USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 709 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 73 MET CE :methyl -140:sc= -0.184 (180deg=-0.564) USER MOD Set 1.2: B 286 GLN : amide:sc= 0 X(o=-0.18,f=-0.63) USER MOD Set 2.1: A 54 ASN : amide:sc= 0.178 K(o=0.32,f=-2.4!) USER MOD Set 2.2: A 57 THR OG1 : rot 66:sc= 0.142 USER MOD Set 3.1: A 10 GLN : amide:sc= 0.432 K(o=0.88,f=0.24) USER MOD Set 3.2: B 289 TYR OH : rot -169:sc= 0.445 USER MOD Set 4.1: A 2 GLN : amide:sc= 1.6 K(o=2.6,f=-2.4) USER MOD Set 4.2: A 14 LYS NZ :NH3+ 170:sc= 0.979 (180deg=0) USER MOD Single : A 1 MET CE :methyl -155:sc= -0.143 (180deg=-0.85) USER MOD Single : A 1 MET N :NH3+ -162:sc= 2.13 (180deg=1.71) USER MOD Single : A 4 THR OG1 : rot 80:sc= 0.396 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.261 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -169:sc= 1.6 (180deg=1.34) USER MOD Single : A 29 LYS NZ :NH3+ -164:sc= 1.18 (180deg=1.13) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 169:sc= 0.924 (180deg=0.792) USER MOD Single : A 44 GLN : amide:sc= 0.727 K(o=0.73,f=-2.7!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -164:sc= 1.24 (180deg=1.2) USER MOD Single : A 62 TYR OH : rot 30:sc= 0.576 USER MOD Single : A 63 LYS NZ :NH3+ 177:sc= 0.914 (180deg=0.907) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : B 291 MET CE :methyl 169:sc= 0 (180deg=-0.0874) USER MOD Single : B 292 GLN : amide:sc= 0.615 K(o=0.61,f=0) USER MOD Single : B 293 MET CE :methyl -143:sc= -0.115 (180deg=-0.362) USER MOD Single : B 294 SER OG : rot -37:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.174 6.970 7.625 1.00 0.00 N ATOM 2 CA MET A 1 3.463 6.566 6.227 1.00 0.00 C ATOM 3 C MET A 1 3.495 5.052 6.137 1.00 0.00 C ATOM 4 O MET A 1 4.323 4.388 6.756 1.00 0.00 O ATOM 5 CB MET A 1 4.780 7.158 5.704 1.00 0.00 C ATOM 6 CG MET A 1 5.037 6.873 4.217 1.00 0.00 C ATOM 7 SD MET A 1 6.604 7.544 3.586 1.00 0.00 S ATOM 8 CE MET A 1 7.717 6.122 3.805 1.00 0.00 C ATOM 0 H1 MET A 1 2.852 7.959 7.641 1.00 0.00 H new ATOM 0 H2 MET A 1 2.430 6.358 8.017 1.00 0.00 H new ATOM 0 H3 MET A 1 4.037 6.877 8.199 1.00 0.00 H new ATOM 0 HA MET A 1 2.667 6.962 5.596 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.771 8.236 5.862 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.607 6.757 6.290 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.027 5.795 4.059 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.216 7.288 3.632 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.744 6.475 3.895 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.439 5.578 4.708 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.635 5.460 2.943 1.00 0.00 H new ATOM 20 N GLN A 2 2.569 4.502 5.368 1.00 0.00 N ATOM 21 CA GLN A 2 2.329 3.065 5.243 1.00 0.00 C ATOM 22 C GLN A 2 3.240 2.441 4.175 1.00 0.00 C ATOM 23 O GLN A 2 2.818 2.171 3.050 1.00 0.00 O ATOM 24 CB GLN A 2 0.846 2.779 4.979 1.00 0.00 C ATOM 25 CG GLN A 2 -0.169 3.490 5.891 1.00 0.00 C ATOM 26 CD GLN A 2 -1.509 3.634 5.179 1.00 0.00 C ATOM 27 OE1 GLN A 2 -2.420 2.828 5.336 1.00 0.00 O ATOM 28 NE2 GLN A 2 -1.659 4.639 4.343 1.00 0.00 N ATOM 0 H GLN A 2 1.939 5.060 4.791 1.00 0.00 H new ATOM 0 HA GLN A 2 2.584 2.592 6.191 1.00 0.00 H new ATOM 0 HB2 GLN A 2 0.625 3.052 3.947 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.686 1.704 5.065 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -0.298 2.924 6.813 1.00 0.00 H new ATOM 0 HG3 GLN A 2 0.209 4.473 6.171 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -0.902 5.310 4.211 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -2.532 4.747 3.827 1.00 0.00 H new ATOM 37 N VAL A 3 4.505 2.213 4.527 1.00 0.00 N ATOM 38 CA VAL A 3 5.469 1.472 3.699 1.00 0.00 C ATOM 39 C VAL A 3 4.932 0.061 3.441 1.00 0.00 C ATOM 40 O VAL A 3 4.516 -0.622 4.378 1.00 0.00 O ATOM 41 CB VAL A 3 6.847 1.394 4.391 1.00 0.00 C ATOM 42 CG1 VAL A 3 7.891 0.688 3.517 1.00 0.00 C ATOM 43 CG2 VAL A 3 7.414 2.787 4.668 1.00 0.00 C ATOM 0 H VAL A 3 4.900 2.541 5.408 1.00 0.00 H new ATOM 0 HA VAL A 3 5.596 1.998 2.753 1.00 0.00 H new ATOM 0 HB VAL A 3 6.672 0.841 5.314 1.00 0.00 H new ATOM 0 HG11 VAL A 3 8.845 0.656 4.044 1.00 0.00 H new ATOM 0 HG12 VAL A 3 7.560 -0.328 3.304 1.00 0.00 H new ATOM 0 HG13 VAL A 3 8.011 1.234 2.581 1.00 0.00 H new ATOM 0 HG21 VAL A 3 8.384 2.694 5.156 1.00 0.00 H new ATOM 0 HG22 VAL A 3 7.530 3.326 3.728 1.00 0.00 H new ATOM 0 HG23 VAL A 3 6.732 3.335 5.318 1.00 0.00 H new ATOM 53 N THR A 4 4.926 -0.392 2.188 1.00 0.00 N ATOM 54 CA THR A 4 4.644 -1.801 1.870 1.00 0.00 C ATOM 55 C THR A 4 5.907 -2.632 2.111 1.00 0.00 C ATOM 56 O THR A 4 6.999 -2.238 1.706 1.00 0.00 O ATOM 57 CB THR A 4 4.185 -1.957 0.417 1.00 0.00 C ATOM 58 OG1 THR A 4 2.949 -1.300 0.214 1.00 0.00 O ATOM 59 CG2 THR A 4 3.971 -3.426 0.048 1.00 0.00 C ATOM 0 H THR A 4 5.113 0.192 1.373 1.00 0.00 H new ATOM 0 HA THR A 4 3.839 -2.152 2.516 1.00 0.00 H new ATOM 0 HB THR A 4 4.970 -1.524 -0.203 1.00 0.00 H new ATOM 0 HG1 THR A 4 3.105 -0.340 0.093 1.00 0.00 H new ATOM 0 HG21 THR A 4 3.646 -3.497 -0.990 1.00 0.00 H new ATOM 0 HG22 THR A 4 4.906 -3.973 0.174 1.00 0.00 H new ATOM 0 HG23 THR A 4 3.209 -3.857 0.697 1.00 0.00 H new ATOM 67 N LEU A 5 5.780 -3.785 2.763 1.00 0.00 N ATOM 68 CA LEU A 5 6.873 -4.700 3.095 1.00 0.00 C ATOM 69 C LEU A 5 6.786 -5.988 2.270 1.00 0.00 C ATOM 70 O LEU A 5 5.694 -6.441 1.918 1.00 0.00 O ATOM 71 CB LEU A 5 6.779 -5.034 4.596 1.00 0.00 C ATOM 72 CG LEU A 5 7.327 -3.983 5.582 1.00 0.00 C ATOM 73 CD1 LEU A 5 8.723 -4.391 6.029 1.00 0.00 C ATOM 74 CD2 LEU A 5 7.353 -2.531 5.112 1.00 0.00 C ATOM 0 H LEU A 5 4.875 -4.123 3.089 1.00 0.00 H new ATOM 0 HA LEU A 5 7.826 -4.224 2.865 1.00 0.00 H new ATOM 0 HB2 LEU A 5 5.731 -5.212 4.838 1.00 0.00 H new ATOM 0 HB3 LEU A 5 7.310 -5.970 4.769 1.00 0.00 H new ATOM 0 HG LEU A 5 6.604 -3.985 6.398 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.113 -3.650 6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.678 -5.363 6.520 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.379 -4.453 5.161 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.761 -1.900 5.902 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.977 -2.448 4.222 1.00 0.00 H new ATOM 0 HD23 LEU A 5 6.339 -2.207 4.876 1.00 0.00 H new ATOM 86 N LYS A 6 7.945 -6.609 2.038 1.00 0.00 N ATOM 87 CA LYS A 6 8.112 -7.917 1.388 1.00 0.00 C ATOM 88 C LYS A 6 9.189 -8.755 2.083 1.00 0.00 C ATOM 89 O LYS A 6 10.226 -8.221 2.477 1.00 0.00 O ATOM 90 CB LYS A 6 8.400 -7.707 -0.108 1.00 0.00 C ATOM 91 CG LYS A 6 8.358 -9.038 -0.875 1.00 0.00 C ATOM 92 CD LYS A 6 8.059 -8.836 -2.364 1.00 0.00 C ATOM 93 CE LYS A 6 7.636 -10.178 -2.967 1.00 0.00 C ATOM 94 NZ LYS A 6 7.094 -10.009 -4.342 1.00 0.00 N ATOM 0 H LYS A 6 8.837 -6.196 2.310 1.00 0.00 H new ATOM 0 HA LYS A 6 7.187 -8.487 1.479 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.667 -7.019 -0.529 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.379 -7.244 -0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 6 9.314 -9.550 -0.764 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.597 -9.684 -0.437 1.00 0.00 H new ATOM 0 HD2 LYS A 6 7.268 -8.098 -2.494 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.940 -8.452 -2.878 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.491 -10.853 -2.992 1.00 0.00 H new ATOM 0 HE3 LYS A 6 6.882 -10.642 -2.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.817 -10.936 -4.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.263 -9.384 -4.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.823 -9.588 -4.953 1.00 0.00 H new ATOM 108 N THR A 7 8.942 -10.054 2.243 1.00 0.00 N ATOM 109 CA THR A 7 9.813 -10.998 2.970 1.00 0.00 C ATOM 110 C THR A 7 10.677 -11.842 2.024 1.00 0.00 C ATOM 111 O THR A 7 10.414 -11.915 0.821 1.00 0.00 O ATOM 112 CB THR A 7 8.985 -11.930 3.878 1.00 0.00 C ATOM 113 OG1 THR A 7 8.372 -12.967 3.141 1.00 0.00 O ATOM 114 CG2 THR A 7 7.861 -11.219 4.633 1.00 0.00 C ATOM 0 H THR A 7 8.107 -10.500 1.862 1.00 0.00 H new ATOM 0 HA THR A 7 10.478 -10.391 3.584 1.00 0.00 H new ATOM 0 HB THR A 7 9.714 -12.316 4.590 1.00 0.00 H new ATOM 0 HG1 THR A 7 7.857 -13.539 3.748 1.00 0.00 H new ATOM 0 HG21 THR A 7 7.324 -11.940 5.250 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.285 -10.442 5.269 1.00 0.00 H new ATOM 0 HG23 THR A 7 7.172 -10.768 3.919 1.00 0.00 H new ATOM 122 N LEU A 8 11.679 -12.553 2.560 1.00 0.00 N ATOM 123 CA LEU A 8 12.437 -13.563 1.801 1.00 0.00 C ATOM 124 C LEU A 8 11.595 -14.796 1.430 1.00 0.00 C ATOM 125 O LEU A 8 11.842 -15.433 0.407 1.00 0.00 O ATOM 126 CB LEU A 8 13.689 -13.991 2.578 1.00 0.00 C ATOM 127 CG LEU A 8 14.713 -12.874 2.826 1.00 0.00 C ATOM 128 CD1 LEU A 8 15.972 -13.469 3.445 1.00 0.00 C ATOM 129 CD2 LEU A 8 15.164 -12.187 1.545 1.00 0.00 C ATOM 0 H LEU A 8 11.987 -12.447 3.526 1.00 0.00 H new ATOM 0 HA LEU A 8 12.732 -13.089 0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.379 -14.399 3.540 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.179 -14.798 2.032 1.00 0.00 H new ATOM 0 HG LEU A 8 14.218 -12.150 3.474 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.700 -12.677 3.622 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.721 -13.948 4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.397 -14.208 2.766 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.887 -11.407 1.785 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.626 -12.919 0.883 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.302 -11.742 1.048 1.00 0.00 H new ATOM 141 N GLN A 9 10.560 -15.103 2.217 1.00 0.00 N ATOM 142 CA GLN A 9 9.536 -16.102 1.882 1.00 0.00 C ATOM 143 C GLN A 9 8.551 -15.582 0.806 1.00 0.00 C ATOM 144 O GLN A 9 7.594 -16.275 0.453 1.00 0.00 O ATOM 145 CB GLN A 9 8.810 -16.546 3.164 1.00 0.00 C ATOM 146 CG GLN A 9 9.736 -17.317 4.119 1.00 0.00 C ATOM 147 CD GLN A 9 8.973 -17.854 5.329 1.00 0.00 C ATOM 148 OE1 GLN A 9 8.607 -17.127 6.244 1.00 0.00 O ATOM 149 NE2 GLN A 9 8.698 -19.142 5.391 1.00 0.00 N ATOM 0 H GLN A 9 10.406 -14.657 3.121 1.00 0.00 H new ATOM 0 HA GLN A 9 10.027 -16.971 1.444 1.00 0.00 H new ATOM 0 HB2 GLN A 9 8.411 -15.670 3.676 1.00 0.00 H new ATOM 0 HB3 GLN A 9 7.960 -17.175 2.899 1.00 0.00 H new ATOM 0 HG2 GLN A 9 10.202 -18.145 3.585 1.00 0.00 H new ATOM 0 HG3 GLN A 9 10.539 -16.662 4.456 1.00 0.00 H new ATOM 0 HE21 GLN A 9 8.994 -19.764 4.639 1.00 0.00 H new ATOM 0 HE22 GLN A 9 8.189 -19.517 6.191 1.00 0.00 H new ATOM 158 N GLN A 10 8.790 -14.378 0.263 1.00 0.00 N ATOM 159 CA GLN A 10 8.050 -13.725 -0.823 1.00 0.00 C ATOM 160 C GLN A 10 6.604 -13.349 -0.443 1.00 0.00 C ATOM 161 O GLN A 10 5.753 -13.144 -1.313 1.00 0.00 O ATOM 162 CB GLN A 10 8.212 -14.559 -2.115 1.00 0.00 C ATOM 163 CG GLN A 10 8.410 -13.689 -3.362 1.00 0.00 C ATOM 164 CD GLN A 10 8.707 -14.531 -4.602 1.00 0.00 C ATOM 165 OE1 GLN A 10 7.862 -14.736 -5.466 1.00 0.00 O ATOM 166 NE2 GLN A 10 9.911 -15.045 -4.753 1.00 0.00 N ATOM 0 H GLN A 10 9.559 -13.797 0.596 1.00 0.00 H new ATOM 0 HA GLN A 10 8.485 -12.746 -1.023 1.00 0.00 H new ATOM 0 HB2 GLN A 10 9.065 -15.229 -2.005 1.00 0.00 H new ATOM 0 HB3 GLN A 10 7.330 -15.185 -2.251 1.00 0.00 H new ATOM 0 HG2 GLN A 10 7.514 -13.092 -3.534 1.00 0.00 H new ATOM 0 HG3 GLN A 10 9.230 -12.991 -3.192 1.00 0.00 H new ATOM 0 HE21 GLN A 10 10.627 -14.885 -4.044 1.00 0.00 H new ATOM 0 HE22 GLN A 10 10.127 -15.603 -5.579 1.00 0.00 H new ATOM 175 N GLN A 11 6.341 -13.201 0.860 1.00 0.00 N ATOM 176 CA GLN A 11 5.075 -12.712 1.421 1.00 0.00 C ATOM 177 C GLN A 11 5.109 -11.186 1.552 1.00 0.00 C ATOM 178 O GLN A 11 6.188 -10.595 1.586 1.00 0.00 O ATOM 179 CB GLN A 11 4.817 -13.357 2.793 1.00 0.00 C ATOM 180 CG GLN A 11 4.807 -14.893 2.723 1.00 0.00 C ATOM 181 CD GLN A 11 4.397 -15.555 4.040 1.00 0.00 C ATOM 182 OE1 GLN A 11 3.498 -15.119 4.751 1.00 0.00 O ATOM 183 NE2 GLN A 11 5.024 -16.650 4.418 1.00 0.00 N ATOM 0 H GLN A 11 7.028 -13.426 1.579 1.00 0.00 H new ATOM 0 HA GLN A 11 4.264 -12.988 0.747 1.00 0.00 H new ATOM 0 HB2 GLN A 11 5.585 -13.032 3.495 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.861 -13.007 3.183 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.122 -15.210 1.936 1.00 0.00 H new ATOM 0 HG3 GLN A 11 5.800 -15.244 2.442 1.00 0.00 H new ATOM 0 HE21 GLN A 11 5.775 -17.032 3.843 1.00 0.00 H new ATOM 0 HE22 GLN A 11 4.758 -17.116 5.285 1.00 0.00 H new ATOM 192 N THR A 12 3.948 -10.533 1.627 1.00 0.00 N ATOM 193 CA THR A 12 3.839 -9.066 1.693 1.00 0.00 C ATOM 194 C THR A 12 2.775 -8.592 2.689 1.00 0.00 C ATOM 195 O THR A 12 1.757 -9.252 2.915 1.00 0.00 O ATOM 196 CB THR A 12 3.571 -8.454 0.304 1.00 0.00 C ATOM 197 OG1 THR A 12 2.426 -9.031 -0.293 1.00 0.00 O ATOM 198 CG2 THR A 12 4.742 -8.643 -0.666 1.00 0.00 C ATOM 0 H THR A 12 3.045 -11.008 1.644 1.00 0.00 H new ATOM 0 HA THR A 12 4.805 -8.713 2.053 1.00 0.00 H new ATOM 0 HB THR A 12 3.423 -7.389 0.481 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.276 -8.625 -1.172 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.495 -8.192 -1.627 1.00 0.00 H new ATOM 0 HG22 THR A 12 5.633 -8.165 -0.259 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.933 -9.707 -0.803 1.00 0.00 H new ATOM 206 N PHE A 13 3.038 -7.443 3.315 1.00 0.00 N ATOM 207 CA PHE A 13 2.172 -6.723 4.262 1.00 0.00 C ATOM 208 C PHE A 13 2.449 -5.206 4.186 1.00 0.00 C ATOM 209 O PHE A 13 3.190 -4.765 3.305 1.00 0.00 O ATOM 210 CB PHE A 13 2.347 -7.312 5.680 1.00 0.00 C ATOM 211 CG PHE A 13 3.763 -7.353 6.236 1.00 0.00 C ATOM 212 CD1 PHE A 13 4.601 -8.447 5.944 1.00 0.00 C ATOM 213 CD2 PHE A 13 4.226 -6.337 7.096 1.00 0.00 C ATOM 214 CE1 PHE A 13 5.893 -8.518 6.495 1.00 0.00 C ATOM 215 CE2 PHE A 13 5.521 -6.410 7.645 1.00 0.00 C ATOM 216 CZ PHE A 13 6.357 -7.497 7.340 1.00 0.00 C ATOM 0 H PHE A 13 3.921 -6.954 3.166 1.00 0.00 H new ATOM 0 HA PHE A 13 1.124 -6.856 3.995 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.729 -6.734 6.367 1.00 0.00 H new ATOM 0 HB3 PHE A 13 1.954 -8.329 5.676 1.00 0.00 H new ATOM 0 HD1 PHE A 13 4.250 -9.235 5.294 1.00 0.00 H new ATOM 0 HD2 PHE A 13 3.586 -5.500 7.335 1.00 0.00 H new ATOM 0 HE1 PHE A 13 6.530 -9.360 6.268 1.00 0.00 H new ATOM 0 HE2 PHE A 13 5.872 -5.628 8.302 1.00 0.00 H new ATOM 0 HZ PHE A 13 7.353 -7.547 7.754 1.00 0.00 H new ATOM 226 N LYS A 14 1.887 -4.388 5.086 1.00 0.00 N ATOM 227 CA LYS A 14 2.253 -2.964 5.234 1.00 0.00 C ATOM 228 C LYS A 14 2.610 -2.597 6.678 1.00 0.00 C ATOM 229 O LYS A 14 2.154 -3.240 7.625 1.00 0.00 O ATOM 230 CB LYS A 14 1.168 -2.047 4.629 1.00 0.00 C ATOM 231 CG LYS A 14 -0.153 -2.006 5.419 1.00 0.00 C ATOM 232 CD LYS A 14 -1.155 -1.037 4.772 1.00 0.00 C ATOM 233 CE LYS A 14 -2.424 -0.924 5.627 1.00 0.00 C ATOM 234 NZ LYS A 14 -3.355 0.108 5.099 1.00 0.00 N ATOM 0 H LYS A 14 1.163 -4.692 5.737 1.00 0.00 H new ATOM 0 HA LYS A 14 3.165 -2.798 4.661 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.565 -1.034 4.559 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.957 -2.378 3.612 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.585 -3.006 5.463 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.043 -1.699 6.446 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.698 -0.054 4.658 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -1.413 -1.386 3.772 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -2.930 -1.889 5.656 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -2.150 -0.676 6.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -4.266 0.040 5.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -2.948 1.053 5.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -3.503 -0.046 4.081 1.00 0.00 H new ATOM 248 N ILE A 15 3.413 -1.547 6.832 1.00 0.00 N ATOM 249 CA ILE A 15 3.900 -0.976 8.094 1.00 0.00 C ATOM 250 C ILE A 15 3.701 0.536 8.053 1.00 0.00 C ATOM 251 O ILE A 15 4.382 1.251 7.320 1.00 0.00 O ATOM 252 CB ILE A 15 5.375 -1.369 8.348 1.00 0.00 C ATOM 253 CG1 ILE A 15 5.489 -2.848 8.761 1.00 0.00 C ATOM 254 CG2 ILE A 15 6.078 -0.483 9.388 1.00 0.00 C ATOM 255 CD1 ILE A 15 4.989 -3.210 10.168 1.00 0.00 C ATOM 0 H ILE A 15 3.768 -1.034 6.025 1.00 0.00 H new ATOM 0 HA ILE A 15 3.331 -1.380 8.931 1.00 0.00 H new ATOM 0 HB ILE A 15 5.887 -1.211 7.399 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.935 -3.447 8.038 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.535 -3.143 8.685 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.108 -0.817 9.514 1.00 0.00 H new ATOM 0 HG22 ILE A 15 6.072 0.552 9.048 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.554 -0.555 10.341 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.123 -4.278 10.338 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.557 -2.650 10.911 1.00 0.00 H new ATOM 0 HD13 ILE A 15 3.932 -2.959 10.254 1.00 0.00 H new ATOM 267 N ASP A 16 2.735 1.019 8.830 1.00 0.00 N ATOM 268 CA ASP A 16 2.557 2.454 9.072 1.00 0.00 C ATOM 269 C ASP A 16 3.627 2.969 10.052 1.00 0.00 C ATOM 270 O ASP A 16 3.525 2.762 11.264 1.00 0.00 O ATOM 271 CB ASP A 16 1.146 2.774 9.574 1.00 0.00 C ATOM 272 CG ASP A 16 0.921 4.295 9.689 1.00 0.00 C ATOM 273 OD1 ASP A 16 1.455 5.060 8.847 1.00 0.00 O ATOM 274 OD2 ASP A 16 0.205 4.729 10.623 1.00 0.00 O ATOM 0 H ASP A 16 2.054 0.431 9.310 1.00 0.00 H new ATOM 0 HA ASP A 16 2.682 2.972 8.121 1.00 0.00 H new ATOM 0 HB2 ASP A 16 0.410 2.346 8.893 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.990 2.307 10.546 1.00 0.00 H new ATOM 279 N ILE A 17 4.667 3.612 9.529 1.00 0.00 N ATOM 280 CA ILE A 17 5.816 4.162 10.268 1.00 0.00 C ATOM 281 C ILE A 17 5.933 5.680 10.044 1.00 0.00 C ATOM 282 O ILE A 17 5.534 6.199 9.001 1.00 0.00 O ATOM 283 CB ILE A 17 7.100 3.376 9.894 1.00 0.00 C ATOM 284 CG1 ILE A 17 8.379 3.900 10.583 1.00 0.00 C ATOM 285 CG2 ILE A 17 7.334 3.316 8.369 1.00 0.00 C ATOM 286 CD1 ILE A 17 8.339 3.842 12.116 1.00 0.00 C ATOM 0 H ILE A 17 4.742 3.776 8.525 1.00 0.00 H new ATOM 0 HA ILE A 17 5.667 4.034 11.340 1.00 0.00 H new ATOM 0 HB ILE A 17 6.911 2.370 10.268 1.00 0.00 H new ATOM 0 HG12 ILE A 17 9.231 3.319 10.231 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.547 4.932 10.274 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.245 2.755 8.163 1.00 0.00 H new ATOM 0 HG22 ILE A 17 6.488 2.823 7.890 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.434 4.328 7.976 1.00 0.00 H new ATOM 0 HD11 ILE A 17 9.275 4.228 12.519 1.00 0.00 H new ATOM 0 HD12 ILE A 17 7.509 4.447 12.481 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.204 2.809 12.438 1.00 0.00 H new ATOM 298 N ASP A 18 6.463 6.418 11.022 1.00 0.00 N ATOM 299 CA ASP A 18 6.724 7.860 10.873 1.00 0.00 C ATOM 300 C ASP A 18 7.934 8.106 9.933 1.00 0.00 C ATOM 301 O ASP A 18 9.039 7.655 10.248 1.00 0.00 O ATOM 302 CB ASP A 18 6.939 8.482 12.259 1.00 0.00 C ATOM 303 CG ASP A 18 7.012 10.021 12.213 1.00 0.00 C ATOM 304 OD1 ASP A 18 7.778 10.577 11.392 1.00 0.00 O ATOM 305 OD2 ASP A 18 6.285 10.677 12.997 1.00 0.00 O ATOM 0 H ASP A 18 6.723 6.041 11.934 1.00 0.00 H new ATOM 0 HA ASP A 18 5.862 8.341 10.410 1.00 0.00 H new ATOM 0 HB2 ASP A 18 6.126 8.180 12.919 1.00 0.00 H new ATOM 0 HB3 ASP A 18 7.861 8.091 12.690 1.00 0.00 H new ATOM 310 N PRO A 19 7.774 8.787 8.778 1.00 0.00 N ATOM 311 CA PRO A 19 8.839 8.922 7.779 1.00 0.00 C ATOM 312 C PRO A 19 9.979 9.876 8.182 1.00 0.00 C ATOM 313 O PRO A 19 11.038 9.860 7.551 1.00 0.00 O ATOM 314 CB PRO A 19 8.132 9.417 6.517 1.00 0.00 C ATOM 315 CG PRO A 19 6.973 10.243 7.071 1.00 0.00 C ATOM 316 CD PRO A 19 6.566 9.457 8.316 1.00 0.00 C ATOM 0 HA PRO A 19 9.343 7.965 7.647 1.00 0.00 H new ATOM 0 HB2 PRO A 19 8.794 10.018 5.894 1.00 0.00 H new ATOM 0 HB3 PRO A 19 7.779 8.589 5.902 1.00 0.00 H new ATOM 0 HG2 PRO A 19 7.281 11.259 7.316 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.154 10.322 6.356 1.00 0.00 H new ATOM 0 HD2 PRO A 19 6.169 10.121 9.084 1.00 0.00 H new ATOM 0 HD3 PRO A 19 5.783 8.735 8.083 1.00 0.00 H new ATOM 324 N GLU A 20 9.803 10.703 9.217 1.00 0.00 N ATOM 325 CA GLU A 20 10.867 11.542 9.769 1.00 0.00 C ATOM 326 C GLU A 20 11.687 10.815 10.853 1.00 0.00 C ATOM 327 O GLU A 20 12.776 11.270 11.212 1.00 0.00 O ATOM 328 CB GLU A 20 10.278 12.861 10.280 1.00 0.00 C ATOM 329 CG GLU A 20 9.512 13.620 9.182 1.00 0.00 C ATOM 330 CD GLU A 20 9.615 15.144 9.364 1.00 0.00 C ATOM 331 OE1 GLU A 20 8.885 15.721 10.207 