -6.961 1.00 0.00 C ATOM 1427 C ASN A 89 10.755 -2.464 -6.020 1.00 0.00 C ATOM 1428 O ASN A 89 10.949 -3.063 -4.962 1.00 0.00 O ATOM 1429 CB ASN A 89 13.023 -3.183 -6.811 1.00 0.00 C ATOM 1430 CG ASN A 89 14.160 -2.959 -7.789 1.00 0.00 C ATOM 1431 OD1 ASN A 89 15.116 -2.242 -7.495 1.00 0.00 O ATOM 1432 ND2 ASN A 89 14.062 -3.575 -8.962 1.00 0.00 N ATOM 0 H ASN A 89 12.617 -0.623 -5.700 1.00 0.00 H new ATOM 0 HA ASN A 89 11.548 -2.165 -7.988 1.00 0.00 H new ATOM 0 HB2 ASN A 89 13.411 -3.153 -5.793 1.00 0.00 H new ATOM 0 HB3 ASN A 89 12.606 -4.178 -6.964 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.797 -3.462 -9.660 1.00 0.00 H new ATOM 0 HD22 ASN A 89 13.252 -4.161 -9.164 1.00 0.00 H new ATOM 1439 N MET A 90 9.551 -2.056 -6.413 1.00 0.00 N ATOM 1440 CA MET A 90 8.358 -2.289 -5.603 1.00 0.00 C ATOM 1441 C MET A 90 8.121 -3.780 -5.382 1.00 0.00 C ATOM 1442 O MET A 90 7.539 -4.181 -4.375 1.00 0.00 O ATOM 1443 CB MET A 90 7.135 -1.660 -6.274 1.00 0.00 C ATOM 1444 CG MET A 90 5.892 -1.659 -5.398 1.00 0.00 C ATOM 1445 SD MET A 90 6.126 -0.742 -3.863 1.00 0.00 S ATOM 1446 CE MET A 90 4.471 -0.785 -3.183 1.00 0.00 C ATOM 0 H MET A 90 9.375 -1.562 -7.288 1.00 0.00 H new ATOM 0 HA MET A 90 8.516 -1.823 -4.630 1.00 0.00 H new ATOM 0 HB2 MET A 90 7.373 -0.634 -6.554 1.00 0.00 H new ATOM 0 HB3 MET A 90 6.919 -2.200 -7.196 1.00 0.00 H new ATOM 0 HG2 MET A 90 5.061 -1.224 -5.953 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.616 -2.687 -5.164 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.498 -0.467 -2.141 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.827 -0.114 -3.751 1.00 0.00 H new ATOM 0 HE3 MET A 90 4.079 -1.800 -3.243 1.00 0.00 H new ATOM 1456 N ALA A 91 8.573 -4.595 -6.330 1.00 0.00 N ATOM 1457 CA ALA A 91 8.408 -6.041 -6.236 1.00 0.00 C ATOM 1458 C ALA A 91 9.195 -6.612 -5.061 1.00 0.00 C ATOM 1459 O ALA A 91 8.627 -7.241 -4.166 1.00 0.00 O ATOM 1460 CB ALA A 91 8.842 -6.702 -7.534 1.00 0.00 C ATOM 0 H ALA A 91 9.056 -4.279 -7.171 1.00 0.00 H new ATOM 0 HA ALA A 91 7.352 -6.251 -6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 91 8.715 -7.781 -7.453 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.233 -6.325 -8.356 1.00 0.00 H new ATOM 0 HB3 ALA A 91 9.890 -6.474 -7.726 1.00 0.00 H new ATOM 1466 N ALA A 92 10.504 -6.382 -5.066 1.00 0.00 N ATOM 1467 CA ALA A 92 11.374 -6.875 -4.004 1.00 0.00 C ATOM 1468 C ALA A 92 11.112 -6.144 -2.692 1.00 0.00 C ATOM 1469 O ALA A 92 11.373 -6.675 -1.612 1.00 0.00 O ATOM 1470 CB ALA A 92 12.833 -6.728 -4.408 1.00 0.00 C ATOM 0 H ALA A 92 10.986 -5.856 -5.795 1.00 0.00 H new ATOM 0 HA ALA A 92 11.153 -7.931 -3.850 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.472 -7.100 -3.607 1.00 0.00 H new ATOM 0 HB2 ALA A 92 13.019 -7.302 -5.316 1.00 0.00 H new ATOM 0 HB3 ALA A 92 13.056 -5.677 -4.591 1.00 0.00 H new ATOM 1476 N PHE A 93 10.596 -4.923 -2.792 1.00 0.00 N ATOM 1477 CA PHE A 93 10.305 -4.117 -1.611 1.00 0.00 C ATOM 1478 C PHE A 93 9.155 -4.714 -0.807 1.00 0.00 C ATOM 1479 O PHE A 93 9.284 -4.947 0.395 1.00 0.00 O ATOM 1480 CB PHE A 93 9.967 -2.680 -2.017 1.00 0.00 C ATOM 1481 CG PHE A 93 9.711 -1.770 -0.850 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.740 -1.417 0.010 1.00 0.00 C ATOM 1483 CD2 PHE A 93 8.442 -1.266 -0.613 1.00 0.00 C ATOM 1484 CE1 PHE A 93 10.508 -0.579 1.083 1.00 0.00 C ATOM 1485 CE2 PHE A 93 8.204 -0.428 0.461 1.00 0.00 C ATOM 1486 CZ PHE A 93 9.238 -0.084 1.309 1.00 0.00 C ATOM 0 H PHE A 93 10.371 -4.470 -3.678 1.00 0.00 H new ATOM 0 HA PHE A 93 11.196 -4.111 -0.982 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.788 -2.276 -2.609 1.00 0.00 H new ATOM 0 HB3 PHE A 93 9.086 -2.690 -2.659 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.734 -1.802 -0.161 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.630 -1.531 -1.274 1.00 0.00 H new ATOM 0 HE1 PHE A 93 11.318 -0.311 1.745 1.00 0.00 H new ATOM 0 HE2 PHE A 93 7.210 -0.043 0.636 1.00 0.00 H new ATOM 0 HZ PHE A 93 9.054 0.571 2.148 1.00 0.00 H new ATOM 1496 N THR A 94 8.032 -4.962 -1.476 1.00 0.00 N ATOM 1497 CA THR A 94 6.855 -5.523 -0.818 1.00 0.00 C ATOM 1498 C THR A 94 7.138 -6.908 -0.245 1.00 0.00 C ATOM 1499 O THR A 94 6.738 -7.215 0.878 1.00 0.00 O ATOM 1500 CB THR A 94 5.659 -5.612 -1.783 1.00 0.00 C ATOM 1501 OG1 THR A 94 6.029 -6.336 -2.962 1.00 0.00 O ATOM 1502 CG2 THR A 94 5.168 -4.224 -2.162 1.00 0.00 C ATOM 0 H THR A 94 7.912 -4.783 -2.473 1.00 0.00 H new ATOM 0 HA THR A 94 6.605 -4.846 -0.001 1.00 0.00 H new ATOM 0 HB THR A 94 4.851 -6.140 -1.277 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.534 -5.748 -3.562 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.323 -4.311 -2.844 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.856 -3.691 -1.264 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.973 -3.674 -2.650 1.00 0.00 H new ATOM 1510 N THR A 95 7.826 -7.742 -1.021 1.00 0.00 N ATOM 1511 CA THR A 95 8.155 -9.094 -0.584 1.00 0.00 C ATOM 1512 C THR A 95 8.901 -9.082 0.745 1.00 0.00 C ATOM 1513 O THR A 95 8.535 -9.792 1.682 1.00 0.00 O ATOM 1514 CB THR A 95 9.007 -9.832 -1.631 1.00 0.00 C ATOM 1515 OG1 THR A 95 10.167 -9.056 -1.955 1.00 0.00 O ATOM 1516 CG2 THR A 95 8.201 -10.101 -2.892 1.00 0.00 C ATOM 0 H THR A 95 8.165 -7.505 -1.953 1.00 0.00 H new ATOM 0 HA THR A 95 7.209 -9.621 -0.459 1.00 0.00 H new ATOM 0 HB THR A 95 9.317 -10.787 -1.207 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.782 -9.596 -2.494 1.00 0.00 H new ATOM 0 HG21 THR A 95 8.824 -10.624 -3.618 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.336 -10.717 -2.646 1.00 0.00 H new ATOM 0 HG23 THR A 95 7.864 -9.156 -3.317 1.00 0.00 H new ATOM 1524 N THR A 96 9.949 -8.270 0.820 1.00 0.00 N ATOM 1525 CA THR A 96 10.750 -8.161 2.033 1.00 0.00 C ATOM 1526 C THR A 96 9.985 -7.429 3.132 1.00 0.00 C ATOM 1527 O THR A 96 10.200 -7.673 4.320 1.00 0.00 O ATOM 1528 CB THR A 96 12.076 -7.428 1.762 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.762 -8.051 0.670 