1.00 0.00 O ATOM 332 OE2 GLU A 20 10.433 15.775 8.648 1.00 0.00 O ATOM 0 H GLU A 20 8.910 10.809 9.698 1.00 0.00 H new ATOM 0 HA GLU A 20 11.571 11.766 8.968 1.00 0.00 H new ATOM 0 HB2 GLU A 20 9.607 12.658 11.115 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.081 13.491 10.662 1.00 0.00 H new ATOM 0 HG2 GLU A 20 9.908 13.343 8.205 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.464 13.322 9.198 1.00 0.00 H new ATOM 339 N GLU A 21 11.201 9.673 11.354 1.00 0.00 N ATOM 340 CA GLU A 21 11.969 8.760 12.208 1.00 0.00 C ATOM 341 C GLU A 21 12.908 7.885 11.349 1.00 0.00 C ATOM 342 O GLU A 21 12.921 7.951 10.112 1.00 0.00 O ATOM 343 CB GLU A 21 11.039 7.878 13.063 1.00 0.00 C ATOM 344 CG GLU A 21 10.174 8.646 14.071 1.00 0.00 C ATOM 345 CD GLU A 21 11.018 9.323 15.168 1.00 0.00 C ATOM 346 OE1 GLU A 21 11.555 8.612 16.052 1.00 0.00 O ATOM 347 OE2 GLU A 21 11.148 10.572 15.165 1.00 0.00 O ATOM 0 H GLU A 21 10.249 9.353 11.175 1.00 0.00 H new ATOM 0 HA GLU A 21 12.573 9.362 12.887 1.00 0.00 H new ATOM 0 HB2 GLU A 21 10.384 7.314 12.399 1.00 0.00 H new ATOM 0 HB3 GLU A 21 11.646 7.152 13.604 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.592 9.402 13.545 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.463 7.961 14.533 1.00 0.00 H new ATOM 354 N THR A 22 13.739 7.075 12.006 1.00 0.00 N ATOM 355 CA THR A 22 14.822 6.336 11.347 1.00 0.00 C ATOM 356 C THR A 22 14.452 4.916 10.926 1.00 0.00 C ATOM 357 O THR A 22 13.381 4.390 11.234 1.00 0.00 O ATOM 358 CB THR A 22 16.105 6.347 12.182 1.00 0.00 C ATOM 359 OG1 THR A 22 15.932 5.547 13.331 1.00 0.00 O ATOM 360 CG2 THR A 22 16.524 7.747 12.625 1.00 0.00 C ATOM 0 H THR A 22 13.682 6.911 13.011 1.00 0.00 H new ATOM 0 HA THR A 22 15.006 6.877 10.419 1.00 0.00 H new ATOM 0 HB THR A 22 16.893 5.954 11.540 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.756 5.555 13.862 1.00 0.00 H new ATOM 0 HG21 THR A 22 17.440 7.684 13.212 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.698 8.369 11.747 1.00 0.00 H new ATOM 0 HG23 THR A 22 15.733 8.188 13.232 1.00 0.00 H new ATOM 368 N VAL A 23 15.369 4.264 10.214 1.00 0.00 N ATOM 369 CA VAL A 23 15.252 2.851 9.824 1.00 0.00 C ATOM 370 C VAL A 23 15.184 1.933 11.056 1.00 0.00 C ATOM 371 O VAL A 23 14.473 0.928 11.036 1.00 0.00 O ATOM 372 CB VAL A 23 16.437 2.483 8.918 1.00 0.00 C ATOM 373 CG1 VAL A 23 16.498 0.996 8.549 1.00 0.00 C ATOM 374 CG2 VAL A 23 16.397 3.301 7.620 1.00 0.00 C ATOM 0 H VAL A 23 16.228 4.704 9.885 1.00 0.00 H new ATOM 0 HA VAL A 23 14.322 2.707 9.274 1.00 0.00 H new ATOM 0 HB VAL A 23 17.328 2.715 9.502 1.00 0.00 H new ATOM 0 HG11 VAL A 23 17.361 0.815 7.908 1.00 0.00 H new ATOM 0 HG12 VAL A 23 16.589 0.399 9.457 1.00 0.00 H new ATOM 0 HG13 VAL A 23 15.588 0.715 8.019 1.00 0.00 H new ATOM 0 HG21 VAL A 23 17.244 3.027 6.991 1.00 0.00 H new ATOM 0 HG22 VAL A 23 15.468 3.095 7.088 1.00 0.00 H new ATOM 0 HG23 VAL A 23 16.451 4.363 7.858 1.00 0.00 H new ATOM 384 N LYS A 24 15.840 2.292 12.168 1.00 0.00 N ATOM 385 CA LYS A 24 15.670 1.608 13.460 1.00 0.00 C ATOM 386 C LYS A 24 14.223 1.678 13.974 1.00 0.00 C ATOM 387 O LYS A 24 13.726 0.691 14.513 1.00 0.00 O ATOM 388 CB LYS A 24 16.684 2.185 14.459 1.00 0.00 C ATOM 389 CG LYS A 24 16.748 1.379 15.766 1.00 0.00 C ATOM 390 CD LYS A 24 17.965 1.769 16.620 1.00 0.00 C ATOM 391 CE LYS A 24 17.988 3.235 17.083 1.00 0.00 C ATOM 392 NZ LYS A 24 16.890 3.552 18.036 1.00 0.00 N ATOM 0 H LYS A 24 16.504 3.065 12.198 1.00 0.00 H new ATOM 0 HA LYS A 24 15.869 0.544 13.332 1.00 0.00 H new ATOM 0 HB2 LYS A 24 17.672 2.204 13.999 1.00 0.00 H new ATOM 0 HB3 LYS A 24 16.418 3.218 14.686 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.835 1.543 16.339 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.793 0.315 15.535 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.995 1.125 17.499 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.871 1.570 16.048 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.947 3.448 17.556 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.909 3.888 16.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 16.951 4.552 18.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 15.972 3.376 17.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 16.978 2.950 18.879 1.00 0.00 H new ATOM 406 N ALA A 25 13.519 2.795 13.763 1.00 0.00 N ATOM 407 CA ALA A 25 12.089 2.919 14.069 1.00 0.00 C ATOM 408 C ALA A 25 11.202 2.043 13.152 1.00 0.00 C ATOM 409 O ALA A 25 10.245 1.432 13.625 1.00 0.00 O ATOM 410 CB ALA A 25 11.681 4.395 14.038 1.00 0.00 C ATOM 0 H ALA A 25 13.928 3.644 13.373 1.00 0.00 H new ATOM 0 HA ALA A 25 11.924 2.535 15.076 1.00 0.00 H new ATOM 0 HB1 ALA A 25 10.619 4.484 14.266 1.00 0.00 H new ATOM 0 HB2 ALA A 25 12.258 4.948 14.779 1.00 0.00 H new ATOM 0 HB3 ALA A 25 11.875 4.805 13.047 1.00 0.00 H new ATOM 416 N LEU A 26 11.532 1.913 11.859 1.00 0.00 N ATOM 417 CA LEU A 26 10.906 0.947 10.947 1.00 0.00 C ATOM 418 C LEU A 26 11.041 -0.489 11.488 1.00 0.00 C ATOM 419 O LEU A 26 10.035 -1.166 11.710 1.00 0.00 O ATOM 420 CB LEU A 26 11.486 1.158 9.530 1.00 0.00 C ATOM 421 CG LEU A 26 11.131 0.106 8.468 1.00 0.00 C ATOM 422 CD1 LEU A 26 9.634 -0.159 8.441 1.00 0.00 C ATOM 423 CD2 LEU A 26 11.558 0.598 7.085 1.00 0.00 C ATOM 0 H LEU A 26 12.250 2.483 11.412 1.00 0.00 H new ATOM 0 HA LEU A 26 9.831 1.114 10.880 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.152 2.131 9.168 1.00 0.00 H new ATOM 0 HB3 LEU A 26 12.572 1.204 9.612 1.00 0.00 H new ATOM 0 HG LEU A 26 11.656 -0.815 8.724 1.00 0.00 H new ATOM 0 HD11 LEU A 26 9.411 -0.907 7.681 1.00 0.00 H new ATOM 0 HD12 LEU A 26 9.312 -0.525 9.416 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.105 0.765 8.207 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.303 -0.153 6.337 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.041 1.530 6.855 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.635 0.769 7.076 1.00 0.00 H new ATOM 435 N LYS A 27 12.271 -0.925 11.780 1.00 0.00 N ATOM 436 CA LYS A 27 12.568 -2.199 12.468 1.00 0.00 C ATOM 437 C LYS A 27 11.747 -2.401 13.749 1.00 0.00 C ATOM 438 O LYS A 27 11.216 -3.492 13.952 1.00 0.00 O ATOM 439 CB LYS A 27 14.075 -2.353 12.741 1.00 0.00 C ATOM 440 CG LYS A 27 14.906 -2.518 11.460 1.00 0.00 C ATOM 441 CD LYS A 27 16.389 -2.727 11.797 1.00 0.00 C ATOM 442 CE LYS A 27 17.209 -2.903 10.514 1.00 0.00 C ATOM 443 NZ LYS A 27 18.637 -3.159 10.824 1.00 0.00 N ATOM 0 H LYS A 27 13.110 -0.395 11.542 1.00 0.00 H new ATOM 0 HA LYS A 27 12.263 -2.990 11.782 1.00 0.00 H new ATOM 0 HB2 LYS A 27 14.430 -1.479 13.287 1.00 0.00 H new ATOM 0 HB3 LYS A 27 14.235 -3.218 13.385 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.535 -3.368 10.887 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.792 -1.635 10.831 1.00 0.00 H new ATOM 0 HD2 LYS A 27 16.764 -1.873 12.362 1.00 0.00 H new ATOM 0 HD3 LYS A 27 16.504 -3.605 12.433 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.806 -3.732 9.932 1.00 0.00 H new ATOM 0 HE3 LYS A 27 17.122 -2.008 9.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 19.199 -3.089 9.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 18.975 -2.455 11.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 18.739 -4.112 11.227 1.00 0.00 H new ATOM 457 N GLU A 28 11.594 -1.363 14.577 1.00 0.00 N ATOM 458 CA GLU A 28 10.698 -1.321 15.749 1.00 0.00 C ATOM 459 C GLU A 28 9.257 -1.723 15.398 1.00 0.00 C ATOM 460 O GLU A 28 8.709 -2.649 16.002 1.00 0.00 O ATOM 461 CB GLU A 28 10.824 0.040 16.479 1.00 0.00 C ATOM 462 CG GLU A 28 9.561 0.887 16.748 1.00 0.00 C ATOM 463 CD GLU A 28 8.614 0.283 17.809 1.00 0.00 C ATOM 464 OE1 GLU A 28 9.084 -0.103 18.907 1.00 0.00 O ATOM 465 OE2 GLU A 28 7.384 0.230 17.567 1.00 0.00 O ATOM 0 H GLU A 28 12.109 -0.492 14.449 1.00 0.00 H new ATOM 0 HA GLU A 28 11.020 -2.081 16.461 1.00 0.00 H new ATOM 0 HB2 GLU A 28 11.299 -0.150 17.442 1.00 0.00 H new ATOM 0 HB3 GLU A 28 11.512 0.657 15.900 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.866 1.882 17.072 1.00 0.00 H new ATOM 0 HG3 GLU A 28 9.013 1.010 15.814 1.00 0.00 H new ATOM 472 N LYS A 29 8.638 -1.066 14.410 1.00 0.00 N ATOM 473 CA LYS A 29 7.248 -1.316 14.032 1.00 0.00 C ATOM 474 C LYS A 29 7.055 -2.691 13.384 1.00 0.00 C ATOM 475 O LYS A 29 6.049 -3.345 13.652 1.00 0.00 O ATOM 476 CB LYS A 29 6.770 -0.140 13.168 1.00 0.00 C ATOM 477 CG LYS A 29 5.248 -0.068 12.997 1.00 0.00 C ATOM 478 CD LYS A 29 4.471 0.063 14.320 1.00 0.00 C ATOM 479 CE LYS A 29 2.978 0.353 14.106 1.00 0.00 C ATOM 480 NZ LYS A 29 2.719 1.776 13.763 1.00 0.00 N ATOM 0 H LYS A 29 9.091 -0.344 13.850 1.00 0.00 H new ATOM 0 HA LYS A 29 6.620 -1.364 14.921 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.119 0.791 13.615 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.232 -0.214 12.184 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.005 0.782 12.360 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.909 -0.964 12.476 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.579 -0.858 14.893 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.910 0.863 14.917 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.598 -0.285 13.308 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.427 0.094 15.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.709 1.986 13.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.283 2.391 14.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.983 1.948 12.772 1.00 0.00 H new ATOM 494 N ILE A 30 8.038 -3.174 12.618 1.00 0.00 N ATOM 495 CA ILE A 30 8.089 -4.556 12.106 1.00 0.00 C ATOM 496 C ILE A 30 8.137 -5.566 13.262 1.00 0.00 C ATOM 497 O ILE A 30 7.339 -6.502 13.284 1.00 0.00 O ATOM 498 CB ILE A 30 9.283 -4.750 11.146 1.00 0.00 C ATOM 499 CG1 ILE A 30 9.147 -3.872 9.882 1.00 0.00 C ATOM 500 CG2 ILE A 30 9.410 -6.228 10.723 1.00 0.00 C ATOM 501 CD1 ILE A 30 10.490 -3.636 9.182 1.00 0.00 C ATOM 0 H ILE A 30 8.837 -2.609 12.329 1.00 0.00 H new ATOM 0 HA ILE A 30 7.176 -4.738 11.539 1.00 0.00 H new ATOM 0 HB ILE A 30 10.179 -4.446 11.687 1.00 0.00 H new ATOM 0 HG12 ILE A 30 8.457 -4.348 9.186 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.711 -2.912 10.156 1.00 0.00 H new ATOM 0 HG21 ILE A 30 10.257 -6.341 10.047 1.00 0.00 H new ATOM 0 HG22 ILE A 30 9.565 -6.847 11.606 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.497 -6.541 10.216 1.00 0.00 H new ATOM 0 HD11 ILE A 30 10.336 -3.013 8.301 1.00 0.00 H new ATOM 0 HD12 ILE A 30 11.174 -3.134 9.866 1.00 0.00 H new ATOM 0 HD13 ILE A 30 10.916 -4.593 8.881 1.00 0.00 H new ATOM 513 N GLU A 31 9.039 -5.383 14.234 1.00 0.00 N ATOM 514 CA GLU A 31 9.153 -6.248 15.419 1.00 0.00 C ATOM 515 C GLU A 31 7.832 -6.290 16.210 1.00 0.00 C ATOM 516 O GLU A 31 7.376 -7.363 16.606 1.00 0.00 O ATOM 517 CB GLU A 31 10.313 -5.767 16.313 1.00 0.00 C ATOM 518 CG GLU A 31 10.625 -6.752 17.448 1.00 0.00 C ATOM 519 CD GLU A 31 11.628 -6.184 18.467 1.00 0.00 C ATOM 520 OE1 GLU A 31 11.233 -5.341 19.308 1.00 0.00 O ATOM 521 OE2 GLU A 31 12.810 -6.601 18.445 1.00 0.00 O ATOM 0 H GLU A 31 9.719 -4.622 14.221 1.00 0.00 H new ATOM 0 HA GLU A 31 9.365 -7.263 15.084 1.00 0.00 H new ATOM 0 HB2 GLU A 31 11.205 -5.627 15.702 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.062 -4.795 16.738 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.700 -7.013 17.962 1.00 0.00 H new ATOM 0 HG3 GLU A 31 11.025 -7.673 17.025 1.00 0.00 H new ATOM 528 N SER A 32 7.191 -5.132 16.404 1.00 0.00 N ATOM 529 CA SER A 32 5.881 -4.996 17.054 1.00 0.00 C ATOM 530 C SER A 32 4.764 -5.742 16.302 1.00 0.00 C ATOM 531 O SER A 32 4.014 -6.513 16.905 1.00 0.00 O ATOM 532 CB SER A 32 5.543 -3.508 17.202 1.00 0.00 C ATOM 533 OG SER A 32 4.365 -3.337 17.975 1.00 0.00 O ATOM 0 H SER A 32 7.580 -4.238 16.105 1.00 0.00 H new ATOM 0 HA SER A 32 5.945 -5.460 18.038 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.374 -2.986 17.676 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.406 -3.061 16.217 1.00 0.00 H new ATOM 0 HG SER A 32 4.166 -2.381 18.060 1.00 0.00 H new ATOM 539 N GLU A 33 4.655 -5.550 14.981 1.00 0.00 N ATOM 540 CA GLU A 33 3.643 -6.180 14.121 1.00 0.00 C ATOM 541 C GLU A 33 3.824 -7.705 14.009 1.00 0.00 C ATOM 542 O GLU A 33 2.908 -8.472 14.318 1.00 0.00 O ATOM 543 CB GLU A 33 3.695 -5.527 12.726 1.00 0.00 C ATOM 544 CG GLU A 33 2.578 -5.975 11.770 1.00 0.00 C ATOM 545 CD GLU A 33 1.172 -5.600 12.283 1.00 0.00 C ATOM 546 OE1 GLU A 33 0.858 -4.389 12.388 1.00 0.00 O ATOM 547 OE2 GLU A 33 0.365 -6.514 12.578 1.00 0.00 O ATOM 0 H GLU A 33 5.285 -4.935 14.466 1.00 0.00 H new ATOM 0 HA GLU A 33 2.666 -6.019 14.578 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.643 -4.445 12.843 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.659 -5.752 12.269 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.737 -5.520 10.792 1.00 0.00 H new ATOM 0 HG3 GLU A 33 2.634 -7.055 11.632 1.00 0.00 H new ATOM 554 N LYS A 34 4.995 -8.151 13.533 1.00 0.00 N ATOM 555 CA LYS A 34 5.280 -9.551 13.168 1.00 0.00 C ATOM 556 C LYS A 34 5.722 -10.427 14.349 1.00 0.00 C ATOM 557 O LYS A 34 5.707 -11.654 14.247 1.00 0.00 O ATOM 558 CB LYS A 34 6.342 -9.586 12.051 1.00 0.00 C ATOM 559 CG LYS A 34 6.011 -8.733 10.810 1.00 0.00 C ATOM 560 CD LYS A 34 4.682 -9.095 10.128 1.00 0.00 C ATOM 561 CE LYS A 34 4.750 -10.464 9.439 1.00 0.00 C ATOM 562 NZ LYS A 34 3.481 -10.784 8.735 1.00 0.00 N ATOM 0 H LYS A 34 5.793 -7.533 13.386 1.00 0.00 H new ATOM 0 HA LYS A 34 4.340 -9.978 12.818 1.00 0.00 H new ATOM 0 HB2 LYS A 34 7.292 -9.247 12.463 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.482 -10.620 11.736 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.981 -7.683 11.103 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.818 -8.839 10.085 1.00 0.00 H new ATOM 0 HD2 LYS A 34 3.883 -9.100 10.869 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.430 -8.330 9.393 1.00 0.00 H new ATOM 0 HE2 LYS A 34 5.575 -10.473 8.726 1.00 0.00 H new ATOM 0 HE3 LYS A 34 4.961 -11.235 10.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 3.562 -11.716 8.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.698 -10.799 9.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 3.294 -10.061 8.011 1.00 0.00 H new ATOM 576 N GLY A 35 6.093 -9.799 15.463 1.00 0.00 N ATOM 577 CA GLY A 35 6.654 -10.415 16.669 1.00 0.00 C ATOM 578 C GLY A 35 8.180 -10.545 16.599 1.00 0.00 C ATOM 579 O GLY A 35 8.738 -10.924 15.564 1.00 0.00 O ATOM 0 H GLY A 35 6.006 -8.787 15.556 1.00 0.00 H new ATOM 0 HA2 GLY A 35 6.382 -9.818 17.540 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.213 -11.402 16.809 1.00 0.00 H new ATOM 583 N LYS A 36 8.868 -10.292 17.722 1.00 0.00 N ATOM 584 CA LYS A 36 10.338 -10.396 17.841 1.00 0.00 C ATOM 585 C LYS A 36 10.874 -11.808 17.576 1.00 0.00 C ATOM 586 O LYS A 36 12.017 -11.982 17.172 1.00 0.00 O ATOM 587 CB LYS A 36 10.787 -9.820 19.204 1.00 0.00 C ATOM 588 CG LYS A 36 11.147 -10.858 20.285 1.00 0.00 C ATOM 589 CD LYS A 36 10.825 -10.396 21.713 1.00 0.00 C ATOM 590 CE LYS A 36 9.332 -10.529 22.063 1.00 0.00 C ATOM 591 NZ LYS A 36 8.885 -11.946 22.181 1.00 0.00 N ATOM 0 H LYS A 36 8.415 -10.004 18.590 1.00 0.00 H new ATOM 0 HA LYS A 36 10.784 -9.794 17.050 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.654 -9.180 19.039 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.990 -9.184 19.589 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.608 -11.784 20.082 1.00 0.00 H new ATOM 0 HG3 LYS A 36 12.211 -11.087 20.217 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.412 -10.982 22.420 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.129 -9.356 21.830 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.138 -10.013 23.003 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.739 -10.029 21.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 7.932 -11.976 22.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 8.866 -12.384 21.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.545 -12.469 22.792 1.00 0.00 H new ATOM 605 N ASP A 37 10.034 -12.817 17.786 1.00 0.00 N ATOM 606 CA ASP A 37 10.319 -14.231 17.541 1.00 0.00 C ATOM 607 C ASP A 37 10.512 -14.526 16.046 1.00 0.00 C ATOM 608 O ASP A 37 11.295 -15.406 15.679 1.00 0.00 O ATOM 609 CB ASP A 37 9.148 -15.060 18.081 1.00 0.00 C ATOM 610 CG ASP A 37 8.992 -14.927 19.609 1.00 0.00 C ATOM 611 OD1 ASP A 37 8.594 -13.837 20.094 1.00 0.00 O ATOM 612 OD2 ASP A 37 9.274 -15.911 20.334 1.00 0.00 O ATOM 0 H ASP A 37 9.092 -12.667 18.148 1.00 0.00 H new ATOM 0 HA ASP A 37 11.248 -14.492 18.047 1.00 0.00 H new ATOM 0 HB2 ASP A 37 8.226 -14.742 17.595 1.00 0.00 H new ATOM 0 HB3 ASP A 37 9.299 -16.108 17.823 1.00 0.00 H new ATOM 617 N ALA A 38 9.817 -13.774 15.184 1.00 0.00 N ATOM 618 CA ALA A 38 9.951 -13.832 13.734 1.00 0.00 C ATOM 619 C ALA A 38 10.996 -12.822 13.213 1.00 0.00 C ATOM 620 O ALA A 38 11.877 -13.188 12.433 1.00 0.00 O ATOM 621 CB ALA A 38 8.572 -13.590 13.107 1.00 0.00 C ATOM 0 H ALA A 38 9.126 -13.089 15.492 1.00 0.00 H new ATOM 0 HA ALA A 38 10.315 -14.818 13.446 1.00 0.00 H new ATOM 0 HB1 ALA A 38 8.654 -13.630 12.021 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.878 -14.358 13.447 1.00 0.00 H new ATOM 0 HB3 ALA A 38 8.203 -12.609 13.407 1.00 0.00 H new ATOM 627 N PHE A 39 10.906 -11.557 13.648 1.00 0.00 N ATOM 628 CA PHE A 39 11.718 -10.425 13.177 1.00 0.00 C ATOM 629 C PHE A 39 12.184 -9.525 14.346 1.00 0.00 C ATOM 630 O PHE A 39 11.615 -8.451 14.558 1.00 0.00 O ATOM 631 CB PHE A 39 10.910 -9.628 12.133 1.00 0.00 C ATOM 632 CG PHE A 39 10.678 -10.337 10.809 1.00 0.00 C ATOM 633 CD1 PHE A 39 11.655 -10.287 9.795 1.00 0.00 C ATOM 634 CD2 PHE A 39 9.475 -11.028 10.578 1.00 0.00 C ATOM 635 CE1 PHE A 39 11.427 -10.922 8.559 1.00 0.00 C ATOM 636 CE2 PHE A 39 9.243 -11.661 9.343 1.00 0.00 C ATOM 637 CZ PHE A 39 10.219 -11.606 8.332 1.00 0.00 C ATOM 0 H PHE A 39 10.237 -11.283 14.368 1.00 0.00 H new ATOM 0 HA PHE A 39 12.625 -10.810 12.710 1.00 0.00 H new ATOM 0 HB2 PHE A 39 9.942 -9.374 12.564 1.00 0.00 H new ATOM 0 HB3 PHE A 39 11.428 -8.689 11.937 1.00 0.00 H new ATOM 0 HD1 PHE A 39 12.582 -9.760 9.966 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.725 -11.073 11.353 1.00 0.00 H new ATOM 0 HE1 PHE A 39 12.180 -10.884 7.785 1.00 0.00 H new ATOM 0 HE2 PHE A 39 8.316 -12.189 9.172 1.00 0.00 H new ATOM 0 HZ PHE A 39 10.041 -12.088 7.382 1.00 0.00 H new ATOM 647 N PRO A 40 13.231 -9.900 15.106 1.00 0.00 N ATOM 648 CA PRO A 40 13.782 -9.057 16.171 1.00 0.00 C ATOM 649 C PRO A 40 14.550 -7.870 15.562 1.00 0.00 C ATOM 650 O PRO A 40 15.258 -8.040 14.568 1.00 0.00 O ATOM 651 CB PRO A 40 14.722 -9.979 16.954 1.00 0.00 C ATOM 652 CG PRO A 40 15.205 -10.990 15.913 1.00 0.00 C ATOM 653 CD PRO A 40 14.046 -11.094 14.920 1.00 0.00 C ATOM 0 HA PRO A 40 13.010 -8.631 16.812 1.00 0.00 H new ATOM 0 HB2 PRO A 40 15.554 -9.425 17.387 1.00 0.00 H new ATOM 0 HB3 PRO A 40 14.204 -10.471 17.777 1.00 0.00 H new ATOM 0 HG2 PRO A 40 16.118 -10.652 15.424 1.00 0.00 H new ATOM 0 HG3 PRO A 40 15.426 -11.955 16.369 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.417 -11.155 13.897 1.00 0.00 H new ATOM 0 HD3 PRO A 40 13.460 -11.995 15.101 1.00 0.00 H new ATOM 661 N VAL A 41 14.503 -6.681 16.173 1.00 0.00 N ATOM 662 CA VAL A 41 15.324 -5.511 15.769 1.00 0.00 C ATOM 663 C VAL A 41 16.802 -5.895 15.665 1.00 0.00 C ATOM 664 O VAL A 41 17.477 -5.564 14.691 1.00 0.00 O ATOM 665 CB VAL A 41 15.157 -4.343 16.765 1.00 0.00 C ATOM 666 CG1 VAL A 41 16.174 -3.211 16.550 1.00 0.00 C ATOM 667 CG2 VAL A 41 13.760 -3.736 16.647 1.00 0.00 C ATOM 0 H VAL A 41 13.893 -6.492 16.968 1.00 0.00 H new ATOM 0 HA VAL A 41 14.973 -5.186 14.790 1.00 0.00 H new ATOM 0 HB VAL A 41 15.322 -4.775 17.752 1.00 0.00 H new ATOM 0 HG11 VAL A 41 16.001 -2.423 17.283 1.00 0.00 H new ATOM 0 HG12 VAL A 41 17.184 -3.602 16.669 1.00 0.00 H new ATOM 0 HG13 VAL A 41 16.059 -2.804 15.545 1.00 0.00 H new ATOM 0 HG21 VAL A 41 13.659 -2.914 17.356 1.00 0.00 H new ATOM 0 HG22 VAL A 41 13.610 -3.362 15.634 1.00 0.00 H new ATOM 0 HG23 VAL A 41 13.012 -4.498 16.867 1.00 0.00 H new ATOM 677 N ALA A 42 17.275 -6.649 16.658 1.00 0.00 N ATOM 678 CA ALA A 42 18.640 -7.161 16.774 1.00 0.00 C ATOM 679 C ALA A 42 19.049 -8.224 15.720 1.00 0.00 C ATOM 680 O ALA A 42 20.184 -8.699 15.762 1.00 0.00 O ATOM 681 CB ALA A 42 