1.00 0.00 O ATOM 1530 CG2 THR A 96 12.966 -7.438 2.995 1.00 0.00 C ATOM 0 H THR A 96 10.264 -7.676 0.053 1.00 0.00 H new ATOM 0 HA THR A 96 10.968 -9.176 2.365 1.00 0.00 H new ATOM 0 HB THR A 96 11.847 -6.393 1.509 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.414 -7.702 -0.177 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.896 -6.914 2.776 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.453 -6.940 3.818 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.187 -8.468 3.276 1.00 0.00 H new ATOM 1538 N LEU A 97 9.093 -6.532 2.725 1.00 0.00 N ATOM 1539 CA LEU A 97 8.294 -5.758 3.670 1.00 0.00 C ATOM 1540 C LEU A 97 7.472 -6.677 4.570 1.00 0.00 C ATOM 1541 O LEU A 97 7.299 -6.404 5.759 1.00 0.00 O ATOM 1542 CB LEU A 97 7.366 -4.802 2.915 1.00 0.00 C ATOM 1543 CG LEU A 97 7.160 -3.437 3.573 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.418 -2.501 2.633 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.402 -3.581 4.884 1.00 0.00 C ATOM 0 H LEU A 97 8.904 -6.322 1.745 1.00 0.00 H new ATOM 0 HA LEU A 97 8.973 -5.180 4.297 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.767 -4.647 1.913 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.394 -5.281 2.799 1.00 0.00 H new ATOM 0 HG LEU A 97 8.140 -3.010 3.788 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.280 -1.534 3.117 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.997 -2.370 1.719 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.445 -2.927 2.389 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.266 -2.598 5.336 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.427 -4.031 4.693 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.968 -4.218 5.564 1.00 0.00 H new ATOM 1557 N GLN A 98 6.971 -7.766 3.993 1.00 0.00 N ATOM 1558 CA GLN A 98 6.164 -8.728 4.737 1.00 0.00 C ATOM 1559 C GLN A 98 6.871 -9.159 6.018 1.00 0.00 C ATOM 1560 O GLN A 98 6.257 -9.237 7.082 1.00 0.00 O ATOM 1561 CB GLN A 98 5.866 -9.951 3.865 1.00 0.00 C ATOM 1562 CG GLN A 98 5.181 -9.607 2.552 1.00 0.00 C ATOM 1563 CD GLN A 98 4.868 -10.831 1.716 1.00 0.00 C ATOM 1564 OE1 GLN A 98 5.567 -11.842 1.784 1.00 0.00 O ATOM 1565 NE2 GLN A 98 3.810 -10.744 0.916 1.00 0.00 N ATOM 0 H GLN A 98 7.110 -8.004 3.011 1.00 0.00 H new ATOM 0 HA GLN A 98 5.225 -8.246 5.010 1.00 0.00 H new ATOM 0 HB2 GLN A 98 6.799 -10.472 3.653 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.235 -10.642 4.425 1.00 0.00 H new ATOM 0 HG2 GLN A 98 4.257 -9.068 2.760 1.00 0.00 H new ATOM 0 HG3 GLN A 98 5.820 -8.935 1.979 1.00 0.00 H new ATOM 0 HE21 GLN A 98 3.258 -9.886 0.891 1.00 0.00 H new ATOM 0 HE22 GLN A 98 3.550 -11.535 0.327 1.00 0.00 H new ATOM 1574 N HIS A 99 8.166 -9.434 5.908 1.00 0.00 N ATOM 1575 CA HIS A 99 8.957 -9.851 7.060 1.00 0.00 C ATOM 1576 C HIS A 99 9.411 -8.639 7.870 1.00 0.00 C ATOM 1577 O HIS A 99 9.465 -8.687 9.099 1.00 0.00 O ATOM 1578 CB HIS A 99 10.170 -10.662 6.599 1.00 0.00 C ATOM 1579 CG HIS A 99 9.808 -11.902 5.840 1.00 0.00 C ATOM 1580 ND1 HIS A 99 9.839 -13.162 6.398 1.00 0.00 N ATOM 1581 CD2 HIS A 99 9.405 -12.071 4.558 1.00 0.00 C ATOM 1582 CE1 HIS A 99 9.473 -14.053 5.492 1.00 0.00 C ATOM 1583 NE2 HIS A 99 9.203 -13.416 4.368 1.00 0.00 N ATOM 0 H HIS A 99 8.690 -9.376 5.035 1.00 0.00 H new ATOM 0 HA HIS A 99 8.333 -10.477 7.698 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.800 -10.032 5.971 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.764 -10.939 7.470 1.00 0.00 H new ATOM 0 HD2 HIS A 99 9.268 -11.293 3.822 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.406 -15.120 5.646 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.894 -13.852 3.499 1.00 0.00 H new ATOM 1592 N HIS A 100 9.723 -7.550 7.172 1.00 0.00 N ATOM 1593 CA HIS A 100 10.175 -6.325 7.824 1.00 0.00 C ATOM 1594 C HIS A 100 9.047 -5.699 8.639 1.00 0.00 C ATOM 1595 O HIS A 100 9.252 -4.718 9.352 1.00 0.00 O ATOM 1596 CB HIS A 100 10.684 -5.322 6.785 1.00 0.00 C ATOM 1597 CG HIS A 100 11.492 -4.206 7.372 1.00 0.00 C ATOM 1598 ND1 HIS A 100 10.931 -3.050 7.874 1.00 0.00 N ATOM 1599 CD2 HIS A 100 12.831 -4.070 7.529 1.00 0.00 C ATOM 1600 CE1 HIS A 100 11.889 -2.253 8.315 1.00 0.00 C ATOM 1601 NE2 HIS A 100 13.050 -2.849 8.117 1.00 0.00 N ATOM 0 H HIS A 100 9.671 -7.491 6.155 1.00 0.00 H new ATOM 0 HA HIS A 100 10.992 -6.583 8.498 1.00 0.00 H new ATOM 0 HB2 HIS A 100 11.291 -5.850 6.050 1.00 0.00 H new ATOM 0 HB3 HIS A 100 9.832 -4.901 6.252 1.00 0.00 H new ATOM 0 HD2 HIS A 100 13.586 -4.788 7.244 1.00 0.00 H new ATOM 0 HE1 HIS A 100 11.746 -1.280 8.761 1.00 0.00 H new ATOM 0 HE2 HIS A 100 13.963 -2.464 8.361 1.00 0.00 H new ATOM 1610 N LYS A 101 7.854 -6.274 8.521 1.00 0.00 N ATOM 1611 CA LYS A 101 6.690 -5.781 9.247 1.00 0.00 C ATOM 1612 C LYS A 101 6.926 -5.850 10.753 1.00 0.00 C ATOM 1613 O LYS A 101 6.234 -5.194 11.532 1.00 0.00 O ATOM 1614 CB LYS A 101 5.449 -6.593 8.865 1.00 0.00 C ATOM 1615 CG LYS A 101 4.162 -6.087 9.500 1.00 0.00 C ATOM 1616 CD LYS A 101 2.941 -6.811 8.949 1.00 0.00 C ATOM 1617 CE LYS A 101 2.940 -8.283 9.334 1.00 0.00 C ATOM 1618 NZ LYS A 101 2.865 -8.473 10.808 1.00 0.00 N ATOM 0 H LYS A 101 7.669 -7.083 7.928 1.00 0.00 H new ATOM 0 HA LYS A 101 6.527 -4.738 8.974 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.337 -6.579 7.781 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.603 -7.632 9.157 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.210 -6.225 10.580 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.063 -5.017 9.319 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.035 -6.336 9.325 1.00 0.00 H new ATOM 0 HD3 LYS A 101 2.922 -6.719 7.863 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.094 -8.781 8.861 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.844 -8.758 8.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.613 -9.460 11.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 3.788 -8.253 11.