18.811 -7.704 18.200 1.00 0.00 C ATOM 0 H ALA A 42 16.687 -6.933 17.442 1.00 0.00 H new ATOM 0 HA ALA A 42 19.314 -6.330 16.568 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.821 -8.095 18.322 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.644 -6.901 18.918 1.00 0.00 H new ATOM 0 HB3 ALA A 42 18.089 -8.502 18.374 1.00 0.00 H new ATOM 687 N GLY A 43 18.168 -8.622 14.791 1.00 0.00 N ATOM 688 CA GLY A 43 18.464 -9.537 13.670 1.00 0.00 C ATOM 689 C GLY A 43 17.980 -9.058 12.294 1.00 0.00 C ATOM 690 O GLY A 43 18.487 -9.524 11.270 1.00 0.00 O ATOM 0 H GLY A 43 17.198 -8.308 14.796 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.542 -9.694 13.624 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.009 -10.505 13.881 1.00 0.00 H new ATOM 694 N GLN A 44 17.022 -8.129 12.242 1.00 0.00 N ATOM 695 CA GLN A 44 16.477 -7.573 11.001 1.00 0.00 C ATOM 696 C GLN A 44 17.505 -6.796 10.152 1.00 0.00 C ATOM 697 O GLN A 44 18.355 -6.069 10.677 1.00 0.00 O ATOM 698 CB GLN A 44 15.329 -6.603 11.327 1.00 0.00 C ATOM 699 CG GLN A 44 13.960 -7.248 11.582 1.00 0.00 C ATOM 700 CD GLN A 44 12.934 -6.154 11.877 1.00 0.00 C ATOM 701 OE1 GLN A 44 12.695 -5.278 11.063 1.00 0.00 O ATOM 702 NE2 GLN A 44 12.312 -6.123 13.034 1.00 0.00 N ATOM 0 H GLN A 44 16.594 -7.734 13.080 1.00 0.00 H new ATOM 0 HA GLN A 44 16.144 -8.434 10.421 1.00 0.00 H new ATOM 0 HB2 GLN A 44 15.607 -6.025 12.208 1.00 0.00 H new ATOM 0 HB3 GLN A 44 15.229 -5.898 10.502 1.00 0.00 H new ATOM 0 HG2 GLN A 44 13.651 -7.828 10.712 1.00 0.00 H new ATOM 0 HG3 GLN A 44 14.022 -7.941 12.421 1.00 0.00 H new ATOM 0 HE21 GLN A 44 12.495 -6.845 13.731 1.00 0.00 H new ATOM 0 HE22 GLN A 44 11.646 -5.377 13.235 1.00 0.00 H new ATOM 711 N LYS A 45 17.338 -6.864 8.826 1.00 0.00 N ATOM 712 CA LYS A 45 18.009 -6.046 7.797 1.00 0.00 C ATOM 713 C LYS A 45 16.956 -5.547 6.803 1.00 0.00 C ATOM 714 O LYS A 45 15.996 -6.256 6.495 1.00 0.00 O ATOM 715 CB LYS A 45 19.141 -6.795 7.072 1.00 0.00 C ATOM 716 CG LYS A 45 20.286 -7.222 8.000 1.00 0.00 C ATOM 717 CD LYS A 45 21.511 -7.671 7.184 1.00 0.00 C ATOM 718 CE LYS A 45 22.717 -7.993 8.080 1.00 0.00 C ATOM 719 NZ LYS A 45 23.361 -6.766 8.625 1.00 0.00 N ATOM 0 H LYS A 45 16.690 -7.534 8.412 1.00 0.00 H new ATOM 0 HA LYS A 45 18.488 -5.203 8.295 1.00 0.00 H new ATOM 0 HB2 LYS A 45 18.728 -7.680 6.587 1.00 0.00 H new ATOM 0 HB3 LYS A 45 19.541 -6.157 6.284 1.00 0.00 H new ATOM 0 HG2 LYS A 45 20.561 -6.392 8.651 1.00 0.00 H new ATOM 0 HG3 LYS A 45 19.954 -8.036 8.644 1.00 0.00 H new ATOM 0 HD2 LYS A 45 21.251 -8.552 6.596 1.00 0.00 H new ATOM 0 HD3 LYS A 45 21.784 -6.886 6.479 1.00 0.00 H new ATOM 0 HE2 LYS A 45 22.394 -8.628 8.905 1.00 0.00 H new ATOM 0 HE3 LYS A 45 23.450 -8.562 7.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 24.169 -7.034 9.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 23.694 -6.171 7.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 22.671 -6.235 9.194 1.00 0.00 H new ATOM 733 N LEU A 46 17.147 -4.322 6.317 1.00 0.00 N ATOM 734 CA LEU A 46 16.198 -3.538 5.526 1.00 0.00 C ATOM 735 C LEU A 46 16.850 -3.095 4.215 1.00 0.00 C ATOM 736 O LEU A 46 17.905 -2.469 4.249 1.00 0.00 O ATOM 737 CB LEU A 46 15.766 -2.316 6.372 1.00 0.00 C ATOM 738 CG LEU A 46 14.341 -2.361 6.937 1.00 0.00 C ATOM 739 CD1 LEU A 46 13.329 -2.283 5.799 1.00 0.00 C ATOM 740 CD2 LEU A 46 14.080 -3.607 7.780 1.00 0.00 C ATOM 0 H LEU A 46 18.021 -3.819 6.474 1.00 0.00 H new ATOM 0 HA LEU A 46 15.322 -4.136 5.273 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.462 -2.210 7.204 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.864 -1.421 5.758 1.00 0.00 H new ATOM 0 HG LEU A 46 14.230 -1.500 7.596 1.00 0.00 H new ATOM 0 HD11 LEU A 46 12.319 -2.315 6.207 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.469 -1.351 5.251 1.00 0.00 H new ATOM 0 HD13 LEU A 46 13.475 -3.126 5.124 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.056 -3.586 8.154 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.224 -4.497 7.168 1.00 0.00 H new ATOM 0 HD23 LEU A 46 14.773 -3.629 8.621 1.00 0.00 H new ATOM 752 N ILE A 47 16.249 -3.416 3.069 1.00 0.00 N ATOM 753 CA ILE A 47 16.826 -3.225 1.729 1.00 0.00 C ATOM 754 C ILE A 47 15.809 -2.544 0.798 1.00 0.00 C ATOM 755 O ILE A 47 14.676 -3.010 0.658 1.00 0.00 O ATOM 756 CB ILE A 47 17.342 -4.587 1.197 1.00 0.00 C ATOM 757 CG1 ILE A 47 18.499 -5.152 2.065 1.00 0.00 C ATOM 758 CG2 ILE A 47 17.896 -4.488 -0.225 1.00 0.00 C ATOM 759 CD1 ILE A 47 18.070 -6.316 2.946 1.00 0.00 C ATOM 0 H ILE A 47 15.317 -3.830 3.042 1.00 0.00 H new ATOM 0 HA ILE A 47 17.683 -2.553 1.774 1.00 0.00 H new ATOM 0 HB ILE A 47 16.469 -5.240 1.228 1.00 0.00 H new ATOM 0 HG12 ILE A 47 19.309 -5.477 1.413 1.00 0.00 H new ATOM 0 HG13 ILE A 47 18.896 -4.355 2.694 1.00 0.00 H new ATOM 0 HG21 ILE A 47 18.244 -5.469 -0.549 1.00 0.00 H new ATOM 0 HG22 ILE A 47 17.112 -4.140 -0.898 1.00 0.00 H new ATOM 0 HG23 ILE A 47 18.728 -3.784 -0.243 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.923 -6.666 3.527 1.00 0.00 H new ATOM 0 HD12 ILE A 47 17.280 -5.989 3.622 1.00 0.00 H new ATOM 0 HD13 ILE A 47 17.699 -7.128 2.321 1.00 0.00 H new ATOM 771 N TYR A 48 16.212 -1.438 0.161 1.00 0.00 N ATOM 772 CA TYR A 48 15.428 -0.711 -0.846 1.00 0.00 C ATOM 773 C TYR A 48 16.275 -0.384 -2.082 1.00 0.00 C ATOM 774 O TYR A 48 17.435 -0.001 -1.942 1.00 0.00 O ATOM 775 CB TYR A 48 14.843 0.575 -0.250 1.00 0.00 C ATOM 776 CG TYR A 48 13.788 1.268 -1.101 1.00 0.00 C ATOM 777 CD1 TYR A 48 12.632 0.573 -1.515 1.00 0.00 C ATOM 778 CD2 TYR A 48 13.947 2.623 -1.456 1.00 0.00 C ATOM 779 CE1 TYR A 48 11.644 1.227 -2.277 1.00 0.00 C ATOM 780 CE2 TYR A 48 12.959 3.283 -2.214 1.00 0.00 C ATOM 781 CZ TYR A 48 11.802 2.585 -2.626 1.00 0.00 C ATOM 782 OH TYR A 48 10.835 3.216 -3.349 1.00 0.00 O ATOM 0 H TYR A 48 17.121 -1.011 0.337 1.00 0.00 H new ATOM 0 HA TYR A 48 14.609 -1.359 -1.158 1.00 0.00 H new ATOM 0 HB2 TYR A 48 14.406 0.339 0.720 1.00 0.00 H new ATOM 0 HB3 TYR A 48 15.658 1.276 -0.070 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.504 -0.465 -1.246 1.00 0.00 H new ATOM 0 HD2 TYR A 48 14.832 3.159 -1.145 1.00 0.00 H new ATOM 0 HE1 TYR A 48 10.764 0.688 -2.595 1.00 0.00 H new ATOM 0 HE2 TYR A 48 13.086 4.322 -2.480 1.00 0.00 H new ATOM 0 HH TYR A 48 11.098 4.147 -3.504 1.00 0.00 H new ATOM 792 N ALA A 49 15.712 -0.507 -3.291 1.00 0.00 N ATOM 793 CA ALA A 49 16.389 -0.198 -4.560 1.00 0.00 C ATOM 794 C ALA A 49 17.777 -0.875 -4.743 1.00 0.00 C ATOM 795 O ALA A 49 18.654 -0.355 -5.439 1.00 0.00 O ATOM 796 CB ALA A 49 16.421 1.332 -4.708 1.00 0.00 C ATOM 0 H ALA A 49 14.753 -0.831 -3.418 1.00 0.00 H new ATOM 0 HA ALA A 49 15.818 -0.639 -5.377 1.00 0.00 H new ATOM 0 HB1 ALA A 49 16.918 1.597 -5.641 1.00 0.00 H new ATOM 0 HB2 ALA A 49 15.402 1.718 -4.717 1.00 0.00 H new ATOM 0 HB3 ALA A 49 16.966 1.767 -3.871 1.00 0.00 H new ATOM 802 N GLY A 50 17.993 -2.026 -4.097 1.00 0.00 N ATOM 803 CA GLY A 50 19.248 -2.784 -4.061 1.00 0.00 C ATOM 804 C GLY A 50 20.319 -2.238 -3.104 1.00 0.00 C ATOM 805 O GLY A 50 21.489 -2.602 -3.231 1.00 0.00 O ATOM 0 H GLY A 50 17.256 -2.478 -3.556 1.00 0.00 H new ATOM 0 HA2 GLY A 50 19.024 -3.813 -3.780 1.00 0.00 H new ATOM 0 HA3 GLY A 50 19.665 -2.813 -5.068 1.00 0.00 H new ATOM 809 N LYS A 51 19.941 -1.382 -2.144 1.00 0.00 N ATOM 810 CA LYS A 51 20.806 -0.766 -1.121 1.00 0.00 C ATOM 811 C LYS A 51 20.241 -0.997 0.286 1.00 0.00 C ATOM 812 O LYS A 51 19.067 -0.727 0.544 1.00 0.00 O ATOM 813 CB LYS A 51 20.953 0.741 -1.398 1.00 0.00 C ATOM 814 CG LYS A 51 21.617 1.041 -2.755 1.00 0.00 C ATOM 815 CD LYS A 51 21.808 2.547 -2.994 1.00 0.00 C ATOM 816 CE LYS A 51 22.842 3.202 -2.064 1.00 0.00 C ATOM 817 NZ LYS A 51 24.236 2.796 -2.388 1.00 0.00 N ATOM 0 H LYS A 51 18.970 -1.083 -2.053 1.00 0.00 H new ATOM 0 HA LYS A 51 21.788 -1.235 -1.171 1.00 0.00 H new ATOM 0 HB2 LYS A 51 19.968 1.208 -1.370 1.00 0.00 H new ATOM 0 HB3 LYS A 51 21.544 1.195 -0.602 1.00 0.00 H new ATOM 0 HG2 LYS A 51 22.586 0.543 -2.800 1.00 0.00 H new ATOM 0 HG3 LYS A 51 21.006 0.624 -3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 51 22.114 2.704 -4.028 1.00 0.00 H new ATOM 0 HD3 LYS A 51 20.849 3.049 -2.865 1.00 0.00 H new ATOM 0 HE2 LYS A 51 22.756 4.286 -2.137 1.00 0.00 H new ATOM 0 HE3 LYS A 51 22.619 2.933 -1.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 24.895 3.264 -1.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 24.328 1.764 -2.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 24.461 3.075 -3.364 1.00 0.00 H new ATOM 831 N ILE A 52 21.062 -1.511 1.203 1.00 0.00 N ATOM 832 CA ILE A 52 20.689 -1.705 2.613 1.00 0.00 C ATOM 833 C ILE A 52 20.543 -0.344 3.315 1.00 0.00 C ATOM 834 O ILE A 52 21.457 0.485 3.289 1.00 0.00 O ATOM 835 CB ILE A 52 21.699 -2.621 3.334 1.00 0.00 C ATOM 836 CG1 ILE A 52 22.011 -3.835 2.429 1.00 0.00 C ATOM 837 CG2 ILE A 52 21.146 -3.037 4.707 1.00 0.00 C ATOM 838 CD1 ILE A 52 22.460 -5.110 3.126 1.00 0.00 C ATOM 0 H ILE A 52 22.014 -1.808 0.990 1.00 0.00 H new ATOM 0 HA ILE A 52 19.722 -2.207 2.654 1.00 0.00 H new ATOM 0 HB ILE A 52 22.633 -2.090 3.518 1.00 0.00 H new ATOM 0 HG12 ILE A 52 21.119 -4.062 1.846 1.00 0.00 H new ATOM 0 HG13 ILE A 52 22.788 -3.542 1.723 1.00 0.00 H new ATOM 0 HG21 ILE A 52 21.866 -3.684 5.209 1.00 0.00 H new ATOM 0 HG22 ILE A 52 20.972 -2.148 5.314 1.00 0.00 H new ATOM 0 HG23 ILE A 52 20.207 -3.574 4.573 1.00 0.00 H new ATOM 0 HD11 ILE A 52 22.647 -5.885 2.382 1.00 0.00 H new ATOM 0 HD12 ILE A 52 23.375 -4.916 3.686 1.00 0.00 H new ATOM 0 HD13 ILE A 52 21.680 -5.444 3.810 1.00 0.00 H new ATOM 850 N LEU A 53 19.379 -0.105 3.917 1.00 0.00 N ATOM 851 CA LEU A 53 19.016 1.120 4.625 1.00 0.00 C ATOM 852 C LEU A 53 19.828 1.281 5.928 1.00 0.00 C ATOM 853 O LEU A 53 19.881 0.368 6.756 1.00 0.00 O ATOM 854 CB LEU A 53 17.506 1.108 4.927 1.00 0.00 C ATOM 855 CG LEU A 53 16.547 0.878 3.748 1.00 0.00 C ATOM 856 CD1 LEU A 53 15.100 1.088 4.198 1.00 0.00 C ATOM 857 CD2 LEU A 53 16.801 1.867 2.621 1.00 0.00 C ATOM 0 H LEU A 53 18.627 -0.794 3.924 1.00 0.00 H new ATOM 0 HA LEU A 53 19.252 1.972 3.987 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.318 