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.142 -7.839 11.203 1.00 0.00 H new ATOM 1632 N ASP A 102 7.914 -6.645 11.157 1.00 0.00 N ATOM 1633 CA ASP A 102 8.245 -6.798 12.569 1.00 0.00 C ATOM 1634 C ASP A 102 9.021 -5.588 13.083 1.00 0.00 C ATOM 1635 O ASP A 102 8.997 -5.285 14.276 1.00 0.00 O ATOM 1636 CB ASP A 102 9.065 -8.070 12.789 1.00 0.00 C ATOM 1637 CG ASP A 102 9.343 -8.334 14.257 1.00 0.00 C ATOM 1638 OD1 ASP A 102 8.499 -8.977 14.915 1.00 0.00 O ATOM 1639 OD2 ASP A 102 10.404 -7.896 14.748 1.00 0.00 O ATOM 0 H ASP A 102 8.499 -7.193 10.526 1.00 0.00 H new ATOM 0 HA ASP A 102 7.311 -6.873 13.126 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.531 -8.921 12.365 1.00 0.00 H new ATOM 0 HB3 ASP A 102 10.010 -7.987 12.253 1.00 0.00 H new ATOM 1644 N GLU A 103 9.709 -4.902 12.175 1.00 0.00 N ATOM 1645 CA GLU A 103 10.489 -3.723 12.537 1.00 0.00 C ATOM 1646 C GLU A 103 9.722 -2.443 12.211 1.00 0.00 C ATOM 1647 O GLU A 103 9.460 -1.624 13.093 1.00 0.00 O ATOM 1648 CB GLU A 103 11.835 -3.729 11.806 1.00 0.00 C ATOM 1649 CG GLU A 103 12.752 -2.583 12.204 1.00 0.00 C ATOM 1650 CD GLU A 103 13.164 -2.641 13.663 1.00 0.00 C ATOM 1651 OE1 GLU A 103 12.426 -2.100 14.511 1.00 0.00 O ATOM 1652 OE2 GLU A 103 14.227 -3.228 13.956 1.00 0.00 O ATOM 0 H GLU A 103 9.742 -5.142 11.184 1.00 0.00 H new ATOM 0 HA GLU A 103 10.670 -3.753 13.611 1.00 0.00 H new ATOM 0 HB2 GLU A 103 12.342 -4.674 12.004 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.655 -3.683 10.732 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.644 -2.603 11.578 1.00 0.00 H new ATOM 0 HG3 GLU A 103 12.248 -1.636 12.011 1.00 0.00 H new ATOM 1659 N VAL A 104 9.364 -2.278 10.939 1.00 0.00 N ATOM 1660 CA VAL A 104 8.625 -1.100 10.497 1.00 0.00 C ATOM 1661 C VAL A 104 7.282 -0.998 11.214 1.00 0.00 C ATOM 1662 O VAL A 104 6.783 -1.983 11.758 1.00 0.00 O ATOM 1663 CB VAL A 104 8.383 -1.126 8.972 1.00 0.00 C ATOM 1664 CG1 VAL A 104 7.300 -2.135 8.612 1.00 0.00 C ATOM 1665 CG2 VAL A 104 8.020 0.262 8.463 1.00 0.00 C ATOM 0 H VAL A 104 9.574 -2.946 10.197 1.00 0.00 H new ATOM 0 HA VAL A 104 9.234 -0.230 10.744 1.00 0.00 H new ATOM 0 HB VAL A 104 9.308 -1.437 8.486 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.147 -2.135 7.533 1.00 0.00 H new ATOM 0 HG12 VAL A 104 7.607 -3.130 8.935 1.00 0.00 H new ATOM 0 HG13 VAL A 104 6.369 -1.863 9.110 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.853 0.223 7.387 1.00 0.00 H new ATOM 0 HG22 VAL A 104 7.112 0.605 8.958 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.835 0.953 8.679 1.00 0.00 H new ATOM 1675 N ALA A 105 6.703 0.199 11.212 1.00 0.00 N ATOM 1676 CA ALA A 105 5.415 0.426 11.856 1.00 0.00 C ATOM 1677 C ALA A 105 4.336 -0.453 11.232 1.00 0.00 C ATOM 1678 O ALA A 105 3.895 -0.208 10.108 1.00 0.00 O ATOM 1679 CB ALA A 105 5.028 1.894 11.755 1.00 0.00 C ATOM 0 H ALA A 105 7.106 1.026 10.771 1.00 0.00 H new ATOM 0 HA ALA A 105 5.505 0.159 12.909 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.064 2.050 12.240 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.785 2.505 12.247 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.957 2.180 10.706 1.00 0.00 H new ATOM 1685 N GLY A 106 3.917 -1.478 11.968 1.00 0.00 N ATOM 1686 CA GLY A 106 2.895 -2.380 11.472 1.00 0.00 C ATOM 1687 C GLY A 106 1.564 -1.688 11.254 1.00 0.00 C ATOM 1688 O GLY A 106 0.842 -2.005 10.310 1.00 0.00 O ATOM 0 H GLY A 106 4.268 -1.700 12.900 1.00 0.00 H new ATOM 0 HA2 GLY A 106 3.229 -2.821 10.533 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.763 -3.199 12.180 1.00 0.00 H new ATOM 1692 N ASP A 107 1.244 -0.740 12.130 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.011 -0.002 12.036 1.00 0.00 C ATOM 1694 C ASP A 107 -0.118 0.735 10.704 1.00 0.00 C ATOM 1695 O ASP A 107 -1.207 0.867 10.145 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.127 0.994 13.192 1.00 0.00 C ATOM 1697 CG ASP A 107 -1.424 1.778 13.151 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -1.459 2.833 12.482 1.00 0.00 O ATOM 1699 OD2 ASP A 107 -2.404 1.339 13.788 1.00 0.00 O ATOM 0 H ASP A 107 1.837 -0.465 12.913 1.00 0.00 H new ATOM 0 HA ASP A 107 -0.828 -0.721 12.097 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -0.060 0.458 14.138 1.00 0.00 H new ATOM 0 HB3 ASP A 107 0.714 1.686 13.157 1.00 0.00 H new ATOM 1704 N ILE A 108 1.017 1.211 10.200 1.00 0.00 N ATOM 1705 CA ILE A 108 1.043 1.937 8.935 1.00 0.00 C ATOM 1706 C ILE A 108 0.874 0.996 7.748 1.00 0.00 C ATOM 1707 O ILE A 108 0.054 1.243 6.864 1.00 0.00 O ATOM 1708 CB ILE A 108 2.357 2.729 8.763 1.00 0.00 C ATOM 1709 CG1 ILE A 108 2.477 3.808 9.841 1.00 0.00 C ATOM 1710 CG2 ILE A 108 2.434 3.343 7.369 1.00 0.00 C ATOM 1711 CD1 ILE A 108 1.399 4.864 9.760 1.00 0.00 C ATOM 0 H ILE A 108 1.928 1.107 10.647 1.00 0.00 H new ATOM 0 HA ILE A 108 0.206 2.635 8.962 1.00 0.00 H new ATOM 0 HB ILE A 108 3.194 2.040 8.877 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.439 3.336 10.823 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.452 4.288 9.756 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.367 3.897 7.267 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.398 2.552 6.620 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.592 4.020 7.222 1.00 0.00 H new ATOM 0 HD11 ILE A 108 1.546 5.596 10.554 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.450 5.363 8.792 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.422 4.396 9.875 1.00 0.00 H new ATOM 1723 N PHE A 109 1.651 -0.082 7.731 1.00 0.00 N ATOM 1724 CA PHE A 109 1.582 -1.042 6.638 1.00 0.00 C ATOM 1725 C PHE A 109 0.213 -1.706 6.567 1.00 0.00 C ATOM 1726 O PHE A 109 -0.226 -2.099 5.491 1.00 0.00 O ATOM 1727 CB PHE A 109 2.672 -2.108 6.755 1.00 0.00 C ATOM 1728 CG PHE A 109 2.729 -3.016 5.556 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.798 -2.487 4.274 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.696 -4.392 5.705 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.836 -3.314 3.166 1.00 0.00 C ATOM 1732 CE2 PHE A 109 2.733 -5.225 4.602 1.00 0.00 C ATOM 1733 CZ PHE