0.332 5.669 1.00 0.00 H new ATOM 0 HB3 LEU A 53 17.248 2.061 5.389 1.00 0.00 H new ATOM 0 HG LEU A 53 16.715 -0.141 3.400 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.429 0.923 3.355 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.861 0.384 4.995 1.00 0.00 H new ATOM 0 HD13 LEU A 53 14.977 2.107 4.565 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.105 1.675 1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.657 2.883 2.989 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.823 1.753 2.261 1.00 0.00 H new ATOM 869 N ASN A 54 20.458 2.441 6.117 1.00 0.00 N ATOM 870 CA ASN A 54 21.256 2.785 7.299 1.00 0.00 C ATOM 871 C ASN A 54 20.376 2.994 8.550 1.00 0.00 C ATOM 872 O ASN A 54 19.511 3.869 8.554 1.00 0.00 O ATOM 873 CB ASN A 54 22.054 4.058 6.979 1.00 0.00 C ATOM 874 CG ASN A 54 22.996 4.445 8.106 1.00 0.00 C ATOM 875 OD1 ASN A 54 22.598 5.015 9.112 1.00 0.00 O ATOM 876 ND2 ASN A 54 24.267 4.135 7.990 1.00 0.00 N ATOM 0 H ASN A 54 20.427 3.194 5.429 1.00 0.00 H new ATOM 0 HA ASN A 54 21.929 1.959 7.530 1.00 0.00 H new ATOM 0 HB2 ASN A 54 22.628 3.905 6.065 1.00 0.00 H new ATOM 0 HB3 ASN A 54 21.363 4.879 6.788 1.00 0.00 H new ATOM 0 HD21 ASN A 54 24.920 4.370 8.738 1.00 0.00 H new ATOM 0 HD22 ASN A 54 24.602 3.660 7.152 1.00 0.00 H new ATOM 883 N ASP A 55 20.623 2.231 9.621 1.00 0.00 N ATOM 884 CA ASP A 55 19.844 2.220 10.874 1.00 0.00 C ATOM 885 C ASP A 55 19.566 3.612 11.477 1.00 0.00 C ATOM 886 O ASP A 55 18.452 3.876 11.935 1.00 0.00 O ATOM 887 CB ASP A 55 20.568 1.354 11.917 1.00 0.00 C ATOM 888 CG ASP A 55 20.572 -0.132 11.537 1.00 0.00 C ATOM 889 OD1 ASP A 55 21.495 -0.576 10.815 1.00 0.00 O ATOM 890 OD2 ASP A 55 19.645 -0.862 11.959 1.00 0.00 O ATOM 0 H ASP A 55 21.404 1.575 9.644 1.00 0.00 H new ATOM 0 HA ASP A 55 18.870 1.808 10.612 1.00 0.00 H new ATOM 0 HB2 ASP A 55 21.595 1.702 12.025 1.00 0.00 H new ATOM 0 HB3 ASP A 55 20.086 1.478 12.887 1.00 0.00 H new ATOM 895 N ASP A 56 20.567 4.497 11.485 1.00 0.00 N ATOM 896 CA ASP A 56 20.520 5.837 12.092 1.00 0.00 C ATOM 897 C ASP A 56 20.024 6.941 11.131 1.00 0.00 C ATOM 898 O ASP A 56 19.695 8.047 11.567 1.00 0.00 O ATOM 899 CB ASP A 56 21.928 6.161 12.618 1.00 0.00 C ATOM 900 CG ASP A 56 21.981 7.453 13.453 1.00 0.00 C ATOM 901 OD1 ASP A 56 21.345 7.503 14.535 1.00 0.00 O ATOM 902 OD2 ASP A 56 22.700 8.404 13.060 1.00 0.00 O ATOM 0 H ASP A 56 21.469 4.295 11.053 1.00 0.00 H new ATOM 0 HA ASP A 56 19.788 5.820 12.900 1.00 0.00 H new ATOM 0 HB2 ASP A 56 22.282 5.328 13.226 1.00 0.00 H new ATOM 0 HB3 ASP A 56 22.612 6.253 11.774 1.00 0.00 H new ATOM 907 N THR A 57 19.942 6.662 9.827 1.00 0.00 N ATOM 908 CA THR A 57 19.442 7.597 8.804 1.00 0.00 C ATOM 909 C THR A 57 17.907 7.569 8.750 1.00 0.00 C ATOM 910 O THR A 57 17.283 6.521 8.948 1.00 0.00 O ATOM 911 CB THR A 57 20.081 7.265 7.443 1.00 0.00 C ATOM 912 OG1 THR A 57 21.484 7.410 7.549 1.00 0.00 O ATOM 913 CG2 THR A 57 19.669 8.192 6.308 1.00 0.00 C ATOM 0 H THR A 57 20.226 5.762 9.441 1.00 0.00 H new ATOM 0 HA THR A 57 19.729 8.615 9.067 1.00 0.00 H new ATOM 0 HB THR A 57 19.747 6.254 7.210 1.00 0.00 H new ATOM 0 HG1 THR A 57 21.837 6.735 8.166 1.00 0.00 H new ATOM 0 HG21 THR A 57 20.166 7.884 5.388 1.00 0.00 H new ATOM 0 HG22 THR A 57 18.589 8.142 6.171 1.00 0.00 H new ATOM 0 HG23 THR A 57 19.956 9.215 6.551 1.00 0.00 H new ATOM 921 N ALA A 58 17.273 8.724 8.516 1.00 0.00 N ATOM 922 CA ALA A 58 15.813 8.830 8.464 1.00 0.00 C ATOM 923 C ALA A 58 15.205 8.303 7.149 1.00 0.00 C ATOM 924 O ALA A 58 15.838 8.352 6.094 1.00 0.00 O ATOM 925 CB ALA A 58 15.395 10.268 8.770 1.00 0.00 C ATOM 0 H ALA A 58 17.757 9.608 8.358 1.00 0.00 H new ATOM 0 HA ALA A 58 15.404 8.174 9.233 1.00 0.00 H new ATOM 0 HB1 ALA A 58 14.309 10.347 8.731 1.00 0.00 H new ATOM 0 HB2 ALA A 58 15.744 10.544 9.765 1.00 0.00 H new ATOM 0 HB3 ALA A 58 15.834 10.939 8.032 1.00 0.00 H new ATOM 931 N LEU A 59 13.956 7.826 7.189 1.00 0.00 N ATOM 932 CA LEU A 59 13.283 7.212 6.030 1.00 0.00 C ATOM 933 C LEU A 59 13.093 8.194 4.858 1.00 0.00 C ATOM 934 O LEU A 59 13.279 7.821 3.696 1.00 0.00 O ATOM 935 CB LEU A 59 11.937 6.615 6.476 1.00 0.00 C ATOM 936 CG LEU A 59 12.075 5.445 7.465 1.00 0.00 C ATOM 937 CD1 LEU A 59 10.718 5.110 8.072 1.00 0.00 C ATOM 938 CD2 LEU A 59 12.584 4.184 6.773 1.00 0.00 C ATOM 0 H LEU A 59 13.377 7.853 8.029 1.00 0.00 H new ATOM 0 HA LEU A 59 13.929 6.418 5.654 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.337 7.400 6.937 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.392 6.273 5.596 1.00 0.00 H new ATOM 0 HG LEU A 59 12.784 5.758 8.231 1.00 0.00 H new ATOM 0 HD11 LEU A 59 10.827 4.280 8.771 1.00 0.00 H new ATOM 0 HD12 LEU A 59 10.331 5.981 8.600 1.00 0.00 H new ATOM 0 HD13 LEU A 59 10.024 4.828 7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 59 12.669 3.378 7.502 1.00 0.00 H new ATOM 0 HD22 LEU A 59 11.885 3.892 5.989 1.00 0.00 H new ATOM 0 HD23 LEU A 59 13.562 4.380 6.333 1.00 0.00 H new ATOM 950 N LYS A 60 12.805 9.466 5.161 1.00 0.00 N ATOM 951 CA LYS A 60 12.740 10.584 4.202 1.00 0.00 C ATOM 952 C LYS A 60 14.003 10.766 3.344 1.00 0.00 C ATOM 953 O LYS A 60 13.903 11.234 2.212 1.00 0.00 O ATOM 954 CB LYS A 60 12.365 11.883 4.944 1.00 0.00 C ATOM 955 CG LYS A 60 13.430 12.342 5.961 1.00 0.00 C ATOM 956 CD LYS A 60 12.995 13.554 6.797 1.00 0.00 C ATOM 957 CE LYS A 60 12.830 14.827 5.957 1.00 0.00 C ATOM 958 NZ LYS A 60 12.525 16.005 6.811 1.00 0.00 N ATOM 0 H LYS A 60 12.603 9.759 6.117 1.00 0.00 H new ATOM 0 HA LYS A 60 11.960 10.331 3.484 1.00 0.00 H new ATOM 0 HB2 LYS A 60 12.207 12.676 4.213 1.00 0.00 H new ATOM 0 HB3 LYS A 60 11.418 11.735 5.464 1.00 0.00 H new ATOM 0 HG2 LYS A 60 13.663 11.514 6.630 1.00 0.00 H new ATOM 0 HG3 LYS A 60 14.348 12.589 5.428 1.00 0.00 H new ATOM 0 HD2 LYS A 60 12.052 13.327 7.294 1.00 0.00 H new ATOM 0 HD3 LYS A 60 13.732 13.733 7.579 1.00 0.00 H new ATOM 0 HE2 LYS A 60 13.743 15.012 5.392 1.00 0.00 H new ATOM 0 HE3 LYS A 60 12.029 14.685 5.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.156 16.777 6.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.813 15.743 7.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 13.393 16.320 7.290 1.00 0.00 H new ATOM 972 N GLU A 61 15.178 10.345 3.819 1.00 0.00 N ATOM 973 CA GLU A 61 16.446 10.426 3.079 1.00 0.00 C ATOM 974 C GLU A 61 16.514 9.448 1.892 1.00 0.00 C ATOM 975 O GLU A 61 17.252 9.693 0.934 1.00 0.00 O ATOM 976 CB GLU A 61 17.620 10.136 4.023 1.00 0.00 C ATOM 977 CG GLU A 61 17.706 11.060 5.245 1.00 0.00 C ATOM 978 CD GLU A 61 18.044 12.511 4.850 1.00 0.00 C ATOM 979 OE1 GLU A 61 19.236 12.814 4.599 1.00 0.00 O ATOM 980 OE2 GLU A 61 17.123 13.361 4.788 1.00 0.00 O ATOM 0 H GLU A 61 15.280 9.930 4.745 1.00 0.00 H new ATOM 0 HA GLU A 61 16.507 11.438 2.679 1.00 0.00 H new ATOM 0 HB2 GLU A 61 17.544 9.105 4.369 1.00 0.00 H new ATOM 0 HB3 GLU A 61 18.549 10.215 3.459 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.757 11.042 5.780 1.00 0.00 H new ATOM 0 HG3 GLU A 61 18.466 10.685 5.930 1.00 0.00 H new ATOM 987 N TYR A 62 15.715 8.375 1.923 1.00 0.00 N ATOM 988 CA TYR A 62 15.618 7.334 0.890 1.00 0.00 C ATOM 989 C TYR A 62 14.389 7.516 -0.018 1.00 0.00 C ATOM 990 O TYR A 62 14.212 6.773 -0.986 1.00 0.00 O ATOM 991 CB TYR A 62 15.601 5.961 1.578 1.00 0.00 C ATOM 992 CG TYR A 62 16.920 5.585 2.225 1.00 0.00 C ATOM 993 CD1 TYR A 62 17.964 5.086 1.422 1.00 0.00 C ATOM 994 CD2 TYR A 62 17.102 5.720 3.616 1.00 0.00 C ATOM 995 CE1 TYR A 62 19.191 4.717 2.004 1.00 0.00 C ATOM 996 CE2 TYR A 62 18.326 5.344 4.204 1.00 0.00 C ATOM 997 CZ TYR A 62 19.374 4.848 3.398 1.00 0.00 C ATOM 998 OH TYR A 62 20.556 4.491 3.967 1.00 0.00 O ATOM 0 H TYR A 62 15.087 8.199 2.707 1.00 0.00 H new ATOM 0 HA TYR A 62 16.486 7.413 0.236 1.00 0.00 H new ATOM 0 HB2 TYR A 62 14.819 5.955 2.338 1.00 0.00 H new ATOM 0 HB3 TYR A 62 15.337 5.200 0.844 1.00 0.00 H new ATOM 0 HD1 TYR A 62 17.822 4.986 0.356 1.00 0.00 H new ATOM 0 HD2 TYR A 62 16.304 6.111 4.230 1.00 0.00 H new ATOM 0 HE1 TYR A 62 19.990 4.335 1.386 1.00 0.00 H new ATOM 0 HE2 TYR A 62 18.463 5.435 5.271 1.00 0.00 H new ATOM 0 HH TYR A 62 21.283 4.626 3.324 1.00 0.00 H new ATOM 1008 N LYS A 63 13.555 8.526 0.278 1.00 0.00 N ATOM 1009 CA LYS A 63 12.322 8.920 -0.422 1.00 0.00 C ATOM 1010 C LYS A 63 11.376 7.740 -0.727 1.00 0.00 C ATOM 1011 O LYS A 63 10.732 7.696 -1.778 1.00 0.00 O ATOM 1012 CB LYS A 63 12.642 9.789 -1.664 1.00 0.00 C ATOM 1013 CG LYS A 63 13.442 11.072 -1.368 1.00 0.00 C ATOM 1014 CD LYS A 63 14.963 10.888 -1.487 1.00 0.00 C ATOM 1015 CE LYS A 63 15.703 12.115 -0.944 1.00 0.00 C ATOM 1016 NZ LYS A 63 17.171 11.889 -0.926 1.00 0.00 N ATOM 0 H LYS A 63 13.740 9.135 1.075 1.00 0.00 H new ATOM 0 HA LYS A 63 11.753 9.542 0.269 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.202 9.185 -2.378 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.705 10.066 -2.147 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.124 11.856 -2.056 1.00 0.00 H new ATOM 0 HG3 LYS A 63 13.203 11.415 -0.361 1.00 0.00 H new ATOM 0 HD2 LYS A 63 15.271 9.999 -0.936 1.00 0.00 H new ATOM 0 HD3 LYS A 63 15.234 10.726 -2.530 1.00 0.00 H new ATOM 0 HE2 LYS A 63 15.473 12.984 -1.560 1.00 0.00 H new ATOM 0 HE3 LYS A 63 15.354 12.338 0.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 17.651 12.753 -0.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 17.394 11.106 -0.