A 109 2.803 -4.684 3.331 1.00 0.00 C ATOM 0 H PHE A 109 2.331 -0.311 8.456 1.00 0.00 H new ATOM 0 HA PHE A 109 1.746 -0.483 5.717 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.639 -1.621 6.883 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.496 -2.705 7.650 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.822 -1.416 4.140 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.641 -4.820 6.695 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.891 -2.889 2.175 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.707 -6.297 4.733 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.832 -5.333 2.468 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.459 -1.827 7.712 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.776 -2.460 7.760 1.00 0.00 C ATOM 1745 C ASP A 110 -2.689 -1.906 6.671 1.00 0.00 C ATOM 1746 O ASP A 110 -3.543 -2.616 6.143 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.424 -2.255 9.131 1.00 0.00 C ATOM 1748 CG ASP A 110 -1.890 -3.216 10.175 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -1.891 -4.437 9.913 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -1.477 -2.749 11.258 1.00 0.00 O ATOM 0 H ASP A 110 -0.115 -1.497 8.614 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.637 -3.527 7.589 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -2.250 -1.231 9.462 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -3.503 -2.383 9.042 1.00 0.00 H new ATOM 1755 N MET A 111 -2.502 -0.633 6.339 1.00 0.00 N ATOM 1756 CA MET A 111 -3.298 0.003 5.299 1.00 0.00 C ATOM 1757 C MET A 111 -2.877 -0.516 3.926 1.00 0.00 C ATOM 1758 O MET A 111 -3.713 -0.932 3.121 1.00 0.00 O ATOM 1759 CB MET A 111 -3.141 1.525 5.369 1.00 0.00 C ATOM 1760 CG MET A 111 -3.943 2.279 4.317 1.00 0.00 C ATOM 1761 SD MET A 111 -3.055 2.460 2.757 1.00 0.00 S ATOM 1762 CE MET A 111 -1.662 3.464 3.271 1.00 0.00 C ATOM 0 H MET A 111 -1.809 -0.024 6.774 1.00 0.00 H new ATOM 0 HA MET A 111 -4.348 -0.243 5.457 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.447 1.866 6.358 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.086 1.777 5.257 1.00 0.00 H new ATOM 0 HG2 MET A 111 -4.881 1.754 4.137 1.00 0.00 H new ATOM 0 HG3 MET A 111 -4.199 3.267 4.701 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.192 3.910 2.395 1.00 0.00 H new ATOM 0 HE2 MET A 111 -2.009 4.253 3.938 1.00 0.00 H new ATOM 0 HE3 MET A 111 -0.937 2.840 3.793 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.572 -0.504 3.677 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.024 -0.977 2.410 1.00 0.00 C ATOM 1774 C LEU A 112 -1.229 -2.481 2.265 1.00 0.00 C ATOM 1775 O LEU A 112 -1.236 -3.013 1.158 1.00 0.00 O ATOM 1776 CB LEU A 112 0.468 -0.642 2.309 1.00 0.00 C ATOM 1777 CG LEU A 112 0.808 0.850 2.288 1.00 0.00 C ATOM 1778 CD1 LEU A 112 2.317 1.048 2.291 1.00 0.00 C ATOM 1779 CD2 LEU A 112 0.185 1.526 1.076 1.00 0.00 C ATOM 0 H LEU A 112 -0.871 -0.170 4.339 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.553 -0.471 1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.984 -1.103 3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.865 -1.100 1.403 1.00 0.00 H new ATOM 0 HG LEU A 112 0.395 1.310 3.185 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.544 2.114 2.276 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.741 0.599 3.189 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.748 0.573 1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.439 2.586 1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.568 1.065 0.165 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.898 1.412 1.113 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.397 -3.155 3.397 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.592 -4.600 3.422 1.00 0.00 C ATOM 1793 C LEU A 113 -2.701 -5.018 2.464 1.00 0.00 C ATOM 1794 O LEU A 113 -2.709 -6.142 1.961 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.913 -5.068 4.845 1.00 0.00 C ATOM 1796 CG LEU A 113 -2.058 -6.582 5.021 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.813 -7.305 4.529 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -2.328 -6.922 6.479 1.00 0.00 C ATOM 0 H LEU A 113 -1.402 -2.718 4.319 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.666 -5.074 3.096 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.126 -4.716 5.512 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.839 -4.592 5.166 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.905 -6.916 4.422 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.939 -8.379 4.664 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.660 -7.088 3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.053 -6.967 5.098 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.429 -8.002 6.588 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.499 -6.571 7.094 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -3.250 -6.437 6.801 1.00 0.00 H new ATOM 1810 N THR A 114 -3.639 -4.107 2.221 1.00 0.00 N ATOM 1811 CA THR A 114 -4.757 -4.377 1.321 1.00 0.00 C ATOM 1812 C THR A 114 -4.283 -4.687 -0.103 1.00 0.00 C ATOM 1813 O THR A 114 -5.100 -4.903 -0.998 1.00 0.00 O ATOM 1814 CB THR A 114 -5.733 -3.187 1.270 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.043 -2.002 0.857 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.379 -2.957 2.629 1.00 0.00 C ATOM 0 H THR A 114 -3.647 -3.175 2.635 1.00 0.00 H new ATOM 0 HA THR A 114 -5.268 -5.252 1.722 1.00 0.00 H new ATOM 0 HB THR A 114 -6.516 -3.420 0.548 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.575 -1.612 1.625 1.00 0.00 H new ATOM 0 HG21 THR A 114 -7.064 -2.111 2.568 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.930 -3.850 2.926 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.606 -2.745 3.368 1.00 0.00 H new ATOM 1824 N PHE A 115 -2.966 -4.711 -0.309 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.407 -5.001 -1.626 1.00 0.00 C ATOM 1826 C PHE A 115 -2.743 -6.426 -2.059 1.00 0.00 C ATOM 1827 O PHE A 115 -2.926 -6.696 -3.246 1.00 0.00 O ATOM 1828 CB PHE A 115 -0.883 -4.815 -1.624 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.424 -3.384 -1.745 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -1.095 -2.486 -2.563 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.689 -2.939 -1.043 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.667 -1.177 -2.677 1.00 0.00 C ATOM 1833 CE2 PHE A 115 1.119 -1.631 -1.155 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.441 -0.749 -1.972 1.00 0.00 C ATOM 0 H PHE A 115 -2.271 -4.534 0.416 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.852 -4.301 -2.333 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.480 -5.235 -0.702 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.459 -5.389 -2.448 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.962 -2.814 -3.117 1.00 0.00 H new ATOM 0 HD2 PHE A 115 1.224 -3.624 -0.402 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.199 -0.489 -3.317 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.986 -1.298 -0.603 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.776 0.274 -2.060 1.00 0.00 H new ATOM 1844 N THR A 116 -2.827 -7.335 -1.090 1.00 0.00 N ATOM 1845 CA THR A 116 -3.135 -8.732 -1.380 1.00 0.00 C ATOM 1846 C THR A 116 -4.097 -9.322 -0.352 1.00 0.00 C ATOM 1847 O THR A 116 -4.918 -10.180 -0.679 1.00 0.00 O ATOM 1848 CB THR A 116 -1.858 -9.591 -1.416 1.00 0.00 C ATOM 1849 OG1 THR A 116 -1.137 -9.448 -0.186 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.967 -9.188 -2.581 1.00 0.00 C ATOM 0 H THR A 116 -2.687 -7.130 -0.101 1.00 0.00 H new ATOM 0 HA THR A 116 -3.609 -8.747 -2.361 1.00 0.00 H new ATOM 0 HB THR A 116 -2.151 -10.633 -1.547 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.327 -9.999 -0.216 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.071 -9.809 -2.586 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.508 -9.325 -3.517 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.682 -8.141 -2.476 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.990 -8.861 0.892 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.846 -9.353 1.967 1.00 0.00 C ATOM 1860 C ASP A 117 -6.311 -9.018 1.695 1.00 0.00 C ATOM 1861 O ASP A 117 -6.801 -7.957 2.085 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.409 -8.755 3.306 1.00 0.00 C ATOM 1863 CG ASP A 117 -4.915 -9.555 4.491 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -6.037 -9.281 4.960 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -4.184 -10.457 4.952 1.00 0.00 O ATOM 0 H ASP A 117 -3.320 -8.148 1.180 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.746 -10.437 2.012 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.321 -8.708 3.341 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.775 -7.731 3.380 1.00 0.00 H new ATOM 1870 N PHE A 118 -7.004 -9.935 1.023 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.412 -9.744 0.687 1.00 0.00 C ATOM 1872 C PHE A 118 -9.261 -9.601 1.945 1.00 0.00 C ATOM 1873 O PHE A 118 -10.348 -9.024 1.911 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.918 -10.921 -0.151 1.00 0.00 C ATOM 1875 CG PHE A 118 -10.280 -10.696 -0.748 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -10.420 -9.998 -1.936 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -11.418 -11.184 -0.123 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.668 -9.789 -2.491 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.669 -10.979 -0.674 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.794 -10.281 -1.860 1.00 0.00 C ATOM 0 H PHE A 118 -6.612 -10.819 0.700 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.500 -8.825 0.108 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -8.207 -11.117 -0.954 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.948 -11.814 0.473 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.543 -9.612 -2.435 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -11.326 -11.730 0.804 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.763 -9.242 -3.417 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.548 -11.364 -0.178 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.770 -10.120 -2.293 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.757 -10.128 3.055 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.473 -10.064 4.323 1.00 0.00 C ATOM 1892 C LEU A 119 -9.461 -8.647 4.890 1.00 0.00 C ATOM 1893 O LEU A 119 -10.448 -8.195 5.469 1.00 0.00 O ATOM 1894 CB LEU A 119 -8.857 -11.038 5.332 1.00 0.00 C ATOM 1895 CG LEU A 119 -9.163 -12.519 5.085 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -8.490 -13.008 3.811 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -8.725 -13.359 6.275 1.00 0.00 C ATOM 0 H LEU A 119 -7.856 -10.604 3.102 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.509 -10.350 4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.775 -10.902 5.329 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.209 -10.773 6.329 1.00 0.00 H new ATOM 0 HG LEU A 119 -10.241 -12.627 4.962 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.723 -14.062 3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -8.854 -12.429 2.962 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -7.411 -12.884 3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.950 -14.408 6.082 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -7.653 -13.240 6.429 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -9.258 -13.032 7.167 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.341 -7.952 4.718 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.201 -6.589 5.219 1.00 0.00 C ATOM 1911 C ALA A 120 -8.944 -5.598 4.331 1.00 0.00 C ATOM 1912 O ALA A 120 -9.486 -4.604 4.812 1.00 0.00 O ATOM 1913 CB ALA A 120 -6.731 -6.214 5.321 1.00 0.00 C ATOM 0 H ALA A 120 -7.517 -8.310 4.235 1.00 0.00 H new ATOM 0 HA ALA A 120 -8.645 -6.546 6.214 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -6.641 -5.195 5.696 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.228 -6.898 6.004 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.269 -6.280 4.336 1.00 0.00 H new ATOM 1919 N PHE A 121 -8.961 -5.878 3.033 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.633 -5.016 2.067 1.00 0.00 C ATOM 1921 C PHE A 121 -11.135 -4.977 2.338 1.00 0.00 C ATOM 1922 O PHE A 121 -11.724 -3.905 2.509 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.360 -5.525 0.648 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.569 -4.501 -0.435 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -9.067 -3.215 -0.305 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.258 -4.833 -1.592 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.249 -2.280 -1.307 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.444 -3.901 -2.596 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.939 -2.624 -2.453 1.00 0.00 C ATOM 0 H PHE A 121 -8.515 -6.699 2.624 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.244 -4.003 2.165 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.332 -5.885 0.596 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -10.007 -6.380 0.452 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.528 -2.941 0.589 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.654 -5.831 -1.710 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.852 -1.282 -1.194 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -10.984 -4.172 -3.491 1.00 0.00 H new ATOM 0 HZ PHE A 121 -10.083 -1.895 -3.236 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.746 -6.155 2.388 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.177 -6.268 2.641 1.00 0.00 C ATOM 1941 C LYS A 122 -13.531 -5.713 4.018 1.00 0.00 C ATOM 1942 O LYS A 122 -14.398 -4.848 4.143 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.618 -7.728 2.535 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.104 -7.937 2.782 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.491 -9.400 2.645 1.00 0.00 C ATOM 1946 CE LYS A 122 -16.975 -9.608 2.898 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.370 -11.036 2.758 1.00 0.00 N ATOM 0 H LYS A 122 -11.271 -7.048 2.256 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.704 -5.681 1.888 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.367 -8.103 1.543 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.052 -8.322 3.253 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.361 -7.584 3.781 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.679 -7.340 2.074 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.238 -9.753 1.645 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -14.913 -9.998 3.350 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.224 -9.260 3.900 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.550 -9.002 2.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.390 -11.133 2.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.156 -11.362 1.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -16.840 -11.611 3.444 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.850 -6.211 5.047 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.095 -5.768 6.416 1.00 0.00 C ATOM 1963 C GLU A 123 -12.965 -4.252 6.533 1.00 0.00 C ATOM 1964 O GLU A 123 -13.602 -3.631 7.385 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.122 -6.451 7.379 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.375 -6.112 8.839 1.00 0.00 C ATOM 1967 CD GLU A 123 -11.427 -6.828 9.780 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -10.306 -6.321 9.991 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -11.805 -7.896 10.306 1.00 0.00 O ATOM 0 H GLU A 123 -12.124 -6.922 4.958 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.115 -6.047 6.682 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.191 -7.531 7.248 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.103 -6.163 7.119 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.276 -5.036 8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.401 -6.374 9.096 1.00 0.00 H new ATOM 1976 N MET A 124 -12.138 -3.662 5.675 1.00 0.00 N ATOM 1977 CA MET A 124 -11.932 -2.217 5.686 1.00 0.00 C ATOM 1978 C MET A 124 -13.199 -1.484 5.259 1.00 0.00 C ATOM 1979 O MET A 124 -13.623 -0.530 5.910 1.00 0.00 O ATOM 1980 CB MET A 124 -10.776 -1.833 4.761 1.00 0.00 C ATOM 1981 CG MET A 124 -10.449 -0.348 4.784 1.00 0.00 C ATOM 1982 SD MET A 124 -9.161 0.100 3.603 1.00 0.00 S ATOM 1983 CE MET A 124 -9.964 -0.308 2.055 1.00 0.00 C ATOM 0 H MET A 124 -11.601 -4.160 4.965 1.00 0.00 H new ATOM 0 HA MET A 124 -11.685 -1.922 6.706 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.889 -2.397 5.048 1.00 0.00 H new ATOM 0 HB3 MET A 124 -11.024 -2.127 3.741 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.352 0.222 4.564 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.130 -0.066 5.787 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.472 0.222 1.239 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.897 -1.382 1.883 1.00 0.00 H new ATOM 0 HE3 MET A 124 -11.012 -0.012 2.100 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.799 -1.933 4.161 1.00 0.00 N ATOM 1994 CA PHE A 125 -15.021 -1.312 3.655 1.00 0.00 C ATOM 1995 C PHE A 125 -16.184 -1.514 4.621 1.00 0.00 C ATOM 1996 O PHE A 125 -16.905 -0.568 4.941 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.379 -1.876 2.281 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.360 -1.565 1.225 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -14.077 -0.252 0.881 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.686 -2.583 0.575 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -13.139 0.038 -0.090 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.747 -2.301 -0.397 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.473 -0.989 -0.730 1.00 0.00 C ATOM 0 H PHE A 125 -13.462 -2.720 3.606 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.836 -0.242 3.562 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.492 -2.957 2.359 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.345 -1.476 1.973 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.596 0.554 1.378 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.897 -3.611 0.831 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.927 1.065 -0.348 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.227 -3.105 -0.896 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.739 -0.766 -1.490 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.366 -2.749 5.081 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.443 -3.067 6.012 1.00 0.00 C ATOM 2015 C LEU A 126 -17.361 -2.198 7.262 1.00 0.00 C ATOM 2016 O LEU A 126 -18.384 -1.807 7.826 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.399 -4.547 6.400 1.00 0.00 C ATOM 2018 CG LEU A 126 -18.100 -5.497 5.425 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.387 -5.520 4.081 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.179 -6.897 6.013 1.00 0.00 C ATOM 0 H LEU A 126 -15.782 -3.545 4.824 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.389 -2.861 5.511 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.356 -4.851 6.492 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.853 -4.662 7.384 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.114 -5.131 5.262 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -17.904 -6.202 3.406 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -17.385 -4.518 3.653 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.360 -5.857 4.220 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.680 -7.560 5.308 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -17.172 -7.267 6.207 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.741 -6.868 6.946 1.00 0.00 H new ATOM 2032 N ASP A 127 -16.138 -1.900 7.692 1.00 0.00 N ATOM 2033 CA ASP A 127 -15.926 -1.074 8.876 1.00 0.00 C ATOM 2034 C ASP A 127 -16.282 0.380 8.591 1.00 0.00 C ATOM 2035 O ASP A 127 -16.809 1.081 9.455 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.472 -1.176 9.344 1.00 0.00 C ATOM 2037 CG ASP A 127 -14.181 -0.266 10.522 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -14.445 -0.678 11.671 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -13.687 0.858 10.294 1.00 0.00 O ATOM 0 H ASP A 127 -15.281 -2.217 7.239 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.579 -1.441 9.668 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.254 -2.207 9.622 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.808 -0.921 8.518 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.990 0.828 7.373 1.00 0.00 N ATOM 2045 CA TYR A 128 -16.284 2.198 6.970 1.00 0.00 C ATOM 2046 C TYR A 128 -17.788 2.450 6.982 1.00 0.00 C ATOM 2047 O TYR A 128 -18.251 3.489 7.453 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.716 2.476 5.576 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.952 3.890 5.093 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -15.156 4.937 5.540 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.968 4.177 4.190 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -15.366 6.230 5.100 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -17.184 5.468 3.746 1.00 0.00 C ATOM 2054 CZ TYR A 128 -16.381 6.490 4.204 1.00 0.00 C ATOM 2055 OH TYR A 128 -16.593 7.777 3.765 1.00 0.00 O ATOM 0 H TYR A 128 -15.550 0.261 6.648 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.813 2.874 7.684 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.644 2.279 5.584 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -16.163 1.780 4.866 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.360 4.737 6.243 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.599 3.378 3.829 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -14.738 7.033 5.456 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.978 5.675 3.044 1.00 0.00 H new ATOM 0 HH TYR A 128 -17.345 7.789 3.137 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.545 1.487 6.462 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.998 1.596 6.414 1.00 0.00 C ATOM 2067 C ARG A 129 -20.590 1.551 7.820 1.00 0.00 C ATOM 2068 O ARG A 129 -21.593 2.204 8.104 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.587 0.471 5.559 1.00 0.00 C ATOM 2070 CG ARG A 129 -22.104 0.506 5.465 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.637 -0.633 4.611 1.00 0.00 C ATOM 2072 NE ARG A 129 -22.224 -0.511 3.216 1.00 0.00 N ATOM 2073 CZ ARG A 129 -22.684 -1.289 2.241 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -23.564 -2.244 2.510 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -22.262 -1.114 0.996 1.00 0.00 N ATOM 0 H ARG A 129 -18.175 0.622 6.068 1.00 0.00 H new ATOM 0 HA ARG A 129 -20.254 2.554 5.962 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -20.168 0.532 4.555 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -20.279 -0.489 5.975 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.533 0.443 6.465 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -22.421 1.459 5.041 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -22.283 -1.583 5.012 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -23.725 -0.649 4.667 1.00 0.00 H new ATOM 0 HE ARG A 129 -21.545 0.211 2.976 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -23.889 -2.383 3.467 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -23.915 -2.840 1.760 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -21.584 -0.382 0.786 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -22.616 -1.712 0.249 1.00 0.00 H new ATOM 2089 N ALA A 130 -19.959 0.774 8.698 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.423 0.644 10.075 1.00 0.00 C ATOM 2091 C ALA A 130 -20.336 1.977 10.812 1.00 0.00 C ATOM 2092 O ALA A 130 -21.208 2.311 11.613 1.00 0.00 O ATOM 2093 CB ALA A 130 -19.616 -0.420 10.805 1.00 0.00 C ATOM 0 H ALA A 130 -19.127 0.226 8.480 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.469 0.339 10.053 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -19.973 -0.507 11.831 