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 17.497 11.650 -1.884 1.00 0.00 H new ATOM 1030 N ILE A 64 11.298 6.779 0.200 1.00 0.00 N ATOM 1031 CA ILE A 64 10.400 5.613 0.141 1.00 0.00 C ATOM 1032 C ILE A 64 8.944 6.101 0.057 1.00 0.00 C ATOM 1033 O ILE A 64 8.564 7.060 0.731 1.00 0.00 O ATOM 1034 CB ILE A 64 10.611 4.660 1.347 1.00 0.00 C ATOM 1035 CG1 ILE A 64 12.106 4.441 1.684 1.00 0.00 C ATOM 1036 CG2 ILE A 64 9.935 3.300 1.072 1.00 0.00 C ATOM 1037 CD1 ILE A 64 12.326 3.587 2.935 1.00 0.00 C ATOM 0 H ILE A 64 11.876 6.789 1.041 1.00 0.00 H new ATOM 0 HA ILE A 64 10.635 5.034 -0.752 1.00 0.00 H new ATOM 0 HB ILE A 64 10.152 5.139 2.212 1.00 0.00 H new ATOM 0 HG12 ILE A 64 12.596 3.963 0.836 1.00 0.00 H new ATOM 0 HG13 ILE A 64 12.585 5.410 1.825 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.089 2.638 1.924 1.00 0.00 H new ATOM 0 HG22 ILE A 64 8.867 3.450 0.917 1.00 0.00 H new ATOM 0 HG23 ILE A 64 10.372 2.850 0.180 1.00 0.00 H new ATOM 0 HD11 ILE A 64 13.395 3.473 3.114 1.00 0.00 H new ATOM 0 HD12 ILE A 64 11.864 4.074 3.794 1.00 0.00 H new ATOM 0 HD13 ILE A 64 11.876 2.605 2.789 1.00 0.00 H new ATOM 1049 N ASP A 65 8.130 5.449 -0.770 1.00 0.00 N ATOM 1050 CA ASP A 65 6.704 5.755 -0.959 1.00 0.00 C ATOM 1051 C ASP A 65 5.817 4.657 -0.344 1.00 0.00 C ATOM 1052 O ASP A 65 6.272 3.537 -0.103 1.00 0.00 O ATOM 1053 CB ASP A 65 6.436 5.933 -2.462 1.00 0.00 C ATOM 1054 CG ASP A 65 5.060 6.556 -2.738 1.00 0.00 C ATOM 1055 OD1 ASP A 65 4.955 7.805 -2.756 1.00 0.00 O ATOM 1056 OD2 ASP A 65 4.080 5.795 -2.906 1.00 0.00 O ATOM 0 H ASP A 65 8.448 4.670 -1.346 1.00 0.00 H new ATOM 0 HA ASP A 65 6.452 6.681 -0.442 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.212 6.564 -2.895 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.500 4.964 -2.958 1.00 0.00 H new ATOM 1061 N GLU A 66 4.539 4.951 -0.097 1.00 0.00 N ATOM 1062 CA GLU A 66 3.577 3.965 0.411 1.00 0.00 C ATOM 1063 C GLU A 66 3.253 2.858 -0.617 1.00 0.00 C ATOM 1064 O GLU A 66 3.090 1.691 -0.247 1.00 0.00 O ATOM 1065 CB GLU A 66 2.270 4.661 0.835 1.00 0.00 C ATOM 1066 CG GLU A 66 2.474 5.692 1.954 1.00 0.00 C ATOM 1067 CD GLU A 66 1.134 6.224 2.497 1.00 0.00 C ATOM 1068 OE1 GLU A 66 0.393 6.908 1.752 1.00 0.00 O ATOM 1069 OE2 GLU A 66 0.825 5.975 3.689 1.00 0.00 O ATOM 0 H GLU A 66 4.140 5.878 -0.243 1.00 0.00 H new ATOM 0 HA GLU A 66 4.048 3.489 1.271 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.831 5.156 -0.031 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.556 3.908 1.168 1.00 0.00 H new ATOM 0 HG2 GLU A 66 3.040 5.238 2.767 1.00 0.00 H new ATOM 0 HG3 GLU A 66 3.069 6.524 1.577 1.00 0.00 H new ATOM 1076 N LYS A 67 3.153 3.212 -1.909 1.00 0.00 N ATOM 1077 CA LYS A 67 2.790 2.304 -3.015 1.00 0.00 C ATOM 1078 C LYS A 67 3.932 1.367 -3.424 1.00 0.00 C ATOM 1079 O LYS A 67 3.690 0.213 -3.784 1.00 0.00 O ATOM 1080 CB LYS A 67 2.340 3.123 -4.238 1.00 0.00 C ATOM 1081 CG LYS A 67 1.131 4.024 -3.936 1.00 0.00 C ATOM 1082 CD LYS A 67 0.668 4.769 -5.195 1.00 0.00 C ATOM 1083 CE LYS A 67 -0.503 5.697 -4.850 1.00 0.00 C ATOM 1084 NZ LYS A 67 -0.990 6.432 -6.047 1.00 0.00 N ATOM 0 H LYS A 67 3.327 4.166 -2.224 1.00 0.00 H new ATOM 0 HA LYS A 67 1.975 1.679 -2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.170 3.739 -4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.087 2.444 -5.052 1.00 0.00 H new ATOM 0 HG2 LYS A 67 0.312 3.420 -3.546 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.394 4.743 -3.160 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.493 5.348 -5.609 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.364 4.055 -5.960 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.319 5.112 -4.425 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.190 6.410 -4.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.782 7.050 -5.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.218 7.009 -6.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.311 5.752 -6.765 1.00 0.00 H new ATOM 1098 N ASN A 68 5.170 1.860 -3.376 1.00 0.00 N ATOM 1099 CA ASN A 68 6.391 1.068 -3.554 1.00 0.00 C ATOM 1100 C ASN A 68 6.625 0.147 -2.342 1.00 0.00 C ATOM 1101 O ASN A 68 6.121 0.416 -1.248 1.00 0.00 O ATOM 1102 CB ASN A 68 7.567 2.041 -3.755 1.00 0.00 C ATOM 1103 CG ASN A 68 7.517 2.737 -5.106 1.00 0.00 C ATOM 1104 OD1 ASN A 68 7.004 3.836 -5.262 1.00 0.00 O ATOM 1105 ND2 ASN A 68 8.036 2.110 -6.134 1.00 0.00 N ATOM 0 H ASN A 68 5.358 2.848 -3.208 1.00 0.00 H new ATOM 0 HA ASN A 68 6.298 0.423 -4.428 1.00 0.00 H new ATOM 0 HB2 ASN A 68 7.556 2.790 -2.963 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.506 1.495 -3.665 1.00 0.00 H new ATOM 0 HD21 ASN A 68 8.011 2.539 -7.059 1.00 0.00 H new ATOM 0 HD22 ASN A 68 8.465 1.193 -6.009 1.00 0.00 H new ATOM 1112 N PHE A 69 7.415 -0.921 -2.514 1.00 0.00 N ATOM 1113 CA PHE A 69 7.702 -1.878 -1.438 1.00 0.00 C ATOM 1114 C PHE A 69 9.186 -1.931 -1.052 1.00 0.00 C ATOM 1115 O PHE A 69 10.078 -1.894 -1.902 1.00 0.00 O ATOM 1116 CB PHE A 69 7.107 -3.264 -1.735 1.00 0.00 C ATOM 1117 CG PHE A 69 7.757 -4.097 -2.823 1.00 0.00 C ATOM 1118 CD1 PHE A 69 8.895 -4.876 -2.533 1.00 0.00 C ATOM 1119 CD2 PHE A 69 7.174 -4.163 -4.103 1.00 0.00 C ATOM 1120 CE1 PHE A 69 9.456 -5.704 -3.521 1.00 0.00 C ATOM 1121 CE2 PHE A 69 7.717 -5.018 -5.082 1.00 0.00 C ATOM 1122 CZ PHE A 69 8.862 -5.783 -4.793 1.00 0.00 C ATOM 0 H PHE A 69 7.871 -1.145 -3.398 1.00 0.00 H new ATOM 0 HA PHE A 69 7.195 -1.503 -0.549 1.00 0.00 H new ATOM 0 HB2 PHE A 69 7.130 -3.843 -0.812 1.00 0.00 H new ATOM 0 HB3 PHE A 69 6.058 -3.128 -1.999 1.00 0.00 H new ATOM 0 HD1 PHE A 69 9.338 -4.837 -1.549 1.00 0.00 H new ATOM 0 HD2 PHE A 69 6.310 -3.558 -4.334 1.00 0.00 H new ATOM 0 HE1 PHE A 69 10.343 -6.280 -3.303 1.00 0.00 H new ATOM 0 HE2 PHE A 69 7.254 -5.086 -6.055 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.284 -6.430 -5.547 1.00 0.00 H new ATOM 1132 N VAL A 70 9.434 -2.035 0.254 1.00 0.00 N ATOM 1133 CA VAL A 70 10.736 -2.314 0.871 1.00 0.00 C ATOM 1134 C VAL A 70 10.879 -3.829 1.054 1.00 0.00 C ATOM 1135 O VAL A 70 9.878 -4.546 1.136 1.00 0.00 O ATOM 1136 CB VAL A 70 10.852 -1.535 2.208 1.00 0.00 C ATOM 1137 CG1 VAL A 70 10.772 -2.385 3.480 1.00 0.00 C ATOM 1138 CG2 VAL A 70 12.151 -0.728 2.254 1.00 0.00 C ATOM 0 H VAL A 70 8.695 -1.921 0.948 1.00 0.00 H new ATOM 0 HA VAL A 70 11.554 -1.977 0.234 1.00 0.00 H new ATOM 0 HB VAL A 70 9.973 -0.891 2.210 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.864 -1.741 4.354 1.00 0.00 H new ATOM 0 HG12 VAL A 70 9.814 -2.904 3.511 1.00 0.00 H new ATOM 0 HG13 VAL A 70 11.581 -3.116 3.481 1.00 0.00 H new ATOM 0 HG21 VAL A 70 12.212 -0.190 3.200 1.00 0.00 H new ATOM 0 HG22 VAL A 70 13.002 -1.403 2.165 1.00 0.00 H new ATOM 0 HG23 VAL A 70 12.166 -0.015 1.429 1.00 0.00 H new ATOM 1148 N VAL A 71 12.110 -4.321 1.188 1.00 0.00 N ATOM 1149 CA VAL A 71 12.378 -5.725 1.538 1.00 0.00 C ATOM 1150 C VAL A 71 12.957 -5.816 2.944 1.00 0.00 C ATOM 1151 O VAL A 71 13.893 -5.096 3.294 1.00 0.00 O ATOM 1152 CB VAL A 71 13.287 -6.417 0.510 1.00 0.00 C ATOM 1153 CG1 VAL A 71 13.494 -7.895 0.866 1.00 0.00 C ATOM 1154 CG2 VAL A 71 12.657 -6.380 -0.884 1.00 0.00 C ATOM 0 H VAL A 71 12.953 -3.762 1.058 1.00 0.00 H new ATOM 0 HA VAL A 71 11.428 -6.259 1.518 1.00 0.00 H new ATOM 0 HB VAL A 71 14.237 -5.882 0.521 1.00 0.00 H new ATOM 0 HG11 VAL A 71 14.141 -8.361 0.123 1.00 0.00 H new ATOM 0 HG12 VAL A 71 13.958 -7.971 1.849 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.530 -8.404 0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 71 13.318 -6.875 -1.595 1.00 0.00 H new ATOM 0 HG22 VAL A 71 11.696 -6.894 -0.863 1.00 0.00 H new ATOM 0 HG23 VAL A 71 12.508 -5.344 -1.188 1.00 0.00 H new ATOM 1164 N VAL A 72 12.403 -6.728 3.741 1.00 0.00 N ATOM 1165 CA VAL A 72 12.870 -7.086 5.083 1.00 0.00 C ATOM 1166 C VAL A 72 13.369 -8.533 5.103 1.00 0.00 C ATOM 1167 O VAL A 72 12.750 -9.441 4.542 1.00 0.00 O ATOM 1168 CB VAL A 72 11.783 -6.811 6.146 1.00 0.00 C ATOM 1169 CG1 VAL A 72 10.438 -7.502 5.864 1.00 0.00 C ATOM 1170 CG2 VAL A 72 12.267 -7.200 7.549 1.00 0.00 C ATOM 0 H VAL A 72 11.581 -7.262 3.459 1.00 0.00 H new ATOM 0 HA VAL A 72 13.716 -6.450 5.344 1.00 0.00 H new ATOM 0 HB VAL A 72 11.607 -5.737 6.093 1.00 0.00 H new ATOM 0 HG11 VAL A 72 9.730 -7.258 6.656 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.045 -7.157 4.908 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.584 -8.582 5.828 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.480 -6.995 8.275 1.00 0.00 H new ATOM 0 HG22 VAL A 72 12.511 -8.262 7.568 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.154 -6.620 7.802 1.00 0.00 H new ATOM 1180 N MET A 73 14.496 -8.748 5.777 1.00 0.00 N ATOM 1181 CA MET A 73 15.044 -10.064 6.105 1.00 0.00 C ATOM 1182 C MET A 73 15.529 -10.120 7.552 1.00 0.00 C ATOM 1183 O MET A 73 15.628 -9.091 8.219 1.00 0.00 O ATOM 1184 CB MET A 73 16.138 -10.450 5.102 1.00 0.00 C ATOM 1185 CG MET A 73 17.375 -9.554 5.109 1.00 0.00 C ATOM 1186 SD MET A 73 18.687 -10.095 3.978 1.00 0.00 S ATOM 1187 CE MET A 73 19.233 -11.608 4.820 1.00 0.00 C ATOM 0 H MET A 73 15.075 -7.983 6.123 1.00 0.00 H new ATOM 0 HA MET A 73 14.249 -10.805 6.021 1.00 0.00 H new ATOM 0 HB2 MET A 73 16.450 -11.474 5.306 1.00 0.00 H new ATOM 0 HB3 MET A 73 15.709 -10.441 4.100 1.00 0.00 H new ATOM 0 HG2 MET A 73 17.077 -8.539 4.844 1.00 0.00 H new ATOM 0 HG3 MET A 73 17.776 -9.514 6.122 1.00 0.00 H new ATOM 0 HE1 MET A 73 20.319 -11.681 4.769 1.00 0.00 H new ATOM 0 HE2 MET A 73 18.920 -11.577 5.864 1.00 0.00 H new ATOM 0 HE3 MET A 73 18.788 -12.476 4.334 1.00 0.00 H new ATOM 1197 N VAL A 74 15.837 -11.324 8.034 1.00 0.00 N ATOM 1198 CA VAL A 74 16.311 -11.587 9.395 1.00 0.00 C ATOM 1199 C VAL A 74 17.554 -12.486 9.357 1.00 0.00 C ATOM 1200 O VAL A 74 17.480 -13.669 9.020 1.00 0.00 O ATOM 1201 CB VAL A 74 15.169 -12.116 10.293 1.00 0.00 C ATOM 1202 CG1 VAL A 74 14.433 -13.353 9.757 1.00 0.00 C ATOM 1203 CG2 VAL A 74 15.658 -12.400 11.716 1.00 0.00 C ATOM 0 H VAL A 74 15.761 -12.171 7.471 1.00 0.00 H new ATOM 0 HA VAL A 74 16.626 -10.653 9.860 1.00 0.00 H new ATOM 0 HB VAL A 74 14.443 -11.303 10.294 1.00 0.00 H new ATOM 0 HG11 VAL A 74 13.652 -13.644 10.459 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.984 -13.119 8.791 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.140 -14.174 9.639 1.00 0.00 H new ATOM 0 HG21 VAL A 74 14.829 -12.770 12.319 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.448 -13.150 11.686 1.00 0.00 H new ATOM 0 HG23 VAL A 74 16.046 -11.482 12.157 1.00 0.00 H new ATOM 1872 N GLU B 283 24.351 -16.123 3.381 1.00 0.00 N ATOM 1873 CA GLU B 283 23.816 -14.820 3.823 1.00 0.00 C ATOM 1874 C GLU B 283 24.008 -13.694 2.788 1.00 0.00 C ATOM 1875 O GLU B 283 23.100 -12.894 2.566 1.00 0.00 O ATOM 1876 CB GLU B 283 24.438 -14.456 5.181 1.00 0.00 C ATOM 1877 CG GLU B 283 23.720 -13.292 5.871 1.00 0.00 C ATOM 1878 CD GLU B 283 24.282 -13.067 7.287 1.00 0.00 C ATOM 1879 OE1 GLU B 283 23.870 -13.789 8.227 1.00 0.00 O ATOM 1880 OE2 GLU B 283 25.140 -12.168 7.469 1.00 0.00 O ATOM 0 HA GLU B 283 22.736 -14.923 3.929 1.00 0.00 H new ATOM 0 HB2 GLU B 283 24.413 -15.330 5.833 1.00 0.00 H new ATOM 0 HB3 GLU B 283 25.487 -14.196 5.037 1.00 0.00 H new ATOM 0 HG2 GLU B 283 23.837 -12.384 5.279 1.00 0.00 H new ATOM 0 HG3 GLU B 283 22.651 -13.500 5.927 1.00 0.00 H new ATOM 1887 N GLU B 284 25.149 -13.666 2.093 1.00 0.00 N ATOM 1888 CA GLU B 284 25.414 -12.723 0.994 1.00 0.00 C ATOM 1889 C GLU B 284 24.453 -12.908 -0.196 1.00 0.00 C ATOM 1890 O GLU B 284 24.023 -11.928 -0.805 1.00 0.00 O ATOM 1891 CB GLU B 284 26.866 -12.868 0.511 1.00 0.00 C ATOM 1892 CG GLU B 284 27.885 -12.437 1.575 1.00 0.00 C ATOM 1893 CD GLU B 284 29.323 -12.533 1.031 1.00 0.00 C ATOM 1894 OE1 GLU B 284 29.956 -13.610 1.157 1.00 0.00 O ATOM 1895 OE2 GLU B 284 29.839 -11.529 0.479 1.00 0.00 O ATOM 0 H GLU B 284 25.925 -14.302 2.277 1.00 0.00 H new ATOM 0 HA GLU B 284 25.249 -11.722 1.392 1.00 0.00 H new ATOM 0 HB2 GLU B 284 27.052 -13.906 0.234 1.00 0.00 H new ATOM 0 HB3 GLU B 284 27.008 -12.268 -0.388 1.00 0.00 H new ATOM 0 HG2 GLU B 284 27.678 -11.414 1.889 1.00 0.00 H new ATOM 0 HG3 GLU B 284 27.783 -13.068 2.458 1.00 0.00 H new ATOM 1902 N GLU B 285 24.075 -14.148 -0.519 1.00 0.00 N ATOM 1903 CA GLU B 285 23.100 -14.450 -1.573 1.00 0.00 C ATOM 1904 C GLU B 285 21.650 -14.193 -1.119 1.00 0.00 C ATOM 1905 O GLU B 285 20.837 -13.752 -1.929 1.00 0.00 O ATOM 1906 CB GLU B 285 23.280 -15.891 -2.078 1.00 0.00 C ATOM 1907 CG GLU B 285 24.630 -16.147 -2.766 1.00 0.00 C ATOM 1908 CD GLU B 285 24.775 -15.364 -4.087 1.00 0.00 C ATOM 1909 OE1 GLU B 285 24.272 -15.836 -5.135 1.00 0.00 O ATOM 1910 OE2 GLU B 285 25.408 -14.280 -4.093 1.00 0.00 O ATOM 0 H GLU B 285 24.440 -14.978 -0.053 1.00 0.00 H new ATOM 0 HA GLU B 285 23.293 -13.767 -2.401 1.00 0.00 H new ATOM 0 HB2 GLU B 285 23.177 -16.576 -1.236 1.00 0.00 H new ATOM 0 HB3 GLU B 285 22.477 -16.123 -2.778 1.00 0.00 H new ATOM 0 HG2 GLU B 285 25.438 -15.867 -2.090 1.00 0.00 H new ATOM 0 HG3 GLU B 285 24.737 -17.213 -2.965 1.00 0.00 H new ATOM 1917 N GLN B 286 21.324 -14.376 0.171 1.00 0.00 N ATOM 1918 CA GLN B 286 20.035 -13.953 0.746 1.00 0.00 C ATOM 1919 C GLN B 286 19.864 -12.429 0.620 1.00 0.00 C ATOM 1920 O GLN B 286 18.820 -11.945 0.180 1.00 0.00 O ATOM 1921 CB GLN B 286 19.912 -14.337 2.231 1.00 0.00 C ATOM 1922 CG GLN B 286 19.965 -15.836 2.547 1.00 0.00 C ATOM 1923 CD GLN B 286 19.944 -16.126 4.048 1.00 0.00 C ATOM 1924 OE1 GLN B 286 19.367 -15.408 4.854 1.00 0.00 O ATOM 1925 NE2 GLN B 286 20.576 -17.192 4.489 1.00 0.00 N ATOM 0 H GLN B 286 21.946 -14.821 0.845 1.00 0.00 H new ATOM 0 HA GLN B 286 19.256 -14.470 0.185 1.00 0.00 H new ATOM 0 HB2 GLN B 286 20.713 -13.842 2.781 1.00 0.00 H new ATOM 0 HB3 GLN B 286 18.971 -13.939 2.611 1.00 0.00 H new ATOM 0 HG2 GLN B 286 19.118 -16.333 2.074 1.00 0.00 H new ATOM 0 HG3 GLN B 286 20.869 -16.263 2.112 1.00 0.00 H new ATOM 0 HE21 GLN B 286 21.063 -17.804 3.834 1.00 0.00 H new ATOM 0 HE22 GLN B 286 20.579 -17.407 5.486 1.00 0.00 H new ATOM 1934 N ILE B 287 20.915 -11.678 0.967 1.00 0.00 N ATOM 1935 CA ILE B 287 21.015 -10.227 0.762 1.00 0.00 C ATOM 1936 C ILE B 287 20.842 -9.874 -0.724 1.00 0.00 C ATOM 1937 O ILE B 287 19.984 -9.061 -1.050 1.00 0.00 O ATOM 1938 CB ILE B 287 22.327 -9.682 1.377 1.00 0.00 C ATOM 1939 CG1 ILE B 287 22.222 -9.694 2.921 1.00 0.00 C ATOM 1940 CG2 ILE B 287 22.636 -8.258 0.882 1.00 0.00 C ATOM 1941 CD1 ILE B 287 23.563 -9.523 3.645 1.00 0.00 C ATOM 0 H ILE B 287 21.744 -12.073 1.411 1.00 0.00 H new ATOM 0 HA ILE B 287 20.200 -9.730 1.288 1.00 0.00 H new ATOM 0 HB ILE B 287 23.144 -10.329 1.058 1.00 0.00 H new ATOM 0 HG12 ILE B 287 21.549 -8.896 3.234 1.00 0.00 H new ATOM 0 HG13 ILE B 287 21.770 -10.634 3.236 1.00 0.00 H new ATOM 0 HG21 ILE B 287 23.564 -7.909 1.335 1.00 0.00 H new ATOM 0 HG22 ILE B 287 22.742 -8.265 -0.203 1.00 0.00 H new ATOM 0 HG23 ILE B 287 21.821 -7.590 1.163 1.00 0.00 H new ATOM 0 HD11 ILE B 287 23.400 -9.543 4.723 1.00 0.00 H new ATOM 0 HD12 ILE B 287 24.234 -10.335 3.365 1.00 0.00 H new ATOM 0 HD13 ILE B 287 24.010 -8.570 3.363 1.00 0.00 H new ATOM 1953 N ALA B 288 21.598 -10.480 -1.645 1.00 0.00 N ATOM 1954 CA ALA B 288 21.476 -10.188 -3.079 1.00 0.00 C ATOM 1955 C ALA B 288 20.080 -10.514 -3.663 1.00 0.00 C ATOM 1956 O ALA B 288 19.577 -9.779 -4.515 1.00 0.00 O ATOM 1957 CB ALA B 288 22.585 -10.930 -3.827 1.00 0.00 C ATOM 0 H ALA B 288 22.305 -11.180 -1.422 1.00 0.00 H new ATOM 0 HA ALA B 288 21.589 -9.112 -3.212 1.00 0.00 H new ATOM 0 HB1 ALA B 288 22.506 -10.722 -4.894 1.00 0.00 H new ATOM 0 HB2 ALA B 288 23.556 -10.596 -3.463 1.00 0.00 H new ATOM 0 HB3 ALA B 288 22.484 -12.002 -3.658 1.00 0.00 H new ATOM 1963 N TYR B 289 19.418 -11.571 -3.183 1.00 0.00 N ATOM 1964 CA TYR B 289 18.015 -11.880 -3.482 1.00 0.00 C ATOM 1965 C TYR B 289 17.070 -10.767 -2.984 1.00 0.00 C ATOM 1966 O TYR B 289 16.237 -10.285 -3.756 1.00 0.00 O ATOM 1967 CB TYR B 289 17.686 -13.264 -2.899 1.00 0.00 C ATOM 1968 CG TYR B 289 16.227 -13.686 -2.893 1.00 0.00 C ATOM 1969 CD1 TYR B 289 15.406 -13.527 -4.029 1.00 0.00 C ATOM 1970 CD2 TYR B 289 15.700 -14.287 -1.734 1.00 0.00 C ATOM 1971 CE1 TYR B 289 14.060 -13.947 -3.994 1.00 0.00 C ATOM 1972 CE2 TYR B 289 14.361 -14.713 -1.698 1.00 0.00 C ATOM 1973 CZ TYR B 289 13.529 -14.537 -2.825 1.00 0.00 C ATOM 1974 OH TYR B 289 12.228 -14.940 -2.783 1.00 0.00 O ATOM 0 H TYR B 289 19.853 -12.252 -2.561 1.00 0.00 H new ATOM 0 HA TYR B 289 17.861 -11.918 -4.560 1.00 0.00 H new ATOM 0 HB2 TYR B 289 18.251 -14.009 -3.459 1.00 0.00 H new ATOM 0 HB3 TYR B 289 18.050 -13.293 -1.872 1.00 0.00 H new ATOM 0 HD1 TYR B 289 15.809 -13.083 -4.927 1.00 0.00 H new ATOM 0 HD2 TYR B 289 16.329 -14.422 -0.866 1.00 0.00 H new ATOM 0 HE1 TYR B 289 13.433 -13.817 -4.864 1.00 0.00 H new ATOM 0 HE2 TYR B 289 13.967 -15.176 -0.805 1.00 0.00 H new ATOM 0 HH TYR B 289 11.983 -15.160 -1.860 1.00 0.00 H new ATOM 1984 N ALA B 290 17.239 -10.279 -1.747 1.00 0.00 N ATOM 1985 CA ALA B 290 16.542 -9.085 -1.261 1.00 0.00 C ATOM 1986 C ALA B 290 16.798 -7.837 -2.128 1.00 0.00 C ATOM 1987 O ALA B 290 15.852 -7.119 -2.454 1.00 0.00 O ATOM 1988 CB ALA B 290 16.912 -8.824 0.204 1.00 0.00 C ATOM 0 H ALA B 290 17.862 -10.701 -1.058 1.00 0.00 H new ATOM 0 HA ALA B 290 15.473 -9.285 -1.335 1.00 0.00 H new ATOM 0 HB1 ALA B 290 16.390 -7.935 0.558 1.00 0.00 H new ATOM 0 HB2 ALA B 290 16.621 -9.681 0.811 1.00 0.00 H new ATOM 0 HB3 ALA B 290 17.988 -8.670 0.286 1.00 0.00 H new ATOM 1994 N MET B 291 18.045 -7.587 -2.546 1.00 0.00 N ATOM 1995 CA MET B 291 18.408 -6.495 -3.454 1.00 0.00 C ATOM 1996 C MET B 291 17.645 -6.585 -4.783 1.00 0.00 C ATOM 1997 O MET B 291 16.990 -5.618 -5.167 1.00 0.00 O ATOM 1998 CB MET B 291 19.930 -6.442 -3.681 1.00 0.00 C ATOM 1999 CG MET B 291 20.699 -6.081 -2.404 1.00 0.00 C ATOM 2000 SD MET B 291 22.489 -5.917 -2.634 1.00 0.00 S ATOM 2001 CE MET B 291 22.905 -5.086 -1.076 1.00 0.00 C ATOM 0 H MET B 291 18.845 -8.150 -2.256 1.00 0.00 H new ATOM 0 HA MET B 291 18.112 -5.561 -2.976 1.00 0.00 H new ATOM 0 HB2 MET B 291 20.274 -7.409 -4.048 1.00 0.00 H new ATOM 0 HB3 MET B 291 20.154 -5.709 -4.456 1.00 0.00 H new ATOM 0 HG2 MET B 291 20.307 -5.143 -2.011 1.00 0.00 H new ATOM 0 HG3 MET B 291 20.510 -6.846 -1.651 1.00 0.00 H new ATOM 0 HE1 MET B 291 23.987 -5.076 -0.947 1.00 0.00 H new ATOM 0 HE2 MET B 291 22.532 -4.062 -1.099 1.00 0.00 H new ATOM 0 HE3 MET B 291 22.446 -5.621 -0.245 1.00 0.00 H new ATOM 2011 N GLN B 292 17.659 -7.744 -5.450 1.00 0.00 N ATOM 2012 CA GLN B 292 16.897 -7.994 -6.681 1.00 0.00 C ATOM 2013 C GLN B 292 15.389 -7.746 -6.509 1.00 0.00 C ATOM 2014 O GLN B 292 14.777 -7.119 -7.378 1.00 0.00 O ATOM 2015 CB GLN B 292 17.178 -9.425 -7.177 1.00 0.00 C ATOM 2016 CG GLN B 292 16.367 -9.832 -8.421 1.00 0.00 C ATOM 2017 CD GLN B 292 16.699 -9.007 -9.666 1.00 0.00 C ATOM 2018 OE1 GLN B 292 17.542 -9.367 -10.479 1.00 0.00 O ATOM 2019 NE2 GLN B 292 16.053 -7.879 -9.874 1.00 0.00 N ATOM 0 H GLN B 292 18.208 -8.548 -5.146 1.00 0.00 H new ATOM 0 HA GLN B 292 17.232 -7.279 -7.432 1.00 0.00 H new ATOM 0 HB2 GLN B 292 18.240 -9.517 -7.403 1.00 0.00 H new ATOM 0 HB3 GLN B 292 16.962 -10.126 -6.371 1.00 0.00 H new ATOM 0 HG2 GLN B 292 16.549 -10.885 -8.634 1.00 0.00 H new ATOM 0 HG3 GLN B 292 15.304 -9.730 -8.201 1.00 0.00 H new ATOM 0 HE21 GLN B 292 15.348 -7.565 -9.207 1.00 0.00 H new ATOM 0 HE22 GLN B 292 16.257 -7.319 -10.702 1.00 0.00 H new ATOM 2028 N MET B 293 14.779 -8.215 -5.416 1.00 0.00 N ATOM 2029 CA MET B 293 13.364 -7.942 -5.137 1.00 0.00 C ATOM 2030 C MET B 293 13.106 -6.441 -4.930 1.00 0.00 C ATOM 2031 O MET B 293 12.205 -5.875 -5.549 1.00 0.00 O ATOM 2032 CB MET B 293 12.879 -8.748 -3.922 1.00 0.00 C ATOM 2033 CG MET B 293 12.724 -10.240 -4.238 1.00 0.00 C ATOM 2034 SD MET B 293 11.896 -11.198 -2.936 1.00 0.00 S ATOM 2035 CE MET B 293 13.156 -11.144 -1.632 1.00 0.00 C ATOM 0 H MET B 293 15.243 -8.786 -4.709 1.00 0.00 H new ATOM 0 HA MET B 293 12.793 -8.258 -6.010 1.00 0.00 H new ATOM 0 HB2 MET B 293 13.585 -8.624 -3.101 1.00 0.00 H new ATOM 0 HB3 MET B 293 11.923 -8.350 -3.583 1.00 0.00 H new ATOM 0 HG2 MET B 293 12.161 -10.346 -5.165 1.00 0.00 H new ATOM 0 HG3 MET B 293 13.711 -10.667 -4.414 1.00 0.00 H new ATOM 0 HE1 MET B 293 13.174 -12.097 -1.104 1.00 0.00 H new ATOM 0 HE2 MET B 293 14.133 -10.957 -2.078 1.00 0.00 H new ATOM 0 HE3 MET B 293 12.919 -10.345 -0.930 1.00 0.00 H new ATOM 2045 N SER B 294 13.906 -5.772 -4.094 1.00 0.00 N ATOM 2046 CA SER B 294 13.757 -4.341 -3.784 1.00 0.00 C ATOM 2047 C SER B 294 14.011 -3.408 -4.976 1.00 0.00 C ATOM 2048 O SER B 294 13.439 -2.321 -5.032 1.00 0.00 O ATOM 2049 CB SER B 294 14.672 -3.955 -2.625 1.00 0.00 C ATOM 2050 OG SER B 294 16.004 -3.811 -3.070 1.00 0.00 O ATOM 0 H SER B 294 14.686 -6.212 -3.606 1.00 0.00 H new ATOM 0 HA SER B 294 12.711 -4.206 -3.509 1.00 0.00 H new ATOM 0 HB2 SER B 294 14.329 -3.021 -2.179 1.00 0.00 H new ATOM 0 HB3 SER B 294 14.623 -4.717 -1.847 1.00 0.00 H new ATOM 0 HG SER B 294 16.196 -4.487 -3.753 1.00 0.00 H new