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -19.734 -1.378 10.298 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -18.563 -0.139 10.809 1.00 0.00 H new ATOM 2099 N GLU A 131 -19.278 2.734 10.535 1.00 0.00 N ATOM 2100 CA GLU A 131 -19.076 4.028 11.168 1.00 0.00 C ATOM 2101 C GLU A 131 -20.180 5.005 10.774 1.00 0.00 C ATOM 2102 O GLU A 131 -20.469 5.956 11.499 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.711 4.590 10.776 1.00 0.00 C ATOM 2104 CG GLU A 131 -17.348 5.878 11.492 1.00 0.00 C ATOM 2105 CD GLU A 131 -17.295 5.713 13.000 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -16.210 5.386 13.523 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -18.338 5.914 13.656 1.00 0.00 O ATOM 0 H GLU A 131 -18.547 2.470 9.874 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.112 3.893 12.249 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.947 3.841 10.986 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.697 4.767 9.701 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.380 6.228 11.134 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.078 6.648 11.240 1.00 0.00 H new ATOM 2114 N LYS A 132 -20.793 4.760 9.620 1.00 0.00 N ATOM 2115 CA LYS A 132 -21.866 5.616 9.127 1.00 0.00 C ATOM 2116 C LYS A 132 -23.114 5.477 9.991 1.00 0.00 C ATOM 2117 O LYS A 132 -23.926 6.400 10.083 1.00 0.00 O ATOM 2118 CB LYS A 132 -22.201 5.269 7.675 1.00 0.00 C ATOM 2119 CG LYS A 132 -21.063 5.538 6.702 1.00 0.00 C ATOM 2120 CD LYS A 132 -20.739 7.022 6.622 1.00 0.00 C ATOM 2121 CE LYS A 132 -19.639 7.298 5.611 1.00 0.00 C ATOM 2122 NZ LYS A 132 -19.326 8.751 5.514 1.00 0.00 N ATOM 0 H LYS A 132 -20.565 3.976 9.009 1.00 0.00 H new ATOM 0 HA LYS A 132 -21.521 6.649 9.177 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -22.475 4.216 7.617 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -23.074 5.843 7.366 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -20.176 4.987 7.016 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.334 5.169 5.713 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -21.636 7.577 6.346 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -20.431 7.382 7.604 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -18.740 6.751 5.894 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -19.943 6.926 4.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -18.571 8.897 4.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -20.177 9.271 5.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -19.011 9.101 6.441 1.00 0.00 H new ATOM 2136 N GLU A 133 -23.263 4.317 10.624 1.00 0.00 N ATOM 2137 CA GLU A 133 -24.414 4.053 11.480 1.00 0.00 C ATOM 2138 C GLU A 133 -24.146 4.506 12.913 1.00 0.00 C ATOM 2139 O GLU A 133 -25.005 4.378 13.786 1.00 0.00 O ATOM 2140 CB GLU A 133 -24.759 2.562 11.457 1.00 0.00 C ATOM 2141 CG GLU A 133 -25.084 2.037 10.068 1.00 0.00 C ATOM 2142 CD GLU A 133 -25.449 0.566 10.073 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -24.529 -0.275 9.975 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -26.653 0.253 10.176 1.00 0.00 O ATOM 0 H GLU A 133 -22.600 3.544 10.560 1.00 0.00 H new ATOM 0 HA GLU A 133 -25.260 4.621 11.094 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -23.920 1.997 11.864 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -25.611 2.384 12.113 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -25.911 2.612 9.650 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -24.226 2.193 9.414 1.00 0.00 H new ATOM 2151 N GLY A 134 -22.949 5.038 13.147 1.00 0.00 N ATOM 2152 CA GLY A 134 -22.588 5.505 14.475 1.00 0.00 C ATOM 2153 C GLY A 134 -22.315 4.367 15.439 1.00 0.00 C ATOM 2154 O GLY A 134 -23.224 3.889 16.117 1.00 0.00 O ATOM 0 H GLY A 134 -22.222 5.154 12.441 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -21.703 6.138 14.406 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -23.393 6.125 14.869 1.00 0.00 H new ATOM 2158 N ARG A 135 -21.058 3.935 15.501 1.00 0.00 N ATOM 2159 CA ARG A 135 -20.667 2.847 16.390 1.00 0.00 C ATOM 2160 C ARG A 135 -19.155 2.821 16.587 1.00 0.00 C ATOM 2161 O ARG A 135 -18.392 2.902 15.624 1.00 0.00 O ATOM 2162 CB ARG A 135 -21.146 1.508 15.828 1.00 0.00 C ATOM 2163 CG ARG A 135 -20.959 0.343 16.785 1.00 0.00 C ATOM 2164 CD ARG A 135 -21.513 -0.947 16.203 1.00 0.00 C ATOM 2165 NE ARG A 135 -21.484 -2.042 17.169 1.00 0.00 N ATOM 2166 CZ ARG A 135 -22.310 -3.085 17.126 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -23.228 -3.169 16.173 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -22.219 -4.043 18.037 1.00 0.00 N ATOM 0 H ARG A 135 -20.294 4.322 14.946 1.00 0.00 H new ATOM 0 HA ARG A 135 -21.136 3.015 17.360 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -22.202 1.589 15.570 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -20.607 1.298 14.904 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -19.899 0.218 17.006 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -21.458 0.562 17.729 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -22.538 -0.784 15.871 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -20.934 -1.225 15.323 1.00 0.00 H new ATOM 0 HE ARG A 135 -20.793 -2.006 17.918 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -23.303 -2.433 15.470 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -23.860 -3.969 16.142 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -21.515 -3.982 18.773 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -22.853 -4.841 18.002 1.00 0.00 H new ATOM 2182 N GLY A 136 -18.727 2.706 17.840 1.00 0.00 N ATOM 2183 CA GLY A 136 -17.309 2.671 18.141 1.00 0.00 C ATOM 2184 C GLY A 136 -16.777 4.019 18.589 1.00 0.00 C ATOM 2185 O GLY A 136 -17.333 5.051 18.155 1.00 0.00 O ATOM 2186 OXT GLY A 136 -15.805 4.044 19.372 1.00 0.00 O ATOM 0 H GLY A 136 -19.339 2.636 18.653 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -17.125 1.933 18.922 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -16.761 2.343 17.257 1.00 0.00 H new TER 2190 GLY A 136